A0A087WQ01_MOUSE Loading...

Inactive tyrosine-protein kinase PEAK1

Probable catalytically inactive kinase. Scaffolding protein that regulates the cytoskeleton to control cell spreading and migration by modulating focal adhesion dynamics. Acts as a scaffold for mediating EGFR signaling.

AlphaFold DB , UniProt , Accession A0A087WQ01, Species MOUSE (Mus musculus, Mouse), Gene Peak1, Length 705 aa.

Structure Viewer

Loading PAE data...

(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	32.9	Very low	32.5	Very low	233 Å²	233	140.5 Å²	140.5	100%	1.148	77%	0.766	S	S	*	*				0	96.5	0	-68.1	164.2	174.2	0	0	105.3
2	S	31.2	Very low	32.3	Very low	106 Å²	106	138 Å²	138	74%	0.741	76%	0.759	S	S	*	*				80.7	104.4	85.8	-55.7	0	0	0	0	109.7
3	L	33.2	Very low	32.4	Very low	152 Å²	152	139.1 Å²	139.1	80%	0.796	75%	0.754	S	S	*	*				92	118	52.5	-76.5	168.5	0	0	0	113.8
4	N	34.5	Very low	32.2	Very low	144 Å²	144	140.9 Å²	140.9	77%	0.77	76%	0.756	S	S	*	*			trans	72.2	160	140.4	-64.6	17.2	0	0	0	122.7
5	G	31.6	Very low	32.2	Very low	65 Å²	65	139.5 Å²	139.5	67%	0.67	75%	0.754	S	S	*	*			trans	126.5	78.9	-173.3	0	0	0	0	0	110.1
6	E	37.1	Very low	32.1	Very low	168 Å²	168	137 Å²	137	79%	0.785	76%	0.758	S	S	*	*				67.5	144.3	64.2	-58.8	-170.5	140.2	0	0	113.2
7	L	32.3	Very low	31.8	Very low	153 Å²	153	133.7 Å²	133.7	80%	0.801	76%	0.762	S	S	*	*			cis	-147	173.9	30.6	-165.9	60.6	0	0	0	114.7
8	C	33.3	Very low	31.8	Very low	99 Å²	99	136.2 Å²	136.2	67%	0.669	77%	0.766	S	S	*	*			trans	-84.8	170.9	-167.7	-45.9	0	0	0	0	117.7
9	D	28.5	Very low	31.6	Very low	119 Å²	119	137.4 Å²	137.4	64%	0.636	77%	0.77	S	S	*	*				-173.8	150.6	114.7	-107.2	20.6	0	0	0	109.6
10	R	31.3	Very low	31.6	Very low	196 Å²	196	135.9 Å²	135.9	74%	0.74	77%	0.769	S	S	*	*			cis	-163.4	133	-17.8	-127	-178.2	-175.5	131.7	-8	111.4
11	V	31.3	Very low	32.1	Very low	111 Å²	111	134.4 Å²	134.4	67%	0.673	76%	0.764	S	S	*	*				53.3	93.8	121.9	172	0	0	0	0	118.4
12	T	30.4	Very low	31.8	Very low	110 Å²	110	134.4 Å²	134.4	68%	0.675	75%	0.752	S	S	*	*				85.5	162.4	94.1	69	0	0	0	0	116.1
13	H	33	Very low	32	Very low	152 Å²	152	136.5 Å²	136.5	70%	0.704	76%	0.755	S	S	*	*			cis	-163.5	158.7	7.9	-127.7	-51.8	0	0	0	111.7
14	E	30.8	Very low	32.2	Very low	165 Å²	165	135.4 Å²	135.4	77%	0.771	76%	0.757	S	S	*	*			trans	67.2	151.3	145.1	-61.9	-128.6	130	0	0	121
15	V	31.5	Very low	31.9	Very low	120 Å²	120	140 Å²	140	73%	0.727	76%	0.763	S	S	*	*			cis	-151.5	170.1	-9.4	111.6	0	0	0	0	113.1
16	A	30.3	Very low	32.1	Very low	99 Å²	99	143.4 Å²	143.4	82%	0.818	77%	0.771	S	S	*	*			trans	-55.3	167.7	-175.3	0	0	0	0	0	119.4
17	G	28.1	Very low	32.4	Very low	81 Å²	81	141 Å²	141	84%	0.835	77%	0.77	S	S	*	*			trans	-170.8	125	164.2	0	0	0	0	0	111.8
18	E	31.2	Very low	32.3	Very low	179 Å²	179	138.4 Å²	138.4	84%	0.836	77%	0.771	S	S	*	*			trans	-104.2	171.8	-176.1	-156.3	-179.6	-146	0	0	111.6
19	L	28.2	Very low	32.1	Very low	158 Å²	158	137.1 Å²	137.1	83%	0.827	77%	0.774	S	S	*	*			trans	83.2	128.5	162.2	-59.7	159.9	0	0	0	120.3
20	S	30.4	Very low	32.3	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	78%	0.78	S	S	*	*			trans	-75.8	163.1	155.1	-163.4	0	0	0	0	109.1
21	P	42.1	Very low	32.6	Very low	105 Å²	105	136.8 Å²	136.8	68%	0.682	78%	0.775	S	S	*	*			cis	-155.6	-173	32.2	45.9	-24.3	0	0	0	119.8
22	R	28.2	Very low	32.5	Very low	234 Å²	234	138.1 Å²	138.1	88%	0.883	78%	0.778	S	S	*	*			trans	78.3	149.1	152.8	-83.9	-178.1	172.4	172.6	-1.1	121.4
23	D	34.4	Very low	32.6	Very low	150 Å²	150	136.1 Å²	136.1	80%	0.802	78%	0.779	S	S	*	*			trans	-62.9	161.8	172.8	-47.2	-86.9	0	0	0	114.2
24	P	38.4	Very low	32.6	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	79%	0.786	S	S	*	*				-128.6	169.1	119.1	37.5	-31.6	0	0	0	114.7
25	R	27.7	Very low	32.7	Very low	239 Å²	239	132.6 Å²	132.6	90%	0.902	79%	0.785	S	S	*	*			trans	-90.7	162.4	-165.9	-58.6	174.4	-175.8	137.8	0	115
26	T	35.9	Very low	32.6	Very low	137 Å²	137	133.1 Å²	133.1	84%	0.84	79%	0.788	S	S	*	*			trans	-53.6	150.9	164.2	-14.3	0	0	0	0	114
27	P	43	Very low	32.4	Very low	118 Å²	118	133.9 Å²	133.9	77%	0.766	78%	0.782	S	S	*	*				-142.9	169.2	120.7	37.3	-24.3	0	0	0	113.5
28	A	30	Very low	33.2	Very low	99 Å²	99	135.3 Å²	135.3	82%	0.818	78%	0.777	S	S	*	*			cis	-173	155.8	-27.7	0	0	0	0	0	110.5
29	G	28.7	Very low	33	Very low	72 Å²	72	132.3 Å²	132.3	74%	0.742	77%	0.771	S	S	*	*			trans	106.6	154.8	156	0	0	0	0	0	117.4
30	K	33.2	Very low	33	Very low	175 Å²	175	132.3 Å²	132.3	76%	0.761	77%	0.771	S	S	*	*			cis	-165.7	136.8	-3.7	-119.9	-168	171.2	-143.4	0	112.2
31	Q	37.6	Very low	33.7	Very low	133 Å²	133	132.6 Å²	132.6	62%	0.621	77%	0.77	S	S	*	*			trans	62	148.7	142.1	-72.2	-172.6	-93.8	0	0	120.1
32	D	30.1	Very low	33.8	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	77%	0.772	S	S	*	*			cis	-131.9	167.7	-6	-82.7	-46.2	0	0	0	107.5
33	G	32.8	Very low	34.6	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	76%	0.762	S	S	*	*			cis	114.4	134.6	27.1	0	0	0	0	0	108.7
34	T	32.8	Very low	34.3	Very low	137 Å²	137	126 Å²	126	84%	0.84	76%	0.758	S	S	*	*			cis	-144	-150.9	-0.3	-32.6	0	0	0	0	106.8
35	S	32.4	Very low	33.9	Very low	106 Å²	106	127 Å²	127	74%	0.741	76%	0.756	S	S	*	*			cis	-176.9	148.2	-0.5	31.5	0	0	0	0	107.1
36	V	30.2	Very low	34	Very low	131 Å²	131	123.3 Å²	123.3	79%	0.794	75%	0.749	S	S	*	*			cis	-158.5	176.7	-6.6	103.8	0	0	0	0	110.9
37	T	25.7	Very low	33.7	Very low	114 Å²	114	128.6 Å²	128.6	70%	0.699	75%	0.753	S	S	*	*			trans	-72.1	-173.5	176.1	17.8	0	0	0	0	115
38	P	44.2	Very low	33.1	Very low	111 Å²	111	131 Å²	131	72%	0.721	76%	0.755	S	S	*	*			cis	-143.2	149.2	17.1	36.3	-12.9	0	0	0	121.6
39	T	26.9	Very low	33.1	Very low	116 Å²	116	134.3 Å²	134.3	71%	0.712	75%	0.753	S	S	*	*				55.4	119.1	122.6	-45.5	0	0	0	0	125.1
40	L	28.8	Very low	33.1	Very low	158 Å²	158	140.4 Å²	140.4	83%	0.827	76%	0.762	S	S	*	*			trans	27	161.2	136.2	-58.5	169.1	0	0	0	123.4
41	P	44.1	Very low	33	Very low	114 Å²	114	139.1 Å²	139.1	74%	0.74	76%	0.756	S	S	*	*			cis	-123.3	-110.4	-29.3	25.4	0.2	0	0	0	115.7
42	P	44.2	Very low	32.5	Very low	111 Å²	111	138 Å²	138	72%	0.721	76%	0.755	S	S	*	*			trans	-115.2	-158.2	-137.5	42.8	-21.6	0	0	0	113
43	P	44.6	Very low	32.5	Very low	104 Å²	104	137.6 Å²	137.6	68%	0.675	75%	0.753	S	S	*	*			cis	-139.9	-118	5.6	39.1	-13	0	0	0	115.7
44	D	29	Very low	32.3	Very low	135 Å²	135	139.8 Å²	139.8	72%	0.722	75%	0.753	S	S	*	*			trans	67.8	155.3	171.1	-54	-28.8	0	0	0	121.5
45	L	29.8	Very low	32.2	Very low	149 Å²	149	140.7 Å²	140.7	78%	0.78	75%	0.751	S	S	*	*			cis	170.8	177.9	-47.4	-100.4	172.9	0	0	0	108.3
46	E	29.3	Very low	32.1	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	75%	0.752	S	S	*	*			trans	63	99.2	164.9	-70	172.6	-146.2	0	0	120
47	R	30.3	Very low	32.8	Very low	247 Å²	247	140.9 Å²	140.9	93%	0.932	75%	0.745	S	S	*	*				-130.2	114.2	111.9	171	168.8	-78.5	-165	-6.3	107.8
48	E	30.1	Very low	32.9	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.794	75%	0.745	S	S	*	*			trans	-73.2	170.1	178.1	-68.5	-168.6	121.6	0	0	113
49	E	30.4	Very low	32.2	Very low	168 Å²	168	142.8 Å²	142.8	79%	0.785	75%	0.749	S	S	*	*			trans	-67.7	162	175.9	-48.8	177	130.2	0	0	111.7
50	E	29.5	Very low	32.4	Very low	199 Å²	199	142.6 Å²	142.6	93%	0.93	75%	0.748	S	S	*	*				-136.9	138.1	127.8	-150.2	172	-159.7	0	0	109.5
51	K	29.9	Very low	32.8	Very low	148 Å²	148	140.3 Å²	140.3	64%	0.643	75%	0.745	S	S	*	*			trans	-80.9	-177.4	171.7	-45.7	167	90.7	-123.8	0	107.4
52	D	28.2	Very low	32.7	Very low	110 Å²	110	140.4 Å²	140.4	59%	0.588	75%	0.745	S	S	*	*			cis	-157.8	-179.4	12.5	-139	-26.5	0	0	0	111.2
53	D	28.7	Very low	32.1	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	75%	0.749	S	S	*	*			trans	70.9	107.9	143	-85.8	-23.8	0	0	0	123.4
54	T	30	Very low	31.5	Very low	114 Å²	114	141.9 Å²	141.9	70%	0.699	76%	0.76	S	S	*	*				84	148.3	123.5	-22.5	0	0	0	0	123
55	L	30.1	Very low	31.8	Very low	155 Å²	155	139.6 Å²	139.6	81%	0.812	76%	0.759	S	S	*	*			trans	85.6	82.2	160.2	-56.8	178.7	0	0	0	118.4
56	D	30.9	Very low	31.9	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	76%	0.759	S	S	*	*				-63.6	149.3	129.1	-163.1	17.5	0	0	0	108.3	T58	D56-T58 PolarHBondContact OD1-N 3.39Å
57	P	44.1	Very low	32.1	Very low	98 Å²	98	140.6 Å²	140.6	64%	0.636	76%	0.762	S	S	*	*				-152.4	152.5	88.1	41.1	-22.7	0	0	0	117.4
58	T	28.9	Very low	32.3	Very low	115 Å²	115	133.7 Å²	133.7	71%	0.706	75%	0.751	S	S	*	*			trans	68.1	114.3	137.7	52.7	0	0	0	0	122.2	D56	D56-T58 PolarHBondContact OD1-N 3.39Å
59	D	28.6	Very low	32.6	Very low	151 Å²	151	131.6 Å²	131.6	81%	0.807	75%	0.745	S	S	*	*				88	164.8	114.7	-160.9	30.1	0	0	0	121
60	V	31.5	Very low	32.8	Very low	111 Å²	111	130.9 Å²	130.9	67%	0.673	75%	0.746	S	S	*	*			trans	80	95	166.9	-165.3	0	0	0	0	117.6
61	S	36.8	Very low	32.9	Very low	110 Å²	110	125 Å²	125	77%	0.769	74%	0.739	S	S	*	*			trans	-74.7	149.3	144.3	82.8	0	0	0	0	109.6
62	P	41.6	Very low	33.3	Very low	116 Å²	116	126.3 Å²	126.3	75%	0.753	75%	0.748	S	S	*	*				-152.6	-176.9	87.4	40.6	-21.9	0	0	0	116.6
63	C	31.6	Very low	33.6	Very low	118 Å²	118	127.1 Å²	127.1	80%	0.797	76%	0.762	S	S	*	*			trans	-57	170.4	-173.3	-52.1	0	0	0	0	119.4
64	S	32.2	Very low	34	Very low	128 Å²	128	132.6 Å²	132.6	90%	0.895	77%	0.773	S	S	*	*			trans	95.7	166.6	153.1	82.3	0	0	0	0	117.7
65	A	36.2	Very low	34.3	Very low	87 Å²	87	131.4 Å²	131.4	72%	0.719	78%	0.775	S	S	*	*			trans	-131.5	165.2	-157.2	0	0	0	0	0	112.8
66	T	31.6	Very low	34.5	Very low	127 Å²	127	128.7 Å²	128.7	78%	0.779	78%	0.775	S	S	*	*				167.8	128.2	124.5	-70.8	0	0	0	0	113
67	Y	32	Very low	34.5	Very low	206 Å²	206	130.2 Å²	130.2	81%	0.808	78%	0.779	S	S	*	*			trans	12.2	129.8	159.4	-77.5	-95.4	0	0	0	123.5
68	S	36.3	Very low	34.3	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	78%	0.783	S	S	*	*				-156.7	124.9	123.1	-88.9	0	0	0	0	110.5
69	N	35.5	Very low	34.7	Very low	125 Å²	125	132.3 Å²	132.3	67%	0.668	79%	0.786	S	S	*	*				66.2	130.1	88.4	-59.2	-47.1	0	0	0	112.9
70	L	34.3	Very low	35.3	Very low	153 Å²	153	131 Å²	131	80%	0.801	79%	0.786	S	S	*	*			cis	-155.4	148.1	9.7	-158.3	80.6	0	0	0	110.8
71	G	32.1	Very low	35.4	Very low	76 Å²	76	134 Å²	134	78%	0.784	79%	0.79	S	S	*	*			trans	-170.1	130.8	173.2	0	0	0	0	0	112.5
72	Q	37.3	Very low	35.2	Very low	175 Å²	175	136.7 Å²	136.7	82%	0.818	79%	0.79	S	S	*	*			trans	-107.9	128.9	-164.7	-62.6	176.5	-5.4	0	0	113.9
73	S	35.6	Very low	35.1	Very low	128 Å²	128	136.9 Å²	136.9	90%	0.895	79%	0.791	S	S	*	*				165.7	163	127.4	-77.8	0	0	0	0	111.6
74	R	36.8	Very low	35.2	Very low	245 Å²	245	143.1 Å²	143.1	93%	0.925	80%	0.798	S	S	*	*			trans	-137.3	150	-164	-155.3	-176.7	-169.9	-168.7	4.6	113.3
75	A	36.3	Very low	35.1	Very low	89 Å²	89	145.9 Å²	145.9	74%	0.736	80%	0.796	S	S	*	*			trans	73.6	103.6	158.3	0	0	0	0	0	119.6
76	A	34.3	Very low	35.9	Very low	99 Å²	99	146.2 Å²	146.2	82%	0.818	79%	0.791	S	S	*	*				37.6	140.1	123.4	0	0	0	0	0	122.1
77	M	32	Very low	35.9	Very low	175 Å²	175	150 Å²	150	86%	0.862	80%	0.797	S	S	*	*			trans	-155.4	156.2	131.5	-108.4	-64.5	-91.3	0	0	112
78	I	38.3	Very low	35.7	Very low	138 Å²	138	143.6 Å²	143.6	71%	0.708	79%	0.794	S	S	*	*			trans	-99.1	141.8	-178	-62.6	164	0	0	0	109	P80	I78-P80 WeakPolarHBondContact O-CD 3.29Å
79	P	38	Very low	35.4	Very low	119 Å²	119	143.4 Å²	143.4	77%	0.773	80%	0.799	S	S	*	*			trans	-73	121.8	175.7	28.4	-34	0	0	0	112.6
80	P	41.3	Very low	35.2	Very low	124 Å²	124	143.4 Å²	143.4	81%	0.805	80%	0.802	S	S	*	*			trans	-88.8	-173.8	175.1	37.3	-34.7	0	0	0	112.7	I78	I78-P80 WeakPolarHBondContact O-CD 3.29Å
81	K	33.5	Very low	35	Very low	174 Å²	174	142.8 Å²	142.8	76%	0.757	80%	0.8	S	S	*	*			trans	-137	139.4	-158	-144.8	174.7	-176.9	177.4	0	113.1
82	H	31.8	Very low	35.1	Very low	166 Å²	166	146.7 Å²	146.7	77%	0.769	80%	0.803	S	S	*	*			trans	67.6	175.7	174.4	-40.8	111.9	0	0	0	115.8
83	P	40.7	Very low	34.8	Very low	119 Å²	119	142 Å²	142	77%	0.773	79%	0.794	S	S	*	*			cis	-130	175.2	-9.7	40.6	-25.8	0	0	0	115.1
84	R	32.7	Very low	35	Very low	249 Å²	249	144 Å²	144	94%	0.94	79%	0.793	S	S	*	*			trans	-148.1	140.1	152.9	-71.9	-164.2	-163.2	158.7	7.3	113.4
85	H	31.3	Very low	34.7	Very low	186 Å²	186	136.1 Å²	136.1	86%	0.861	78%	0.78	S	S	*	*			trans	-172.8	170.1	169.5	-111.4	-44.2	0	0	0	105.6
86	P	52.9	Low	34.6	Very low	95 Å²	95	142.2 Å²	142.2	62%	0.617	79%	0.791	S	S	*	*			cis	-131	-165.1	-22.7	35.2	-15	0	0	0	112
87	K	30.1	Very low	34.4	Very low	205 Å²	205	141.2 Å²	141.2	89%	0.891	79%	0.79	S	S	*	*			trans	72.6	151.2	173.7	-49.5	170.4	-178.7	178.8	0	115.3
88	G	28.4	Very low	34.3	Very low	73 Å²	73	140.5 Å²	140.5	75%	0.753	78%	0.784	S	S	*	*			cis	154.9	153.9	-13.9	0	0	0	0	0	114.6
89	A	29.8	Very low	34.1	Very low	99 Å²	99	141 Å²	141	82%	0.818	78%	0.782	S	S	*	*			trans	78.7	137	164.4	0	0	0	0	0	120.7
90	V	30.9	Very low	33.8	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	78%	0.777	S	S	*	*			trans	74.9	125.6	147.5	168.5	0	0	0	0	119.9
91	D	31.6	Very low	33.5	Very low	141 Å²	141	141 Å²	141	75%	0.754	77%	0.772	S	S	*	*			trans	32.1	154.7	139.3	-44.6	-25.3	0	0	0	120.8
92	D	33.3	Very low	33.7	Very low	157 Å²	157	140.2 Å²	140.2	84%	0.84	77%	0.772	S	S	*	*			cis	-153.5	-174.9	25.2	-152.7	-13	0	0	0	113.4
93	A	30.9	Very low	33.7	Very low	76 Å²	76	140 Å²	140	63%	0.628	77%	0.771	S	S	*	*			trans	-50.8	156.4	-172.7	0	0	0	0	0	118.8
94	I	39.8	Very low	33.4	Very low	170 Å²	170	137.8 Å²	137.8	87%	0.872	77%	0.769	S	S	*	*				-164.2	147.4	105.3	-94.3	155.4	0	0	0	109.5
95	A	31.3	Very low	33.3	Very low	80 Å²	80	133.8 Å²	133.8	66%	0.661	77%	0.766	S	S	*	*			trans	-114.5	161.1	-177.6	0	0	0	0	0	112.3
96	F	33.4	Very low	33.3	Very low	217 Å²	217	133.2 Å²	133.2	95%	0.952	77%	0.769	S	S	*	*			trans	174.5	108.2	150.1	-85.9	-59.6	0	0	0	105.3
97	G	29.3	Very low	32.3	Very low	78 Å²	78	133.2 Å²	133.2	80%	0.804	78%	0.777	S	S	*	*				117.1	156.4	70.8	0	0	0	0	0	107.5
98	E	29.8	Very low	32.6	Very low	160 Å²	160	129.4 Å²	129.4	75%	0.748	78%	0.776	S	S	*	*			cis	-166.8	166.3	-3.3	-161	-157.9	150.1	0	0	108.1
99	K	34.2	Very low	32.8	Very low	149 Å²	149	134.5 Å²	134.5	65%	0.648	78%	0.781	S	S	*	*			trans	78.3	110.6	162.1	-53.5	-171.8	-172.3	-178.3	0	117.8
100	T	32.5	Very low	33.4	Very low	112 Å²	112	134.5 Å²	134.5	69%	0.687	77%	0.772	S	S	*	*				101.5	140.6	79	54.4	0	0	0	0	111.1
101	D	35.8	Very low	33.6	Very low	130 Å²	130	135 Å²	135	70%	0.695	78%	0.776	S	S	*	*			cis	-164	161	-4.3	-102.9	-24.8	0	0	0	111.5
102	Q	37.3	Very low	34	Very low	159 Å²	159	133.7 Å²	133.7	74%	0.743	78%	0.775	S	S	*	*			trans	62.1	155	156.1	-70.8	176.3	-56.6	0	0	118.9
103	E	32.2	Very low	34.3	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.752	77%	0.773	S	S	*	*			cis	-149.5	162.2	3.8	-164.3	67.3	-114.8	0	0	109.5
104	G	33	Very low	34.8	Very low	72 Å²	72	134.6 Å²	134.6	74%	0.742	78%	0.783	S	S	*	*			trans	115.9	94.7	153.9	0	0	0	0	0	118.3
105	L	30.6	Very low	34.5	Very low	165 Å²	165	134.1 Å²	134.1	86%	0.864	78%	0.781	S	S	*	*			trans	-94.1	148.2	172.5	-76.1	163.2	0	0	0	113.1
106	N	31.5	Very low	34.8	Very low	174 Å²	174	136.3 Å²	136.3	93%	0.93	79%	0.789	S	S	*	*			trans	-165.2	150.3	139	-100.1	-46.7	0	0	0	110.4
107	A	32.8	Very low	34.9	Very low	96 Å²	96	135.9 Å²	135.9	79%	0.793	79%	0.787	S	S	*	*			trans	-144.9	142	-163.1	0	0	0	0	0	115.6
108	S	35.9	Very low	35.3	Very low	124 Å²	124	142.1 Å²	142.1	87%	0.867	79%	0.792	S	S	*	*			trans	-172.8	152.5	149.1	45.6	0	0	0	0	111.6
109	Q	32.9	Very low	35.2	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	80%	0.796	S	S	*	*			trans	-121.5	-170	173	-45.2	-175.8	-11.8	0	0	109.1
110	P	43.4	Very low	35.1	Very low	99 Å²	99	143.1 Å²	143.1	64%	0.643	80%	0.804	S	S	*	*			cis	-137.9	-169.1	-9.2	37.1	-15.9	0	0	0	115.7
111	T	34.9	Very low	35	Very low	135 Å²	135	148 Å²	148	83%	0.828	81%	0.81	S	S	*	*			trans	81.5	149.2	154.7	38.4	0	0	0	0	121.6
112	P	39.5	Very low	34.7	Very low	113 Å²	113	145.7 Å²	145.7	73%	0.734	81%	0.809	S	S	*	*			trans	-121.9	165.7	-159.1	43	-30.5	0	0	0	117
113	P	38.4	Very low	34.3	Very low	123 Å²	123	145.6 Å²	145.6	80%	0.799	81%	0.814	S	S	*	*			trans	-98.5	166.8	164.5	37.1	-31.3	0	0	0	113.8
114	P	41.4	Very low	34.5	Very low	129 Å²	129	144.5 Å²	144.5	84%	0.838	82%	0.818	S	S	*	*			trans	-105.8	176.1	-160	40.7	-37.6	0	0	0	117.1
115	L	34.3	Very low	34.4	Very low	159 Å²	159	149.4 Å²	149.4	83%	0.832	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-55.6	147	175.4	-70.4	163.9	0	0	0	114.3
116	P	38.1	Very low	34.7	Very low	127 Å²	127	147.5 Å²	147.5	83%	0.825	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.6	137.3	-177.1	30.4	-35.5	0	0	0	113.3
117	K	35.8	Very low	34.8	Very low	208 Å²	208	145.3 Å²	145.3	90%	0.904	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95.3	142.4	168.7	-70.7	-179.6	179	176.1	0	110.5
118	K	36.6	Very low	34.8	Very low	208 Å²	208	144.3 Å²	144.3	90%	0.904	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.6	137.6	174.2	-61.4	-179.2	178.8	-177.4	0	110.7
119	M	29.1	Very low	35	Very low	169 Å²	169	146.7 Å²	146.7	83%	0.833	79%	0.788	S	S	*	*			trans	-149.7	143.1	151.4	-127.6	176.9	72.6	0	0	111.2
120	I	32	Very low	35.1	Very low	162 Å²	162	144 Å²	144	83%	0.831	78%	0.779	S	S	*	*			trans	-99.1	132.2	-176.9	-62.8	164.3	0	0	0	108.7
121	R	28.6	Very low	34.7	Very low	214 Å²	214	145 Å²	145	81%	0.808	78%	0.779	S	S	*	*			trans	-151.6	129.2	157.2	-175.7	157.6	-71	175.7	-2.8	109.6
122	A	30.8	Very low	34.7	Very low	82 Å²	82	143.7 Å²	143.7	68%	0.678	76%	0.764	S	S	*	*			trans	-78.2	145.6	171.1	0	0	0	0	0	110.3
123	N	29.4	Very low	34.3	Very low	156 Å²	156	145.6 Å²	145.6	83%	0.834	76%	0.76	S	S	*	*			trans	-141	138.6	155.5	-86.8	-36	0	0	0	106.5
124	T	34.7	Very low	33.9	Very low	139 Å²	139	142.5 Å²	142.5	85%	0.853	75%	0.745	S	S	*	*			trans	-110.5	107.3	-174.1	-47.5	0	0	0	0	108.9
125	E	32	Very low	33.5	Very low	174 Å²	174	143.4 Å²	143.4	81%	0.813	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-85.1	138.6	172.6	-66.9	-173.3	167.9	0	0	110.3
126	P	36	Very low	33.3	Very low	125 Å²	125	141.9 Å²	141.9	81%	0.812	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-76.9	128.1	-177.3	30.3	-33.8	0	0	0	111.5
127	I	34.1	Very low	32.9	Very low	128 Å²	128	140.6 Å²	140.6	66%	0.656	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-62	136.5	173.6	-68.5	172	0	0	0	110.1	L131	I127-L131 HydrophobicContact CG2-CB 4.32Å; I127-L131 HydrophobicContact CG2-CD2 4.04Å
128	S	33.6	Very low	32.7	Very low	75 Å²	75	134.9 Å²	134.9	52%	0.524	71%	0.709	S	S	.	*	P	Polyproline II helix	trans	-65	138.8	178.3	-175.1	0	0	0	0	112	D130 L131	S128-D130 PolarHBondContact O-N 3.15Å; S128-L131 PolarHBondContact O-N 3.48Å; S128-L131 VanDerWaalsContact O-N 3.17Å
129	K	38.7	Very low	32.6	Very low	175 Å²	175	132.3 Å²	132.3	76%	0.761	70%	0.704	S	S	*	*	H	α-helix	trans	-63.4	-22.7	-174.7	-65.1	-177.6	178	-179.1	0	113.7	Q132 K133	K129-Q132 PolarHBondContact O-N 3.11Å; K129-K133 PolarHBondContact O-N 2.95Å
130	D	36	Very low	32.7	Very low	123 Å²	123	129.5 Å²	129.5	66%	0.658	70%	0.7	S	S	*	*	H	α-helix	trans	-68.8	-33	177.3	-64	-48.3	0	0	0	112.9	S128 Q132 K133 A134	S128-D130 PolarHBondContact O-N 3.15Å; D130-Q132 VanDerWaalsContact C-N 3.32Å; D130-Q132 PolarHBondContact O-N 2.83Å; D130-K133 PolarHBondContact O-N 3.46Å; D130-A134 PolarHBondContact O-N 3.31Å; D130-A134 VanDerWaalsContact O-N 3.16Å
131	L	35.7	Very low	32.7	Very low	121 Å²	121	127.8 Å²	127.8	63%	0.634	70%	0.697	S	S	*	*	H	α-helix	trans	-68.1	-35.8	177.2	-175.3	61.8	0	0	0	111.4	I127 S128 M135	I127-L131 HydrophobicContact CG2-CB 4.32Å; I127-L131 HydrophobicContact CG2-CD2 4.04Å; S128-L131 PolarHBondContact O-N 3.48Å; S128-L131 VanDerWaalsContact O-N 3.17Å; L131-M135 PolarHBondContact O-N 2.63Å
132	Q	34.2	Very low	33.1	Very low	108 Å²	108	123.7 Å²	123.7	51%	0.505	69%	0.688	S	S	.	*	H	α-helix	trans	-68.6	-41.9	178.2	-162.9	167.1	-7.8	0	0	111.1	K129 D130 A134 M135 E136	K129-Q132 PolarHBondContact O-N 3.11Å; D130-Q132 VanDerWaalsContact C-N 3.32Å; D130-Q132 PolarHBondContact O-N 2.83Å; Q132-A134 PolarHBondContact O-N 3.05Å; Q132-M135 WeakPolarHBondContact O-CB 3.47Å; Q132-M135 PolarHBondContact O-N 3.3Å; Q132-M135 VanDerWaalsContact O-N 3.1Å; Q132-E136 PolarHBondContact O-N 3.25Å
133	K	30.2	Very low	33.1	Very low	152 Å²	152	123.5 Å²	123.5	66%	0.661	69%	0.687	S	S	*	*	H	α-helix	trans	-65.4	-34.5	178	-159.8	173.6	-174.9	-178.7	0	113.3	K129 D130 M135 S137	K129-K133 PolarHBondContact O-N 2.95Å; D130-K133 PolarHBondContact O-N 3.46Å; K133-M135 VanDerWaalsContact C-N 3.33Å; K133-S137 WeakPolarHBondContact O-CB 3.41Å; K133-S137 PolarHBondContact O-N 2.59Å; K133-S137 VanDerWaalsContact O-N 3.1Å
134	A	31.3	Very low	33.5	Very low	59 Å²	59	118.9 Å²	118.9	49%	0.488	66%	0.662	S	S	.	*	H	α-helix	trans	-66.1	-35.4	171.9	0	0	0	0	0	112.5	D130 Q132 S138	D130-A134 PolarHBondContact O-N 3.31Å; D130-A134 VanDerWaalsContact O-N 3.16Å; Q132-A134 PolarHBondContact O-N 3.05Å; A134-S138 PolarHBondContact O-N 3.44Å; A134-S138 PolarHBondContact O-OG 2.83Å
135	M	33	Very low	33.6	Very low	148 Å²	148	118.3 Å²	118.3	73%	0.729	66%	0.661	S	S	*	*	H	α-helix	trans	-74.1	-37.5	179.7	-146.8	173.5	74.6	0	0	112.2	L131 Q132 K133 S138	L131-M135 PolarHBondContact O-N 2.63Å; Q132-M135 WeakPolarHBondContact O-CB 3.47Å; Q132-M135 PolarHBondContact O-N 3.3Å; Q132-M135 VanDerWaalsContact O-N 3.1Å; K133-M135 VanDerWaalsContact C-N 3.33Å; M135-S138 WeakPolarHBondContact O-CB 3.39Å; M135-S138 PolarHBondContact O-N 3.37Å
136	E	29.3	Very low	34	Very low	126 Å²	126	114.9 Å²	114.9	59%	0.589	65%	0.652	S	S	*	*	H	α-helix	trans	-69.4	-35.6	174.9	-72	167.1	-177.1	0	0	111.8	Q132 S138	Q132-E136 PolarHBondContact O-N 3.25Å; E136-S138 PolarHBondContact O-N 3.04Å
137	S	30.1	Very low	34.1	Very low	100 Å²	100	116.4 Å²	116.4	70%	0.699	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-4.8	172.3	-169.9	0	0	0	0	114.5	K133 L139	K133-S137 WeakPolarHBondContact O-CB 3.41Å; K133-S137 PolarHBondContact O-N 2.59Å; K133-S137 VanDerWaalsContact O-N 3.1Å; S137-L139 VanDerWaalsContact C-N 3.34Å
138	S	32.3	Very low	34.1	Very low	89 Å²	89	117.9 Å²	117.9	62%	0.622	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	4.7	-178.9	-62	0	0	0	0	113.7	A134 M135 E136 C140	A134-S138 PolarHBondContact O-N 3.44Å; A134-S138 PolarHBondContact O-OG 2.83Å; M135-S138 WeakPolarHBondContact O-CB 3.39Å; M135-S138 PolarHBondContact O-N 3.37Å; E136-S138 PolarHBondContact O-N 3.04Å; S138-C140 PolarHBondContact O-N 2.98Å
139	L	34.6	Very low	34.3	Very low	153 Å²	153	121 Å²	121	80%	0.801	66%	0.661	S	S	*	*			trans	-73.4	61.2	163.1	-74.6	172.2	0	0	0	110.6	S137 V141	S137-L139 VanDerWaalsContact C-N 3.34Å; L139-V141 PolarHBondContact O-N 3.28Å
140	C	30.9	Very low	33.9	Very low	110 Å²	110	118.5 Å²	118.5	74%	0.743	66%	0.656	S	S	*	*			trans	-62.1	118.9	170.4	-172	0	0	0	0	108.6	S138 M142	S138-C140 PolarHBondContact O-N 2.98Å; C140-M142 PolarHBondContact O-N 3.03Å
141	V	31.7	Very low	34	Very low	126 Å²	126	118.2 Å²	118.2	76%	0.764	66%	0.661	S	S	*	*			trans	-68	95.5	-176.8	177.2	0	0	0	0	108.6	L139 A143	L139-V141 PolarHBondContact O-N 3.28Å; V141-A143 HydrophobicContact CG1-CB 3.88Å; V141-A143 PolarHBondContact O-N 3.06Å
142	M	37.2	Very low	34	Very low	128 Å²	128	119 Å²	119	63%	0.631	67%	0.666	S	S	*	*			trans	-77.1	38.9	-176.4	-155.2	-177	-57.5	0	0	112.3	C140 I656	C140-M142 PolarHBondContact O-N 3.03Å; M142-I656 HydrophobicContact CE-CD1 3.85Å; M142-I656 HydrophobicContact SD-CD1 4.42Å; M142-I656 HydrophobicContact SD-CG2 4.36Å
143	A	31.1	Very low	34.4	Very low	78 Å²	78	123.8 Å²	123.8	65%	0.645	68%	0.679	S	S	*	*			trans	-73.4	124.6	175.3	0	0	0	0	0	109.4	V141	V141-A143 HydrophobicContact CG1-CB 3.88Å; V141-A143 PolarHBondContact O-N 3.06Å
144	N	37.3	Very low	34.6	Very low	59 Å²	59	124.6 Å²	124.6	32%	0.316	69%	0.691	S	S	.	*			trans	-94.1	114.3	178.3	173.8	60.7	0	0	0	109.2	T146 Y147	N144-T146 PolarHBondContact ND2-OG1 2.73Å; N144-T146 PolarHBondContact O-N 3.25Å; N144-T146 PolarHBondContact OD1-OG1 3.26Å; N144-Y147 HydrophobicContact CB-CD2 3.97Å; N144-Y147 HydrophobicContact CB-CE2 4.19Å; N144-Y147 WeakPolarHBondContact ND2-CD2 3.19Å; N144-Y147 PolarHBondContact O-N 2.98Å
145	P	36.1	Very low	34.7	Very low	127 Å²	127	125.9 Å²	125.9	83%	0.825	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	27.4	-175.6	33.5	-37.8	0	0	0	113.9
146	T	40.1	Very low	34.8	Very low	103 Å²	103	123.8 Å²	123.8	63%	0.632	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.6	20.9	175	47.8	0	0	0	0	112.1	N144	N144-T146 PolarHBondContact ND2-OG1 2.73Å; N144-T146 PolarHBondContact O-N 3.25Å; N144-T146 PolarHBondContact OD1-OG1 3.26Å
147	Y	39.6	Very low	35	Very low	156 Å²	156	123.6 Å²	123.6	61%	0.612	71%	0.714	S	S	*	*	S	Bend	trans	-99.6	113.2	153.2	-73.2	-67.4	0	0	0	107.9	N144 I149	N144-Y147 HydrophobicContact CB-CD2 3.97Å; N144-Y147 HydrophobicContact CB-CE2 4.19Å; N144-Y147 WeakPolarHBondContact ND2-CD2 3.19Å; N144-Y147 PolarHBondContact O-N 2.98Å; Y147-I149 PolarHBondContact O-N 2.99Å
148	D	32.7	Very low	35.1	Very low	160 Å²	160	124.3 Å²	124.3	86%	0.856	73%	0.726	S	S	*	*			trans	-72	108.4	172.5	-159	1.9	0	0	0	108.1
149	I	38.9	Very low	35	Very low	139 Å²	139	123.6 Å²	123.6	71%	0.713	73%	0.733	S	S	*	*			trans	-103.9	110.6	173.8	-62.9	-179.5	0	0	0	106.2	Y147	Y147-I149 PolarHBondContact O-N 2.99Å
150	D	29.8	Very low	34.7	Very low	123 Å²	123	121.7 Å²	121.7	66%	0.658	73%	0.732	S	S	*	*			trans	-47.1	115.3	-173.2	-158.7	-19.1	0	0	0	111.9	N152	D150-N152 PolarHBondContact O-N 3.12Å
151	P	38.1	Very low	34.4	Very low	117 Å²	117	122.5 Å²	122.5	76%	0.76	74%	0.739	S	S	*	*	S	Bend	trans	-76.4	19.2	-160.2	30.1	-37.7	0	0	0	115.4
152	N	34.7	Very low	34.1	Very low	137 Å²	137	124.3 Å²	124.3	73%	0.733	74%	0.743	S	S	*	*			trans	-97.6	13.3	-172.8	-163.9	29.7	0	0	0	114.5	D150	D150-N152 PolarHBondContact O-N 3.12Å
153	W	44.1	Very low	33.6	Very low	209 Å²	209	123.6 Å²	123.6	79%	0.792	75%	0.75	S	S	*	*			trans	-89.4	-14.6	-169.7	-103.7	95	0	0	0	116.7	A155	W153-A155 PolarHBondContact O-N 3.23Å; W153-A155 VanDerWaalsContact O-N 3.1Å
154	D	33.6	Very low	33.5	Very low	169 Å²	169	129.4 Å²	129.4	90%	0.904	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	2.8	-172	-82.5	-30.4	0	0	0	115.5
155	A	33.1	Very low	33.1	Very low	86 Å²	86	135 Å²	135	71%	0.711	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-9.6	-174.3	0	0	0	0	0	115.7	W153	W153-A155 PolarHBondContact O-N 3.23Å; W153-A155 VanDerWaalsContact O-N 3.1Å
156	S	34.8	Very low	32.8	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	78%	0.781	S	S	*	*	S	Bend	trans	-147	53.7	-168.5	-65	0	0	0	0	116
157	S	33.5	Very low	32.4	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	79%	0.794	S	S	*	*			trans	-144.3	34.7	168.1	-154.5	0	0	0	0	114.7	G159	S157-G159 PolarHBondContact O-N 2.97Å
158	A	33.3	Very low	31.8	Very low	116 Å²	116	137.7 Å²	137.7	96%	0.959	80%	0.802	S	S	*	*			trans	-89.9	74.7	175.6	0	0	0	0	0	112.1
159	G	29.1	Very low	31.7	Very low	73 Å²	73	138.4 Å²	138.4	75%	0.753	81%	0.805	S	S	*	*			trans	122.5	104.5	157.9	0	0	0	0	0	117.5	S157	S157-G159 PolarHBondContact O-N 2.97Å
160	S	28.4	Very low	31.2	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	81%	0.811	S	S	*	*				-166.4	108.3	117.4	-170.3	0	0	0	0	110.7
161	S	25.4	Very low	31.3	Very low	126 Å²	126	138.5 Å²	138.5	88%	0.881	81%	0.811	S	S	*	*			trans	-139.8	83.3	173.4	-76.6	0	0	0	0	110.3
162	I	25.9	Very low	30.8	Very low	164 Å²	164	141.8 Å²	141.8	84%	0.841	82%	0.816	S	S	*	*			trans	-138.2	112.6	162	20.5	174.4	0	0	0	109.1
163	S	26.9	Very low	30.4	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	82%	0.816	S	S	*	*			trans	-77.2	152.1	170.8	179.9	0	0	0	0	110.3
164	Y	29	Very low	29.6	Very low	200 Å²	200	140.5 Å²	140.5	78%	0.784	82%	0.819	S	S	*	*			trans	-137.3	134.3	156.3	107.9	-99.7	0	0	0	109.9
165	E	28.9	Very low	29.2	Very low	176 Å²	176	140.4 Å²	140.4	82%	0.822	81%	0.813	S	S	*	*			trans	-88.5	145.6	178.7	-67.6	-166.9	135.2	0	0	112	K167	E165-K167 PolarHBondContact O-N 3.25Å
166	L	29.1	Very low	29.1	Very low	158 Å²	158	140.5 Å²	140.5	83%	0.827	81%	0.808	S	S	*	*			trans	-75.2	109.1	-178.4	-178.7	69	0	0	0	112.4
167	K	31.2	Very low	29	Very low	209 Å²	209	142.4 Å²	142.4	91%	0.909	81%	0.81	S	S	*	*			trans	-160.8	129	162.7	-112.2	166.8	-173.2	168.1	0	111.7	E165	E165-K167 PolarHBondContact O-N 3.25Å
168	G	28.2	Very low	28.7	Very low	76 Å²	76	142.3 Å²	142.3	78%	0.784	80%	0.796	S	S	*	*			trans	159.1	154.7	178.3	0	0	0	0	0	110.8
169	L	30.1	Very low	28.5	Very low	175 Å²	175	146.2 Å²	146.2	92%	0.916	79%	0.785	S	S	*	*			trans	-132.4	151.1	-177.2	-77.3	167.6	0	0	0	111.3
170	D	28	Very low	29.3	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	78%	0.782	S	S	*	*			trans	83.1	161.7	146.1	-134	-14	0	0	0	121.1
171	V	31.1	Very low	29.3	Very low	110 Å²	110	149 Å²	149	67%	0.667	78%	0.779	S	S	*	*			trans	80	88.3	167.4	-165.6	0	0	0	0	120
172	E	27.7	Very low	29.5	Very low	185 Å²	185	151.5 Å²	151.5	86%	0.864	78%	0.776	S	S	*	*				60.6	166.8	125.2	-60.5	-166.4	124	0	0	125.3
173	S	28.1	Very low	29.9	Very low	105 Å²	105	152.6 Å²	152.6	73%	0.734	78%	0.775	S	S	*	*			trans	78.4	117.8	178	-151.7	0	0	0	0	116.6
174	Y	26.3	Very low	30	Very low	214 Å²	214	156.7 Å²	156.7	84%	0.839	78%	0.782	S	S	*	*				55.5	132.5	62.1	-77.6	-96.6	0	0	0	112.3
175	E	26.1	Very low	30.2	Very low	168 Å²	168	156.6 Å²	156.6	79%	0.785	78%	0.78	S	S	*	*			cis	-160	168.1	30.1	-172.5	162.7	-175.7	0	0	114.7
176	S	30.4	Very low	30.6	Very low	87 Å²	87	154.1 Å²	154.1	61%	0.608	78%	0.779	S	S	*	*			trans	-6.1	172.5	156.2	-52.2	0	0	0	0	123.9
177	L	31.6	Very low	30.7	Very low	145 Å²	145	151.3 Å²	151.3	76%	0.759	77%	0.769	S	S	*	*			cis	-169.6	158.9	-25.9	-95.8	173.3	0	0	0	109.3
178	E	27.6	Very low	32.2	Very low	120 Å²	120	146.6 Å²	146.6	56%	0.561	76%	0.759	S	S	*	*			trans	53	117.4	145.3	-69.1	-159.5	-170.4	0	0	127
179	R	30.3	Very low	32.2	Very low	197 Å²	197	148.9 Å²	148.9	74%	0.743	76%	0.763	S	S	*	*				67.9	176.6	120.2	-64.3	-172.1	-172.4	127.5	10.7	120.3
180	P	44.8	Very low	32.3	Very low	104 Å²	104	145.2 Å²	145.2	68%	0.675	76%	0.758	S	S	*	*				-139.8	-179.2	-57.7	42	-26.8	0	0	0	116.1
181	L	29.5	Very low	32.3	Very low	141 Å²	141	142.2 Å²	142.2	74%	0.738	76%	0.755	S	S	*	*			trans	68.8	136.8	152.4	-108.4	89.3	0	0	0	120.8
182	H	28.9	Very low	32.4	Very low	179 Å²	179	144.4 Å²	144.4	83%	0.829	76%	0.763	S	S	*	*				-166.1	167.2	99.5	-113.2	-95.5	0	0	0	112.6
183	K	35.1	Very low	32.6	Very low	187 Å²	187	140.4 Å²	140.4	81%	0.813	76%	0.755	S	S	*	*			trans	-104.4	160.1	176.5	-69.2	173.2	173.5	171.7	0	110.7
184	E	27.5	Very low	32.8	Very low	200 Å²	200	143.2 Å²	143.2	94%	0.935	76%	0.761	S	S	*	*				-163.1	173.6	119.7	-117.1	172.8	-149.9	0	0	115.3
185	R	33.4	Very low	33	Very low	198 Å²	198	138.7 Å²	138.7	75%	0.747	76%	0.76	S	S	*	*			trans	-163.4	132.2	-173.9	177.5	-168.6	-171.9	-160	5.8	111.8	V187	R185-V187 HydrophobicContact CG-CG2 4.26Å
186	P	37.7	Very low	33.2	Very low	124 Å²	124	135.5 Å²	135.5	81%	0.805	76%	0.756	S	S	*	*			trans	-107.9	173.2	153.1	-6.3	27.4	0	0	0	113.8
187	V	30.3	Very low	33.3	Very low	99 Å²	99	139 Å²	139	60%	0.6	77%	0.767	S	S	*	*			trans	-139.9	-160.3	-175.3	-146.7	0	0	0	0	110.5	R185	R185-V187 HydrophobicContact CG-CG2 4.26Å
188	P	62.9	Low	33.1	Very low	109 Å²	109	136 Å²	136	71%	0.708	76%	0.763	S	S	*	*				-119.7	-176.5	-121.9	44.6	-28.9	0	0	0	116.3
189	S	28.9	Very low	33.3	Very low	125 Å²	125	137.2 Å²	137.2	87%	0.874	78%	0.779	S	S	*	*			trans	-169.1	172.6	146.7	-82.8	0	0	0	0	111.9
190	A	31.3	Very low	33.2	Very low	97 Å²	97	136 Å²	136	80%	0.802	79%	0.787	S	S	*	*				-177.1	128.5	-82.9	0	0	0	0	0	111.3
191	A	29.6	Very low	32.3	Very low	93 Å²	93	136.6 Å²	136.6	77%	0.769	79%	0.793	S	S	*	*			trans	-163.7	117.9	166.2	0	0	0	0	0	113.8
192	N	33	Very low	32.6	Very low	156 Å²	156	136.7 Å²	136.7	83%	0.834	80%	0.799	S	S	*	*				32.4	139.8	127.9	-52.1	-6.9	0	0	0	119.9
193	S	31.5	Very low	32.7	Very low	101 Å²	101	137 Å²	137	71%	0.706	80%	0.799	S	S	*	*			cis	-170.4	153.5	6.3	-125	0	0	0	0	115
194	I	32.6	Very low	32.3	Very low	164 Å²	164	133 Å²	133	84%	0.841	79%	0.786	S	S	*	*			trans	28.6	117.1	158.4	46.9	168.9	0	0	0	122.6
195	S	29.4	Very low	32.6	Very low	119 Å²	119	134.4 Å²	134.4	83%	0.832	78%	0.782	S	S	*	*				-177.2	139.7	100.4	-174.5	0	0	0	0	114.8
196	S	31	Very low	32.3	Very low	101 Å²	101	133 Å²	133	71%	0.706	78%	0.782	S	S	*	*			trans	-46.1	160.3	164.5	-63.4	0	0	0	0	116.2
197	L	31.8	Very low	31.9	Very low	159 Å²	159	132.1 Å²	132.1	83%	0.832	78%	0.779	S	S	*	*			cis	-159.4	147.2	10.2	-126.4	163.3	0	0	0	113.3
198	A	28.8	Very low	31.9	Very low	82 Å²	82	135.4 Å²	135.4	68%	0.678	79%	0.793	S	S	*	*			trans	37.4	113.8	153.3	0	0	0	0	0	123.6
199	T	31.2	Very low	30.2	Very low	146 Å²	146	136 Å²	136	90%	0.896	80%	0.8	S	S	*	*				-137.8	156.9	122.1	46.5	0	0	0	0	109.8
200	L	28.2	Very low	30.4	Very low	173 Å²	173	137.5 Å²	137.5	91%	0.906	80%	0.795	S	S	*	*			trans	-93.2	113.7	-171.7	-72.6	168.8	0	0	0	112.5
201	S	26.8	Very low	30.4	Very low	116 Å²	116	140.8 Å²	140.8	81%	0.811	79%	0.794	S	S	*	*			trans	-83.3	116	169.6	-177.2	0	0	0	0	110.8	K203	S201-K203 PolarHBondContact O-N 3.07Å
202	V	33.9	Very low	30.6	Very low	142 Å²	142	141 Å²	141	86%	0.861	79%	0.789	S	S	*	*			trans	-87.2	96.2	169.5	179.2	0	0	0	0	108.4
203	K	30.8	Very low	30.5	Very low	187 Å²	187	142 Å²	142	81%	0.813	79%	0.794	S	S	*	*			trans	-85.3	116.5	175.2	-174.5	165.9	-178.5	171	0	111.7	S201	S201-K203 PolarHBondContact O-N 3.07Å
204	D	28.4	Very low	30.5	Very low	103 Å²	103	143 Å²	143	55%	0.551	80%	0.801	S	S	*	*			trans	-27.1	131.8	160.5	-178.3	11.1	0	0	0	115.2	F206	D204-F206 WeakPolarHBondContact OD1-CD2 3.47Å; D204-F206 WeakPolarHBondContact OD1-CE2 3.45Å; D204-F206 PolarHBondContact OD1-N 3.36Å; D204-F206 WeakPolarHBondContact OD2-CE2 3.16Å
205	R	33.1	Very low	30.4	Very low	228 Å²	228	141.1 Å²	141.1	86%	0.86	80%	0.802	S	S	*	*			trans	-147.3	98.1	156.5	-100.2	-163.2	-68.9	179.3	-2.5	110.4
206	F	27.7	Very low	30.8	Very low	169 Å²	169	146.3 Å²	146.3	74%	0.741	80%	0.804	S	S	*	*			trans	-52.6	140.5	156.4	-69.2	-92.7	0	0	0	110.7	D204	D204-F206 WeakPolarHBondContact OD1-CD2 3.47Å; D204-F206 WeakPolarHBondContact OD1-CE2 3.45Å; D204-F206 PolarHBondContact OD1-N 3.36Å; D204-F206 WeakPolarHBondContact OD2-CE2 3.16Å
207	S	29.3	Very low	30.9	Very low	105 Å²	105	153.5 Å²	153.5	73%	0.734	82%	0.815	S	S	*	*			trans	-154.3	112	171.9	-74.6	0	0	0	0	109.9
208	N	30	Very low	30.9	Very low	168 Å²	168	149.7 Å²	149.7	90%	0.898	81%	0.814	S	S	*	*			trans	-78.2	121.7	175.2	-63.6	-27.9	0	0	0	109.3
209	S	27.5	Very low	31.2	Very low	121 Å²	121	154.5 Å²	154.5	85%	0.846	83%	0.827	S	S	*	*			trans	-153.7	146.7	158.9	-162.6	0	0	0	0	111.8
210	M	32.2	Very low	31.2	Very low	157 Å²	157	152.8 Å²	152.8	77%	0.773	82%	0.822	S	S	*	*			trans	-86.8	177.9	170.1	-82.7	166	32.8	0	0	111.3
211	E	30.7	Very low	31.4	Very low	166 Å²	166	155.3 Å²	155.3	78%	0.776	82%	0.821	S	S	*	*			trans	68.5	83.6	161.3	-66.6	-173.2	143.7	0	0	119.3
212	S	34.4	Very low	32	Very low	97 Å²	97	160.6 Å²	160.6	68%	0.678	82%	0.823	S	S	*	*				40.8	114.3	117.6	61.4	0	0	0	0	120.8
213	L	31.7	Very low	32	Very low	179 Å²	179	162.3 Å²	162.3	94%	0.937	82%	0.821	S	S	*	*			trans	-135.9	109.1	143	-76.8	-179.2	0	0	0	111.1	S215	L213-S215 PolarHBondContact O-N 2.89Å
214	S	32	Very low	32.1	Very low	120 Å²	120	160.1 Å²	160.1	84%	0.839	82%	0.824	S	S	*	*			trans	-85.1	108	174.1	-58.5	0	0	0	0	110.9
215	S	29.1	Very low	32.5	Very low	126 Å²	126	165.6 Å²	165.6	88%	0.881	84%	0.837	S	S	*	*			trans	-66.9	138.4	178.8	-172.6	0	0	0	0	112.7	L213	L213-S215 PolarHBondContact O-N 2.89Å
216	R	37.5	Very low	32.6	Very low	227 Å²	227	159.8 Å²	159.8	86%	0.857	83%	0.831	S	S	*	*			trans	-103.1	115.5	173.4	-75.7	-170.8	-179.6	-151.6	4.8	111.6
217	R	33	Very low	33.4	Very low	253 Å²	253	159.5 Å²	159.5	96%	0.955	84%	0.836	S	S	*	*				-176.8	140.9	119.6	-104.5	172.2	-104.9	-138.5	1.1	111.6
218	G	31.5	Very low	34.2	Very low	78 Å²	78	162.1 Å²	162.1	80%	0.804	84%	0.836	S	S	*	*			trans	155.9	98.4	-178.9	0	0	0	0	0	110
219	L	35.6	Very low	35	Very low	183 Å²	183	163.4 Å²	163.4	96%	0.958	83%	0.834	S	S	*	*			trans	-106.3	115.2	-178.9	-76.1	169.3	0	0	0	110.2
220	S	32.6	Very low	36.1	Very low	111 Å²	111	163.4 Å²	163.4	78%	0.776	83%	0.831	S	S	*	*			trans	-160.7	133.8	143.9	-162.2	0	0	0	0	112.8
221	Y	31.2	Very low	37.2	Very low	225 Å²	225	161.7 Å²	161.7	88%	0.882	82%	0.821	S	S	*	*			trans	52.8	152.1	162.5	-107.1	-107.8	0	0	0	122.4
222	R	39.5	Very low	38.4	Very low	228 Å²	228	162.9 Å²	162.9	86%	0.86	82%	0.819	S	S	*	*			trans	-92.1	130.4	-174.4	-65.7	174.6	173.3	176.3	-3	111.8
223	Q	34	Very low	39.4	Very low	177 Å²	177	165.5 Å²	165.5	83%	0.827	82%	0.82	S	S	*	*			trans	-141.4	107.2	138.5	-103.2	-168.6	11.7	0	0	110.5	R225	Q223-R225 PolarHBondContact O-N 3.41Å; Q223-R225 VanDerWaalsContact O-N 3.07Å
224	T	32.6	Very low	40.8	Very low	142 Å²	142	159.3 Å²	159.3	87%	0.871	80%	0.795	S	S	*	*			trans	-79.3	87.3	178.3	-3.4	0	0	0	0	110.3
225	R	38	Very low	42.2	Very low	218 Å²	218	158.2 Å²	158.2	82%	0.823	78%	0.779	S	S	*	*			trans	-98.4	108.6	157.9	-78.4	-172.6	172.1	-174.3	-1.6	108.8	Q223 I227	Q223-R225 PolarHBondContact O-N 3.41Å; Q223-R225 VanDerWaalsContact O-N 3.07Å; R225-I227 PolarHBondContact O-N 2.9Å
226	S	34	Very low	44	Very low	105 Å²	105	159.2 Å²	159.2	73%	0.734	77%	0.765	S	S	*	*			trans	-69.2	96.7	172.6	36.9	0	0	0	0	109.7	Q228	S226-Q228 VanDerWaalsContact C-N 3.32Å; S226-Q228 PolarHBondContact O-N 2.93Å
227	I	45.4	Very low	45.9	Very low	163 Å²	163	157.9 Å²	157.9	84%	0.836	76%	0.76	S	S	*	*			trans	-63.5	98.2	165.9	-60.4	173	0	0	0	106.7	R225 K229	R225-I227 PolarHBondContact O-N 2.9Å; I227-K229 PolarHBondContact O-N 2.8Å
228	Q	45.3	Very low	47.9	Very low	161 Å²	161	146.1 Å²	146.1	75%	0.752	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-62.8	125.7	175.1	-65.8	-171.9	4.2	0	0	108.3	S226	S226-Q228 VanDerWaalsContact C-N 3.32Å; S226-Q228 PolarHBondContact O-N 2.93Å
229	K	47.8	Very low	50.3	Low	194 Å²	194	147.2 Å²	147.2	84%	0.843	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-57.7	127.2	164.7	-69.7	-178.9	176.5	-179.4	0	107.1	I227 Q231	I227-K229 PolarHBondContact O-N 2.8Å; K229-Q231 PolarHBondContact O-N 3.03Å
230	P	49.4	Very low	52.6	Low	122 Å²	122	145.8 Å²	145.8	79%	0.792	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-55.6	127.9	-179.9	21.1	-31.9	0	0	0	109.6	R232	P230-R232 PolarHBondContact O-N 3.28Å
231	Q	55.1	Low	55.4	Low	120 Å²	120	143.2 Å²	143.2	56%	0.561	68%	0.675	S	S	*	*			trans	-75.3	88.4	-157.2	-170.4	179.5	15.8	0	0	111.6	K229 Q233 A234	K229-Q231 PolarHBondContact O-N 3.03Å; Q231-Q233 HydrophobicContact CG-CB 4.05Å; Q231-Q233 PolarHBondContact O-N 3.46Å; Q231-A234 HydrophobicContact CB-CB 4.22Å; Q231-A234 HydrophobicContact CG-CB 4.18Å; Q231-A234 WeakPolarHBondContact O-CB 3.36Å; Q231-A234 PolarHBondContact O-N 3.06Å
232	R	56.2	Low	58.1	Low	191 Å²	191	141.6 Å²	141.6	72%	0.721	67%	0.667	S	S	*	*	H	α-helix	trans	-48.9	-34.1	173.4	-83.6	-173.6	169.9	-177.9	-4.1	112.5	P230 A234 L235 Y236	P230-R232 PolarHBondContact O-N 3.28Å; R232-A234 VanDerWaalsContact C-N 3.25Å; R232-A234 PolarHBondContact O-N 3.41Å; R232-L235 PolarHBondContact O-N 2.82Å; R232-Y236 HydrophobicContact CB-CE2 4.36Å; R232-Y236 WeakPolarHBondContact O-CD2 3.23Å; R232-Y236 PolarHBondContact O-N 3.38Å
233	Q	55.4	Low	60.5	Low	152 Å²	152	136.9 Å²	136.9	71%	0.71	66%	0.655	S	S	*	*	H	α-helix	trans	-61.3	-25.2	175.4	-65.8	169.7	-27.7	0	0	114.4	Q231 R237	Q231-Q233 HydrophobicContact CG-CB 4.05Å; Q231-Q233 PolarHBondContact O-N 3.46Å; Q233-R237 PolarHBondContact O-N 2.79Å
234	A	61.9	Low	63.1	Low	50 Å²	50	132.9 Å²	132.9	41%	0.413	64%	0.636	S	S	.	*	H	α-helix	trans	-76.7	-33.9	177.9	0	0	0	0	0	112.2	Q231 R232 Y236 K248	Q231-A234 HydrophobicContact CB-CB 4.22Å; Q231-A234 HydrophobicContact CG-CB 4.18Å; Q231-A234 WeakPolarHBondContact O-CB 3.36Å; Q231-A234 PolarHBondContact O-N 3.06Å; R232-A234 VanDerWaalsContact C-N 3.25Å; R232-A234 PolarHBondContact O-N 3.41Å; A234-Y236 VanDerWaalsContact C-N 3.32Å; A234-Y236 PolarHBondContact O-N 2.89Å; A234-K248 PolarHBondContact O-NZ 2.97Å
235	L	60.3	Low	65.9	Low	96 Å²	96	128.6 Å²	128.6	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-62.1	-42.1	173.8	-63.4	173.8	0	0	0	110.8	R232 K248	R232-L235 PolarHBondContact O-N 2.82Å; L235-K248 PolarHBondContact O-NZ 3.27Å
236	Y	68.4	Low	68.4	Low	148 Å²	148	121 Å²	121	58%	0.58	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	6.6	-174.7	-52.7	-53.6	0	0	0	115.8	R232 A234 L239	R232-Y236 HydrophobicContact CB-CE2 4.36Å; R232-Y236 WeakPolarHBondContact O-CD2 3.23Å; R232-Y236 PolarHBondContact O-N 3.38Å; A234-Y236 VanDerWaalsContact C-N 3.32Å; A234-Y236 PolarHBondContact O-N 2.89Å; Y236-L239 HydrophobicContact CD1-CD1 3.98Å; Y236-L239 HydrophobicContact CG-CD1 4.32Å; Y236-L239 WeakPolarHBondContact O-CG 3.25Å
237	R	76.1	Confident	71.2	Confident	198 Å²	198	117.5 Å²	117.5	75%	0.747	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	139.3	167.2	174.6	-177	-76.6	-160.2	-4.5	109.9	Q233 L239 K248	Q233-R237 PolarHBondContact O-N 2.79Å; R237-L239 VanDerWaalsContact C-N 3.34Å; R237-K248 PolarHBondContact O-NZ 3.43Å
238	G	75.4	Confident	73.4	Confident	7 Å²	7	112.6 Å²	112.6	7%	0.072	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	24.2	175.8	0	0	0	0	0	113.8	D240	G238-D240 WeakPolarHBondContact CA-OD1 3.33Å; G238-D240 PolarHBondContact N-OD1 3.02Å
239	L	81.9	Confident	75.6	Confident	100 Å²	100	109 Å²	109	52%	0.524	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.4	168.6	-69.5	179.5	0	0	0	112.3	Y236 R237 N241 V245	Y236-L239 HydrophobicContact CD1-CD1 3.98Å; Y236-L239 HydrophobicContact CG-CD1 4.32Å; Y236-L239 WeakPolarHBondContact O-CG 3.25Å; R237-L239 VanDerWaalsContact C-N 3.34Å; L239-N241 PolarHBondContact O-N 2.85Å; L239-V245 HydrophobicContact CD2-CG2 4.03Å
240	D	84.4	Confident	77.9	Confident	154 Å²	154	103.2 Å²	103.2	82%	0.824	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-12.8	175.2	46.8	-56.7	0	0	0	113.6	G238	G238-D240 WeakPolarHBondContact CA-OD1 3.33Å; G238-D240 PolarHBondContact N-OD1 3.02Å
241	N	90.6	Very high	80.1	Confident	56 Å²	56	100.2 Å²	100.2	30%	0.299	48%	0.481	S	S	.	.			trans	-116.5	115.7	177.4	-177.7	5	0	0	0	110.9	L239 E243 E244 V245	L239-N241 PolarHBondContact O-N 2.85Å; N241-E243 VanDerWaalsContact C-N 3.31Å; N241-E243 PolarHBondContact O-N 2.98Å; N241-E243 PolarHBondContact OD1-N 2.94Å; N241-E243 PolarHBondContact OD1-OE2 3.09Å; N241-E244 HydrophobicContact CB-CB 4.13Å; N241-E244 HydrophobicContact CB-CG 4.29Å; N241-E244 WeakPolarHBondContact ND2-CG 3.48Å; N241-E244 PolarHBondContact ND2-OE1 2.95Å; N241-E244 PolarHBondContact O-N 2.98Å; N241-V245 WeakPolarHBondContact O-CG2 3.29Å; N241-V245 PolarHBondContact O-N 2.98Å
242	R	89.1	Confident	82	Confident	191 Å²	191	98.9 Å²	98.9	72%	0.721	48%	0.477	S	S	*	.	H	α-helix	trans	-59.1	-41.7	-174.8	179.9	-175.7	-176.8	176.1	0.4	112	E244 V245 V246	R242-E244 PolarHBondContact O-N 3.11Å; R242-V245 PolarHBondContact O-N 2.94Å; R242-V246 WeakPolarHBondContact O-CG2 3.23Å; R242-V246 PolarHBondContact O-N 2.81Å
243	E	88.5	Confident	83.9	Confident	129 Å²	129	91.2 Å²	91.2	60%	0.603	45%	0.45	S	S	*	.	H	α-helix	trans	-69.4	-34.7	-175.9	-73.2	56.6	-127.5	0	0	111.4	N241 G247	N241-E243 VanDerWaalsContact C-N 3.31Å; N241-E243 PolarHBondContact O-N 2.98Å; N241-E243 PolarHBondContact OD1-N 2.94Å; N241-E243 PolarHBondContact OD1-OE2 3.09Å; E243-G247 PolarHBondContact O-N 2.76Å
244	E	89.3	Confident	85.9	Confident	93 Å²	93	84.9 Å²	84.9	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-68.2	-40.8	170.8	-79.4	177.3	-117.7	0	0	112	N241 R242 G247 K248	N241-E244 HydrophobicContact CB-CB 4.13Å; N241-E244 HydrophobicContact CB-CG 4.29Å; N241-E244 WeakPolarHBondContact ND2-CG 3.48Å; N241-E244 PolarHBondContact ND2-OE1 2.95Å; N241-E244 PolarHBondContact O-N 2.98Å; R242-E244 PolarHBondContact O-N 3.11Å; E244-G247 PolarHBondContact O-N 2.72Å; E244-K248 WeakPolarHBondContact O-CB 3.49Å; E244-K248 WeakPolarHBondContact O-CG 3.33Å; E244-K248 PolarHBondContact O-N 3.1Å
245	V	90.8	Very high	87.5	Confident	53 Å²	53	85.8 Å²	85.8	32%	0.321	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-45.8	174.8	173.6	0	0	0	0	111.2	L239 N241 R242 K248 L249	L239-V245 HydrophobicContact CD2-CG2 4.03Å; N241-V245 WeakPolarHBondContact O-CG2 3.29Å; N241-V245 PolarHBondContact O-N 2.98Å; R242-V245 PolarHBondContact O-N 2.94Å; V245-K248 PolarHBondContact O-N 2.86Å; V245-L249 WeakPolarHBondContact O-CB 3.43Å; V245-L249 PolarHBondContact O-N 3.35Å
246	V	91.1	Very high	89.3	Confident	57 Å²	57	82.3 Å²	82.3	35%	0.345	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-45	176.7	171.5	0	0	0	0	111	R242 K248 L249 R250	R242-V246 WeakPolarHBondContact O-CG2 3.23Å; R242-V246 PolarHBondContact O-N 2.81Å; V246-K248 VanDerWaalsContact C-N 3.31Å; V246-K248 PolarHBondContact O-N 2.85Å; V246-L249 PolarHBondContact O-N 3.35Å; V246-R250 WeakPolarHBondContact O-CB 3.16Å; V246-R250 PolarHBondContact O-N 3.06Å
247	G	92.2	Very high	90.6	Very high	32 Å²	32	75.3 Å²	75.3	33%	0.33	38%	0.377	S	S	.	.	H	α-helix	trans	-60.3	-38.3	176	0	0	0	0	0	113.4	E243 E244 S251	E243-G247 PolarHBondContact O-N 2.76Å; E244-G247 PolarHBondContact O-N 2.72Å; G247-S251 PolarHBondContact O-N 2.87Å; G247-S251 PolarHBondContact O-OG 2.72Å
248	K	92	Very high	91.7	Very high	61 Å²	61	69.3 Å²	69.3	27%	0.265	36%	0.357	S	S	.	.	H	α-helix	trans	-70.4	-42	174.8	-78.4	178.5	162	-165.1	0	113.2	A234 L235 R237 E244 V245 V246 R250 S251 L252	A234-K248 PolarHBondContact O-NZ 2.97Å; L235-K248 PolarHBondContact O-NZ 3.27Å; R237-K248 PolarHBondContact O-NZ 3.43Å; E244-K248 WeakPolarHBondContact O-CB 3.49Å; E244-K248 WeakPolarHBondContact O-CG 3.33Å; E244-K248 PolarHBondContact O-N 3.1Å; V245-K248 PolarHBondContact O-N 2.86Å; V246-K248 VanDerWaalsContact C-N 3.31Å; V246-K248 PolarHBondContact O-N 2.85Å; K248-R250 VanDerWaalsContact C-N 3.33Å; K248-S251 PolarHBondContact O-N 2.64Å; K248-S251 PolarHBondContact O-OG 2.93Å; K248-S251 VanDerWaalsContact O-OG 3.05Å; K248-L252 WeakPolarHBondContact O-CB 3.3Å; K248-L252 VanDerWaalsContact O-CG 3.26Å; K248-L252 WeakPolarHBondContact O-CG 3.42Å; K248-L252 PolarHBondContact O-N 3.3Å
249	L	92.6	Very high	92.7	Very high	86 Å²	86	75.7 Å²	75.7	45%	0.45	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-43.3	177.9	-170.8	65.5	0	0	0	110.6	V245 V246 S251 L252 H253	V245-L249 WeakPolarHBondContact O-CB 3.43Å; V245-L249 PolarHBondContact O-N 3.35Å; V246-L249 PolarHBondContact O-N 3.35Å; L249-S251 PolarHBondContact O-N 3.34Å; L249-L252 PolarHBondContact O-N 2.9Å; L249-H253 WeakPolarHBondContact CD1-NE2 3.48Å; L249-H253 WeakPolarHBondContact O-CB 3.47Å; L249-H253 PolarHBondContact O-N 2.88Å
250	R	95.1	Very high	93.3	Very high	71 Å²	71	72.9 Å²	72.9	27%	0.268	36%	0.364	S	S	.	.	H	α-helix	trans	-56.8	-47.9	175.1	178.5	-179.6	-57.8	143.1	8.2	112.9	V246 K248 T254 D655	V246-R250 WeakPolarHBondContact O-CB 3.16Å; V246-R250 PolarHBondContact O-N 3.06Å; K248-R250 VanDerWaalsContact C-N 3.33Å; R250-T254 WeakPolarHBondContact O-CB 3.19Å; R250-T254 PolarHBondContact O-N 2.9Å; R250-T254 PolarHBondContact O-OG1 3Å; R250-D655 WeakPolarHBondContact CG-OD1 3.41Å; R250-D655 IonicContact CZ-OD2 3.72Å; R250-D655 IonicContact NE-OD1 2.73Å; R250-D655 PolarHBondContact NE-OD1 2.83Å; R250-D655 IonicContact NE-OD2 3.26Å; R250-D655 PolarHBondContact NE-OD2 2.94Å; R250-D655 IonicContact NH2-OD2 2.79Å; R250-D655 PolarHBondContact NH2-OD2 3.05Å
251	S	94.9	Very high	93.8	Very high	59 Å²	59	65.7 Å²	65.7	41%	0.413	33%	0.326	S	S	.	.	H	α-helix	trans	-68.7	-42.5	179.1	60.4	0	0	0	0	111.8	G247 K248 L249 H253 T254 D255	G247-S251 PolarHBondContact O-N 2.87Å; G247-S251 PolarHBondContact O-OG 2.72Å; K248-S251 PolarHBondContact O-N 2.64Å; K248-S251 PolarHBondContact O-OG 2.93Å; K248-S251 VanDerWaalsContact O-OG 3.05Å; L249-S251 PolarHBondContact O-N 3.34Å; S251-H253 PolarHBondContact O-N 3.18Å; S251-T254 PolarHBondContact O-N 2.85Å; S251-D255 WeakPolarHBondContact O-CB 3.23Å; S251-D255 PolarHBondContact O-N 3.34Å
252	L	95.3	Very high	94	Very high	92 Å²	92	66.6 Å²	66.6	48%	0.482	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-46.2	175.3	-72	169.8	0	0	0	112.4	K248 L249 A256	K248-L252 WeakPolarHBondContact O-CB 3.3Å; K248-L252 VanDerWaalsContact O-CG 3.26Å; K248-L252 WeakPolarHBondContact O-CG 3.42Å; K248-L252 PolarHBondContact O-N 3.3Å; L249-L252 PolarHBondContact O-N 2.9Å; L252-A256 WeakPolarHBondContact O-CB 3.14Å; L252-A256 PolarHBondContact O-N 2.9Å
253	H	96.5	Very high	94.2	Very high	30 Å²	30	64.4 Å²	64.4	14%	0.139	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-43.8	176.6	-73.1	-175.8	0	0	0	111.9	L249 S251 A256 L257 R658 T659	L249-H253 WeakPolarHBondContact CD1-NE2 3.48Å; L249-H253 WeakPolarHBondContact O-CB 3.47Å; L249-H253 PolarHBondContact O-N 2.88Å; S251-H253 PolarHBondContact O-N 3.18Å; H253-A256 PolarHBondContact O-N 2.7Å; H253-L257 WeakPolarHBondContact O-CG 3.3Å; H253-L257 PolarHBondContact O-N 2.87Å; H253-R658 HydrophobicContact CB-CB 4.3Å; H253-T659 PolarHBondContact CE1-OG1 3.13Å; H253-T659 PolarHBondContact ND1-OG1 2.85Å; H253-T659 VanDerWaalsContact ND1-OG1 3.09Å
254	T	96.6	Very high	94.4	Very high	19 Å²	19	58.4 Å²	58.4	12%	0.117	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-47	178.9	-56.5	0	0	0	0	111.3	R250 S251 L257 K258	R250-T254 WeakPolarHBondContact O-CB 3.19Å; R250-T254 PolarHBondContact O-N 2.9Å; R250-T254 PolarHBondContact O-OG1 3Å; S251-T254 PolarHBondContact O-N 2.85Å; T254-L257 PolarHBondContact O-N 3.02Å; T254-K258 WeakPolarHBondContact O-CG 3.48Å; T254-K258 PolarHBondContact O-N 3.41Å
255	D	96.7	Very high	94.5	Very high	69 Å²	69	58.2 Å²	58.2	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-72.7	-29.8	179.8	-73.6	-7.4	0	0	0	112.7	S251 K258 R259	S251-D255 WeakPolarHBondContact O-CB 3.23Å; S251-D255 PolarHBondContact O-N 3.34Å; D255-K258 IonicContact OD1-NZ 3.21Å; D255-R259 VanDerWaalsContact C-NH2 3.26Å; D255-R259 WeakPolarHBondContact O-CG 3.42Å; D255-R259 PolarHBondContact O-N 3.18Å; D255-R259 VanDerWaalsContact O-N 3.13Å; D255-R259 PolarHBondContact O-NE 3.41Å; D255-R259 PolarHBondContact O-NH2 3.29Å
256	A	96.9	Very high	94.5	Very high	24 Å²	24	59.7 Å²	59.7	20%	0.198	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-44.8	171.4	0	0	0	0	0	111.2	L252 H253 K258 R259 L260 M662	L252-A256 WeakPolarHBondContact O-CB 3.14Å; L252-A256 PolarHBondContact O-N 2.9Å; H253-A256 PolarHBondContact O-N 2.7Å; A256-K258 PolarHBondContact O-N 2.66Å; A256-R259 PolarHBondContact O-N 3.45Å; A256-L260 WeakPolarHBondContact O-CG 3.37Å; A256-L260 PolarHBondContact O-N 2.82Å; A256-M662 HydrophobicContact CB-CE 3.52Å; A256-M662 HydrophobicContact CB-SD 3.97Å
257	L	97.6	Very high	94.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-39.6	175.5	-72.6	173.4	0	0	0	112.6	H253 T254 R259 L260 A261 R658 L661 M662 L687 A688	H253-L257 WeakPolarHBondContact O-CG 3.3Å; H253-L257 PolarHBondContact O-N 2.87Å; T254-L257 PolarHBondContact O-N 3.02Å; L257-R259 VanDerWaalsContact C-N 3.32Å; L257-R259 PolarHBondContact O-N 3.25Å; L257-L260 HydrophobicContact CD2-CD1 4.27Å; L257-L260 PolarHBondContact O-N 3.42Å; L257-A261 WeakPolarHBondContact O-CB 3.5Å; L257-A261 PolarHBondContact O-N 3.38Å; L257-R658 HydrophobicContact CD1-CB 3.79Å; L257-R658 HydrophobicContact CD1-CG 3.56Å; L257-L661 HydrophobicContact CD2-CB 4.43Å; L257-L661 HydrophobicContact CD2-CD2 3.85Å; L257-L661 HydrophobicContact CD2-CG 4.05Å; L257-M662 HydrophobicContact CD2-CE 3.68Å; L257-M662 HydrophobicContact CG-CE 3.59Å; L257-L687 HydrophobicContact CD1-CB 3.96Å; L257-A688 HydrophobicContact CB-CB 3.97Å
258	K	97.5	Very high	94.2	Very high	72 Å²	72	60.3 Å²	60.3	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-58.3	-44	172.1	-72	170.6	-175.2	166.3	0	111.8	T254 D255 A256 A261 V262 A688 F689	T254-K258 WeakPolarHBondContact O-CG 3.48Å; T254-K258 PolarHBondContact O-N 3.41Å; D255-K258 IonicContact OD1-NZ 3.21Å; A256-K258 PolarHBondContact O-N 2.66Å; K258-A261 PolarHBondContact O-N 2.74Å; K258-V262 WeakPolarHBondContact O-CG2 3.41Å; K258-V262 PolarHBondContact O-N 3.28Å; K258-A688 WeakPolarHBondContact CE-O 3.35Å; K258-A688 HydrophobicContact CG-CB 3.85Å; K258-F689 HydrophobicContact CD-CE1 4.45Å; K258-F689 HydrophobicContact CG-CE1 4.22Å; K258-F689 HydrophobicContact CG-CZ 4.28Å
259	R	96.7	Very high	94	Very high	141 Å²	141	57.9 Å²	57.9	53%	0.532	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-33.4	175.8	-74.6	-179.4	-71.7	-95.7	-1.3	113.1	D255 A256 L257 K263	D255-R259 VanDerWaalsContact C-NH2 3.26Å; D255-R259 WeakPolarHBondContact O-CG 3.42Å; D255-R259 PolarHBondContact O-N 3.18Å; D255-R259 VanDerWaalsContact O-N 3.13Å; D255-R259 PolarHBondContact O-NE 3.41Å; D255-R259 PolarHBondContact O-NH2 3.29Å; A256-R259 PolarHBondContact O-N 3.45Å; L257-R259 VanDerWaalsContact C-N 3.32Å; L257-R259 PolarHBondContact O-N 3.25Å; R259-K263 WeakPolarHBondContact O-CB 3.36Å; R259-K263 WeakPolarHBondContact O-CG 3.4Å; R259-K263 PolarHBondContact O-N 3.15Å; R259-K263 VanDerWaalsContact O-N 3.13Å
260	L	95.4	Very high	93.6	Very high	41 Å²	41	56.8 Å²	56.8	22%	0.215	29%	0.293	C	S	.	.	H	α-helix	trans	-69.6	-46	173.8	-73.9	166.6	0	0	0	111.2	A256 L257 V262 K263 C264 M662 F665	A256-L260 WeakPolarHBondContact O-CG 3.37Å; A256-L260 PolarHBondContact O-N 2.82Å; L257-L260 HydrophobicContact CD2-CD1 4.27Å; L257-L260 PolarHBondContact O-N 3.42Å; L260-V262 VanDerWaalsContact C-N 3.33Å; L260-V262 PolarHBondContact O-N 2.95Å; L260-K263 WeakPolarHBondContact O-CB 3.45Å; L260-K263 PolarHBondContact O-N 2.83Å; L260-K263 VanDerWaalsContact O-N 3.12Å; L260-C264 PolarHBondContact O-N 2.88Å; L260-C264 PolarHBondContact O-SG 3.37Å; L260-M662 HydrophobicContact CD1-CE 4.04Å; L260-M662 HydrophobicContact CD1-SD 3.91Å; L260-F665 HydrophobicContact CD1-CB 4.19Å; L260-F665 HydrophobicContact CD1-CD2 4.03Å; L260-F665 HydrophobicContact CD1-CG 4.03Å; L260-F665 HydrophobicContact CD2-CD1 4.25Å; L260-F665 HydrophobicContact CD2-CG 4.46Å
261	A	95.3	Very high	92.4	Very high	3 Å²	3	54.9 Å²	54.9	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-40.3	178.7	0	0	0	0	0	112.7	L257 K258 C264 E265 W681 A684 Q685	L257-A261 WeakPolarHBondContact O-CB 3.5Å; L257-A261 PolarHBondContact O-N 3.38Å; K258-A261 PolarHBondContact O-N 2.74Å; A261-C264 PolarHBondContact O-N 3.14Å; A261-E265 PolarHBondContact O-N 3.31Å; A261-W681 PolarHBondContact O-NE1 3.47Å; A261-A684 HydrophobicContact CB-CB 4.4Å; A261-Q685 HydrophobicContact CB-CG 4.18Å
262	V	94.7	Very high	91.1	Very high	76 Å²	76	53.2 Å²	53.2	46%	0.461	28%	0.281	S	S	.	.	H	α-helix	trans	-69.4	-39.8	174	174.2	0	0	0	0	111.8	K258 L260 C264 E265 D266	K258-V262 WeakPolarHBondContact O-CG2 3.41Å; K258-V262 PolarHBondContact O-N 3.28Å; L260-V262 VanDerWaalsContact C-N 3.33Å; L260-V262 PolarHBondContact O-N 2.95Å; V262-C264 VanDerWaalsContact C-N 3.34Å; V262-C264 PolarHBondContact O-N 3.47Å; V262-E265 WeakPolarHBondContact O-CB 3.32Å; V262-E265 PolarHBondContact O-N 3.45Å; V262-D266 PolarHBondContact O-N 3.31Å
263	K	93.3	Very high	89.2	Confident	144 Å²	144	54.1 Å²	54.1	63%	0.626	28%	0.281	S	S	*	.	H	α-helix	trans	-63	-39.6	173.8	-83.1	-174.8	170.7	-164.3	0	112.6	R259 L260 D266 L267	R259-K263 WeakPolarHBondContact O-CB 3.36Å; R259-K263 WeakPolarHBondContact O-CG 3.4Å; R259-K263 PolarHBondContact O-N 3.15Å; R259-K263 VanDerWaalsContact O-N 3.13Å; L260-K263 WeakPolarHBondContact O-CB 3.45Å; L260-K263 PolarHBondContact O-N 2.83Å; L260-K263 VanDerWaalsContact O-N 3.12Å; K263-D266 PolarHBondContact O-N 3.21Å; K263-L267 WeakPolarHBondContact O-CG 3.21Å; K263-L267 PolarHBondContact O-N 3.14Å; K263-L267 VanDerWaalsContact O-N 3.14Å
264	C	92.1	Very high	87.7	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.027	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-47.3	172.7	-67	0	0	0	0	110.1	L260 A261 V262 D266 L267 F268 W681	L260-C264 PolarHBondContact O-N 2.88Å; L260-C264 PolarHBondContact O-SG 3.37Å; A261-C264 PolarHBondContact O-N 3.14Å; V262-C264 VanDerWaalsContact C-N 3.34Å; V262-C264 PolarHBondContact O-N 3.47Å; C264-D266 VanDerWaalsContact C-N 3.32Å; C264-D266 PolarHBondContact O-N 3.32Å; C264-L267 CarbonylContact O-C 3.58Å; C264-L267 WeakPolarHBondContact O-CA 3.33Å; C264-L267 WeakPolarHBondContact O-CB 3.35Å; C264-L267 PolarHBondContact O-N 2.86Å; C264-F268 HydrophobicContact CB-CD2 4.16Å; C264-F268 HydrophobicContact CB-CE2 4.33Å; C264-F268 VanDerWaalsContact O-CD2 3.22Å; C264-F268 WeakPolarHBondContact O-CD2 3.17Å; C264-F268 PolarHBondContact O-N 3.2Å; C264-W681 HydrophobicContact CB-CB 3.88Å; C264-W681 HydrophobicContact CB-CD2 4.19Å; C264-W681 HydrophobicContact CB-CG 3.5Å; C264-W681 VanDerWaalsContact CB-CG 3.5Å
265	E	91.8	Very high	85.9	Confident	88 Å²	88	65.3 Å²	65.3	41%	0.411	34%	0.336	S	S	.	.	H	α-helix	trans	-54.4	-44.9	175.7	-173.8	-178.9	139	0	0	112.5	A261 V262 L267 F268 M269 W681	A261-E265 PolarHBondContact O-N 3.31Å; V262-E265 WeakPolarHBondContact O-CB 3.32Å; V262-E265 PolarHBondContact O-N 3.45Å; E265-L267 VanDerWaalsContact C-N 3.3Å; E265-L267 PolarHBondContact O-N 3.4Å; E265-F268 PolarHBondContact O-N 3.14Å; E265-M269 HydrophobicContact CG-CG 4.2Å; E265-M269 WeakPolarHBondContact O-CB 3.48Å; E265-M269 WeakPolarHBondContact O-CG 3.1Å; E265-M269 PolarHBondContact O-N 2.96Å; E265-W681 HydrophobicContact CB-CZ2 3.61Å; E265-W681 HydrophobicContact CG-CH2 4.46Å; E265-W681 HydrophobicContact CG-CZ2 3.81Å
266	D	90.8	Very high	84.7	Confident	85 Å²	85	65.4 Å²	65.4	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-30.1	174.7	-87.1	-39.4	0	0	0	113.9	V262 K263 C264 A270 K273	V262-D266 PolarHBondContact O-N 3.31Å; K263-D266 PolarHBondContact O-N 3.21Å; C264-D266 VanDerWaalsContact C-N 3.32Å; C264-D266 PolarHBondContact O-N 3.32Å; D266-A270 PolarHBondContact O-N 2.95Å; D266-K273 IonicContact OD1-NZ 3.18Å; D266-K273 PolarHBondContact OD1-NZ 2.99Å
267	L	89.4	Confident	83.9	Confident	97 Å²	97	71 Å²	71	51%	0.508	35%	0.352	S	S	.	.	H	α-helix	trans	-76.4	-46.8	174.3	-69.4	167	0	0	0	112	K263 C264 E265 M269 A270	K263-L267 WeakPolarHBondContact O-CG 3.21Å; K263-L267 PolarHBondContact O-N 3.14Å; K263-L267 VanDerWaalsContact O-N 3.14Å; C264-L267 CarbonylContact O-C 3.58Å; C264-L267 WeakPolarHBondContact O-CA 3.33Å; C264-L267 WeakPolarHBondContact O-CB 3.35Å; C264-L267 PolarHBondContact O-N 2.86Å; E265-L267 VanDerWaalsContact C-N 3.3Å; E265-L267 PolarHBondContact O-N 3.4Å; L267-M269 VanDerWaalsContact C-N 3.31Å; L267-M269 PolarHBondContact O-N 2.74Å; L267-A270 VanDerWaalsContact O-CB 3.3Å; L267-A270 WeakPolarHBondContact O-CB 3.38Å; L267-A270 PolarHBondContact O-N 3.1Å
268	F	87.9	Confident	83.1	Confident	5 Å²	5	71.8 Å²	71.8	2%	0.022	36%	0.355	C	S	.	.	H	α-helix	trans	-71.6	-23.8	-179.7	-79.2	-78.9	0	0	0	112.8	C264 E265 F344 H486 P488 I676 L678 W681	C264-F268 HydrophobicContact CB-CD2 4.16Å; C264-F268 HydrophobicContact CB-CE2 4.33Å; C264-F268 VanDerWaalsContact O-CD2 3.22Å; C264-F268 WeakPolarHBondContact O-CD2 3.17Å; C264-F268 PolarHBondContact O-N 3.2Å; E265-F268 PolarHBondContact O-N 3.14Å; F268-F344 HydrophobicContact CB-CD2 4.14Å; F268-F344 HydrophobicContact CB-CE2 3.82Å; F268-F344 HydrophobicContact CD1-CE2 4.08Å; F268-F344 HydrophobicContact CD1-CZ 4.06Å; F268-F344 HydrophobicContact CG-CE2 4.37Å; F268-H486 AromaticContact CD1-CD2 3.38Å; F268-H486 WeakPolarHBondContact CD1-CD2 3.33Å; F268-H486 AromaticContact CD1-CE1 3.99Å; F268-H486 AromaticContact CD1-NE2 3.22Å; F268-H486 WeakPolarHBondContact CD1-NE2 3.41Å; F268-H486 AromaticContact CE1-CD2 3.53Å; F268-H486 AromaticContact CE1-NE2 3.75Å; F268-H486 PolarHBondContact O-CE1 3.4Å; F268-H486 VanDerWaalsContact O-CE1 3.28Å; F268-P488 HydrophobicContact CE1-CB 4.26Å; F268-P488 HydrophobicContact CE1-CG 4.44Å; F268-P488 HydrophobicContact CZ-CB 4.47Å; F268-I676 HydrophobicContact CE2-CG2 4.39Å; F268-L678 HydrophobicContact CE1-CB 4.12Å; F268-L678 HydrophobicContact CE1-CD1 4.48Å; F268-L678 HydrophobicContact CZ-CB 4.39Å; F268-W681 HydrophobicContact CB-CE3 3.77Å; F268-W681 HydrophobicContact CB-CH2 4.05Å; F268-W681 HydrophobicContact CB-CZ3 3.47Å; F268-W681 VanDerWaalsContact CB-CZ3 3.47Å; F268-W681 HydrophobicContact CD1-CE3 4.1Å; F268-W681 HydrophobicContact CD1-CZ3 4.32Å; F268-W681 HydrophobicContact CD2-CB 4.17Å; F268-W681 AromaticContact CD2-CD2 3.73Å; F268-W681 HydrophobicContact CD2-CD2 3.73Å; F268-W681 AromaticContact CD2-CE3 3.34Å; F268-W681 HydrophobicContact CD2-CE3 3.34Å; F268-W681 HydrophobicContact CD2-CG 4.09Å; F268-W681 HydrophobicContact CD2-CZ3 4.01Å; F268-W681 HydrophobicContact CE2-CB 3.82Å; F268-W681 HydrophobicContact CE2-CD2 4.28Å; F268-W681 AromaticContact CE2-CE3 4Å; F268-W681 HydrophobicContact CE2-CE3 4Å; F268-W681 HydrophobicContact CE2-CG 4.25Å; F268-W681 HydrophobicContact CG-CD2 4.27Å; F268-W681 AromaticContact CG-CE3 3.46Å; F268-W681 HydrophobicContact CG-CE3 3.46Å; F268-W681 VanDerWaalsContact CG-CE3 3.46Å; F268-W681 AromaticContact CG-CZ3 3.68Å; F268-W681 HydrophobicContact CG-CZ3 3.68Å
269	M	87.6	Confident	82.3	Confident	9 Å²	9	69.8 Å²	69.8	4%	0.044	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	10	174.4	-59.6	-68.9	-66.7	0	0	113.4	E265 L267 Q272 V342 F344	E265-M269 HydrophobicContact CG-CG 4.2Å; E265-M269 WeakPolarHBondContact O-CB 3.48Å; E265-M269 WeakPolarHBondContact O-CG 3.1Å; E265-M269 PolarHBondContact O-N 2.96Å; L267-M269 VanDerWaalsContact C-N 3.31Å; L267-M269 PolarHBondContact O-N 2.74Å; M269-Q272 PolarHBondContact O-N 2.95Å; M269-Q272 PolarHBondContact SD-OE1 2.86Å; M269-Q272 VanDerWaalsContact SD-OE1 3.4Å; M269-V342 HydrophobicContact CE-CB 4.1Å; M269-V342 HydrophobicContact CE-CG2 3.98Å; M269-F344 VanDerWaalsContact SD-CA 3.56Å; M269-F344 HydrophobicContact SD-CB 3.71Å; M269-F344 HydrophobicContact SD-CD2 3.87Å; M269-F344 HydrophobicContact SD-CG 4.3Å
270	A	82.8	Confident	81.5	Confident	63 Å²	63	67.7 Å²	67.7	52%	0.521	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	142.8	177	0	0	0	0	0	111.4	D266 L267 Q272	D266-A270 PolarHBondContact O-N 2.95Å; L267-A270 VanDerWaalsContact O-CB 3.3Å; L267-A270 WeakPolarHBondContact O-CB 3.38Å; L267-A270 PolarHBondContact O-N 3.1Å; A270-Q272 PolarHBondContact O-N 2.92Å
271	G	70.6	Confident	80.7	Confident	32 Å²	32	72.6 Å²	72.6	33%	0.33	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	-25.3	-177.8	0	0	0	0	0	115.7	K273 D274 R423	G271-K273 PolarHBondContact O-N 2.84Å; G271-D274 PolarHBondContact O-N 3.02Å; G271-R423 PolarHBondContact O-NH1 3.5Å
272	Q	67.9	Low	79.9	Confident	24 Å²	24	73.4 Å²	73.4	11%	0.112	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.8	173.9	-66.6	-150.7	-58.9	0	0	113	M269 A270 D274 E424 R509	M269-Q272 PolarHBondContact O-N 2.95Å; M269-Q272 PolarHBondContact SD-OE1 2.86Å; M269-Q272 VanDerWaalsContact SD-OE1 3.4Å; A270-Q272 PolarHBondContact O-N 2.92Å; Q272-D274 VanDerWaalsContact C-N 3.26Å; Q272-D274 PolarHBondContact O-N 3.49Å; Q272-E424 VanDerWaalsContact NE2-CG 3.33Å; Q272-E424 PolarHBondContact NE2-OE1 3.39Å; Q272-R509 VanDerWaalsContact NE2-NH1 3.12Å; Q272-R509 VanDerWaalsContact NE2-NH2 3.15Å
273	K	55.8	Low	79.2	Confident	110 Å²	110	73.7 Å²	73.7	48%	0.478	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.4	179.6	-59.9	179.6	-175.5	-176.3	0	113.3	D266 G271 Q275	D266-K273 IonicContact OD1-NZ 3.18Å; D266-K273 PolarHBondContact OD1-NZ 2.99Å; G271-K273 PolarHBondContact O-N 2.84Å; K273-Q275 PolarHBondContact O-N 3.43Å
274	D	64	Low	78.6	Confident	103 Å²	103	71.8 Å²	71.8	55%	0.551	39%	0.387	S	S	*	.	S	Bend	trans	-83.5	112	-178.2	-64.6	-41	0	0	0	111.4	G271 Q272 L276 R423	G271-D274 PolarHBondContact O-N 3.02Å; Q272-D274 VanDerWaalsContact C-N 3.26Å; Q272-D274 PolarHBondContact O-N 3.49Å; D274-L276 PolarHBondContact O-N 3.34Å; D274-R423 VanDerWaalsContact CB-NH2 3.33Å; D274-R423 PolarHBondContact O-NH2 3.03Å
275	Q	59.9	Low	78.3	Confident	182 Å²	182	72.9 Å²	72.9	85%	0.85	39%	0.393	S	S	*	.			trans	-75.5	60.6	-175.8	-61.6	-174.7	4	0	0	113.7	K273 R277	K273-Q275 PolarHBondContact O-N 3.43Å; Q275-R277 PolarHBondContact O-N 2.89Å
276	L	71.7	Confident	78.1	Confident	71 Å²	71	69.4 Å²	69.4	37%	0.372	38%	0.377	S	S	.	.			trans	-64.3	126.7	160.6	-66.9	-179.5	0	0	0	108.6	D274 F278 Y315 C350	D274-L276 PolarHBondContact O-N 3.34Å; L276-F278 HydrophobicContact CB-CE2 4.22Å; L276-F278 HydrophobicContact CB-CZ 4.02Å; L276-F278 HydrophobicContact CD1-CZ 4.05Å; L276-Y315 WeakPolarHBondContact CD1-OH 3.46Å; L276-C350 WeakPolarHBondContact O-CA 3.45Å; L276-C350 VanDerWaalsContact O-CB 3.3Å; L276-C350 WeakPolarHBondContact O-CB 3.48Å
277	R	79.3	Confident	78	Confident	142 Å²	142	73.9 Å²	73.9	54%	0.536	39%	0.387	S	S	.	.			trans	-129.2	108.5	177.5	-73.6	-59.3	-165.3	175.8	0.6	109.5	Q275 D349 C350	Q275-R277 PolarHBondContact O-N 2.89Å; R277-D349 IonicContact CZ-OD2 2.65Å; R277-D349 PolarHBondContact NH1-O 2.68Å; R277-D349 VanDerWaalsContact NH1-O 3.13Å; R277-D349 IonicContact NH1-OD2 3.25Å; R277-D349 PolarHBondContact NH1-OD2 2.98Å; R277-C350 CarbonylContact C-O 3.6Å; R277-C350 VanDerWaalsContact CA-O 3.23Å; R277-C350 WeakPolarHBondContact CA-O 3.27Å
278	F	81.5	Confident	78.1	Confident	15 Å²	15	71.8 Å²	71.8	7%	0.066	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-94.4	138.4	178.2	-54.3	-62.6	0	0	0	110.7	L276 F286 Y307 Y315 C350 G351 I421	L276-F278 HydrophobicContact CB-CE2 4.22Å; L276-F278 HydrophobicContact CB-CZ 4.02Å; L276-F278 HydrophobicContact CD1-CZ 4.05Å; F278-F286 HydrophobicContact CB-CE2 4.25Å; F278-F286 HydrophobicContact CD1-CE2 4.05Å; F278-F286 HydrophobicContact CD1-CZ 4.08Å; F278-F286 HydrophobicContact CD2-CE2 4.11Å; F278-F286 AromaticContact CD2-CZ 3.71Å; F278-F286 HydrophobicContact CD2-CZ 3.71Å; F278-F286 HydrophobicContact CE1-CE2 4.44Å; F278-F286 HydrophobicContact CE1-CZ 4.08Å; F278-F286 HydrophobicContact CE2-CE2 4.49Å; F278-F286 AromaticContact CE2-CZ 3.71Å; F278-F286 HydrophobicContact CE2-CZ 3.71Å; F278-F286 AromaticContact CG-CE2 3.87Å; F278-F286 HydrophobicContact CG-CE2 3.87Å; F278-F286 AromaticContact CG-CZ 3.9Å; F278-F286 HydrophobicContact CG-CZ 3.9Å; F278-F286 AromaticContact CZ-CZ 3.89Å; F278-F286 HydrophobicContact CZ-CZ 3.89Å; F278-Y307 HydrophobicContact CD1-CE2 4.17Å; F278-Y307 HydrophobicContact CE1-CD1 4.24Å; F278-Y307 HydrophobicContact CE1-CD2 4.24Å; F278-Y307 AromaticContact CE1-CE1 3.74Å; F278-Y307 HydrophobicContact CE1-CE1 3.74Å; F278-Y307 AromaticContact CE1-CE2 3.75Å; F278-Y307 HydrophobicContact CE1-CE2 3.75Å; F278-Y307 HydrophobicContact CE1-CG 4.48Å; F278-Y307 AromaticContact CE1-CZ 3.49Å; F278-Y307 VanDerWaalsContact CE1-CZ 3.49Å; F278-Y307 HydrophobicContact CZ-CD1 4.31Å; F278-Y307 HydrophobicContact CZ-CE1 4.2Å; F278-Y315 HydrophobicContact CE2-CD1 4.29Å; F278-Y315 AromaticContact CE2-CE1 3.74Å; F278-Y315 HydrophobicContact CE2-CE1 3.74Å; F278-Y315 HydrophobicContact CZ-CE1 4.03Å; F278-C350 HydrophobicContact CD2-CB 4.17Å; F278-C350 WeakPolarHBondContact CD2-O 3.47Å; F278-C350 HydrophobicContact CE2-CB 4.1Å; F278-C350 PolarHBondContact N-O 3.48Å; F278-G351 WeakPolarHBondContact O-CA 3.47Å; F278-I421 HydrophobicContact CD2-CB 4.17Å; F278-I421 HydrophobicContact CD2-CG1 4.49Å; F278-I421 HydrophobicContact CD2-CG2 4.01Å; F278-I421 HydrophobicContact CE2-CG2 4.25Å
279	G	79.3	Confident	78.2	Confident	31 Å²	31	75.6 Å²	75.6	32%	0.32	40%	0.4	S	S	.	.			trans	-119.7	-169.6	172.7	0	0	0	0	0	111.6	D281 S282	G279-D281 VanDerWaalsContact C-N 3.27Å; G279-D281 PolarHBondContact O-N 3.2Å; G279-S282 WeakPolarHBondContact O-CB 3.4Å; G279-S282 PolarHBondContact O-N 3.14Å
280	V	79.6	Confident	78.2	Confident	97 Å²	97	77.2 Å²	77.2	59%	0.588	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-49.3	-47.3	-180	-176.9	0	0	0	0	111.8	S282 W283 F353	V280-S282 PolarHBondContact O-N 3.47Å; V280-S282 VanDerWaalsContact O-N 3.12Å; V280-W283 VanDerWaalsContact O-CB 3.25Å; V280-W283 WeakPolarHBondContact O-CB 3.37Å; V280-W283 PolarHBondContact O-N 2.88Å; V280-F353 HydrophobicContact CG2-CB 3.8Å
281	D	79.1	Confident	78.4	Confident	144 Å²	144	79 Å²	79	77%	0.77	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-56.3	-33	-178.6	-47.7	-34.2	0	0	0	112.8	G279 W283 S284	G279-D281 VanDerWaalsContact C-N 3.27Å; G279-D281 PolarHBondContact O-N 3.2Å; D281-W283 VanDerWaalsContact C-N 3.31Å; D281-W283 PolarHBondContact O-N 2.63Å; D281-S284 PolarHBondContact O-OG 2.9Å
282	S	79	Confident	79.3	Confident	20 Å²	20	85.2 Å²	85.2	14%	0.14	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-75.9	-14.3	-179.5	-49.5	0	0	0	0	113.4	G279 V280 S284 D285 F286	G279-S282 WeakPolarHBondContact O-CB 3.4Å; G279-S282 PolarHBondContact O-N 3.14Å; V280-S282 PolarHBondContact O-N 3.47Å; V280-S282 VanDerWaalsContact O-N 3.12Å; S282-S284 PolarHBondContact O-N 2.83Å; S282-D285 WeakPolarHBondContact O-CB 3.47Å; S282-D285 PolarHBondContact O-N 2.94Å; S282-F286 VanDerWaalsContact O-CD2 3.23Å; S282-F286 WeakPolarHBondContact O-CD2 3.14Å
283	W	79.5	Confident	80.5	Confident	82 Å²	82	86.2 Å²	86.2	31%	0.311	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-58.5	-38.2	-178.5	179	-134.8	0	0	0	112	V280 D281 D285 F286 V317 F353 V419	V280-W283 VanDerWaalsContact O-CB 3.25Å; V280-W283 WeakPolarHBondContact O-CB 3.37Å; V280-W283 PolarHBondContact O-N 2.88Å; D281-W283 VanDerWaalsContact C-N 3.31Å; D281-W283 PolarHBondContact O-N 2.63Å; W283-D285 PolarHBondContact O-N 3.43Å; W283-F286 HydrophobicContact CE3-CB 4.19Å; W283-F286 HydrophobicContact CZ3-CB 4.37Å; W283-F286 PolarHBondContact O-N 2.7Å; W283-V317 HydrophobicContact CH2-CG1 3.92Å; W283-V317 HydrophobicContact CZ3-CG1 3.85Å; W283-V317 HydrophobicContact CZ3-CG2 4.1Å; W283-F353 HydrophobicContact CB-CE2 3.79Å; W283-F353 HydrophobicContact CB-CZ 3.79Å; W283-F353 AromaticContact CD2-CE2 3.7Å; W283-F353 HydrophobicContact CD2-CE2 3.7Å; W283-F353 AromaticContact CD2-CZ 3.9Å; W283-F353 HydrophobicContact CD2-CZ 3.9Å; W283-F353 AromaticContact CE3-CE2 3.79Å; W283-F353 HydrophobicContact CE3-CE2 3.79Å; W283-F353 AromaticContact CE3-CZ 3.57Å; W283-F353 HydrophobicContact CE3-CZ 3.57Å; W283-F353 AromaticContact CG-CE2 3.73Å; W283-F353 HydrophobicContact CG-CE2 3.73Å; W283-F353 HydrophobicContact CG-CZ 4.03Å; W283-F353 HydrophobicContact CZ3-CZ 4.38Å; W283-V419 HydrophobicContact CH2-CG1 4.45Å; W283-V419 HydrophobicContact CZ3-CG1 4.18Å
284	S	81.9	Confident	82.3	Confident	103 Å²	103	82.6 Å²	82.6	72%	0.72	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-66.8	-17.9	177.5	69	0	0	0	0	114.6	D281 S282	D281-S284 PolarHBondContact O-OG 2.9Å; S282-S284 PolarHBondContact O-N 2.83Å
285	D	84.6	Confident	83.8	Confident	28 Å²	28	78 Å²	78	15%	0.15	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-82.7	-18.8	172.6	-63.7	-81.5	0	0	0	112.9	S282 W283 Y307 A308 K309	S282-D285 WeakPolarHBondContact O-CB 3.47Å; S282-D285 PolarHBondContact O-N 2.94Å; W283-D285 PolarHBondContact O-N 3.43Å; D285-Y307 HydrophobicContact CB-CD2 3.61Å; D285-Y307 HydrophobicContact CB-CE2 3.36Å; D285-A308 HydrophobicContact CB-CB 4Å; D285-A308 VanDerWaalsContact O-CB 3.29Å; D285-A308 WeakPolarHBondContact O-CB 3.28Å; D285-A308 PolarHBondContact O-N 3.13Å; D285-K309 IonicContact OD1-NZ 2.83Å; D285-K309 PolarHBondContact OD1-NZ 3.46Å; D285-K309 IonicContact OD2-NZ 2.63Å; D285-K309 PolarHBondContact OD2-NZ 3.34Å
286	F	87.2	Confident	85.5	Confident	15 Å²	15	73.5 Å²	73.5	7%	0.066	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.8	179.7	-74.5	-79.1	0	0	0	110.9	F278 S282 W283 A305 Y307 Y315 I421	F278-F286 HydrophobicContact CB-CE2 4.25Å; F278-F286 HydrophobicContact CD1-CE2 4.05Å; F278-F286 HydrophobicContact CD1-CZ 4.08Å; F278-F286 HydrophobicContact CD2-CE2 4.11Å; F278-F286 AromaticContact CD2-CZ 3.71Å; F278-F286 HydrophobicContact CD2-CZ 3.71Å; F278-F286 HydrophobicContact CE1-CE2 4.44Å; F278-F286 HydrophobicContact CE1-CZ 4.08Å; F278-F286 HydrophobicContact CE2-CE2 4.49Å; F278-F286 AromaticContact CE2-CZ 3.71Å; F278-F286 HydrophobicContact CE2-CZ 3.71Å; F278-F286 AromaticContact CG-CE2 3.87Å; F278-F286 HydrophobicContact CG-CE2 3.87Å; F278-F286 AromaticContact CG-CZ 3.9Å; F278-F286 HydrophobicContact CG-CZ 3.9Å; F278-F286 AromaticContact CZ-CZ 3.89Å; F278-F286 HydrophobicContact CZ-CZ 3.89Å; S282-F286 VanDerWaalsContact O-CD2 3.23Å; S282-F286 WeakPolarHBondContact O-CD2 3.14Å; W283-F286 HydrophobicContact CE3-CB 4.19Å; W283-F286 HydrophobicContact CZ3-CB 4.37Å; W283-F286 PolarHBondContact O-N 2.7Å; F286-A305 HydrophobicContact CD1-CB 4.38Å; F286-Y307 HydrophobicContact CD1-CD2 4.29Å; F286-Y307 HydrophobicContact CD2-CD2 4.23Å; F286-Y307 AromaticContact CE1-CD2 3.84Å; F286-Y307 HydrophobicContact CE1-CD2 3.84Å; F286-Y307 HydrophobicContact CE1-CG 4.07Å; F286-Y307 AromaticContact CE2-CD2 3.76Å; F286-Y307 HydrophobicContact CE2-CD2 3.76Å; F286-Y307 HydrophobicContact CE2-CE2 4.11Å; F286-Y307 HydrophobicContact CG-CD2 4.47Å; F286-Y307 AromaticContact CZ-CD2 3.52Å; F286-Y307 HydrophobicContact CZ-CD2 3.52Å; F286-Y307 HydrophobicContact CZ-CE2 4.17Å; F286-Y307 HydrophobicContact CZ-CG 4.03Å; F286-Y315 HydrophobicContact CE1-CD1 4.24Å; F286-Y315 HydrophobicContact CE1-CD2 4.07Å; F286-Y315 AromaticContact CE1-CG 3.86Å; F286-Y315 HydrophobicContact CE1-CG 3.86Å; F286-I421 HydrophobicContact CD2-CD1 4.25Å; F286-I421 HydrophobicContact CE1-CG2 3.77Å; F286-I421 HydrophobicContact CE2-CD1 4.33Å; F286-I421 HydrophobicContact CE2-CG1 4.14Å; F286-I421 HydrophobicContact CE2-CG2 4.39Å; F286-I421 HydrophobicContact CG-CD1 4.41Å; F286-I421 HydrophobicContact CZ-CG1 4.28Å; F286-I421 HydrophobicContact CZ-CG2 3.69Å
287	R	89.1	Confident	86.5	Confident	179 Å²	179	70.3 Å²	70.3	68%	0.675	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.3	176	-62.3	-177.4	-176.6	177.9	1.5	109.2	T289 A305 S306	R287-T289 PolarHBondContact O-N 2.75Å; R287-A305 CarbonylContact O-C 3.23Å; R287-A305 VanDerWaalsContact O-CA 3.23Å; R287-A305 WeakPolarHBondContact O-CA 3.16Å; R287-A305 WeakPolarHBondContact O-CB 3.41Å; R287-S306 PolarHBondContact N-O 3.19Å; R287-S306 PolarHBondContact O-N 3.33Å
288	L	91.4	Very high	87	Confident	53 Å²	53	64.5 Å²	64.5	28%	0.277	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	131.7	174.6	-55.7	-171.7	0	0	0	109.3	S290 Y303 T304 A305 V317 L361	L288-S290 VanDerWaalsContact C-N 3.34Å; L288-Y303 HydrophobicContact CD1-CD1 4.34Å; L288-Y303 HydrophobicContact CD1-CG 4.26Å; L288-T304 CarbonylContact C-O 3.54Å; L288-T304 WeakPolarHBondContact CA-O 3.33Å; L288-A305 HydrophobicContact CD2-CB 4.08Å; L288-V317 HydrophobicContact CD2-CB 4.12Å; L288-V317 HydrophobicContact CD2-CG2 3.88Å; L288-L361 HydrophobicContact CD1-CD1 3.9Å; L288-L361 HydrophobicContact CD1-CD2 4.34Å
289	T	90.1	Very high	87.3	Confident	84 Å²	84	64.6 Å²	64.6	52%	0.515	35%	0.351	S	S	.	.	S	Bend	trans	-87.3	-9.3	176.5	44.3	0	0	0	0	112.6	R287 T304	R287-T289 PolarHBondContact O-N 2.75Å; T289-T304 PolarHBondContact N-O 2.74Å; T289-T304 VanDerWaalsContact OG1-C 3.23Å; T289-T304 WeakPolarHBondContact OG1-CB 3.22Å; T289-T304 PolarHBondContact OG1-O 3.5Å; T289-T304 VanDerWaalsContact OG1-O 3.09Å; T289-T304 PolarHBondContact OG1-OG1 2.96Å
290	S	88.4	Confident	88	Confident	43 Å²	43	63.1 Å²	63.1	30%	0.301	34%	0.336	S	S	.	.			trans	-149.3	137.5	178.3	170	0	0	0	0	110.1	L288 K292	L288-S290 VanDerWaalsContact C-N 3.34Å; S290-K292 VanDerWaalsContact C-N 3.28Å; S290-K292 WeakPolarHBondContact OG-CA 3.42Å; S290-K292 PolarHBondContact OG-N 3.18Å; S290-K292 PolarHBondContact OG-O 2.93Å
291	D	85.9	Confident	88.7	Confident	102 Å²	102	58.5 Å²	58.5	55%	0.545	31%	0.308	S	S	.	.	S	Bend	trans	-79.3	-10.3	168.2	-81.5	-48.3	0	0	0	113	R360	D291-R360 VanDerWaalsContact CG-NH1 3.35Å; D291-R360 IonicContact OD1-CZ 3.49Å; D291-R360 IonicContact OD1-NH1 2.67Å; D291-R360 PolarHBondContact OD1-NH1 3.19Å; D291-R360 IonicContact OD1-NH2 3.72Å; D291-R360 PolarHBondContact OD1-NH2 3.48Å
292	K	90.2	Very high	89.5	Confident	162 Å²	162	51.7 Å²	51.7	70%	0.704	27%	0.272	S	S	*	.	S	Bend	trans	-92.7	142	169.6	-64.2	-174.7	178.2	-174.8	0	110.4	S290 Y303	S290-K292 VanDerWaalsContact C-N 3.28Å; S290-K292 WeakPolarHBondContact OG-CA 3.42Å; S290-K292 PolarHBondContact OG-N 3.18Å; S290-K292 PolarHBondContact OG-O 2.93Å; K292-Y303 VanDerWaalsContact C-CE1 3.49Å
293	P	93.8	Very high	90.2	Very high	45 Å²	45	51 Å²	51	29%	0.292	27%	0.266	S	S	.	.			trans	-66	153.3	174.8	30.1	-35.6	0	0	0	111.5	E296 V301 Y302 Y303	P293-E296 HydrophobicContact CB-CG 4.42Å; P293-E296 HydrophobicContact CG-CG 4.34Å; P293-V301 HydrophobicContact CB-CG2 3.35Å; P293-V301 HydrophobicContact CG-CG2 4.21Å; P293-Y302 CarbonylContact C-O 3.04Å; P293-Y302 WeakPolarHBondContact CA-O 3.49Å; P293-Y302 WeakPolarHBondContact CB-O 3.32Å; P293-Y303 HydrophobicContact CB-CD1 4.42Å; P293-Y303 HydrophobicContact CB-CE1 3.97Å; P293-Y303 HydrophobicContact CB-CE2 4.45Å; P293-Y303 VanDerWaalsContact N-CE1 3.31Å
294	C	93.4	Very high	90.9	Very high	33 Å²	33	48.6 Å²	48.6	22%	0.223	26%	0.26	C	S	.	.	S	Bend	trans	-98.8	-15.8	173.9	66.9	0	0	0	0	113.4	Y302 T304 P426 H427	C294-Y302 PolarHBondContact N-O 2.87Å; C294-Y302 PolarHBondContact SG-O 3.15Å; C294-T304 HydrophobicContact CB-CG2 3.97Å; C294-P426 PolarHBondContact SG-O 3.06Å; C294-H427 CarbonylContact O-C 3.45Å; C294-H427 VanDerWaalsContact O-C 3.23Å; C294-H427 WeakPolarHBondContact O-CA 3.47Å; C294-H427 VanDerWaalsContact O-O 3.12Å
295	C	94.6	Very high	91.4	Very high	6 Å²	6	43.7 Å²	43.7	4%	0.041	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	141.9	173.5	-172.4	0	0	0	0	109.7	Y302 P426 L428	C295-Y302 HydrophobicContact CB-CD2 4.08Å; C295-Y302 HydrophobicContact CB-CG 4.43Å; C295-Y302 PolarHBondContact O-N 3.47Å; C295-P426 HydrophobicContact CB-CB 3.85Å; C295-P426 HydrophobicContact CB-CG 3.67Å; C295-L428 VanDerWaalsContact SG-C 3.52Å
296	E	94.9	Very high	91.7	Very high	89 Å²	89	43.8 Å²	43.8	42%	0.416	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	113	170.5	-70.6	-174.1	-141.4	0	0	109	P293 V301 T429	P293-E296 HydrophobicContact CB-CG 4.42Å; P293-E296 HydrophobicContact CG-CG 4.34Å; E296-V301 HydrophobicContact CG-CG2 3.98Å; E296-T429 VanDerWaalsContact O-CG2 3.27Å; E296-T429 WeakPolarHBondContact O-CG2 3.31Å
297	A	94.1	Very high	91.8	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.025	23%	0.231	C	C	.	.			trans	-106.1	173.3	-176	0	0	0	0	0	111.8	D299 A300 Y302 K321 T429 E479 L482	A297-D299 VanDerWaalsContact C-N 3.27Å; A297-D299 PolarHBondContact O-N 2.82Å; A297-A300 PolarHBondContact N-O 2.95Å; A297-Y302 HydrophobicContact CB-CD2 4.47Å; A297-Y302 HydrophobicContact CB-CE2 3.73Å; A297-K321 PolarHBondContact O-NZ 3.46Å; A297-T429 HydrophobicContact CB-CG2 4.22Å; A297-E479 CarbonylContact C-O 3.58Å; A297-E479 WeakPolarHBondContact CA-O 3.47Å; A297-E479 WeakPolarHBondContact CB-O 3.45Å; A297-L482 HydrophobicContact CB-CD2 3.78Å
298	G	88.4	Confident	91.6	Very high	20 Å²	20	38.2 Å²	38.2	21%	0.206	22%	0.219	C	C	.	.	S	Bend	trans	-53	-42.2	176.2	0	0	0	0	0	113.4	K321 E479	G298-K321 WeakPolarHBondContact O-CD 3.49Å; G298-K321 PolarHBondContact O-NZ 2.65Å; G298-E479 PolarHBondContact N-O 3.34Å
299	D	88.8	Confident	91.3	Very high	18 Å²	18	42 Å²	42	10%	0.096	23%	0.233	C	C	.	.	S	Bend	trans	-100.3	-14.7	-173.9	71.8	-11.1	0	0	0	116.4	A297 K318 K321 N514	A297-D299 VanDerWaalsContact C-N 3.27Å; A297-D299 PolarHBondContact O-N 2.82Å; D299-K318 VanDerWaalsContact CG-NZ 3.34Å; D299-K318 VanDerWaalsContact OD1-CE 3.24Å; D299-K318 WeakPolarHBondContact OD1-CE 3.37Å; D299-K318 IonicContact OD1-NZ 2.74Å; D299-K318 PolarHBondContact OD1-NZ 3.38Å; D299-K318 WeakPolarHBondContact OD2-CE 3.46Å; D299-K318 IonicContact OD2-NZ 2.66Å; D299-K318 PolarHBondContact OD2-NZ 3.28Å; D299-K321 WeakPolarHBondContact O-CB 3.41Å; D299-K321 PolarHBondContact O-N 2.89Å; D299-N514 HydrophobicContact CB-CB 3.79Å; D299-N514 WeakPolarHBondContact OD2-CA 3.22Å
300	A	93.3	Very high	90.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	165.6	-167.2	0	0	0	0	0	113.7	A297 Y302 K318 I319	A297-A300 PolarHBondContact N-O 2.95Å; A300-Y302 HydrophobicContact CB-CE2 4.27Å; A300-K318 HydrophobicContact CB-CD 4.05Å; A300-K318 HydrophobicContact CB-CG 3.42Å; A300-K318 VanDerWaalsContact CB-CG 3.42Å; A300-I319 WeakPolarHBondContact CA-O 3.27Å; A300-I319 VanDerWaalsContact CB-O 3.24Å; A300-I319 WeakPolarHBondContact CB-O 3.18Å
301	V	95.1	Very high	90.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	145.6	160.8	61	0	0	0	0	109.7	P293 E296 Y303 K318 I319 P363 W364	P293-V301 HydrophobicContact CB-CG2 3.35Å; P293-V301 HydrophobicContact CG-CG2 4.21Å; E296-V301 HydrophobicContact CG-CG2 3.98Å; V301-Y303 HydrophobicContact CB-CE2 4.33Å; V301-Y303 HydrophobicContact CG1-CD2 4.36Å; V301-Y303 HydrophobicContact CG1-CE2 3.72Å; V301-Y303 HydrophobicContact CG2-CD2 4.22Å; V301-Y303 HydrophobicContact CG2-CE2 3.6Å; V301-K318 CarbonylContact O-C 3.48Å; V301-K318 WeakPolarHBondContact O-CA 3.46Å; V301-I319 HydrophobicContact CG1-CB 3.91Å; V301-I319 PolarHBondContact N-O 3.47Å; V301-I319 PolarHBondContact O-N 3.23Å; V301-P363 HydrophobicContact CG2-CG 4.28Å; V301-W364 HydrophobicContact CB-CH2 4.28Å; V301-W364 HydrophobicContact CB-CZ3 3.9Å; V301-W364 HydrophobicContact CG1-CH2 3.73Å; V301-W364 HydrophobicContact CG1-CZ3 3.8Å
302	Y	95.6	Very high	90	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.2	177.3	-62.8	-101.6	0	0	0	110.7	P293 C294 C295 A297 A300 A316 V317 K318 Q347 P426 L482	P293-Y302 CarbonylContact C-O 3.04Å; P293-Y302 WeakPolarHBondContact CA-O 3.49Å; P293-Y302 WeakPolarHBondContact CB-O 3.32Å; C294-Y302 PolarHBondContact N-O 2.87Å; C294-Y302 PolarHBondContact SG-O 3.15Å; C295-Y302 HydrophobicContact CB-CD2 4.08Å; C295-Y302 HydrophobicContact CB-CG 4.43Å; C295-Y302 PolarHBondContact O-N 3.47Å; A297-Y302 HydrophobicContact CB-CD2 4.47Å; A297-Y302 HydrophobicContact CB-CE2 3.73Å; A300-Y302 HydrophobicContact CB-CE2 4.27Å; Y302-A316 HydrophobicContact CD1-CB 4.23Å; Y302-V317 WeakPolarHBondContact CA-O 3.21Å; Y302-K318 HydrophobicContact CD1-CB 3.75Å; Y302-K318 HydrophobicContact CD1-CG 4.06Å; Y302-K318 HydrophobicContact CE1-CB 3.57Å; Y302-K318 HydrophobicContact CE1-CD 3.69Å; Y302-K318 HydrophobicContact CE1-CG 3.54Å; Y302-K318 HydrophobicContact CE2-CG 4.31Å; Y302-K318 WeakPolarHBondContact OH-CD 3.43Å; Y302-K318 WeakPolarHBondContact OH-CE 3.23Å; Y302-K318 PolarHBondContact OH-NZ 3.02Å; Y302-Q347 PolarHBondContact OH-NE2 3.15Å; Y302-P426 HydrophobicContact CD1-CG 3.54Å; Y302-P426 HydrophobicContact CD2-CG 3.87Å; Y302-P426 HydrophobicContact CE1-CG 4.02Å; Y302-P426 HydrophobicContact CE2-CG 4.33Å; Y302-P426 HydrophobicContact CG-CG 3.46Å; Y302-P426 VanDerWaalsContact CG-CG 3.46Å; Y302-L482 HydrophobicContact CE1-CD1 4.36Å; Y302-L482 HydrophobicContact CE2-CD1 4.37Å; Y302-L482 HydrophobicContact CE2-CD2 4.17Å; Y302-L482 WeakPolarHBondContact OH-CD1 3.23Å
303	Y	94.6	Very high	89.6	Confident	5 Å²	5	39.4 Å²	39.4	2%	0.02	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.7	171.5	-70	-90.2	0	0	0	110.3	L288 K292 P293 V301 A316 V317 I319 L361	L288-Y303 HydrophobicContact CD1-CD1 4.34Å; L288-Y303 HydrophobicContact CD1-CG 4.26Å; K292-Y303 VanDerWaalsContact C-CE1 3.49Å; P293-Y303 HydrophobicContact CB-CD1 4.42Å; P293-Y303 HydrophobicContact CB-CE1 3.97Å; P293-Y303 HydrophobicContact CB-CE2 4.45Å; P293-Y303 VanDerWaalsContact N-CE1 3.31Å; V301-Y303 HydrophobicContact CB-CE2 4.33Å; V301-Y303 HydrophobicContact CG1-CD2 4.36Å; V301-Y303 HydrophobicContact CG1-CE2 3.72Å; V301-Y303 HydrophobicContact CG2-CD2 4.22Å; V301-Y303 HydrophobicContact CG2-CE2 3.6Å; Y303-A316 WeakPolarHBondContact O-CA 3.33Å; Y303-V317 PolarHBondContact N-O 3.24Å; Y303-V317 PolarHBondContact O-N 2.87Å; Y303-I319 HydrophobicContact CD2-CD1 3.97Å; Y303-I319 HydrophobicContact CE2-CD1 4.08Å; Y303-L361 HydrophobicContact CD1-CD2 4.49Å; Y303-L361 HydrophobicContact CE1-CD2 3.84Å; Y303-L361 HydrophobicContact CE2-CB 4.1Å; Y303-L361 HydrophobicContact CE2-CD2 4.47Å; Y303-L361 WeakPolarHBondContact CE2-O 3.44Å; Y303-L361 WeakPolarHBondContact OH-CA 3.38Å; Y303-L361 PolarHBondContact OH-O 3.32Å; Y303-L361 VanDerWaalsContact OH-O 3.14Å
304	T	93.8	Very high	89	Confident	32 Å²	32	42.6 Å²	42.6	20%	0.196	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	138.2	172.1	43.8	0	0	0	0	110.9	L288 T289 C294 V425	L288-T304 CarbonylContact C-O 3.54Å; L288-T304 WeakPolarHBondContact CA-O 3.33Å; T289-T304 PolarHBondContact N-O 2.74Å; T289-T304 VanDerWaalsContact OG1-C 3.23Å; T289-T304 WeakPolarHBondContact OG1-CB 3.22Å; T289-T304 PolarHBondContact OG1-O 3.5Å; T289-T304 VanDerWaalsContact OG1-O 3.09Å; T289-T304 PolarHBondContact OG1-OG1 2.96Å; C294-T304 HydrophobicContact CB-CG2 3.97Å; T304-V425 HydrophobicContact CG2-CG1 3.65Å
305	A	92.3	Very high	88.9	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	148.1	-179.7	0	0	0	0	0	113.1	F286 R287 L288 Y315 V317	F286-A305 HydrophobicContact CD1-CB 4.38Å; R287-A305 CarbonylContact O-C 3.23Å; R287-A305 VanDerWaalsContact O-CA 3.23Å; R287-A305 WeakPolarHBondContact O-CA 3.16Å; R287-A305 WeakPolarHBondContact O-CB 3.41Å; L288-A305 HydrophobicContact CD2-CB 4.08Å; A305-Y315 PolarHBondContact N-O 2.93Å; A305-Y315 PolarHBondContact O-N 2.93Å; A305-V317 HydrophobicContact CB-CG2 3.63Å
306	S	90.3	Very high	88.8	Confident	29 Å²	29	40.8 Å²	40.8	20%	0.203	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	139.2	169.3	178.9	0	0	0	0	109.4	R287 P311	R287-S306 PolarHBondContact N-O 3.19Å; R287-S306 PolarHBondContact O-N 3.33Å; S306-P311 WeakPolarHBondContact OG-CA 3.35Å
307	Y	89.3	Confident	88.8	Confident	26 Å²	26	36.6 Å²	36.6	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.2	172.2	179.8	-128.1	0	0	0	110.3	F278 D285 F286 K309 D310 P311 Y315	F278-Y307 HydrophobicContact CD1-CE2 4.17Å; F278-Y307 HydrophobicContact CE1-CD1 4.24Å; F278-Y307 HydrophobicContact CE1-CD2 4.24Å; F278-Y307 AromaticContact CE1-CE1 3.74Å; F278-Y307 HydrophobicContact CE1-CE1 3.74Å; F278-Y307 AromaticContact CE1-CE2 3.75Å; F278-Y307 HydrophobicContact CE1-CE2 3.75Å; F278-Y307 HydrophobicContact CE1-CG 4.48Å; F278-Y307 AromaticContact CE1-CZ 3.49Å; F278-Y307 VanDerWaalsContact CE1-CZ 3.49Å; F278-Y307 HydrophobicContact CZ-CD1 4.31Å; F278-Y307 HydrophobicContact CZ-CE1 4.2Å; D285-Y307 HydrophobicContact CB-CD2 3.61Å; D285-Y307 HydrophobicContact CB-CE2 3.36Å; F286-Y307 HydrophobicContact CD1-CD2 4.29Å; F286-Y307 HydrophobicContact CD2-CD2 4.23Å; F286-Y307 AromaticContact CE1-CD2 3.84Å; F286-Y307 HydrophobicContact CE1-CD2 3.84Å; F286-Y307 HydrophobicContact CE1-CG 4.07Å; F286-Y307 AromaticContact CE2-CD2 3.76Å; F286-Y307 HydrophobicContact CE2-CD2 3.76Å; F286-Y307 HydrophobicContact CE2-CE2 4.11Å; F286-Y307 HydrophobicContact CG-CD2 4.47Å; F286-Y307 AromaticContact CZ-CD2 3.52Å; F286-Y307 HydrophobicContact CZ-CD2 3.52Å; F286-Y307 HydrophobicContact CZ-CE2 4.17Å; F286-Y307 HydrophobicContact CZ-CG 4.03Å; Y307-K309 HydrophobicContact CD1-CB 4.16Å; Y307-K309 HydrophobicContact CE1-CB 3.6Å; Y307-K309 HydrophobicContact CE1-CD 4.49Å; Y307-K309 HydrophobicContact CE1-CG 4.05Å; Y307-K309 HydrophobicContact CE2-CG 4.45Å; Y307-K309 PolarHBondContact O-N 3.11Å; Y307-K309 VanDerWaalsContact O-N 3.11Å; Y307-K309 WeakPolarHBondContact OH-CD 3.45Å; Y307-K309 PolarHBondContact OH-NZ 3.26Å; Y307-D310 HydrophobicContact CD1-CB 4.06Å; Y307-D310 CarbonylContact O-C 3.54Å; Y307-D310 PolarHBondContact O-N 2.92Å; Y307-P311 WeakPolarHBondContact O-CA 3.24Å; Y307-Y315 HydrophobicContact CG-CE2 4.43Å
308	A	85.9	Confident	88.8	Confident	51 Å²	51	36.9 Å²	36.9	42%	0.421	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.1	-171.8	0	0	0	0	0	114.7	D285	D285-A308 HydrophobicContact CB-CB 4Å; D285-A308 VanDerWaalsContact O-CB 3.29Å; D285-A308 WeakPolarHBondContact O-CB 3.28Å; D285-A308 PolarHBondContact O-N 3.13Å
309	K	83.7	Confident	89	Confident	134 Å²	134	36 Å²	36	58%	0.583	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-8.4	178.2	-41.2	-169.2	-172.9	67.2	0	113.9	D285 Y307	D285-K309 IonicContact OD1-NZ 2.83Å; D285-K309 PolarHBondContact OD1-NZ 3.46Å; D285-K309 IonicContact OD2-NZ 2.63Å; D285-K309 PolarHBondContact OD2-NZ 3.34Å; Y307-K309 HydrophobicContact CD1-CB 4.16Å; Y307-K309 HydrophobicContact CE1-CB 3.6Å; Y307-K309 HydrophobicContact CE1-CD 4.49Å; Y307-K309 HydrophobicContact CE1-CG 4.05Å; Y307-K309 HydrophobicContact CE2-CG 4.45Å; Y307-K309 PolarHBondContact O-N 3.11Å; Y307-K309 VanDerWaalsContact O-N 3.11Å; Y307-K309 WeakPolarHBondContact OH-CD 3.45Å; Y307-K309 PolarHBondContact OH-NZ 3.26Å
310	D	81.4	Confident	89.1	Confident	54 Å²	54	35.4 Å²	35.4	29%	0.289	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	77.7	170.5	-178.9	9.5	0	0	0	109.4	Y307 L312 S313	Y307-D310 HydrophobicContact CD1-CB 4.06Å; Y307-D310 CarbonylContact O-C 3.54Å; Y307-D310 PolarHBondContact O-N 2.92Å; D310-L312 PolarHBondContact O-N 3.12Å; D310-S313 PolarHBondContact O-N 3.38Å; D310-S313 PolarHBondContact OD1-N 2.84Å; D310-S313 WeakPolarHBondContact OD2-CB 3.22Å; D310-S313 PolarHBondContact OD2-OG 3.16Å
311	P	79.4	Confident	88.8	Confident	87 Å²	87	38.7 Å²	38.7	57%	0.565	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	1.8	-173.3	33.3	-37.5	0	0	0	113.8	S306 Y307	S306-P311 WeakPolarHBondContact OG-CA 3.35Å; Y307-P311 WeakPolarHBondContact O-CA 3.24Å
312	L	77.8	Confident	87.7	Confident	156 Å²	156	40 Å²	40	82%	0.817	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	-19.8	174.3	-63.1	179.3	0	0	0	112	D310	D310-L312 PolarHBondContact O-N 3.12Å
313	S	80.8	Confident	86.1	Confident	38 Å²	38	45.3 Å²	45.3	27%	0.266	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.8	172.5	-71.5	0	0	0	0	111.4	D310 Y315	D310-S313 PolarHBondContact O-N 3.38Å; D310-S313 PolarHBondContact OD1-N 2.84Å; D310-S313 WeakPolarHBondContact OD2-CB 3.22Å; D310-S313 PolarHBondContact OD2-OG 3.16Å; S313-Y315 VanDerWaalsContact O-CD2 3.29Å; S313-Y315 WeakPolarHBondContact O-CD2 3.34Å; S313-Y315 WeakPolarHBondContact O-CE2 3.24Å
314	N	82.4	Confident	84.4	Confident	113 Å²	113	46.9 Å²	46.9	60%	0.604	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.3	169	-66.3	-51.7	0	0	0	110.4	V425	N314-V425 HydrophobicContact CB-CG2 4.12Å
315	Y	90.4	Very high	82.4	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	159	171	-65.1	-96.3	0	0	0	109.6	L276 F278 F286 A305 Y307 S313 I421 T422 R423	L276-Y315 WeakPolarHBondContact CD1-OH 3.46Å; F278-Y315 HydrophobicContact CE2-CD1 4.29Å; F278-Y315 AromaticContact CE2-CE1 3.74Å; F278-Y315 HydrophobicContact CE2-CE1 3.74Å; F278-Y315 HydrophobicContact CZ-CE1 4.03Å; F286-Y315 HydrophobicContact CE1-CD1 4.24Å; F286-Y315 HydrophobicContact CE1-CD2 4.07Å; F286-Y315 AromaticContact CE1-CG 3.86Å; F286-Y315 HydrophobicContact CE1-CG 3.86Å; A305-Y315 PolarHBondContact N-O 2.93Å; A305-Y315 PolarHBondContact O-N 2.93Å; Y307-Y315 HydrophobicContact CG-CE2 4.43Å; S313-Y315 VanDerWaalsContact O-CD2 3.29Å; S313-Y315 WeakPolarHBondContact O-CD2 3.34Å; S313-Y315 WeakPolarHBondContact O-CE2 3.24Å; Y315-I421 HydrophobicContact CD1-CG2 3.85Å; Y315-I421 HydrophobicContact CG-CG2 4.35Å; Y315-T422 WeakPolarHBondContact CA-O 3.1Å; Y315-R423 HydrophobicContact CD1-CG 4.16Å; Y315-R423 HydrophobicContact CE1-CG 3.88Å
316	A	93	Very high	80.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.9	165.7	0	0	0	0	0	110.8	Y302 Y303 T422 V425	Y302-A316 HydrophobicContact CD1-CB 4.23Å; Y303-A316 WeakPolarHBondContact O-CA 3.33Å; A316-T422 HydrophobicContact CB-CG2 3.96Å; A316-T422 PolarHBondContact N-O 3.43Å; A316-T422 PolarHBondContact O-N 2.9Å; A316-V425 HydrophobicContact CB-CB 4.39Å; A316-V425 HydrophobicContact CB-CG1 4.47Å; A316-V425 HydrophobicContact CB-CG2 4.11Å
317	V	93.9	Very high	79.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	105.7	170.3	176.5	0	0	0	0	107	W283 L288 Y302 Y303 A305 I319 V419 I421	W283-V317 HydrophobicContact CH2-CG1 3.92Å; W283-V317 HydrophobicContact CZ3-CG1 3.85Å; W283-V317 HydrophobicContact CZ3-CG2 4.1Å; L288-V317 HydrophobicContact CD2-CB 4.12Å; L288-V317 HydrophobicContact CD2-CG2 3.88Å; Y302-V317 WeakPolarHBondContact CA-O 3.21Å; Y303-V317 PolarHBondContact N-O 3.24Å; Y303-V317 PolarHBondContact O-N 2.87Å; A305-V317 HydrophobicContact CB-CG2 3.63Å; V317-I319 HydrophobicContact CG1-CD1 4.49Å; V317-I319 HydrophobicContact CG1-CG1 4.04Å; V317-V419 HydrophobicContact CG1-CG1 3.63Å; V317-I421 HydrophobicContact CG2-CD1 3.96Å
318	K	94.3	Very high	78.5	Confident	9 Å²	9	64.5 Å²	64.5	4%	0.039	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118.1	174.8	179.8	-174.1	-174.2	174.2	0	108.7	D299 A300 V301 Y302 V419 V420	D299-K318 VanDerWaalsContact CG-NZ 3.34Å; D299-K318 VanDerWaalsContact OD1-CE 3.24Å; D299-K318 WeakPolarHBondContact OD1-CE 3.37Å; D299-K318 IonicContact OD1-NZ 2.74Å; D299-K318 PolarHBondContact OD1-NZ 3.38Å; D299-K318 WeakPolarHBondContact OD2-CE 3.46Å; D299-K318 IonicContact OD2-NZ 2.66Å; D299-K318 PolarHBondContact OD2-NZ 3.28Å; A300-K318 HydrophobicContact CB-CD 4.05Å; A300-K318 HydrophobicContact CB-CG 3.42Å; A300-K318 VanDerWaalsContact CB-CG 3.42Å; V301-K318 CarbonylContact O-C 3.48Å; V301-K318 WeakPolarHBondContact O-CA 3.46Å; Y302-K318 HydrophobicContact CD1-CB 3.75Å; Y302-K318 HydrophobicContact CD1-CG 4.06Å; Y302-K318 HydrophobicContact CE1-CB 3.57Å; Y302-K318 HydrophobicContact CE1-CD 3.69Å; Y302-K318 HydrophobicContact CE1-CG 3.54Å; Y302-K318 HydrophobicContact CE2-CG 4.31Å; Y302-K318 WeakPolarHBondContact OH-CD 3.43Å; Y302-K318 WeakPolarHBondContact OH-CE 3.23Å; Y302-K318 PolarHBondContact OH-NZ 3.02Å; K318-V419 CarbonylContact O-C 3.52Å; K318-V419 WeakPolarHBondContact O-CA 3.44Å; K318-V420 HydrophobicContact CB-CB 4.15Å; K318-V420 HydrophobicContact CD-CB 4.41Å; K318-V420 HydrophobicContact CD-CG2 4.48Å; K318-V420 PolarHBondContact N-O 3.44Å; K318-V420 PolarHBondContact O-N 3.39Å
319	I	92.4	Very high	77.8	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.015	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	114	177.7	-49.6	180	0	0	0	108.2	A300 V301 Y303 V317 V357 L362 H417 V419	A300-I319 WeakPolarHBondContact CA-O 3.27Å; A300-I319 VanDerWaalsContact CB-O 3.24Å; A300-I319 WeakPolarHBondContact CB-O 3.18Å; V301-I319 HydrophobicContact CG1-CB 3.91Å; V301-I319 PolarHBondContact N-O 3.47Å; V301-I319 PolarHBondContact O-N 3.23Å; Y303-I319 HydrophobicContact CD2-CD1 3.97Å; Y303-I319 HydrophobicContact CE2-CD1 4.08Å; V317-I319 HydrophobicContact CG1-CD1 4.49Å; V317-I319 HydrophobicContact CG1-CG1 4.04Å; I319-V357 HydrophobicContact CD1-CG1 3.98Å; I319-V357 HydrophobicContact CD1-CG2 4.32Å; I319-V357 HydrophobicContact CG2-CG1 4.41Å; I319-V357 HydrophobicContact CG2-CG2 3.94Å; I319-L362 HydrophobicContact CG2-CD2 3.75Å; I319-H417 HydrophobicContact CG2-CB 3.97Å; I319-V419 HydrophobicContact CG1-CG2 4.42Å
320	C	90.8	Very high	77.4	Confident	4 Å²	4	60.4 Å²	60.4	3%	0.027	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	143.8	-173.4	-73.7	0	0	0	0	113	Y330 H417 V418	C320-Y330 HydrophobicContact CB-CD2 4.27Å; C320-H417 PolarHBondContact O-ND1 3.03Å; C320-V418 HydrophobicContact CB-CB 4.49Å; C320-V418 PolarHBondContact N-O 2.9Å
321	K	87	Confident	77.4	Confident	70 Å²	70	62.7 Å²	62.7	30%	0.304	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-36	-177	-75.5	170.9	175.4	175.9	0	113.8	A297 G298 D299 K323 W364	A297-K321 PolarHBondContact O-NZ 3.46Å; G298-K321 WeakPolarHBondContact O-CD 3.49Å; G298-K321 PolarHBondContact O-NZ 2.65Å; D299-K321 WeakPolarHBondContact O-CB 3.41Å; D299-K321 PolarHBondContact O-N 2.89Å; K321-K323 PolarHBondContact O-N 2.98Å; K321-W364 HydrophobicContact CB-CH2 4.35Å; K321-W364 HydrophobicContact CB-CZ2 4.17Å; K321-W364 HydrophobicContact CD-CE3 4.19Å; K321-W364 HydrophobicContact CD-CZ3 4.14Å; K321-W364 HydrophobicContact CG-CD2 3.88Å; K321-W364 HydrophobicContact CG-CE3 3.7Å; K321-W364 HydrophobicContact CG-CH2 3.41Å; K321-W364 VanDerWaalsContact CG-CH2 3.41Å; K321-W364 HydrophobicContact CG-CZ2 3.64Å; K321-W364 HydrophobicContact CG-CZ3 3.45Å; K321-W364 VanDerWaalsContact CG-CZ3 3.45Å
322	S	72.3	Confident	77.5	Confident	28 Å²	28	62 Å²	62	20%	0.196	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	133.1	177.8	-48.4	0	0	0	0	111.5
323	K	63.3	Low	77.9	Confident	110 Å²	110	55 Å²	55	48%	0.478	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	161.6	177.2	-65.7	174.6	-179.7	173	0	110.8	K321 K325 E326 S327	K321-K323 PolarHBondContact O-N 2.98Å; K323-K325 PolarHBondContact O-N 3.46Å; K323-K325 VanDerWaalsContact O-N 3.16Å; K323-E326 PolarHBondContact N-OE2 3.07Å; K323-E326 CarbonylContact O-C 3.59Å; K323-E326 WeakPolarHBondContact O-CA 3.4Å; K323-E326 WeakPolarHBondContact O-CB 3.4Å; K323-E326 PolarHBondContact O-N 3.35Å; K323-S327 PolarHBondContact O-N 2.9Å
324	A	57.9	Low	78.1	Confident	38 Å²	38	53.5 Å²	53.5	31%	0.314	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-54.2	-35.5	178.8	0	0	0	0	0	114.2	E326 S327	A324-E326 VanDerWaalsContact C-N 3.26Å; A324-E326 PolarHBondContact O-N 3.41Å; A324-S327 WeakPolarHBondContact O-CB 3.42Å; A324-S327 PolarHBondContact O-N 2.78Å; A324-S327 PolarHBondContact O-OG 2.87Å
325	K	51.3	Low	78.2	Confident	164 Å²	164	51 Å²	51	71%	0.713	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-70.8	-17.1	175.1	-68.4	-177.7	176.1	177.3	0	113.6	K323 E374	K323-K325 PolarHBondContact O-N 3.46Å; K323-K325 VanDerWaalsContact O-N 3.16Å; K325-E374 IonicContact NZ-OE1 2.94Å; K325-E374 PolarHBondContact NZ-OE1 3.49Å; K325-E374 IonicContact NZ-OE2 2.72Å; K325-E374 PolarHBondContact NZ-OE2 3.42Å
326	E	58.9	Low	78	Confident	108 Å²	108	51.1 Å²	51.1	51%	0.505	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-102.9	4.6	179.4	-58.2	168.7	140.9	0	0	112.5	K323 A324 Q328 Q329	K323-E326 PolarHBondContact N-OE2 3.07Å; K323-E326 CarbonylContact O-C 3.59Å; K323-E326 WeakPolarHBondContact O-CA 3.4Å; K323-E326 WeakPolarHBondContact O-CB 3.4Å; K323-E326 PolarHBondContact O-N 3.35Å; A324-E326 VanDerWaalsContact C-N 3.26Å; A324-E326 PolarHBondContact O-N 3.41Å; E326-Q328 PolarHBondContact O-N 3.31Å; E326-Q329 PolarHBondContact O-N 3.02Å
327	S	63	Low	77.8	Confident	22 Å²	22	52 Å²	52	15%	0.154	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.4	-165.8	64.1	0	0	0	0	115.5	K323 A324 Q329 Y330 Y331	K323-S327 PolarHBondContact O-N 2.9Å; A324-S327 WeakPolarHBondContact O-CB 3.42Å; A324-S327 PolarHBondContact O-N 2.78Å; A324-S327 PolarHBondContact O-OG 2.87Å; S327-Q329 VanDerWaalsContact C-N 3.27Å; S327-Q329 PolarHBondContact O-N 3.01Å; S327-Y330 WeakPolarHBondContact O-CB 3.47Å; S327-Y330 PolarHBondContact O-N 3.05Å; S327-Y330 VanDerWaalsContact O-N 3.11Å; S327-Y331 WeakPolarHBondContact O-CD2 3.38Å; S327-Y331 PolarHBondContact O-N 3.28Å; S327-Y331 WeakPolarHBondContact OG-CE2 3.26Å
328	Q	68.3	Low	77.5	Confident	164 Å²	164	56 Å²	56	77%	0.766	28%	0.275	S	S	*	.	H	α-helix	trans	-55.1	-41.6	175.4	-65.5	-177.3	-4.4	0	0	112.1	E326 Y330 Y331 H332	E326-Q328 PolarHBondContact O-N 3.31Å; Q328-Y330 VanDerWaalsContact C-N 3.33Å; Q328-Y330 PolarHBondContact O-N 3.48Å; Q328-Y331 PolarHBondContact O-N 2.84Å; Q328-H332 WeakPolarHBondContact O-CB 3.41Å; Q328-H332 PolarHBondContact O-N 3.26Å
329	Q	71.4	Confident	77.2	Confident	88 Å²	88	58.2 Å²	58.2	41%	0.411	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-37.3	177.3	-67.4	-176.4	-4.7	0	0	112	E326 S327 S333	E326-Q329 PolarHBondContact O-N 3.02Å; S327-Q329 VanDerWaalsContact C-N 3.27Å; S327-Q329 PolarHBondContact O-N 3.01Å; Q329-S333 WeakPolarHBondContact O-CB 3.42Å; Q329-S333 PolarHBondContact O-N 3.48Å
330	Y	75.8	Confident	77.1	Confident	12 Å²	12	58.9 Å²	58.9	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-49.9	173.3	170.2	-85.5	0	0	0	111.4	C320 S327 Q328 H332 S333 L334 H352 V418 V420	C320-Y330 HydrophobicContact CB-CD2 4.27Å; S327-Y330 WeakPolarHBondContact O-CB 3.47Å; S327-Y330 PolarHBondContact O-N 3.05Å; S327-Y330 VanDerWaalsContact O-N 3.11Å; Q328-Y330 VanDerWaalsContact C-N 3.33Å; Q328-Y330 PolarHBondContact O-N 3.48Å; Y330-H332 PolarHBondContact O-N 3.2Å; Y330-S333 VanDerWaalsContact O-CB 3.27Å; Y330-S333 WeakPolarHBondContact O-CB 3.32Å; Y330-S333 PolarHBondContact O-N 3.26Å; Y330-S333 VanDerWaalsContact O-N 3.13Å; Y330-L334 HydrophobicContact CE1-CB 4.01Å; Y330-L334 HydrophobicContact CE1-CD2 3.84Å; Y330-L334 HydrophobicContact CE1-CG 4.45Å; Y330-L334 WeakPolarHBondContact O-CB 3.36Å; Y330-L334 PolarHBondContact O-N 3.12Å; Y330-H352 WeakPolarHBondContact OH-CB 3.2Å; Y330-V418 HydrophobicContact CD1-CB 4.23Å; Y330-V418 HydrophobicContact CD1-CG1 3.74Å; Y330-V418 HydrophobicContact CD1-CG2 4.02Å; Y330-V418 HydrophobicContact CD2-CB 4.25Å; Y330-V418 HydrophobicContact CD2-CG1 4.1Å; Y330-V418 HydrophobicContact CE1-CB 4.44Å; Y330-V418 HydrophobicContact CE1-CG1 3.49Å; Y330-V418 VanDerWaalsContact CE1-CG1 3.49Å; Y330-V418 HydrophobicContact CE2-CB 4.4Å; Y330-V418 HydrophobicContact CE2-CG1 3.81Å; Y330-V418 HydrophobicContact CG-CB 4.18Å; Y330-V418 HydrophobicContact CG-CG1 4.07Å; Y330-V418 HydrophobicContact CG-CG2 4.08Å; Y330-V420 HydrophobicContact CE2-CG2 3.55Å; Y330-V420 WeakPolarHBondContact OH-CG2 3.22Å
331	Y	80.1	Confident	77.2	Confident	101 Å²	101	61.7 Å²	61.7	40%	0.396	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-33	-177.7	-72	-61.1	0	0	0	111.7	S327 Q328 A335	S327-Y331 WeakPolarHBondContact O-CD2 3.38Å; S327-Y331 PolarHBondContact O-N 3.28Å; S327-Y331 WeakPolarHBondContact OG-CE2 3.26Å; Q328-Y331 PolarHBondContact O-N 2.84Å; Y331-A335 VanDerWaalsContact O-CB 3.23Å; Y331-A335 WeakPolarHBondContact O-CB 3.38Å; Y331-A335 PolarHBondContact O-N 3.18Å
332	H	83.4	Confident	77.4	Confident	74 Å²	74	62 Å²	62	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-51.8	169	179.7	67.1	0	0	0	112.5	Q328 Y330 L334 A335 V336 A518	Q328-H332 WeakPolarHBondContact O-CB 3.41Å; Q328-H332 PolarHBondContact O-N 3.26Å; Y330-H332 PolarHBondContact O-N 3.2Å; H332-L334 PolarHBondContact O-N 3.24Å; H332-A335 PolarHBondContact O-N 3.02Å; H332-A335 VanDerWaalsContact O-N 3.15Å; H332-V336 WeakPolarHBondContact O-CG2 3.39Å; H332-V336 PolarHBondContact O-N 2.79Å; H332-A518 PolarHBondContact CE1-O 2.86Å; H332-A518 PolarHBondContact NE2-O 3.13Å
333	S	85.2	Confident	78.5	Confident	7 Å²	7	62.6 Å²	62.6	5%	0.049	32%	0.321	C	S	.	.	H	α-helix	trans	-51.5	-42.8	174.7	-162.5	0	0	0	0	112.3	Q329 Y330 R337 F515 S516	Q329-S333 WeakPolarHBondContact O-CB 3.42Å; Q329-S333 PolarHBondContact O-N 3.48Å; Y330-S333 VanDerWaalsContact O-CB 3.27Å; Y330-S333 WeakPolarHBondContact O-CB 3.32Å; Y330-S333 PolarHBondContact O-N 3.26Å; Y330-S333 VanDerWaalsContact O-N 3.13Å; S333-R337 VanDerWaalsContact O-CB 3.27Å; S333-R337 WeakPolarHBondContact O-CB 3.47Å; S333-R337 PolarHBondContact O-N 2.86Å; S333-F515 VanDerWaalsContact OG-C 3.28Å; S333-F515 WeakPolarHBondContact OG-CA 3.46Å; S333-F515 PolarHBondContact OG-N 3.29Å; S333-F515 VanDerWaalsContact OG-N 3.11Å; S333-S516 WeakPolarHBondContact CB-OG 3.41Å; S333-S516 PolarHBondContact OG-N 3.5Å; S333-S516 PolarHBondContact OG-OG 2.83Å
334	L	84.4	Confident	80	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-69.6	-49.4	176.7	-176.1	68.8	0	0	0	112.2	Y330 H332 R337 Q338 H352	Y330-L334 HydrophobicContact CE1-CB 4.01Å; Y330-L334 HydrophobicContact CE1-CD2 3.84Å; Y330-L334 HydrophobicContact CE1-CG 4.45Å; Y330-L334 WeakPolarHBondContact O-CB 3.36Å; Y330-L334 PolarHBondContact O-N 3.12Å; H332-L334 PolarHBondContact O-N 3.24Å; L334-R337 VanDerWaalsContact CD1-NH2 3.34Å; L334-R337 PolarHBondContact O-N 3.35Å; L334-Q338 HydrophobicContact CD1-CG 4.01Å; L334-Q338 HydrophobicContact CG-CG 4.26Å; L334-Q338 WeakPolarHBondContact O-CB 3.5Å; L334-Q338 WeakPolarHBondContact O-CG 3.43Å; L334-Q338 PolarHBondContact O-N 3.36Å; L334-H352 VanDerWaalsContact CD2-CE1 3.46Å; L334-H352 WeakPolarHBondContact CD2-CE1 3.47Å; L334-H352 WeakPolarHBondContact CD2-NE2 3.21Å
335	A	85.8	Confident	81.8	Confident	59 Å²	59	56 Å²	56	49%	0.488	29%	0.285	S	S	.	.	H	α-helix	trans	-62.5	-44.7	-176.8	0	0	0	0	0	112.2	Y331 H332 R337 Q338 S339	Y331-A335 VanDerWaalsContact O-CB 3.23Å; Y331-A335 WeakPolarHBondContact O-CB 3.38Å; Y331-A335 PolarHBondContact O-N 3.18Å; H332-A335 PolarHBondContact O-N 3.02Å; H332-A335 VanDerWaalsContact O-N 3.15Å; A335-R337 PolarHBondContact O-N 2.98Å; A335-Q338 PolarHBondContact O-N 3.24Å; A335-S339 PolarHBondContact O-N 3.02Å
336	V	86.4	Confident	83.9	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-50.9	173.6	173.2	0	0	0	0	109.8	H332 Q338 S339 V471 F515 A518	H332-V336 WeakPolarHBondContact O-CG2 3.39Å; H332-V336 PolarHBondContact O-N 2.79Å; V336-Q338 PolarHBondContact O-N 3.22Å; V336-S339 WeakPolarHBondContact O-CB 3.42Å; V336-S339 PolarHBondContact O-N 2.73Å; V336-S339 PolarHBondContact O-OG 2.83Å; V336-V471 HydrophobicContact CG1-CG1 3.74Å; V336-V471 HydrophobicContact CG1-CG2 4.1Å; V336-F515 HydrophobicContact CG1-CD1 4.07Å; V336-A518 HydrophobicContact CG1-CB 4.09Å
337	R	88.9	Confident	85.6	Confident	20 Å²	20	43.9 Å²	43.9	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-70.6	-30.5	-174.8	-162.9	172.5	55	57.2	16.4	113.6	S333 L334 A335 L340 I346 Q347 D349 F515	S333-R337 VanDerWaalsContact O-CB 3.27Å; S333-R337 WeakPolarHBondContact O-CB 3.47Å; S333-R337 PolarHBondContact O-N 2.86Å; L334-R337 VanDerWaalsContact CD1-NH2 3.34Å; L334-R337 PolarHBondContact O-N 3.35Å; A335-R337 PolarHBondContact O-N 2.98Å; R337-L340 PolarHBondContact O-N 3.31Å; R337-I346 HydrophobicContact CG-CG2 4.21Å; R337-Q347 VanDerWaalsContact CD-O 3.22Å; R337-Q347 WeakPolarHBondContact CD-O 3.37Å; R337-Q347 PolarHBondContact NH1-O 3.18Å; R337-D349 IonicContact CZ-OD1 2.72Å; R337-D349 IonicContact NH1-OD1 3.19Å; R337-D349 PolarHBondContact NH1-OD1 3.02Å; R337-D349 IonicContact NH2-OD1 2.73Å; R337-D349 PolarHBondContact NH2-OD1 3.23Å; R337-F515 HydrophobicContact CB-CD2 4.46Å; R337-F515 HydrophobicContact CB-CG 4.42Å; R337-F515 HydrophobicContact CG-CD2 4.21Å; R337-F515 HydrophobicContact CG-CE2 4.31Å
338	Q	85.9	Confident	86.9	Confident	82 Å²	82	43.9 Å²	43.9	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-78.2	-16.5	173.1	-71.7	-173.5	-9.8	0	0	113.6	L334 A335 V336 L340 D349	L334-Q338 HydrophobicContact CD1-CG 4.01Å; L334-Q338 HydrophobicContact CG-CG 4.26Å; L334-Q338 WeakPolarHBondContact O-CB 3.5Å; L334-Q338 WeakPolarHBondContact O-CG 3.43Å; L334-Q338 PolarHBondContact O-N 3.36Å; A335-Q338 PolarHBondContact O-N 3.24Å; V336-Q338 PolarHBondContact O-N 3.22Å; Q338-L340 VanDerWaalsContact C-N 3.27Å; Q338-D349 PolarHBondContact NE2-OD2 3.5Å
339	S	87.9	Confident	87.9	Confident	57 Å²	57	37 Å²	37	40%	0.399	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-15.5	170.9	80.5	0	0	0	0	113.6	A335 V336 Q520	A335-S339 PolarHBondContact O-N 3.02Å; V336-S339 WeakPolarHBondContact O-CB 3.42Å; V336-S339 PolarHBondContact O-N 2.73Å; V336-S339 PolarHBondContact O-OG 2.83Å; S339-Q520 PolarHBondContact OG-NE2 3.1Å
340	L	91.1	Very high	88.5	Confident	16 Å²	16	33.2 Å²	33.2	8%	0.084	18%	0.18	C	C	.	.	S	Bend	trans	-91.7	138	-178.3	-60.9	170.9	0	0	0	111.1	R337 Q338 L466 Y469 V471 F515	R337-L340 PolarHBondContact O-N 3.31Å; Q338-L340 VanDerWaalsContact C-N 3.27Å; L340-L466 HydrophobicContact CD1-CD2 3.47Å; L340-L466 VanDerWaalsContact CD1-CD2 3.47Å; L340-L466 HydrophobicContact CD2-CD2 4.34Å; L340-Y469 HydrophobicContact CD2-CD1 4.47Å; L340-Y469 HydrophobicContact CD2-CD2 3.51Å; L340-Y469 HydrophobicContact CD2-CE2 4.4Å; L340-Y469 HydrophobicContact CD2-CG 3.58Å; L340-V471 HydrophobicContact CD2-CG2 4.26Å; L340-F515 HydrophobicContact CD1-CE1 4.21Å
341	P	92.3	Very high	89	Confident	63 Å²	63	32.8 Å²	32.8	41%	0.409	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-62.2	149.7	165.3	-24.3	36.9	0	0	0	111.7	H465 Y469	P341-H465 PolarHBondContact O-NE2 2.69Å; P341-Y469 VanDerWaalsContact CD-CZ 3.48Å; P341-Y469 HydrophobicContact CG-CE1 4.23Å; P341-Y469 WeakPolarHBondContact CG-OH 3.41Å
342	V	92	Very high	89.4	Confident	77 Å²	77	30.9 Å²	30.9	47%	0.467	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-54.7	138.6	179.1	-63.2	0	0	0	0	112	M269 Q348	M269-V342 HydrophobicContact CE-CB 4.1Å; M269-V342 HydrophobicContact CE-CG2 3.98Å; V342-Q348 HydrophobicContact CB-CG 4.5Å; V342-Q348 HydrophobicContact CG1-CG 4.17Å
343	H	94.6	Very high	89.5	Confident	41 Å²	41	28 Å²	28	19%	0.19	16%	0.16	C	C	.	.			trans	-143.3	149.7	179.7	-176.8	-104.5	0	0	0	110.1	N345 I346 Q348 S461 H465	H343-N345 VanDerWaalsContact C-N 3.25Å; H343-N345 PolarHBondContact ND1-N 3.26Å; H343-N345 PolarHBondContact O-N 2.66Å; H343-I346 HydrophobicContact CB-CB 4.31Å; H343-I346 HydrophobicContact CB-CD1 4Å; H343-I346 HydrophobicContact CB-CG1 4.21Å; H343-I346 PolarHBondContact O-N 3.11Å; H343-Q348 PolarHBondContact O-NE2 3.31Å; H343-Q348 VanDerWaalsContact O-NE2 3.14Å; H343-S461 PolarHBondContact CE1-O 3.38Å; H343-H465 AromaticContact CD2-CG 3.92Å; H343-H465 AromaticContact CD2-ND1 3.68Å; H343-H465 AromaticContact CG-CG 3.85Å; H343-H465 AromaticContact CG-ND1 3.95Å
344	F	94.4	Very high	89.6	Confident	6 Å²	6	31.2 Å²	31.2	3%	0.026	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-32.7	-174.1	-173	-107.2	0	0	0	113	F268 M269 R509 L678 W681	F268-F344 HydrophobicContact CB-CD2 4.14Å; F268-F344 HydrophobicContact CB-CE2 3.82Å; F268-F344 HydrophobicContact CD1-CE2 4.08Å; F268-F344 HydrophobicContact CD1-CZ 4.06Å; F268-F344 HydrophobicContact CG-CE2 4.37Å; M269-F344 VanDerWaalsContact SD-CA 3.56Å; M269-F344 HydrophobicContact SD-CB 3.71Å; M269-F344 HydrophobicContact SD-CD2 3.87Å; M269-F344 HydrophobicContact SD-CG 4.3Å; F344-R509 HydrophobicContact CD1-CG 4.31Å; F344-R509 HydrophobicContact CE1-CB 4.18Å; F344-R509 HydrophobicContact CE1-CG 3.65Å; F344-R509 HydrophobicContact CE2-CG 4.21Å; F344-R509 HydrophobicContact CZ-CB 3.99Å; F344-R509 HydrophobicContact CZ-CG 3.6Å; F344-R509 VanDerWaalsContact O-CZ 3.23Å; F344-R509 PolarHBondContact O-NE 2.87Å; F344-R509 PolarHBondContact O-NH2 3.23Å; F344-L678 HydrophobicContact CD1-CD1 4.44Å; F344-L678 HydrophobicContact CE1-CD1 3.57Å; F344-L678 HydrophobicContact CE1-CD2 4Å; F344-L678 HydrophobicContact CE1-CG 4.47Å; F344-L678 HydrophobicContact CZ-CD1 3.96Å; F344-L678 HydrophobicContact CZ-CD2 4.34Å; F344-W681 HydrophobicContact CB-CH2 3.85Å; F344-W681 HydrophobicContact CB-CZ3 4.23Å; F344-W681 HydrophobicContact CD1-CH2 4.14Å; F344-W681 AromaticContact CD1-CZ3 3.67Å; F344-W681 HydrophobicContact CD1-CZ3 3.67Å; F344-W681 HydrophobicContact CD2-CH2 4.11Å; F344-W681 AromaticContact CD2-CZ3 3.81Å; F344-W681 HydrophobicContact CD2-CZ3 3.81Å; F344-W681 AromaticContact CE1-CZ3 3.89Å; F344-W681 HydrophobicContact CE1-CZ3 3.89Å; F344-W681 HydrophobicContact CE2-CZ3 4.02Å; F344-W681 AromaticContact CG-CH2 3.77Å; F344-W681 HydrophobicContact CG-CH2 3.77Å; F344-W681 AromaticContact CG-CZ3 3.63Å; F344-W681 HydrophobicContact CG-CZ3 3.63Å; F344-W681 HydrophobicContact CZ-CZ3 4.05Å
345	N	96.9	Very high	89.7	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.021	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	20	-176.8	-53.9	110.2	0	0	0	114.7	H343 Q458 L510 V512	H343-N345 VanDerWaalsContact C-N 3.25Å; H343-N345 PolarHBondContact ND1-N 3.26Å; H343-N345 PolarHBondContact O-N 2.66Å; N345-Q458 WeakPolarHBondContact CB-O 3.39Å; N345-Q458 WeakPolarHBondContact ND2-CB 3.38Å; N345-Q458 PolarHBondContact ND2-OE1 2.93Å; N345-Q458 PolarHBondContact OD1-O 2.89Å; N345-L510 WeakPolarHBondContact CA-O 3.19Å; N345-L510 PolarHBondContact ND2-O 2.86Å; N345-V512 WeakPolarHBondContact O-CG2 3.48Å; N345-V512 PolarHBondContact O-N 3.42Å
346	I	96.1	Very high	89.7	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.036	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-125.6	136.8	176.8	-61.7	174.6	0	0	0	109.4	R337 H343 Q348 H465 L466 F515	R337-I346 HydrophobicContact CG-CG2 4.21Å; H343-I346 HydrophobicContact CB-CB 4.31Å; H343-I346 HydrophobicContact CB-CD1 4Å; H343-I346 HydrophobicContact CB-CG1 4.21Å; H343-I346 PolarHBondContact O-N 3.11Å; I346-Q348 PolarHBondContact O-N 2.65Å; I346-H465 HydrophobicContact CD1-CB 4.34Å; I346-L466 HydrophobicContact CD1-CD2 3.69Å; I346-L466 HydrophobicContact CD1-CG 4.5Å; I346-F515 HydrophobicContact CG2-CE2 4.08Å; I346-F515 HydrophobicContact CG2-CZ 3.9Å
347	Q	94.3	Very high	89.7	Confident	9 Å²	9	34.4 Å²	34.4	4%	0.042	18%	0.183	C	C	.	.			trans	-61.8	132.2	-177	175.4	164.4	74.8	0	0	111.9	Y302 R337 I511 V512	Y302-Q347 PolarHBondContact OH-NE2 3.15Å; R337-Q347 VanDerWaalsContact CD-O 3.22Å; R337-Q347 WeakPolarHBondContact CD-O 3.37Å; R337-Q347 PolarHBondContact NH1-O 3.18Å; Q347-I511 VanDerWaalsContact CA-CG2 3.41Å; Q347-I511 HydrophobicContact CB-CG2 3.73Å; Q347-V512 WeakPolarHBondContact CB-O 3.42Å; Q347-V512 PolarHBondContact N-O 3.45Å
348	Q	89.8	Confident	89.6	Confident	23 Å²	23	35.7 Å²	35.7	11%	0.107	19%	0.194	C	C	.	.			trans	-109.6	150.6	175.3	-62.9	161.2	53.1	0	0	109.7	V342 H343 I346 T422 E424	V342-Q348 HydrophobicContact CB-CG 4.5Å; V342-Q348 HydrophobicContact CG1-CG 4.17Å; H343-Q348 PolarHBondContact O-NE2 3.31Å; H343-Q348 VanDerWaalsContact O-NE2 3.14Å; I346-Q348 PolarHBondContact O-N 2.65Å; Q348-T422 VanDerWaalsContact O-CB 3.28Å; Q348-T422 WeakPolarHBondContact O-CB 3.15Å; Q348-T422 PolarHBondContact O-OG1 3.2Å; Q348-E424 WeakPolarHBondContact CB-OE2 3.4Å; Q348-E424 PolarHBondContact N-OE2 2.93Å
349	D	88.3	Confident	89.5	Confident	20 Å²	20	32.7 Å²	32.7	11%	0.107	18%	0.182	C	C	.	.			trans	-123.1	142	175.4	63.3	-86.8	0	0	0	110.4	R277 R337 Q338 V420	R277-D349 IonicContact CZ-OD2 2.65Å; R277-D349 PolarHBondContact NH1-O 2.68Å; R277-D349 VanDerWaalsContact NH1-O 3.13Å; R277-D349 IonicContact NH1-OD2 3.25Å; R277-D349 PolarHBondContact NH1-OD2 2.98Å; R337-D349 IonicContact CZ-OD1 2.72Å; R337-D349 IonicContact NH1-OD1 3.19Å; R337-D349 PolarHBondContact NH1-OD1 3.02Å; R337-D349 IonicContact NH2-OD1 2.73Å; R337-D349 PolarHBondContact NH2-OD1 3.23Å; Q338-D349 PolarHBondContact NE2-OD2 3.5Å; D349-V420 HydrophobicContact CB-CG1 3.62Å
350	C	85.8	Confident	89.4	Confident	8 Å²	8	37 Å²	37	5%	0.054	19%	0.189	C	C	.	.	S	Bend	trans	-112.1	13.9	174.9	56.5	0	0	0	0	111.8	L276 R277 F278 I421	L276-C350 WeakPolarHBondContact O-CA 3.45Å; L276-C350 VanDerWaalsContact O-CB 3.3Å; L276-C350 WeakPolarHBondContact O-CB 3.48Å; R277-C350 CarbonylContact C-O 3.6Å; R277-C350 VanDerWaalsContact CA-O 3.23Å; R277-C350 WeakPolarHBondContact CA-O 3.27Å; F278-C350 HydrophobicContact CD2-CB 4.17Å; F278-C350 WeakPolarHBondContact CD2-O 3.47Å; F278-C350 HydrophobicContact CE2-CB 4.1Å; F278-C350 PolarHBondContact N-O 3.48Å; C350-I421 PolarHBondContact N-O 2.76Å; C350-I421 VanDerWaalsContact SG-C 3.56Å; C350-I421 PolarHBondContact SG-O 3.31Å
351	G	85.4	Confident	89.2	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160	154.7	176.6	0	0	0	0	0	112.3	F278 V420 I421	F278-G351 WeakPolarHBondContact O-CA 3.47Å; G351-V420 WeakPolarHBondContact O-CA 3.48Å; G351-V420 VanDerWaalsContact O-CG1 3.32Å; G351-V420 WeakPolarHBondContact O-CG1 3.17Å; G351-I421 PolarHBondContact O-N 3.13Å
352	H	87.6	Confident	89	Confident	62 Å²	62	34 Å²	34	29%	0.287	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	151.2	173.7	65.3	-77.8	0	0	0	110.4	Y330 L334 V419 V420	Y330-H352 WeakPolarHBondContact OH-CB 3.2Å; L334-H352 VanDerWaalsContact CD2-CE1 3.46Å; L334-H352 WeakPolarHBondContact CD2-CE1 3.47Å; L334-H352 WeakPolarHBondContact CD2-NE2 3.21Å; H352-V419 CarbonylContact C-O 3.59Å; H352-V419 WeakPolarHBondContact CA-O 3.36Å; H352-V420 HydrophobicContact CB-CG1 4.32Å; H352-V420 HydrophobicContact CB-CG2 4.32Å
353	F	87.1	Confident	88.6	Confident	12 Å²	12	33.6 Å²	33.6	5%	0.053	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	165.9	178.1	43.2	-93.9	0	0	0	110.7	V280 W283 A355 V419 I421	V280-F353 HydrophobicContact CG2-CB 3.8Å; W283-F353 HydrophobicContact CB-CE2 3.79Å; W283-F353 HydrophobicContact CB-CZ 3.79Å; W283-F353 AromaticContact CD2-CE2 3.7Å; W283-F353 HydrophobicContact CD2-CE2 3.7Å; W283-F353 AromaticContact CD2-CZ 3.9Å; W283-F353 HydrophobicContact CD2-CZ 3.9Å; W283-F353 AromaticContact CE3-CE2 3.79Å; W283-F353 HydrophobicContact CE3-CE2 3.79Å; W283-F353 AromaticContact CE3-CZ 3.57Å; W283-F353 HydrophobicContact CE3-CZ 3.57Å; W283-F353 AromaticContact CG-CE2 3.73Å; W283-F353 HydrophobicContact CG-CE2 3.73Å; W283-F353 HydrophobicContact CG-CZ 4.03Å; W283-F353 HydrophobicContact CZ3-CZ 4.38Å; F353-A355 HydrophobicContact CD2-CB 4.05Å; F353-A355 HydrophobicContact CE2-CB 4.07Å; F353-V419 HydrophobicContact CD2-CB 4.19Å; F353-V419 HydrophobicContact CE2-CB 3.83Å; F353-V419 HydrophobicContact CE2-CG1 3.89Å; F353-V419 HydrophobicContact CZ-CB 4.38Å; F353-V419 HydrophobicContact CZ-CG1 4.01Å; F353-V419 PolarHBondContact N-O 3.09Å; F353-V419 PolarHBondContact O-N 2.88Å; F353-I421 HydrophobicContact CE1-CD1 4.38Å; F353-I421 HydrophobicContact CE1-CG1 4.13Å; F353-I421 HydrophobicContact CZ-CD1 4.19Å; F353-I421 HydrophobicContact CZ-CG1 4.44Å
354	L	87.4	Confident	88	Confident	76 Å²	76	35.8 Å²	35.8	40%	0.398	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	137.2	164.2	-72.3	168.3	0	0	0	109.4	H417 V418	L354-H417 WeakPolarHBondContact CA-O 3.36Å; L354-V418 HydrophobicContact CD2-CG2 3.74Å
355	A	85.6	Confident	87.1	Confident	9 Å²	9	36.4 Å²	36.4	7%	0.074	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	148.9	173.7	0	0	0	0	0	111.4	F353 V357 S416 H417 V419	F353-A355 HydrophobicContact CD2-CB 4.05Å; F353-A355 HydrophobicContact CE2-CB 4.07Å; A355-V357 PolarHBondContact O-N 3.26Å; A355-S416 WeakPolarHBondContact O-CA 3.44Å; A355-H417 PolarHBondContact N-O 2.9Å; A355-H417 PolarHBondContact O-N 2.73Å; A355-V419 HydrophobicContact CB-CG2 3.93Å
356	E	86.6	Confident	85.4	Confident	126 Å²	126	41.1 Å²	41.1	59%	0.589	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	105.5	170.9	-76.6	-179.1	-175.8	0	0	110.4	Q414 R415	E356-Q414 HydrophobicContact CB-CB 4.19Å; E356-Q414 PolarHBondContact OE2-NE2 2.99Å; E356-R415 WeakPolarHBondContact CA-O 3.38Å
357	V	86.1	Confident	83.5	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.7	178.8	-177.5	0	0	0	0	109.3	I319 A355 L361 L362 R415 H417 V419	I319-V357 HydrophobicContact CD1-CG1 3.98Å; I319-V357 HydrophobicContact CD1-CG2 4.32Å; I319-V357 HydrophobicContact CG2-CG1 4.41Å; I319-V357 HydrophobicContact CG2-CG2 3.94Å; A355-V357 PolarHBondContact O-N 3.26Å; V357-L361 HydrophobicContact CG1-CB 3.98Å; V357-L361 HydrophobicContact CG1-CD1 4.46Å; V357-L362 HydrophobicContact CB-CD2 4.42Å; V357-L362 HydrophobicContact CG1-CD1 4.3Å; V357-L362 HydrophobicContact CG1-CD2 3.77Å; V357-L362 HydrophobicContact CG1-CG 3.95Å; V357-R415 PolarHBondContact N-O 3.09Å; V357-R415 PolarHBondContact O-N 3.04Å; V357-H417 HydrophobicContact CG2-CB 4.04Å; V357-V419 HydrophobicContact CG2-CG2 4.12Å
358	P	85.8	Confident	81.5	Confident	47 Å²	47	51.7 Å²	51.7	31%	0.305	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	131.1	170.5	-15.9	30.3	0	0	0	110.6	R360 L361	P358-R360 HydrophobicContact CB-CG 4.33Å; P358-R360 PolarHBondContact O-N 3.23Å; P358-L361 PolarHBondContact O-N 3.03Å
359	S	83.9	Confident	79.6	Confident	18 Å²	18	52.2 Å²	52.2	13%	0.126	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-56.7	-16.7	-173.8	-53.3	0	0	0	0	115.6	L361 L362 E365 K413	S359-L361 PolarHBondContact O-N 3.17Å; S359-L362 PolarHBondContact O-N 3.28Å; S359-E365 WeakPolarHBondContact CB-OE2 3.38Å; S359-E365 PolarHBondContact OG-OE2 2.99Å; S359-K413 PolarHBondContact OG-O 2.67Å
360	R	85.8	Confident	77.4	Confident	148 Å²	148	56.7 Å²	56.7	56%	0.558	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-58.4	-15.4	169.3	81.7	-177.9	-170.7	80	-6.1	114.6	D291 P358	D291-R360 VanDerWaalsContact CG-NH1 3.35Å; D291-R360 IonicContact OD1-CZ 3.49Å; D291-R360 IonicContact OD1-NH1 2.67Å; D291-R360 PolarHBondContact OD1-NH1 3.19Å; D291-R360 IonicContact OD1-NH2 3.72Å; D291-R360 PolarHBondContact OD1-NH2 3.48Å; P358-R360 HydrophobicContact CB-CG 4.33Å; P358-R360 PolarHBondContact O-N 3.23Å
361	L	87.1	Confident	75.5	Confident	14 Å²	14	62.7 Å²	62.7	7%	0.073	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-106.3	11.8	177.8	-60.5	178.7	0	0	0	112.5	L288 Y303 V357 P358 S359	L288-L361 HydrophobicContact CD1-CD1 3.9Å; L288-L361 HydrophobicContact CD1-CD2 4.34Å; Y303-L361 HydrophobicContact CD1-CD2 4.49Å; Y303-L361 HydrophobicContact CE1-CD2 3.84Å; Y303-L361 HydrophobicContact CE2-CB 4.1Å; Y303-L361 HydrophobicContact CE2-CD2 4.47Å; Y303-L361 WeakPolarHBondContact CE2-O 3.44Å; Y303-L361 WeakPolarHBondContact OH-CA 3.38Å; Y303-L361 PolarHBondContact OH-O 3.32Å; Y303-L361 VanDerWaalsContact OH-O 3.14Å; V357-L361 HydrophobicContact CG1-CB 3.98Å; V357-L361 HydrophobicContact CG1-CD1 4.46Å; P358-L361 PolarHBondContact O-N 3.03Å; S359-L361 PolarHBondContact O-N 3.17Å
362	L	87.5	Confident	73.2	Confident	3 Å²	3	72.2 Å²	72.2	2%	0.016	37%	0.372	C	S	.	.			trans	-124.7	92.8	-175.7	-57.2	178.1	0	0	0	108.9	I319 V357 S359 W364 E365	I319-L362 HydrophobicContact CG2-CD2 3.75Å; V357-L362 HydrophobicContact CB-CD2 4.42Å; V357-L362 HydrophobicContact CG1-CD1 4.3Å; V357-L362 HydrophobicContact CG1-CD2 3.77Å; V357-L362 HydrophobicContact CG1-CG 3.95Å; S359-L362 PolarHBondContact O-N 3.28Å; L362-W364 HydrophobicContact CB-CZ2 4.37Å; L362-W364 HydrophobicContact CD2-CH2 4.11Å; L362-W364 HydrophobicContact CD2-CZ2 3.66Å; L362-W364 PolarHBondContact O-N 3.24Å; L362-E365 HydrophobicContact CB-CB 4.02Å; L362-E365 HydrophobicContact CB-CG 3.83Å; L362-E365 HydrophobicContact CD1-CG 3.93Å; L362-E365 WeakPolarHBondContact CD1-OE2 3.46Å; L362-E365 PolarHBondContact O-N 3.36Å
363	P	84.6	Confident	70.8	Confident	68 Å²	68	73.3 Å²	73.3	44%	0.442	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.6	-174.7	-28.3	35.7	0	0	0	115.8	V301	V301-P363 HydrophobicContact CG2-CG 4.28Å
364	W	81.8	Confident	68.5	Low	86 Å²	86	80 Å²	80	33%	0.326	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.3	178.1	59.9	80.9	0	0	0	114.1	V301 K321 L362	V301-W364 HydrophobicContact CB-CH2 4.28Å; V301-W364 HydrophobicContact CB-CZ3 3.9Å; V301-W364 HydrophobicContact CG1-CH2 3.73Å; V301-W364 HydrophobicContact CG1-CZ3 3.8Å; K321-W364 HydrophobicContact CB-CH2 4.35Å; K321-W364 HydrophobicContact CB-CZ2 4.17Å; K321-W364 HydrophobicContact CD-CE3 4.19Å; K321-W364 HydrophobicContact CD-CZ3 4.14Å; K321-W364 HydrophobicContact CG-CD2 3.88Å; K321-W364 HydrophobicContact CG-CE3 3.7Å; K321-W364 HydrophobicContact CG-CH2 3.41Å; K321-W364 VanDerWaalsContact CG-CH2 3.41Å; K321-W364 HydrophobicContact CG-CZ2 3.64Å; K321-W364 HydrophobicContact CG-CZ3 3.45Å; K321-W364 VanDerWaalsContact CG-CZ3 3.45Å; L362-W364 HydrophobicContact CB-CZ2 4.37Å; L362-W364 HydrophobicContact CD2-CH2 4.11Å; L362-W364 HydrophobicContact CD2-CZ2 3.66Å; L362-W364 PolarHBondContact O-N 3.24Å
365	E	76.5	Confident	65.9	Low	19 Å²	19	84.9 Å²	84.9	9%	0.089	45%	0.45	C	S	.	.			trans	-106.9	111.2	174.5	-64	-147.4	144	0	0	111.4	S359 L362 R415	S359-E365 WeakPolarHBondContact CB-OE2 3.38Å; S359-E365 PolarHBondContact OG-OE2 2.99Å; L362-E365 HydrophobicContact CB-CB 4.02Å; L362-E365 HydrophobicContact CB-CG 3.83Å; L362-E365 HydrophobicContact CD1-CG 3.93Å; L362-E365 WeakPolarHBondContact CD1-OE2 3.46Å; L362-E365 PolarHBondContact O-N 3.36Å; E365-R415 WeakPolarHBondContact OE1-CD 3.47Å; E365-R415 IonicContact OE1-CZ 2.72Å; E365-R415 IonicContact OE1-NE 2.71Å; E365-R415 IonicContact OE1-NH1 2.7Å; E365-R415 PolarHBondContact OE1-NH1 3.21Å; E365-R415 WeakPolarHBondContact OE2-CD 3.34Å; E365-R415 IonicContact OE2-NH1 3.79Å; E365-R415 PolarHBondContact OE2-NH1 3.36Å
366	D	60.8	Low	63.4	Low	103 Å²	103	87.2 Å²	87.2	55%	0.551	48%	0.475	S	S	*	.			trans	-65.1	121.2	166	176.3	-5.9	0	0	0	109.5	D368 A369	D366-D368 PolarHBondContact O-N 3.13Å; D366-D368 PolarHBondContact OD1-N 2.96Å; D366-A369 HydrophobicContact CB-CB 3.99Å; D366-A369 PolarHBondContact O-N 3.35Å; D366-A369 PolarHBondContact OD1-N 3.03Å
367	P	56.9	Low	60.9	Low	94 Å²	94	87.7 Å²	87.7	61%	0.61	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-26.4	-179	27.5	-35.8	0	0	0	113.6
368	D	52	Low	58.3	Low	145 Å²	145	97 Å²	97	78%	0.775	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-2.7	-175.4	-69.3	-42.9	0	0	0	112.9	D366	D366-D368 PolarHBondContact O-N 3.13Å; D366-D368 PolarHBondContact OD1-N 2.96Å
369	A	49.5	Very low	55.7	Low	34 Å²	34	102 Å²	102	28%	0.281	55%	0.554	S	S	.	*			trans	-57.1	130.4	178	0	0	0	0	0	112.1	D366 K413	D366-A369 HydrophobicContact CB-CB 3.99Å; D366-A369 PolarHBondContact O-N 3.35Å; D366-A369 PolarHBondContact OD1-N 3.03Å; A369-K413 PolarHBondContact O-NZ 3.49Å
370	P	41.4	Very low	53.3	Low	114 Å²	114	107.1 Å²	107.1	74%	0.74	59%	0.589	S	S	*	*			trans	-65.7	150.4	174.2	28.7	-34.3	0	0	0	110	K372	P370-K372 PolarHBondContact O-N 3.34Å
371	E	45.2	Very low	50.6	Low	134 Å²	134	109.6 Å²	109.6	63%	0.626	61%	0.608	S	S	*	*			trans	-66.9	115.9	165.5	-77.7	153.7	-147.9	0	0	107.9	A373 K413	E371-A373 PolarHBondContact O-N 3.36Å; E371-K413 WeakPolarHBondContact OE1-CE 3.41Å
372	K	37.2	Very low	48	Very low	202 Å²	202	118.3 Å²	118.3	88%	0.878	65%	0.648	S	S	*	*			trans	-60	116.7	146.6	-76	-161.6	171.5	-162.4	0	105.2	P370	P370-K372 PolarHBondContact O-N 3.34Å
373	A	37.3	Very low	45.3	Very low	85 Å²	85	127.9 Å²	127.9	70%	0.702	69%	0.692	S	S	*	*			trans	-51.2	145.6	171.2	0	0	0	0	0	108.8	E371 D375	E371-A373 PolarHBondContact O-N 3.36Å; A373-D375 PolarHBondContact O-N 2.9Å; A373-D375 VanDerWaalsContact O-N 3.12Å
374	E	39.1	Very low	42.6	Very low	153 Å²	153	128.2 Å²	128.2	72%	0.715	71%	0.709	S	S	*	*			trans	-66.6	115.2	172.9	-52.7	-147.1	123.9	0	0	107.3	K325 G376	K325-E374 IonicContact NZ-OE1 2.94Å; K325-E374 PolarHBondContact NZ-OE1 3.49Å; K325-E374 IonicContact NZ-OE2 2.72Å; K325-E374 PolarHBondContact NZ-OE2 3.42Å; E374-G376 PolarHBondContact O-N 2.89Å
375	D	33.1	Very low	40.1	Very low	177 Å²	177	134.2 Å²	134.2	95%	0.947	74%	0.737	S	S	*	*			trans	-63.5	102.7	176.5	-106.9	-30.4	0	0	0	108.2	A373	A373-D375 PolarHBondContact O-N 2.9Å; A373-D375 VanDerWaalsContact O-N 3.12Å
376	G	34.3	Very low	37.8	Very low	58 Å²	58	138.1 Å²	138.1	60%	0.598	77%	0.773	S	S	*	*			trans	-98.4	115.1	-171.6	0	0	0	0	0	111.1	E374	E374-G376 PolarHBondContact O-N 2.89Å
377	T	32.8	Very low	36.3	Very low	136 Å²	136	141.7 Å²	141.7	83%	0.834	79%	0.786	S	S	*	*			trans	54.7	78.6	160.7	49.8	0	0	0	0	116.2
378	E	32.1	Very low	34.8	Very low	200 Å²	200	143 Å²	143	94%	0.935	79%	0.792	S	S	*	*			trans	-85.1	88.5	142.2	-72.6	-169.4	160	0	0	108.1
379	D	31.5	Very low	33.6	Very low	151 Å²	151	144 Å²	144	81%	0.807	80%	0.796	S	S	*	*			trans	-165.2	76.7	171.8	-123.5	-18.2	0	0	0	110.2
380	S	31.9	Very low	32.5	Very low	125 Å²	125	146 Å²	146	87%	0.874	82%	0.821	S	S	*	*			trans	176.3	83	160.6	-79.3	0	0	0	0	111.3
381	E	30.5	Very low	31.9	Very low	201 Å²	201	144.7 Å²	144.7	94%	0.939	83%	0.828	S	S	*	*			trans	-88.2	109.2	160.6	-71.8	-168.3	153.1	0	0	109.9
382	E	32	Very low	31.1	Very low	196 Å²	196	145.1 Å²	145.1	92%	0.916	84%	0.835	S	S	*	*			trans	-137	123.6	155.2	-82	-153.8	143.8	0	0	110.3	G384	E382-G384 PolarHBondContact O-N 3.29Å
383	E	30.6	Very low	31.3	Very low	204 Å²	204	141.3 Å²	141.3	95%	0.953	83%	0.83	S	S	*	*			trans	-79.4	111.6	173.4	-71.5	-162.6	122.7	0	0	111.6
384	G	29.2	Very low	30.9	Very low	76 Å²	76	145 Å²	145	78%	0.784	83%	0.833	S	S	*	*			trans	-126.1	95.7	177.6	0	0	0	0	0	113.6	E382	E382-G384 PolarHBondContact O-N 3.29Å
385	K	28.6	Very low	31	Very low	212 Å²	212	142.2 Å²	142.2	92%	0.922	83%	0.828	S	S	*	*			trans	-67	134.4	-179.8	-62.8	172	-177.7	169.1	0	113.5
386	A	28.7	Very low	30.5	Very low	101 Å²	101	139.5 Å²	139.5	84%	0.835	82%	0.822	S	S	*	*			trans	-159.5	155.9	140.5	0	0	0	0	0	111.5
387	E	27.6	Very low	30.2	Very low	178 Å²	178	142.7 Å²	142.7	83%	0.832	84%	0.835	S	S	*	*			trans	-99.3	174.5	-165.1	-55	174.9	112.3	0	0	115.1
388	T	26.2	Very low	30	Very low	120 Å²	120	144.8 Å²	144.8	74%	0.736	84%	0.835	S	S	*	*			trans	88.5	130	143.9	39.1	0	0	0	0	123.6
389	L	27	Very low	29.8	Very low	166 Å²	166	141.9 Å²	141.9	87%	0.869	83%	0.831	S	S	*	*			trans	68.8	97.3	139.7	-71.6	162	0	0	0	120.5
390	G	26.6	Very low	29.5	Very low	78 Å²	78	142.7 Å²	142.7	80%	0.804	83%	0.83	S	S	*	*				121.2	133	93.6	0	0	0	0	0	118.7
391	G	27.7	Very low	29.8	Very low	85 Å²	85	141.9 Å²	141.9	88%	0.876	82%	0.822	S	S	*	*			trans	99.3	99.2	152	0	0	0	0	0	117.5
392	N	29	Very low	29.7	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	82%	0.816	S	S	*	*			trans	-110.6	144.5	144.7	-152.6	0.8	0	0	0	105.6	E394	N392-E394 PolarHBondContact OD1-N 2.88Å
393	P	40.9	Very low	29.7	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	82%	0.815	S	S	*	*				-145.6	156.9	79.2	39.1	-21.9	0	0	0	117.5
394	E	29.3	Very low	29.7	Very low	162 Å²	162	137.7 Å²	137.7	76%	0.757	81%	0.812	S	S	*	*			trans	-34	176.5	142.7	-106.6	-177.6	-154.8	0	0	117.4	N392	N392-E394 PolarHBondContact OD1-N 2.88Å
395	P	40.4	Very low	29.7	Very low	96 Å²	96	142.1 Å²	142.1	62%	0.623	81%	0.813	S	S	*	*			cis	-141.8	-175.2	3.8	32.9	-9.3	0	0	0	117.9
396	C	22.8	Very low	29.9	Very low	120 Å²	120	139 Å²	139	81%	0.811	81%	0.806	S	S	*	*			trans	68.4	119.5	145.5	-77	0	0	0	0	122.8
397	S	29.3	Very low	30	Very low	124 Å²	124	143.2 Å²	143.2	87%	0.867	81%	0.808	S	S	*	*				-150.8	160.8	118.2	45.5	0	0	0	0	110.4
398	E	28.1	Very low	30.1	Very low	180 Å²	180	145.8 Å²	145.8	84%	0.841	81%	0.81	S	S	*	*			trans	-103.1	-173.1	-156.8	-54	177.9	125.1	0	0	114.9
399	T	28.2	Very low	30.4	Very low	139 Å²	139	145.7 Å²	145.7	85%	0.853	81%	0.809	S	S	*	*			trans	99.5	95.3	155.5	-9.2	0	0	0	0	119
400	E	25.1	Very low	30.7	Very low	168 Å²	168	143.2 Å²	143.2	79%	0.785	80%	0.801	S	S	*	*			trans	-64	172.1	150.6	-73.5	-87.3	132.7	0	0	111.9
401	P	38.8	Very low	31.3	Very low	108 Å²	108	146.5 Å²	146.5	70%	0.701	80%	0.8	S	S	*	*			cis	-125.4	173.6	-46.9	34.8	-20.2	0	0	0	111
402	S	27.3	Very low	32.2	Very low	117 Å²	117	151.6 Å²	151.6	82%	0.818	79%	0.793	S	S	*	*			trans	-132	123.9	163.8	61.1	0	0	0	0	112.2
403	Q	33	Very low	33.6	Very low	191 Å²	191	148.4 Å²	148.4	89%	0.893	77%	0.772	S	S	*	*			trans	-72.8	131.5	-178.3	-66.3	167.6	-32.7	0	0	110.5
404	K	30.2	Very low	34.9	Very low	205 Å²	205	147.7 Å²	147.7	89%	0.891	76%	0.759	S	S	*	*			trans	-127.7	120.5	153.7	-80.3	-170.6	175	178.7	0	109.1
405	E	29.1	Very low	37	Very low	170 Å²	170	144.2 Å²	144.2	79%	0.794	74%	0.738	S	S	*	*			trans	-71.4	135	-172.4	-65.8	174.4	88.8	0	0	112.7	Q407	E405-Q407 PolarHBondContact O-N 3.02Å; E405-Q407 VanDerWaalsContact O-N 3.15Å
406	N	31.9	Very low	39	Very low	145 Å²	145	142 Å²	142	78%	0.775	73%	0.725	S	S	*	*			trans	41.2	63	132.4	-60.1	-25.7	0	0	0	118.2
407	Q	30.7	Very low	42.1	Very low	190 Å²	190	136.3 Å²	136.3	89%	0.888	69%	0.687	S	S	*	*			trans	-111.6	33.5	141.5	-71.3	-163.8	-4.4	0	0	112.7	E405 V409	E405-Q407 PolarHBondContact O-N 3.02Å; E405-Q407 VanDerWaalsContact O-N 3.15Å; Q407-V409 PolarHBondContact O-N 3.34Å
408	R	30	Very low	44.9	Very low	233 Å²	233	130.5 Å²	130.5	88%	0.879	65%	0.646	S	S	*	*			trans	-72	74.3	151.6	-85.3	-172	171.4	179.2	-1.9	109.2	T410	R408-T410 PolarHBondContact O-N 3.26Å
409	V	32.5	Very low	47.9	Very low	118 Å²	118	122 Å²	122	72%	0.715	61%	0.606	S	S	*	*			trans	-57.5	122.4	149.5	176.1	0	0	0	0	105.3	Q407 N411	Q407-V409 PolarHBondContact O-N 3.34Å; V409-N411 PolarHBondContact O-N 2.63Å
410	T	34.5	Very low	50.8	Low	113 Å²	113	115.7 Å²	115.7	69%	0.693	57%	0.568	S	S	*	*			trans	-71	101.2	178.6	40.5	0	0	0	0	108.4	R408 R412	R408-T410 PolarHBondContact O-N 3.26Å; T410-R412 PolarHBondContact O-N 2.84Å
411	N	38.2	Very low	54	Low	147 Å²	147	107.7 Å²	107.7	79%	0.786	53%	0.53	S	S	*	.			trans	-61.5	83.5	162.4	-79.5	-0.2	0	0	0	107.7	V409 K413	V409-N411 PolarHBondContact O-N 2.63Å; N411-K413 PolarHBondContact O-N 3.31Å
412	R	47.1	Very low	56.5	Low	192 Å²	192	102.7 Å²	102.7	73%	0.725	50%	0.498	S	S	*	.			trans	-57.2	112.2	171.3	-77.3	177.5	160.9	175.1	-6.5	106.3	T410 Q414	T410-R412 PolarHBondContact O-N 2.84Å; R412-Q414 PolarHBondContact O-N 2.72Å
413	K	58.4	Low	59.4	Low	78 Å²	78	100.1 Å²	100.1	34%	0.339	47%	0.47	S	S	.	.			trans	-42.2	114.1	-173.2	-63.4	170.5	-179.4	164.4	0	109.8	S359 A369 E371 N411	S359-K413 PolarHBondContact OG-O 2.67Å; A369-K413 PolarHBondContact O-NZ 3.49Å; E371-K413 WeakPolarHBondContact OE1-CE 3.41Å; N411-K413 PolarHBondContact O-N 3.31Å
414	Q	67.3	Low	62.1	Low	106 Å²	106	91.7 Å²	91.7	50%	0.495	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.9	173	-78.6	168.1	-99.1	0	0	107.8	E356 R412	E356-Q414 HydrophobicContact CB-CB 4.19Å; E356-Q414 PolarHBondContact OE2-NE2 2.99Å; R412-Q414 PolarHBondContact O-N 2.72Å
415	R	73.4	Confident	65.1	Low	88 Å²	88	83.6 Å²	83.6	33%	0.332	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.9	178	-76.7	175.7	174.3	160.4	7	110.2	E356 V357 E365 H417	E356-R415 WeakPolarHBondContact CA-O 3.38Å; V357-R415 PolarHBondContact N-O 3.09Å; V357-R415 PolarHBondContact O-N 3.04Å; E365-R415 WeakPolarHBondContact OE1-CD 3.47Å; E365-R415 IonicContact OE1-CZ 2.72Å; E365-R415 IonicContact OE1-NE 2.71Å; E365-R415 IonicContact OE1-NH1 2.7Å; E365-R415 PolarHBondContact OE1-NH1 3.21Å; E365-R415 WeakPolarHBondContact OE2-CD 3.34Å; E365-R415 IonicContact OE2-NH1 3.79Å; E365-R415 PolarHBondContact OE2-NH1 3.36Å; R415-H417 PolarHBondContact O-N 2.79Å
416	S	84.1	Confident	68.2	Low	49 Å²	49	75.5 Å²	75.5	34%	0.343	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	112.3	177.5	-171.4	0	0	0	0	109.7	A355	A355-S416 WeakPolarHBondContact O-CA 3.44Å
417	H	87.1	Confident	71	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	154.9	176.2	-80.3	-94.7	0	0	0	110.1	I319 C320 L354 A355 V357 R415	I319-H417 HydrophobicContact CG2-CB 3.97Å; C320-H417 PolarHBondContact O-ND1 3.03Å; L354-H417 WeakPolarHBondContact CA-O 3.36Å; A355-H417 PolarHBondContact N-O 2.9Å; A355-H417 PolarHBondContact O-N 2.73Å; V357-H417 HydrophobicContact CG2-CB 4.04Å; R415-H417 PolarHBondContact O-N 2.79Å
418	V	88.2	Confident	74	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	125.8	167.9	-168	0	0	0	0	109.1	C320 Y330 L354	C320-V418 HydrophobicContact CB-CB 4.49Å; C320-V418 PolarHBondContact N-O 2.9Å; Y330-V418 HydrophobicContact CD1-CB 4.23Å; Y330-V418 HydrophobicContact CD1-CG1 3.74Å; Y330-V418 HydrophobicContact CD1-CG2 4.02Å; Y330-V418 HydrophobicContact CD2-CB 4.25Å; Y330-V418 HydrophobicContact CD2-CG1 4.1Å; Y330-V418 HydrophobicContact CE1-CB 4.44Å; Y330-V418 HydrophobicContact CE1-CG1 3.49Å; Y330-V418 VanDerWaalsContact CE1-CG1 3.49Å; Y330-V418 HydrophobicContact CE2-CB 4.4Å; Y330-V418 HydrophobicContact CE2-CG1 3.81Å; Y330-V418 HydrophobicContact CG-CB 4.18Å; Y330-V418 HydrophobicContact CG-CG1 4.07Å; Y330-V418 HydrophobicContact CG-CG2 4.08Å; L354-V418 HydrophobicContact CD2-CG2 3.74Å
419	V	89.9	Confident	77.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.7	176.3	177.4	0	0	0	0	108.9	W283 V317 K318 I319 H352 F353 A355 V357 I421	W283-V419 HydrophobicContact CH2-CG1 4.45Å; W283-V419 HydrophobicContact CZ3-CG1 4.18Å; V317-V419 HydrophobicContact CG1-CG1 3.63Å; K318-V419 CarbonylContact O-C 3.52Å; K318-V419 WeakPolarHBondContact O-CA 3.44Å; I319-V419 HydrophobicContact CG1-CG2 4.42Å; H352-V419 CarbonylContact C-O 3.59Å; H352-V419 WeakPolarHBondContact CA-O 3.36Å; F353-V419 HydrophobicContact CD2-CB 4.19Å; F353-V419 HydrophobicContact CE2-CB 3.83Å; F353-V419 HydrophobicContact CE2-CG1 3.89Å; F353-V419 HydrophobicContact CZ-CB 4.38Å; F353-V419 HydrophobicContact CZ-CG1 4.01Å; F353-V419 PolarHBondContact N-O 3.09Å; F353-V419 PolarHBondContact O-N 2.88Å; A355-V419 HydrophobicContact CB-CG2 3.93Å; V357-V419 HydrophobicContact CG2-CG2 4.12Å; V419-I421 HydrophobicContact CG1-CD1 4.34Å
420	V	90.6	Very high	80.3	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138	178.4	-164.3	0	0	0	0	109.1	K318 Y330 D349 G351 H352	K318-V420 HydrophobicContact CB-CB 4.15Å; K318-V420 HydrophobicContact CD-CB 4.41Å; K318-V420 HydrophobicContact CD-CG2 4.48Å; K318-V420 PolarHBondContact N-O 3.44Å; K318-V420 PolarHBondContact O-N 3.39Å; Y330-V420 HydrophobicContact CE2-CG2 3.55Å; Y330-V420 WeakPolarHBondContact OH-CG2 3.22Å; D349-V420 HydrophobicContact CB-CG1 3.62Å; G351-V420 WeakPolarHBondContact O-CA 3.48Å; G351-V420 VanDerWaalsContact O-CG1 3.32Å; G351-V420 WeakPolarHBondContact O-CG1 3.17Å; H352-V420 HydrophobicContact CB-CG1 4.32Å; H352-V420 HydrophobicContact CB-CG2 4.32Å
421	I	91.1	Very high	83.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.6	174.7	-46.1	-60.6	0	0	0	108.9	F278 F286 Y315 V317 C350 G351 F353 V419	F278-I421 HydrophobicContact CD2-CB 4.17Å; F278-I421 HydrophobicContact CD2-CG1 4.49Å; F278-I421 HydrophobicContact CD2-CG2 4.01Å; F278-I421 HydrophobicContact CE2-CG2 4.25Å; F286-I421 HydrophobicContact CD2-CD1 4.25Å; F286-I421 HydrophobicContact CE1-CG2 3.77Å; F286-I421 HydrophobicContact CE2-CD1 4.33Å; F286-I421 HydrophobicContact CE2-CG1 4.14Å; F286-I421 HydrophobicContact CE2-CG2 4.39Å; F286-I421 HydrophobicContact CG-CD1 4.41Å; F286-I421 HydrophobicContact CZ-CG1 4.28Å; F286-I421 HydrophobicContact CZ-CG2 3.69Å; Y315-I421 HydrophobicContact CD1-CG2 3.85Å; Y315-I421 HydrophobicContact CG-CG2 4.35Å; V317-I421 HydrophobicContact CG2-CD1 3.96Å; C350-I421 PolarHBondContact N-O 2.76Å; C350-I421 VanDerWaalsContact SG-C 3.56Å; C350-I421 PolarHBondContact SG-O 3.31Å; G351-I421 PolarHBondContact O-N 3.13Å; F353-I421 HydrophobicContact CE1-CD1 4.38Å; F353-I421 HydrophobicContact CE1-CG1 4.13Å; F353-I421 HydrophobicContact CZ-CD1 4.19Å; F353-I421 HydrophobicContact CZ-CG1 4.44Å; V419-I421 HydrophobicContact CG1-CD1 4.34Å
422	T	91	Very high	86.1	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.1	170.8	-178.7	0	0	0	0	110.8	Y315 A316 Q348 E424	Y315-T422 WeakPolarHBondContact CA-O 3.1Å; A316-T422 HydrophobicContact CB-CG2 3.96Å; A316-T422 PolarHBondContact N-O 3.43Å; A316-T422 PolarHBondContact O-N 2.9Å; Q348-T422 VanDerWaalsContact O-CB 3.28Å; Q348-T422 WeakPolarHBondContact O-CB 3.15Å; Q348-T422 PolarHBondContact O-OG1 3.2Å; T422-E424 PolarHBondContact OG1-N 2.82Å; T422-E424 VanDerWaalsContact OG1-N 3.14Å; T422-E424 PolarHBondContact OG1-OE2 2.88Å; T422-E424 VanDerWaalsContact OG1-OE2 3.1Å
423	R	88.9	Confident	88.5	Confident	63 Å²	63	31.9 Å²	31.9	24%	0.238	16%	0.156	C	C	.	.	S	Bend	trans	-86	-21.1	170	-55.2	-171	-167	-154.3	12.8	112	G271 D274 Y315 V425	G271-R423 PolarHBondContact O-NH1 3.5Å; D274-R423 VanDerWaalsContact CB-NH2 3.33Å; D274-R423 PolarHBondContact O-NH2 3.03Å; Y315-R423 HydrophobicContact CD1-CG 4.16Å; Y315-R423 HydrophobicContact CE1-CG 3.88Å; R423-V425 PolarHBondContact O-N 3.49Å; R423-V425 VanDerWaalsContact O-N 3.1Å
424	E	90	Very high	90.3	Very high	15 Å²	15	28.7 Å²	28.7	7%	0.07	14%	0.144	C	C	.	.	S	Bend	trans	-84	86.8	-178.3	-59.5	84.8	-119.5	0	0	109.8	Q272 Q348 T422 P426 V484 I511	Q272-E424 VanDerWaalsContact NE2-CG 3.33Å; Q272-E424 PolarHBondContact NE2-OE1 3.39Å; Q348-E424 WeakPolarHBondContact CB-OE2 3.4Å; Q348-E424 PolarHBondContact N-OE2 2.93Å; T422-E424 PolarHBondContact OG1-N 2.82Å; T422-E424 VanDerWaalsContact OG1-N 3.14Å; T422-E424 PolarHBondContact OG1-OE2 2.88Å; T422-E424 VanDerWaalsContact OG1-OE2 3.1Å; E424-P426 WeakPolarHBondContact O-CD 3.24Å; E424-V484 HydrophobicContact CB-CG1 4.48Å; E424-V484 HydrophobicContact CB-CG2 4.32Å; E424-I511 HydrophobicContact CB-CD1 3.65Å; E424-I511 HydrophobicContact CG-CD1 3.74Å
425	V	92.1	Very high	91.7	Very high	34 Å²	34	30.5 Å²	30.5	21%	0.206	15%	0.146	C	C	.	.			trans	-67.6	113.1	178.1	-179.1	0	0	0	0	110.4	T304 N314 A316 R423	T304-V425 HydrophobicContact CG2-CG1 3.65Å; N314-V425 HydrophobicContact CB-CG2 4.12Å; A316-V425 HydrophobicContact CB-CB 4.39Å; A316-V425 HydrophobicContact CB-CG1 4.47Å; A316-V425 HydrophobicContact CB-CG2 4.11Å; R423-V425 PolarHBondContact O-N 3.49Å; R423-V425 VanDerWaalsContact O-N 3.1Å
426	P	94.3	Very high	92.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	145.1	172	35	-33.6	0	0	0	110.3	C294 C295 Y302 E424 L482 L483 V484	C294-P426 PolarHBondContact SG-O 3.06Å; C295-P426 HydrophobicContact CB-CB 3.85Å; C295-P426 HydrophobicContact CB-CG 3.67Å; Y302-P426 HydrophobicContact CD1-CG 3.54Å; Y302-P426 HydrophobicContact CD2-CG 3.87Å; Y302-P426 HydrophobicContact CE1-CG 4.02Å; Y302-P426 HydrophobicContact CE2-CG 4.33Å; Y302-P426 HydrophobicContact CG-CG 3.46Å; Y302-P426 VanDerWaalsContact CG-CG 3.46Å; E424-P426 WeakPolarHBondContact O-CD 3.24Å; P426-L482 HydrophobicContact CB-CB 4.1Å; P426-L482 HydrophobicContact CB-CD1 4.4Å; P426-L483 WeakPolarHBondContact CA-O 3.2Å; P426-V484 HydrophobicContact CB-CG2 4.42Å
427	H	91.6	Very high	93.3	Very high	74 Å²	74	29.1 Å²	29.1	34%	0.343	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-12.7	177.2	62.8	72	0	0	0	113.7	C294 L483 Q485 T508	C294-H427 CarbonylContact O-C 3.45Å; C294-H427 VanDerWaalsContact O-C 3.23Å; C294-H427 WeakPolarHBondContact O-CA 3.47Å; C294-H427 VanDerWaalsContact O-O 3.12Å; H427-L483 PolarHBondContact CD2-O 3.45Å; H427-L483 PolarHBondContact N-O 2.94Å; H427-Q485 PolarHBondContact CD2-N 2.82Å; H427-T508 VanDerWaalsContact NE2-CG2 3.32Å; H427-T508 WeakPolarHBondContact NE2-CG2 3.32Å
428	L	94.4	Very high	93.7	Very high	51 Å²	51	34.1 Å²	34.1	27%	0.267	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	167.3	168.1	52.3	108.3	0	0	0	110.3	C295 D432 F433 L483	C295-L428 VanDerWaalsContact SG-C 3.52Å; L428-D432 HydrophobicContact CB-CB 3.86Å; L428-D432 HydrophobicContact CD1-CB 4.16Å; L428-F433 HydrophobicContact CD1-CB 3.68Å; L428-L483 HydrophobicContact CD1-CB 4.49Å; L428-L483 HydrophobicContact CD1-CD1 3.91Å; L428-L483 WeakPolarHBondContact O-CB 3.29Å; L428-L483 PolarHBondContact O-N 2.84Å
429	T	97.1	Very high	94	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	168.1	172.8	69.3	0	0	0	0	112.1	E296 A297 A431 D432 F433 L481 L482	E296-T429 VanDerWaalsContact O-CG2 3.27Å; E296-T429 WeakPolarHBondContact O-CG2 3.31Å; A297-T429 HydrophobicContact CB-CG2 4.22Å; T429-A431 PolarHBondContact O-N 2.88Å; T429-A431 WeakPolarHBondContact OG1-CB 3.36Å; T429-A431 PolarHBondContact OG1-N 3.24Å; T429-D432 WeakPolarHBondContact CB-OD2 3.41Å; T429-D432 PolarHBondContact N-OD2 3.07Å; T429-D432 WeakPolarHBondContact O-CB 3.49Å; T429-D432 PolarHBondContact O-N 2.87Å; T429-D432 VanDerWaalsContact OG1-CG 3.31Å; T429-D432 PolarHBondContact OG1-N 3.28Å; T429-D432 PolarHBondContact OG1-OD2 3.09Å; T429-F433 PolarHBondContact O-N 2.91Å; T429-L481 CarbonylContact C-O 3.57Å; T429-L481 VanDerWaalsContact CA-O 3.31Å; T429-L481 WeakPolarHBondContact CA-O 3.49Å; T429-L482 HydrophobicContact CG2-CD2 4.32Å
430	V	97.8	Very high	94.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-27.9	170.8	-176.1	0	0	0	0	111.1	F433 V434 L478 L481 L483 L510 M561	V430-F433 PolarHBondContact O-N 3.4Å; V430-V434 HydrophobicContact CG1-CG2 4.23Å; V430-V434 VanDerWaalsContact O-CG2 3.28Å; V430-V434 WeakPolarHBondContact O-CG2 3.26Å; V430-V434 PolarHBondContact O-N 2.87Å; V430-L478 HydrophobicContact CB-CB 4.35Å; V430-L478 HydrophobicContact CB-CD2 4.42Å; V430-L478 HydrophobicContact CG1-CD2 3.87Å; V430-L478 PolarHBondContact N-O 2.71Å; V430-L481 HydrophobicContact CB-CB 4.06Å; V430-L481 HydrophobicContact CG2-CB 3.53Å; V430-L481 HydrophobicContact CG2-CD1 4.4Å; V430-L481 PolarHBondContact N-O 3.26Å; V430-L483 HydrophobicContact CG2-CD2 3.88Å; V430-L483 HydrophobicContact CG2-CG 4.09Å; V430-L510 HydrophobicContact CG2-CD1 3.89Å; V430-M561 HydrophobicContact CG1-CE 3.77Å; V430-M561 HydrophobicContact CG1-CG 4.21Å; V430-M561 HydrophobicContact CG1-SD 4.17Å
431	A	97.7	Very high	94.5	Very high	28 Å²	28	42.3 Å²	42.3	23%	0.231	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-42.7	175	0	0	0	0	0	111.5	T429 R435 L478 E479	T429-A431 PolarHBondContact O-N 2.88Å; T429-A431 WeakPolarHBondContact OG1-CB 3.36Å; T429-A431 PolarHBondContact OG1-N 3.24Å; A431-R435 WeakPolarHBondContact O-CB 3.4Å; A431-R435 PolarHBondContact O-N 3.4Å; A431-L478 HydrophobicContact CB-CB 3.73Å; A431-L478 PolarHBondContact N-O 3.22Å; A431-E479 HydrophobicContact CB-CB 4.16Å
432	D	96.3	Very high	94.7	Very high	28 Å²	28	44.2 Å²	44.2	15%	0.15	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-47.6	173.9	-58.6	-61.1	0	0	0	111.4	L428 T429 V434 R435 D436	L428-D432 HydrophobicContact CB-CB 3.86Å; L428-D432 HydrophobicContact CD1-CB 4.16Å; T429-D432 WeakPolarHBondContact CB-OD2 3.41Å; T429-D432 PolarHBondContact N-OD2 3.07Å; T429-D432 WeakPolarHBondContact O-CB 3.49Å; T429-D432 PolarHBondContact O-N 2.87Å; T429-D432 VanDerWaalsContact OG1-CG 3.31Å; T429-D432 PolarHBondContact OG1-N 3.28Å; T429-D432 PolarHBondContact OG1-OD2 3.09Å; D432-V434 VanDerWaalsContact C-N 3.32Å; D432-V434 PolarHBondContact O-N 3.07Å; D432-R435 PolarHBondContact O-N 2.95Å; D432-R435 IonicContact OD1-CZ 3.17Å; D432-R435 IonicContact OD1-NH1 3.14Å; D432-R435 PolarHBondContact OD1-NH1 2.89Å; D432-R435 IonicContact OD1-NH2 3.62Å; D432-R435 PolarHBondContact OD1-NH2 3.14Å; D432-D436 WeakPolarHBondContact O-CB 3.4Å; D432-D436 PolarHBondContact O-N 2.94Å
433	F	96.3	Very high	94.9	Very high	39 Å²	39	50.8 Å²	50.8	17%	0.171	27%	0.271	C	S	.	.	H	α-helix	trans	-54.5	-47.6	178.2	168.4	-103.4	0	0	0	111.8	L428 T429 V430 S437 Y448 Q451 L455 L483	L428-F433 HydrophobicContact CD1-CB 3.68Å; T429-F433 PolarHBondContact O-N 2.91Å; V430-F433 PolarHBondContact O-N 3.4Å; F433-S437 WeakPolarHBondContact O-CB 3.44Å; F433-S437 PolarHBondContact O-N 3.05Å; F433-S437 VanDerWaalsContact O-N 3.11Å; F433-S437 PolarHBondContact O-OG 3.4Å; F433-Y448 HydrophobicContact CE1-CD2 4.46Å; F433-Y448 AromaticContact CE1-CE2 3.57Å; F433-Y448 HydrophobicContact CE1-CE2 3.57Å; F433-Y448 HydrophobicContact CZ-CD2 4.09Å; F433-Y448 AromaticContact CZ-CE2 3.58Å; F433-Y448 HydrophobicContact CZ-CE2 3.58Å; F433-Q451 HydrophobicContact CZ-CG 3.9Å; F433-L455 HydrophobicContact CD1-CD1 4.04Å; F433-L455 HydrophobicContact CE1-CD1 3.91Å; F433-L483 HydrophobicContact CB-CD1 3.88Å; F433-L483 HydrophobicContact CD2-CD1 4.46Å; F433-L483 HydrophobicContact CG-CD1 4.14Å
434	V	97.4	Very high	95.3	Very high	12 Å²	12	49.8 Å²	49.8	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-55.9	178.1	173.3	0	0	0	0	110	V430 D432 D436 S437 L438 L478 E560 M561 H563	V430-V434 HydrophobicContact CG1-CG2 4.23Å; V430-V434 VanDerWaalsContact O-CG2 3.28Å; V430-V434 WeakPolarHBondContact O-CG2 3.26Å; V430-V434 PolarHBondContact O-N 2.87Å; D432-V434 VanDerWaalsContact C-N 3.32Å; D432-V434 PolarHBondContact O-N 3.07Å; V434-D436 PolarHBondContact O-N 2.77Å; V434-D436 VanDerWaalsContact O-N 3.13Å; V434-S437 PolarHBondContact O-N 3.01Å; V434-L438 PolarHBondContact O-N 3.38Å; V434-L478 HydrophobicContact CG2-CD1 4.09Å; V434-E560 WeakPolarHBondContact CG1-O 3.41Å; V434-M561 HydrophobicContact CG2-CB 4.4Å; V434-M561 HydrophobicContact CG2-CG 4.25Å; V434-H563 PolarHBondContact O-NE2 2.93Å
435	R	96.6	Very high	95.6	Very high	143 Å²	143	50.2 Å²	50.2	54%	0.54	28%	0.278	S	S	.	.	H	α-helix	trans	-50.4	-44	-179.2	-178.9	-168.8	64.5	-125.7	-9.7	112.5	A431 D432 S437	A431-R435 WeakPolarHBondContact O-CB 3.4Å; A431-R435 PolarHBondContact O-N 3.4Å; D432-R435 PolarHBondContact O-N 2.95Å; D432-R435 IonicContact OD1-CZ 3.17Å; D432-R435 IonicContact OD1-NH1 3.14Å; D432-R435 PolarHBondContact OD1-NH1 2.89Å; D432-R435 IonicContact OD1-NH2 3.62Å; D432-R435 PolarHBondContact OD1-NH2 3.14Å; R435-S437 VanDerWaalsContact C-N 3.34Å
436	D	95.3	Very high	95.8	Very high	95 Å²	95	52 Å²	52	51%	0.508	29%	0.286	S	S	.	.	H	α-helix	trans	-85.9	-8.4	-174.6	-54.8	-17.2	0	0	0	112.2	D432 V434	D432-D436 WeakPolarHBondContact O-CB 3.4Å; D432-D436 PolarHBondContact O-N 2.94Å; V434-D436 PolarHBondContact O-N 2.77Å; V434-D436 VanDerWaalsContact O-N 3.13Å
437	S	95.6	Very high	95.9	Very high	13 Å²	13	58 Å²	58	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-100.6	-0.8	-179.4	-65.2	0	0	0	0	115.7	F433 V434 R435 A439 H440 H441 Y448	F433-S437 WeakPolarHBondContact O-CB 3.44Å; F433-S437 PolarHBondContact O-N 3.05Å; F433-S437 VanDerWaalsContact O-N 3.11Å; F433-S437 PolarHBondContact O-OG 3.4Å; V434-S437 PolarHBondContact O-N 3.01Å; R435-S437 VanDerWaalsContact C-N 3.34Å; S437-A439 VanDerWaalsContact C-N 3.28Å; S437-A439 PolarHBondContact O-N 3.48Å; S437-A439 VanDerWaalsContact O-N 3.16Å; S437-H440 CarbonylContact O-C 3.55Å; S437-H440 WeakPolarHBondContact O-CA 3.46Å; S437-H440 WeakPolarHBondContact O-CB 3.47Å; S437-H440 PolarHBondContact O-N 3.24Å; S437-H441 PolarHBondContact O-N 3.19Å; S437-Y448 VanDerWaalsContact CB-CE2 3.42Å
438	L	95.6	Very high	96.2	Very high	107 Å²	107	55 Å²	55	56%	0.56	30%	0.304	S	S	*	.	H	α-helix	trans	-51.2	-44.1	-176.5	-179.2	63.2	0	0	0	113.5	V434 G442 H563	V434-L438 PolarHBondContact O-N 3.38Å; L438-G442 PolarHBondContact O-N 2.79Å; L438-H563 WeakPolarHBondContact CA-NE2 3.45Å; L438-H563 HydrophobicContact CD1-CB 3.82Å; L438-H563 PolarHBondContact N-NE2 3.12Å
439	A	95	Very high	96.4	Very high	66 Å²	66	52.5 Å²	52.5	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-68.5	-32.7	176.5	0	0	0	0	0	113.2	S437 G442 N443	S437-A439 VanDerWaalsContact C-N 3.28Å; S437-A439 PolarHBondContact O-N 3.48Å; S437-A439 VanDerWaalsContact O-N 3.16Å; A439-G442 WeakPolarHBondContact O-CA 3.41Å; A439-G442 PolarHBondContact O-N 3.38Å; A439-N443 VanDerWaalsContact O-CG 3.31Å; A439-N443 PolarHBondContact O-N 3.12Å; A439-N443 PolarHBondContact O-ND2 2.98Å
440	H	92.6	Very high	96.4	Very high	105 Å²	105	54.9 Å²	54.9	49%	0.486	30%	0.299	S	S	.	.	H	α-helix	trans	-71.7	-43.4	176.3	-64.5	103.3	0	0	0	111.3	S437 G442 N443 S444	S437-H440 CarbonylContact O-C 3.55Å; S437-H440 WeakPolarHBondContact O-CA 3.46Å; S437-H440 WeakPolarHBondContact O-CB 3.47Å; S437-H440 PolarHBondContact O-N 3.24Å; H440-G442 PolarHBondContact O-N 3.39Å; H440-N443 PolarHBondContact O-N 2.9Å; H440-S444 PolarHBondContact O-N 3.38Å; H440-S444 PolarHBondContact O-OG 2.97Å
441	H	97.1	Very high	96.3	Very high	11 Å²	11	56.5 Å²	56.5	5%	0.051	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-33.9	169.7	-173.8	-148.6	0	0	0	111.2	S437 Y448 E449 L562 H563 R590	S437-H441 PolarHBondContact O-N 3.19Å; H441-Y448 HydrophobicContact CB-CD1 3.58Å; H441-Y448 HydrophobicContact CB-CD2 4.19Å; H441-Y448 HydrophobicContact CB-CE1 4.01Å; H441-Y448 HydrophobicContact CB-CG 3.67Å; H441-Y448 AromaticContact CD2-CD1 3.28Å; H441-Y448 WeakPolarHBondContact CD2-CD1 3.5Å; H441-Y448 AromaticContact CD2-CG 3.94Å; H441-Y448 AromaticContact CG-CD1 3.4Å; H441-Y448 VanDerWaalsContact CG-CD1 3.4Å; H441-Y448 AromaticContact CG-CE1 3.84Å; H441-Y448 AromaticContact CG-CG 3.99Å; H441-E449 IonicContact CD2-OE1 3.82Å; H441-E449 IonicContact CE1-OE1 3.95Å; H441-E449 WeakPolarHBondContact NE2-CG 3.44Å; H441-E449 CovalentContact NE2-OE1 1.77Å; H441-E449 IonicContact NE2-OE1 3.22Å; H441-E449 PolarHBondContact NE2-OE1 2.85Å; H441-E449 IonicContact NE2-OE2 2.72Å; H441-L562 PolarHBondContact CE1-O 2.98Å; H441-H563 VanDerWaalsContact CB-CE1 3.44Å; H441-H563 WeakPolarHBondContact CB-CE1 3.36Å; H441-H563 AromaticContact CG-CE1 3.86Å; H441-H563 AromaticContact CG-ND1 3.58Å; H441-H563 AromaticContact ND1-CE1 3.66Å; H441-H563 AromaticContact ND1-CG 3.98Å; H441-H563 AromaticContact ND1-ND1 2.92Å; H441-H563 PolarHBondContact ND1-ND1 3.17Å; H441-R590 PolarHBondContact CD2-NH1 3.32Å; H441-R590 VanDerWaalsContact CG-NH1 3.27Å; H441-R590 PolarHBondContact ND1-NH1 3.4Å; H441-R590 PolarHBondContact O-NH1 3.11Å; H441-R590 PolarHBondContact O-NH2 3.31Å
442	G	95.3	Very high	96.4	Very high	39 Å²	39	55.1 Å²	55.1	40%	0.402	30%	0.296	S	S	.	.	H	α-helix	trans	-54.4	-57.3	169.1	0	0	0	0	0	112.9	L438 A439 H440 R590	L438-G442 PolarHBondContact O-N 2.79Å; A439-G442 WeakPolarHBondContact O-CA 3.41Å; A439-G442 PolarHBondContact O-N 3.38Å; H440-G442 PolarHBondContact O-N 3.39Å; G442-R590 PolarHBondContact O-NH2 3.23Å
443	N	96.3	Very high	96.5	Very high	141 Å²	141	53.8 Å²	53.8	75%	0.754	29%	0.289	S	S	*	.	H	α-helix	trans	-84.3	-32.5	-169.5	-64.7	-28.4	0	0	0	115.1	A439 H440	A439-N443 VanDerWaalsContact O-CG 3.31Å; A439-N443 PolarHBondContact O-N 3.12Å; A439-N443 PolarHBondContact O-ND2 2.98Å; H440-N443 PolarHBondContact O-N 2.9Å
444	S	96.4	Very high	96.5	Very high	43 Å²	43	52.2 Å²	52.2	30%	0.301	28%	0.282	S	S	.	.			trans	-139.5	64.7	-173.3	49.7	0	0	0	0	112.1	H440 D446 L447 Y448	H440-S444 PolarHBondContact O-N 3.38Å; H440-S444 PolarHBondContact O-OG 2.97Å; S444-D446 VanDerWaalsContact C-N 3.32Å; S444-D446 PolarHBondContact O-N 3.33Å; S444-L447 PolarHBondContact O-N 3.33Å; S444-L447 VanDerWaalsContact O-N 3.13Å; S444-Y448 PolarHBondContact O-N 3.44Å
445	P	97.1	Very high	96.6	Very high	23 Å²	23	51.7 Å²	51.7	15%	0.149	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-38.5	-173.1	23.8	-34.4	0	0	0	113.5	L447 Y448 E449 R590	P445-L447 VanDerWaalsContact C-N 3.33Å; P445-L447 PolarHBondContact O-N 3.05Å; P445-Y448 PolarHBondContact O-N 3.28Å; P445-E449 WeakPolarHBondContact O-CB 3.21Å; P445-E449 WeakPolarHBondContact O-CG 3.4Å; P445-E449 PolarHBondContact O-N 3.05Å; P445-R590 HydrophobicContact CB-CB 3.88Å; P445-R590 HydrophobicContact CG-CB 4.33Å; P445-R590 VanDerWaalsContact CG-O 3.27Å; P445-R590 WeakPolarHBondContact CG-O 3.35Å
446	D	96.8	Very high	96.7	Very high	71 Å²	71	44.9 Å²	44.9	38%	0.38	25%	0.253	S	S	.	.	H	α-helix	trans	-57.6	-39.4	176.7	-75.3	45.4	0	0	0	114.1	S444 R450 S591 P592 Y593	S444-D446 VanDerWaalsContact C-N 3.32Å; S444-D446 PolarHBondContact O-N 3.33Å; D446-R450 VanDerWaalsContact O-CB 3.22Å; D446-R450 WeakPolarHBondContact O-CB 3.17Å; D446-R450 PolarHBondContact O-N 3.34Å; D446-S591 WeakPolarHBondContact OD1-CA 3.48Å; D446-S591 VanDerWaalsContact OD1-CB 3.31Å; D446-S591 WeakPolarHBondContact OD1-CB 3.27Å; D446-P592 VanDerWaalsContact CG-CD 3.44Å; D446-P592 WeakPolarHBondContact OD1-CD 3.49Å; D446-P592 WeakPolarHBondContact OD2-CD 3.45Å; D446-P592 WeakPolarHBondContact OD2-CG 3.49Å; D446-Y593 WeakPolarHBondContact O-CE2 3.37Å
447	L	95.9	Very high	96.8	Very high	126 Å²	126	40.4 Å²	40.4	66%	0.66	23%	0.229	S	C	*	.	H	α-helix	trans	-74.7	-43.9	178.4	-64	179.8	0	0	0	110.6	S444 P445 Q451	S444-L447 PolarHBondContact O-N 3.33Å; S444-L447 VanDerWaalsContact O-N 3.13Å; P445-L447 VanDerWaalsContact C-N 3.33Å; P445-L447 PolarHBondContact O-N 3.05Å; L447-Q451 PolarHBondContact O-N 3.17Å; L447-Q451 VanDerWaalsContact O-N 3.1Å
448	Y	97.4	Very high	97	Very high	11 Å²	11	39.9 Å²	39.9	4%	0.043	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-49.4	179.4	-178.6	-94.8	0	0	0	112.1	F433 S437 H441 S444 P445 R450 Q451 V452 M561 H563	F433-Y448 HydrophobicContact CE1-CD2 4.46Å; F433-Y448 AromaticContact CE1-CE2 3.57Å; F433-Y448 HydrophobicContact CE1-CE2 3.57Å; F433-Y448 HydrophobicContact CZ-CD2 4.09Å; F433-Y448 AromaticContact CZ-CE2 3.58Å; F433-Y448 HydrophobicContact CZ-CE2 3.58Å; S437-Y448 VanDerWaalsContact CB-CE2 3.42Å; H441-Y448 HydrophobicContact CB-CD1 3.58Å; H441-Y448 HydrophobicContact CB-CD2 4.19Å; H441-Y448 HydrophobicContact CB-CE1 4.01Å; H441-Y448 HydrophobicContact CB-CG 3.67Å; H441-Y448 AromaticContact CD2-CD1 3.28Å; H441-Y448 WeakPolarHBondContact CD2-CD1 3.5Å; H441-Y448 AromaticContact CD2-CG 3.94Å; H441-Y448 AromaticContact CG-CD1 3.4Å; H441-Y448 VanDerWaalsContact CG-CD1 3.4Å; H441-Y448 AromaticContact CG-CE1 3.84Å; H441-Y448 AromaticContact CG-CG 3.99Å; S444-Y448 PolarHBondContact O-N 3.44Å; P445-Y448 PolarHBondContact O-N 3.28Å; Y448-R450 VanDerWaalsContact C-N 3.33Å; Y448-R450 PolarHBondContact O-N 3.21Å; Y448-Q451 CarbonylContact O-C 3.57Å; Y448-Q451 WeakPolarHBondContact O-CA 3.42Å; Y448-Q451 WeakPolarHBondContact O-CB 3.4Å; Y448-Q451 PolarHBondContact O-N 3.44Å; Y448-V452 HydrophobicContact CD1-CG2 3.97Å; Y448-V452 HydrophobicContact CE1-CG2 3.43Å; Y448-V452 VanDerWaalsContact CE1-CG2 3.43Å; Y448-V452 HydrophobicContact CE2-CG2 4.5Å; Y448-V452 WeakPolarHBondContact O-CG2 3.37Å; Y448-V452 PolarHBondContact O-N 3.22Å; Y448-M561 WeakPolarHBondContact CE1-O 3.45Å; Y448-M561 PolarHBondContact OH-O 2.86Å; Y448-H563 AromaticContact CE1-CE1 3.58Å; Y448-H563 AromaticContact CE1-ND1 3.95Å; Y448-H563 AromaticContact CE2-CE1 3.94Å; Y448-H563 AromaticContact CZ-CE1 3.36Å; Y448-H563 PolarHBondContact OH-CE1 2.61Å
449	E	98.2	Very high	97.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70.6	-29.2	-178.1	-64.1	-176.6	-160.5	0	0	112	H441 P445 V452 C453 L562 S591 Y593 S594 L597	H441-E449 IonicContact CD2-OE1 3.82Å; H441-E449 IonicContact CE1-OE1 3.95Å; H441-E449 WeakPolarHBondContact NE2-CG 3.44Å; H441-E449 CovalentContact NE2-OE1 1.77Å; H441-E449 IonicContact NE2-OE1 3.22Å; H441-E449 PolarHBondContact NE2-OE1 2.85Å; H441-E449 IonicContact NE2-OE2 2.72Å; P445-E449 WeakPolarHBondContact O-CB 3.21Å; P445-E449 WeakPolarHBondContact O-CG 3.4Å; P445-E449 PolarHBondContact O-N 3.05Å; E449-V452 PolarHBondContact O-N 3.49Å; E449-C453 PolarHBondContact O-N 3.03Å; E449-C453 PolarHBondContact O-SG 2.71Å; E449-L562 HydrophobicContact CG-CD2 3.66Å; E449-S591 WeakPolarHBondContact OE2-CB 3.36Å; E449-S591 PolarHBondContact OE2-OG 3.24Å; E449-Y593 HydrophobicContact CB-CD2 4.09Å; E449-Y593 HydrophobicContact CB-CG 4.38Å; E449-S594 PolarHBondContact OE1-OG 2.88Å; E449-S594 WeakPolarHBondContact OE2-CA 3.21Å; E449-S594 WeakPolarHBondContact OE2-CB 3.45Å; E449-S594 PolarHBondContact OE2-N 2.75Å; E449-S594 PolarHBondContact OE2-OG 2.91Å; E449-L597 HydrophobicContact CB-CD1 4.5Å
450	R	97.5	Very high	97.3	Very high	51 Å²	51	31.7 Å²	31.7	19%	0.192	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-44.3	166.3	-173.8	175.9	-174.8	74	3.7	111.5	D446 Y448 C453 L454 Y593 L626 E679	D446-R450 VanDerWaalsContact O-CB 3.22Å; D446-R450 WeakPolarHBondContact O-CB 3.17Å; D446-R450 PolarHBondContact O-N 3.34Å; Y448-R450 VanDerWaalsContact C-N 3.33Å; Y448-R450 PolarHBondContact O-N 3.21Å; R450-C453 WeakPolarHBondContact O-CB 3.3Å; R450-C453 PolarHBondContact O-N 3.03Å; R450-L454 PolarHBondContact O-N 2.63Å; R450-Y593 HydrophobicContact CB-CE1 4.38Å; R450-Y593 HydrophobicContact CB-CE2 3.79Å; R450-Y593 HydrophobicContact CG-CE1 4.46Å; R450-Y593 PolarHBondContact NH1-OH 3.36Å; R450-L626 HydrophobicContact CG-CD2 3.89Å; R450-L626 PolarHBondContact NH1-O 3.04Å; R450-L626 PolarHBondContact NH2-O 2.99Å; R450-E679 IonicContact CZ-OE1 1.77Å; R450-E679 IonicContact NE-OE2 3.16Å; R450-E679 IonicContact NH2-OE1 3.83Å; R450-E679 PolarHBondContact NH2-OE1 3.48Å; R450-E679 IonicContact NH2-OE2 3.69Å
451	Q	96.8	Very high	97.6	Very high	34 Å²	34	27 Å²	27	16%	0.159	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-39	177.4	-176.5	58.4	20.3	0	0	111.6	F433 L447 Y448 C453 L454 L455	F433-Q451 HydrophobicContact CZ-CG 3.9Å; L447-Q451 PolarHBondContact O-N 3.17Å; L447-Q451 VanDerWaalsContact O-N 3.1Å; Y448-Q451 CarbonylContact O-C 3.57Å; Y448-Q451 WeakPolarHBondContact O-CA 3.42Å; Y448-Q451 WeakPolarHBondContact O-CB 3.4Å; Y448-Q451 PolarHBondContact O-N 3.44Å; Q451-C453 VanDerWaalsContact C-N 3.35Å; Q451-C453 PolarHBondContact O-N 2.78Å; Q451-L454 PolarHBondContact O-N 3.11Å; Q451-L454 VanDerWaalsContact O-N 3.15Å; Q451-L455 HydrophobicContact CG-CD1 4.46Å; Q451-L455 WeakPolarHBondContact O-CG 3.33Å; Q451-L455 PolarHBondContact O-N 3.13Å
452	V	98.1	Very high	97.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-57	-46.7	170.2	170.3	0	0	0	0	110.8	Y448 E449 L454 L455 L456 M561 L562 L597	Y448-V452 HydrophobicContact CD1-CG2 3.97Å; Y448-V452 HydrophobicContact CE1-CG2 3.43Å; Y448-V452 VanDerWaalsContact CE1-CG2 3.43Å; Y448-V452 HydrophobicContact CE2-CG2 4.5Å; Y448-V452 WeakPolarHBondContact O-CG2 3.37Å; Y448-V452 PolarHBondContact O-N 3.22Å; E449-V452 PolarHBondContact O-N 3.49Å; V452-L454 VanDerWaalsContact C-N 3.34Å; V452-L454 PolarHBondContact O-N 2.93Å; V452-L455 PolarHBondContact O-N 2.84Å; V452-L456 HydrophobicContact CG1-CD1 3.64Å; V452-L456 HydrophobicContact CG1-CG 4.24Å; V452-L456 WeakPolarHBondContact O-CB 3.32Å; V452-L456 VanDerWaalsContact O-CG 3.28Å; V452-L456 WeakPolarHBondContact O-CG 3.39Å; V452-L456 PolarHBondContact O-N 3.33Å; V452-M561 HydrophobicContact CB-CE 4.41Å; V452-M561 HydrophobicContact CG1-CB 4Å; V452-M561 HydrophobicContact CG1-CE 4.12Å; V452-M561 HydrophobicContact CG2-CB 4.3Å; V452-M561 HydrophobicContact CG2-CE 4.28Å; V452-L562 HydrophobicContact CG1-CD2 4.44Å; V452-L597 HydrophobicContact CG1-CD1 4.42Å
453	C	98.5	Very high	97.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-38.6	174.6	-72.7	0	0	0	0	113.3	E449 R450 Q451 L457 L622 L626	E449-C453 PolarHBondContact O-N 3.03Å; E449-C453 PolarHBondContact O-SG 2.71Å; R450-C453 WeakPolarHBondContact O-CB 3.3Å; R450-C453 PolarHBondContact O-N 3.03Å; Q451-C453 VanDerWaalsContact C-N 3.35Å; Q451-C453 PolarHBondContact O-N 2.78Å; C453-L457 VanDerWaalsContact O-CB 3.26Å; C453-L457 WeakPolarHBondContact O-CB 3.42Å; C453-L457 PolarHBondContact O-N 3Å; C453-L622 HydrophobicContact CB-CD2 4.22Å; C453-L626 HydrophobicContact CB-CD1 4.14Å; C453-L626 HydrophobicContact CB-CD2 3.68Å; C453-L626 HydrophobicContact CB-CG 3.81Å
454	L	98.1	Very high	97.8	Very high	5 Å²	5	21 Å²	21	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-68.3	-38.6	177	-73.7	169.7	0	0	0	112.8	R450 Q451 V452 Q458 P507 L626 W627 E679 L682	R450-L454 PolarHBondContact O-N 2.63Å; Q451-L454 PolarHBondContact O-N 3.11Å; Q451-L454 VanDerWaalsContact O-N 3.15Å; V452-L454 VanDerWaalsContact C-N 3.34Å; V452-L454 PolarHBondContact O-N 2.93Å; L454-Q458 WeakPolarHBondContact O-CG 3.44Å; L454-Q458 PolarHBondContact O-N 3.42Å; L454-P507 HydrophobicContact CD1-CB 4.45Å; L454-L626 HydrophobicContact CD2-CD1 3.81Å; L454-L626 HydrophobicContact CD2-CD2 3.98Å; L454-L626 HydrophobicContact CG-CD1 4.29Å; L454-L626 HydrophobicContact CG-CD2 3.85Å; L454-W627 HydrophobicContact CD2-CH2 4.2Å; L454-W627 HydrophobicContact CD2-CZ2 3.94Å; L454-E679 HydrophobicContact CD2-CG 4.08Å; L454-L682 HydrophobicContact CD2-CD1 4.29Å
455	L	98.3	Very high	97.8	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-69	-45.7	175.2	-68.2	179.7	0	0	0	111.2	F433 Q451 V452 L457 Q458 L459 L483 L510 M561	F433-L455 HydrophobicContact CD1-CD1 4.04Å; F433-L455 HydrophobicContact CE1-CD1 3.91Å; Q451-L455 HydrophobicContact CG-CD1 4.46Å; Q451-L455 WeakPolarHBondContact O-CG 3.33Å; Q451-L455 PolarHBondContact O-N 3.13Å; V452-L455 PolarHBondContact O-N 2.84Å; L455-L457 VanDerWaalsContact C-N 3.29Å; L455-L457 PolarHBondContact O-N 3.31Å; L455-Q458 WeakPolarHBondContact O-CB 3.36Å; L455-Q458 PolarHBondContact O-N 3.3Å; L455-L459 PolarHBondContact O-N 3.34Å; L455-L483 HydrophobicContact CD2-CD2 3.67Å; L455-L510 HydrophobicContact CB-CD1 4.03Å; L455-L510 HydrophobicContact CD2-CB 4.1Å; L455-L510 HydrophobicContact CD2-CD1 4.1Å; L455-M561 HydrophobicContact CB-CE 3.78Å; L455-M561 HydrophobicContact CD1-CE 3.78Å; L455-M561 HydrophobicContact CG-CE 4.44Å
456	L	98.8	Very high	97.7	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-35.4	174.9	-70.2	168.4	0	0	0	112.1	V452 L459 C460 T554 I558 M561 L597 L622	V452-L456 HydrophobicContact CG1-CD1 3.64Å; V452-L456 HydrophobicContact CG1-CG 4.24Å; V452-L456 WeakPolarHBondContact O-CB 3.32Å; V452-L456 VanDerWaalsContact O-CG 3.28Å; V452-L456 WeakPolarHBondContact O-CG 3.39Å; V452-L456 PolarHBondContact O-N 3.33Å; L456-L459 HydrophobicContact CD2-CD2 4.48Å; L456-L459 PolarHBondContact O-N 3.16Å; L456-C460 WeakPolarHBondContact O-CB 3.4Å; L456-C460 PolarHBondContact O-N 3.09Å; L456-C460 PolarHBondContact O-SG 3.17Å; L456-T554 HydrophobicContact CD2-CG2 4.48Å; L456-I558 HydrophobicContact CD1-CG1 3.82Å; L456-I558 HydrophobicContact CD2-CG1 4.09Å; L456-M561 HydrophobicContact CD2-SD 3.86Å; L456-M561 HydrophobicContact CG-SD 4.13Å; L456-L597 HydrophobicContact CD1-CD2 3.88Å; L456-L622 HydrophobicContact CB-CD1 3.69Å; L456-L622 HydrophobicContact CB-CD2 3.94Å; L456-L622 HydrophobicContact CB-CG 4.49Å; L456-L622 HydrophobicContact CD1-CD2 4.19Å
457	L	98.7	Very high	97.5	Very high	1 Å²	1	19 Å²	19	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-66.4	-38.8	176.4	177.1	60.4	0	0	0	112.3	C453 L455 S461 K619 L622 Q623 L626 W627 L682	C453-L457 VanDerWaalsContact O-CB 3.26Å; C453-L457 WeakPolarHBondContact O-CB 3.42Å; C453-L457 PolarHBondContact O-N 3Å; L455-L457 VanDerWaalsContact C-N 3.29Å; L455-L457 PolarHBondContact O-N 3.31Å; L457-S461 WeakPolarHBondContact O-CB 3.06Å; L457-S461 PolarHBondContact O-N 3.35Å; L457-S461 VanDerWaalsContact O-N 3.08Å; L457-S461 PolarHBondContact O-OG 2.9Å; L457-K619 HydrophobicContact CD1-CG 3.76Å; L457-L622 HydrophobicContact CB-CB 4.36Å; L457-L622 HydrophobicContact CD1-CB 4.4Å; L457-Q623 HydrophobicContact CD1-CG 3.72Å; L457-Q623 HydrophobicContact CD2-CG 4.19Å; L457-L626 HydrophobicContact CB-CD1 4.29Å; L457-L626 HydrophobicContact CD2-CD1 3.69Å; L457-W627 HydrophobicContact CD2-CH2 3.5Å; L457-W627 VanDerWaalsContact CD2-CH2 3.5Å; L457-W627 HydrophobicContact CD2-CZ3 3.61Å; L457-L682 HydrophobicContact CD2-CB 4.22Å; L457-L682 HydrophobicContact CD2-CD1 4.43Å; L457-L682 HydrophobicContact CD2-CD2 4.44Å
458	Q	98.4	Very high	97.3	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-66.4	-43.1	172.8	-76.7	-175.2	84.1	0	0	111.7	N345 L454 L455 S461 G462 T508 L510 L682	N345-Q458 WeakPolarHBondContact CB-O 3.39Å; N345-Q458 WeakPolarHBondContact ND2-CB 3.38Å; N345-Q458 PolarHBondContact ND2-OE1 2.93Å; N345-Q458 PolarHBondContact OD1-O 2.89Å; L454-Q458 WeakPolarHBondContact O-CG 3.44Å; L454-Q458 PolarHBondContact O-N 3.42Å; L455-Q458 WeakPolarHBondContact O-CB 3.36Å; L455-Q458 PolarHBondContact O-N 3.3Å; Q458-S461 PolarHBondContact O-N 3.17Å; Q458-G462 PolarHBondContact O-N 3.37Å; Q458-T508 PolarHBondContact NE2-O 3.24Å; Q458-L510 HydrophobicContact CB-CB 3.97Å; Q458-L510 HydrophobicContact CB-CD2 4.4Å; Q458-L682 HydrophobicContact CG-CD1 4.27Å
459	L	98.7	Very high	97	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-59	-51.2	173.9	174.5	63	0	0	0	111.3	L455 L456 S461 G462 L463 L476 L481 L510 V512 T554 L557	L455-L459 PolarHBondContact O-N 3.34Å; L456-L459 HydrophobicContact CD2-CD2 4.48Å; L456-L459 PolarHBondContact O-N 3.16Å; L459-S461 PolarHBondContact O-N 3.03Å; L459-G462 PolarHBondContact O-N 3.01Å; L459-G462 VanDerWaalsContact O-N 3.07Å; L459-L463 HydrophobicContact CD1-CD1 3.86Å; L459-L463 HydrophobicContact CD1-CG 3.95Å; L459-L463 HydrophobicContact CG-CD1 3.87Å; L459-L463 HydrophobicContact CG-CG 4.34Å; L459-L463 WeakPolarHBondContact O-CG 3.36Å; L459-L463 PolarHBondContact O-N 2.97Å; L459-L476 HydrophobicContact CD1-CD2 4.24Å; L459-L481 HydrophobicContact CD1-CD1 4.42Å; L459-L481 HydrophobicContact CD1-CD2 3.91Å; L459-L481 HydrophobicContact CD2-CD1 4.23Å; L459-L510 HydrophobicContact CB-CD2 4.21Å; L459-V512 HydrophobicContact CD1-CG2 3.73Å; L459-T554 HydrophobicContact CD2-CG2 4.16Å; L459-L557 HydrophobicContact CD2-CD1 3.61Å
460	C	98.6	Very high	96.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.5	-34.7	178.2	-66.6	0	0	0	0	111.9	L456 E464 I615 K619	L456-C460 WeakPolarHBondContact O-CB 3.4Å; L456-C460 PolarHBondContact O-N 3.09Å; L456-C460 PolarHBondContact O-SG 3.17Å; C460-E464 WeakPolarHBondContact O-CB 3.43Å; C460-E464 PolarHBondContact O-N 3.35Å; C460-I615 HydrophobicContact CB-CD1 4.24Å; C460-I615 HydrophobicContact CB-CG1 4.03Å; C460-K619 HydrophobicContact CB-CB 3.95Å
461	S	98.3	Very high	96.1	Very high	6 Å²	6	23.7 Å²	23.7	4%	0.042	12%	0.115	C	C	.	.	H	α-helix	trans	-70.5	-39.9	175.6	-59	0	0	0	0	112.7	H343 L457 Q458 L459 H465 K619	H343-S461 PolarHBondContact CE1-O 3.38Å; L457-S461 WeakPolarHBondContact O-CB 3.06Å; L457-S461 PolarHBondContact O-N 3.35Å; L457-S461 VanDerWaalsContact O-N 3.08Å; L457-S461 PolarHBondContact O-OG 2.9Å; Q458-S461 PolarHBondContact O-N 3.17Å; L459-S461 PolarHBondContact O-N 3.03Å; S461-H465 PolarHBondContact O-N 2.66Å; S461-K619 VanDerWaalsContact OG-CE 3.23Å; S461-K619 WeakPolarHBondContact OG-CE 3.47Å; S461-K619 PolarHBondContact OG-NZ 3.4Å
462	G	97.9	Very high	95.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62	-44.6	171.5	0	0	0	0	0	112.7	Q458 L459 H465 L466	Q458-G462 PolarHBondContact O-N 3.37Å; L459-G462 PolarHBondContact O-N 3.01Å; L459-G462 VanDerWaalsContact O-N 3.07Å; G462-H465 WeakPolarHBondContact O-CB 3.33Å; G462-H465 PolarHBondContact O-N 2.87Å; G462-L466 PolarHBondContact O-N 3.48Å
463	L	97.8	Very high	95.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-70	-37.9	179.4	-67.5	177.4	0	0	0	113.1	L459 H465 L466 K467 H473 L476 D550 T554 I615	L459-L463 HydrophobicContact CD1-CD1 3.86Å; L459-L463 HydrophobicContact CD1-CG 3.95Å; L459-L463 HydrophobicContact CG-CD1 3.87Å; L459-L463 HydrophobicContact CG-CG 4.34Å; L459-L463 WeakPolarHBondContact O-CG 3.36Å; L459-L463 PolarHBondContact O-N 2.97Å; L463-H465 VanDerWaalsContact C-N 3.27Å; L463-H465 PolarHBondContact O-N 3.05Å; L463-L466 HydrophobicContact CD2-CD1 3.94Å; L463-L466 WeakPolarHBondContact O-CB 3.42Å; L463-L466 PolarHBondContact O-N 3.42Å; L463-K467 WeakPolarHBondContact O-CG 3.41Å; L463-K467 PolarHBondContact O-N 3.23Å; L463-H473 HydrophobicContact CD2-CB 4.39Å; L463-L476 HydrophobicContact CD1-CD1 3.75Å; L463-L476 HydrophobicContact CD2-CD1 3.95Å; L463-L476 HydrophobicContact CD2-CD2 4.19Å; L463-L476 HydrophobicContact CG-CD1 4.47Å; L463-D550 HydrophobicContact CD1-CB 4.22Å; L463-D550 HydrophobicContact CD2-CB 4.17Å; L463-T554 WeakPolarHBondContact CD1-OG1 3.22Å; L463-I615 HydrophobicContact CB-CG1 3.86Å; L463-I615 HydrophobicContact CD1-CD1 3.92Å; L463-I615 HydrophobicContact CD1-CG1 4.18Å
464	E	96.9	Very high	95.2	Very high	67 Å²	67	23.1 Å²	23.1	31%	0.313	11%	0.114	S	C	.	.	H	α-helix	trans	-59.1	-38.7	173.4	-175.7	175.4	-117.8	0	0	111.4	C460 L466 K467 P468 I615 S616 K619	C460-E464 WeakPolarHBondContact O-CB 3.43Å; C460-E464 PolarHBondContact O-N 3.35Å; E464-L466 VanDerWaalsContact C-N 3.27Å; E464-L466 PolarHBondContact O-N 2.88Å; E464-K467 PolarHBondContact O-N 3.31Å; E464-P468 WeakPolarHBondContact O-CD 3.37Å; E464-I615 HydrophobicContact CB-CG2 4.2Å; E464-S616 WeakPolarHBondContact OE1-CB 3.28Å; E464-K619 VanDerWaalsContact OE2-CD 3.29Å; E464-K619 WeakPolarHBondContact OE2-CD 3.25Å; E464-K619 WeakPolarHBondContact OE2-CE 3.44Å; E464-K619 IonicContact OE2-NZ 3.43Å; E464-K619 PolarHBondContact OE2-NZ 2.76Å
465	H	96.9	Very high	94.9	Very high	39 Å²	39	24 Å²	24	18%	0.181	12%	0.118	C	C	.	.	H	α-helix	trans	-65.1	-25	174.6	-174.7	94.1	0	0	0	113.5	P341 H343 I346 S461 G462 L463 Y469	P341-H465 PolarHBondContact O-NE2 2.69Å; H343-H465 AromaticContact CD2-CG 3.92Å; H343-H465 AromaticContact CD2-ND1 3.68Å; H343-H465 AromaticContact CG-CG 3.85Å; H343-H465 AromaticContact CG-ND1 3.95Å; I346-H465 HydrophobicContact CD1-CB 4.34Å; S461-H465 PolarHBondContact O-N 2.66Å; G462-H465 WeakPolarHBondContact O-CB 3.33Å; G462-H465 PolarHBondContact O-N 2.87Å; L463-H465 VanDerWaalsContact C-N 3.27Å; L463-H465 PolarHBondContact O-N 3.05Å; H465-Y469 WeakPolarHBondContact O-CD2 3.34Å; H465-Y469 WeakPolarHBondContact O-CE2 3.38Å
466	L	94.8	Very high	94.8	Very high	2 Å²	2	24 Å²	24	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-73.7	-34.1	176	-57.5	-175.6	0	0	0	112.9	L340 I346 G462 L463 E464 Y469 H470 V471 H473 F515	L340-L466 HydrophobicContact CD1-CD2 3.47Å; L340-L466 VanDerWaalsContact CD1-CD2 3.47Å; L340-L466 HydrophobicContact CD2-CD2 4.34Å; I346-L466 HydrophobicContact CD1-CD2 3.69Å; I346-L466 HydrophobicContact CD1-CG 4.5Å; G462-L466 PolarHBondContact O-N 3.48Å; L463-L466 HydrophobicContact CD2-CD1 3.94Å; L463-L466 WeakPolarHBondContact O-CB 3.42Å; L463-L466 PolarHBondContact O-N 3.42Å; E464-L466 VanDerWaalsContact C-N 3.27Å; E464-L466 PolarHBondContact O-N 2.88Å; L466-Y469 PolarHBondContact O-N 3.33Å; L466-Y469 VanDerWaalsContact O-N 3.12Å; L466-H470 PolarHBondContact O-N 3Å; L466-V471 HydrophobicContact CB-CB 4.27Å; L466-V471 WeakPolarHBondContact CB-O 3.32Å; L466-V471 HydrophobicContact CD1-CG1 4.44Å; L466-V471 HydrophobicContact CD2-CG1 4.43Å; L466-V471 PolarHBondContact O-N 3.49Å; L466-H473 HydrophobicContact CD1-CB 4.33Å; L466-F515 HydrophobicContact CD1-CE1 4.03Å; L466-F515 HydrophobicContact CD2-CE1 3.81Å; L466-F515 HydrophobicContact CD2-CZ 4.2Å
467	K	92.8	Very high	94.7	Very high	53 Å²	53	26.7 Å²	26.7	23%	0.23	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-60.3	-41.3	-169.4	-55	-55.5	-169.9	172.3	0	113.9	L463 E464 Y469 H470 K547 D550 E551 I615	L463-K467 WeakPolarHBondContact O-CG 3.41Å; L463-K467 PolarHBondContact O-N 3.23Å; E464-K467 PolarHBondContact O-N 3.31Å; K467-Y469 VanDerWaalsContact C-N 3.29Å; K467-Y469 PolarHBondContact O-N 3.33Å; K467-H470 PolarHBondContact O-N 2.85Å; K467-K547 PolarHBondContact NZ-O 2.82Å; K467-D550 IonicContact NZ-OD2 2.66Å; K467-D550 PolarHBondContact NZ-OD2 3.42Å; K467-E551 WeakPolarHBondContact CE-OE1 3.18Å; K467-E551 VanDerWaalsContact NZ-CD 3.33Å; K467-E551 IonicContact NZ-OE1 2.74Å; K467-E551 PolarHBondContact NZ-OE1 2.89Å; K467-E551 IonicContact NZ-OE2 2.75Å; K467-E551 PolarHBondContact NZ-OE2 3.37Å; K467-I615 HydrophobicContact CG-CG2 4.27Å
468	P	92	Very high	94.7	Very high	87 Å²	87	27.3 Å²	27.3	57%	0.565	13%	0.132	S	C	*	.	G	3₁₀ helix	trans	-58.2	-36.5	174.8	-27	35.6	0	0	0	114.1	E464 H470	E464-P468 WeakPolarHBondContact O-CD 3.37Å; P468-H470 PolarHBondContact O-N 3.1Å; P468-H470 PolarHBondContact O-ND1 2.83Å
469	Y	90.3	Very high	94.6	Very high	91 Å²	91	30 Å²	30	36%	0.357	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-82.3	3.4	179.1	-53.9	-76.7	0	0	0	112.9	L340 P341 H465 L466 K467 V471	L340-Y469 HydrophobicContact CD2-CD1 4.47Å; L340-Y469 HydrophobicContact CD2-CD2 3.51Å; L340-Y469 HydrophobicContact CD2-CE2 4.4Å; L340-Y469 HydrophobicContact CD2-CG 3.58Å; P341-Y469 VanDerWaalsContact CD-CZ 3.48Å; P341-Y469 HydrophobicContact CG-CE1 4.23Å; P341-Y469 WeakPolarHBondContact CG-OH 3.41Å; H465-Y469 WeakPolarHBondContact O-CD2 3.34Å; H465-Y469 WeakPolarHBondContact O-CE2 3.38Å; L466-Y469 PolarHBondContact O-N 3.33Å; L466-Y469 VanDerWaalsContact O-N 3.12Å; K467-Y469 VanDerWaalsContact C-N 3.29Å; K467-Y469 PolarHBondContact O-N 3.33Å; Y469-V471 PolarHBondContact O-N 3.08Å
470	H	88.5	Confident	94.5	Very high	108 Å²	108	30 Å²	30	50%	0.5	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	38	-178	-59.5	70	0	0	0	112.6	L466 K467 P468 K521	L466-H470 PolarHBondContact O-N 3Å; K467-H470 PolarHBondContact O-N 2.85Å; P468-H470 PolarHBondContact O-N 3.1Å; P468-H470 PolarHBondContact O-ND1 2.83Å; H470-K521 HydrophobicContact CB-CB 3.79Å; H470-K521 HydrophobicContact CB-CD 4.26Å; H470-K521 PolarHBondContact O-N 3.46Å
471	V	89.9	Confident	94.4	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.2	171.5	176.6	0	0	0	0	108.6	V336 L340 L466 Y469 A518 K519 Q520	V336-V471 HydrophobicContact CG1-CG1 3.74Å; V336-V471 HydrophobicContact CG1-CG2 4.1Å; L340-V471 HydrophobicContact CD2-CG2 4.26Å; L466-V471 HydrophobicContact CB-CB 4.27Å; L466-V471 WeakPolarHBondContact CB-O 3.32Å; L466-V471 HydrophobicContact CD1-CG1 4.44Å; L466-V471 HydrophobicContact CD2-CG1 4.43Å; L466-V471 PolarHBondContact O-N 3.49Å; Y469-V471 PolarHBondContact O-N 3.08Å; V471-A518 HydrophobicContact CG1-CB 4.29Å; V471-K519 WeakPolarHBondContact CA-O 3.39Å; V471-Q520 HydrophobicContact CG2-CB 4.22Å; V471-Q520 HydrophobicContact CG2-CG 3.96Å
472	T	90.8	Very high	94.4	Very high	15 Å²	15	29.8 Å²	29.8	9%	0.092	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141.2	163.5	56.6	0	0	0	0	108.5	C474 A518 K519 D550	T472-C474 PolarHBondContact OG1-SG 3.29Å; T472-A518 CarbonylContact O-C 3.57Å; T472-A518 WeakPolarHBondContact O-CA 3.41Å; T472-A518 WeakPolarHBondContact O-CB 3.05Å; T472-K519 PolarHBondContact N-O 3.21Å; T472-K519 PolarHBondContact O-N 3.2Å; T472-D550 WeakPolarHBondContact CA-OD2 3.4Å; T472-D550 WeakPolarHBondContact CB-OD2 3.28Å; T472-D550 WeakPolarHBondContact CG2-OD2 3.42Å
473	H	92.9	Very high	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.144	C	C	.	.			trans	-75.1	-40.3	-174.3	-166.8	-89.9	0	0	0	112.4	L463 L466 D475 L476 S513 N514 F515 A518 D550	L463-H473 HydrophobicContact CD2-CB 4.39Å; L466-H473 HydrophobicContact CD1-CB 4.33Å; H473-D475 PolarHBondContact CE1-O 2.92Å; H473-D475 VanDerWaalsContact CE1-O 3.31Å; H473-D475 PolarHBondContact ND1-O 3.37Å; H473-D475 PolarHBondContact O-N 3.3Å; H473-L476 HydrophobicContact CB-CD2 4.02Å; H473-L476 HydrophobicContact CB-CG 4.06Å; H473-L476 WeakPolarHBondContact ND1-CD2 3.31Å; H473-S513 PolarHBondContact CE1-O 3.06Å; H473-S513 PolarHBondContact NE2-O 3.48Å; H473-S513 VanDerWaalsContact NE2-O 3.09Å; H473-N514 PolarHBondContact CE1-O 2.98Å; H473-N514 PolarHBondContact NE2-O 3.1Å; H473-F515 AromaticContact CD2-CD1 3.88Å; H473-F515 AromaticContact CD2-CE1 3.77Å; H473-F515 AromaticContact CD2-CZ 3.87Å; H473-F515 AromaticContact NE2-CD2 3.93Å; H473-A518 WeakPolarHBondContact O-CA 3.38Å; H473-D550 PolarHBondContact N-OD1 2.92Å
474	C	90.6	Very high	94.1	Very high	7 Å²	7	30.4 Å²	30.4	5%	0.047	15%	0.146	C	C	.	.			trans	60	-12.6	177	-55	0	0	0	0	117.5	T472 D550 Q553	T472-C474 PolarHBondContact OG1-SG 3.29Å; C474-D550 PolarHBondContact N-OD1 3.29Å; C474-Q553 VanDerWaalsContact C-OE1 3.24Å; C474-Q553 PolarHBondContact O-NE2 3.36Å; C474-Q553 PolarHBondContact O-OE1 3.35Å
475	D	92	Very high	93.4	Very high	22 Å²	22	34.4 Å²	34.4	12%	0.118	17%	0.165	C	C	.	.			trans	-125.3	51.5	176.4	-170.7	33.1	0	0	0	111.7	H473 R477 N480 N514 Q517	H473-D475 PolarHBondContact CE1-O 2.92Å; H473-D475 VanDerWaalsContact CE1-O 3.31Å; H473-D475 PolarHBondContact ND1-O 3.37Å; H473-D475 PolarHBondContact O-N 3.3Å; D475-R477 VanDerWaalsContact CG-NH2 3.27Å; D475-R477 PolarHBondContact O-N 3.25Å; D475-R477 IonicContact OD1-CZ 2.7Å; D475-R477 VanDerWaalsContact OD1-CZ 3.25Å; D475-R477 IonicContact OD1-NE 3.19Å; D475-R477 PolarHBondContact OD1-NE 3.03Å; D475-R477 IonicContact OD1-NH2 3.77Å; D475-R477 PolarHBondContact OD1-NH2 2.67Å; D475-R477 IonicContact OD2-CZ 2.71Å; D475-R477 IonicContact OD2-NE 3.27Å; D475-R477 IonicContact OD2-NH2 2.8Å; D475-R477 PolarHBondContact OD2-NH2 3.47Å; D475-N480 VanDerWaalsContact CG-ND2 3.32Å; D475-N480 PolarHBondContact O-ND2 3.35Å; D475-N480 PolarHBondContact OD2-ND2 3.48Å; D475-N514 PolarHBondContact OD2-ND2 3.43Å; D475-Q517 HydrophobicContact CB-CB 3.96Å; D475-Q517 HydrophobicContact CB-CG 4.17Å
476	L	96.4	Very high	92.1	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.168	C	C	.	.			trans	-80	109.2	175.7	-66.7	174.3	0	0	0	110.7	L459 L463 H473 V512 D550 Q553 L557	L459-L476 HydrophobicContact CD1-CD2 4.24Å; L463-L476 HydrophobicContact CD1-CD1 3.75Å; L463-L476 HydrophobicContact CD2-CD1 3.95Å; L463-L476 HydrophobicContact CD2-CD2 4.19Å; L463-L476 HydrophobicContact CG-CD1 4.47Å; H473-L476 HydrophobicContact CB-CD2 4.02Å; H473-L476 HydrophobicContact CB-CG 4.06Å; H473-L476 WeakPolarHBondContact ND1-CD2 3.31Å; L476-V512 HydrophobicContact CD2-CG1 4.37Å; L476-D550 HydrophobicContact CD1-CB 3.92Å; L476-Q553 HydrophobicContact CB-CB 3.85Å; L476-Q553 HydrophobicContact CD1-CB 4.27Å; L476-L557 HydrophobicContact CB-CD1 4.33Å
477	R	96.2	Very high	90.5	Very high	59 Å²	59	39.8 Å²	39.8	22%	0.223	19%	0.19	C	C	.	.			trans	-140.3	154.6	176.6	-66	-177.5	-81.2	140.9	-6.5	109.3	D475 E479 N480	D475-R477 VanDerWaalsContact CG-NH2 3.27Å; D475-R477 PolarHBondContact O-N 3.25Å; D475-R477 IonicContact OD1-CZ 2.7Å; D475-R477 VanDerWaalsContact OD1-CZ 3.25Å; D475-R477 IonicContact OD1-NE 3.19Å; D475-R477 PolarHBondContact OD1-NE 3.03Å; D475-R477 IonicContact OD1-NH2 3.77Å; D475-R477 PolarHBondContact OD1-NH2 2.67Å; D475-R477 IonicContact OD2-CZ 2.71Å; D475-R477 IonicContact OD2-NE 3.27Å; D475-R477 IonicContact OD2-NH2 2.8Å; D475-R477 PolarHBondContact OD2-NH2 3.47Å; R477-E479 VanDerWaalsContact C-N 3.26Å; R477-E479 WeakPolarHBondContact CB-OE2 3.47Å; R477-E479 WeakPolarHBondContact CD-OE1 3.26Å; R477-E479 IonicContact CZ-OE1 2.69Å; R477-E479 IonicContact NE-OE1 3.52Å; R477-E479 IonicContact NH1-OE1 3.57Å; R477-E479 PolarHBondContact NH1-OE1 2.65Å; R477-E479 PolarHBondContact O-N 2.88Å; R477-N480 WeakPolarHBondContact O-CB 3.2Å; R477-N480 PolarHBondContact O-N 3.31Å
478	L	97.8	Very high	88.4	Confident	14 Å²	14	40.2 Å²	40.2	7%	0.073	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-62.8	-30.7	-172.6	-60	-177.5	0	0	0	113.4	V430 A431 V434 N480 L481 L557 E560 M561	V430-L478 HydrophobicContact CB-CB 4.35Å; V430-L478 HydrophobicContact CB-CD2 4.42Å; V430-L478 HydrophobicContact CG1-CD2 3.87Å; V430-L478 PolarHBondContact N-O 2.71Å; A431-L478 HydrophobicContact CB-CB 3.73Å; A431-L478 PolarHBondContact N-O 3.22Å; V434-L478 HydrophobicContact CG2-CD1 4.09Å; L478-N480 VanDerWaalsContact C-N 3.29Å; L478-N480 PolarHBondContact O-N 3.25Å; L478-L481 PolarHBondContact O-N 2.88Å; L478-L557 HydrophobicContact CD2-CB 4.37Å; L478-L557 HydrophobicContact CD2-CD2 3.82Å; L478-L557 HydrophobicContact CD2-CG 4.49Å; L478-L557 HydrophobicContact CG-CD2 4.24Å; L478-E560 HydrophobicContact CD1-CB 3.71Å; L478-E560 HydrophobicContact CG-CB 4.28Å; L478-M561 HydrophobicContact CD1-CG 4.48Å; L478-M561 HydrophobicContact CD2-CG 3.53Å; L478-M561 HydrophobicContact CD2-SD 4.18Å
479	E	96.3	Very high	86.1	Confident	57 Å²	57	38.2 Å²	38.2	27%	0.266	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-76.6	-10.3	176.1	69.3	-84.8	-159.2	0	0	114	A297 G298 A431 R477	A297-E479 CarbonylContact C-O 3.58Å; A297-E479 WeakPolarHBondContact CA-O 3.47Å; A297-E479 WeakPolarHBondContact CB-O 3.45Å; G298-E479 PolarHBondContact N-O 3.34Å; A431-E479 HydrophobicContact CB-CB 4.16Å; R477-E479 VanDerWaalsContact C-N 3.26Å; R477-E479 WeakPolarHBondContact CB-OE2 3.47Å; R477-E479 WeakPolarHBondContact CD-OE1 3.26Å; R477-E479 IonicContact CZ-OE1 2.69Å; R477-E479 IonicContact NE-OE1 3.52Å; R477-E479 IonicContact NH1-OE1 3.57Å; R477-E479 PolarHBondContact NH1-OE1 2.65Å; R477-E479 PolarHBondContact O-N 2.88Å
480	N	96.4	Very high	83.6	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-92.3	-7.8	171.5	-70.6	-23	0	0	0	112.2	D475 R477 L478 S513 N514	D475-N480 VanDerWaalsContact CG-ND2 3.32Å; D475-N480 PolarHBondContact O-ND2 3.35Å; D475-N480 PolarHBondContact OD2-ND2 3.48Å; R477-N480 WeakPolarHBondContact O-CB 3.2Å; R477-N480 PolarHBondContact O-N 3.31Å; L478-N480 VanDerWaalsContact C-N 3.29Å; L478-N480 PolarHBondContact O-N 3.25Å; N480-S513 PolarHBondContact O-N 3.34Å; N480-S513 PolarHBondContact O-OG 2.96Å; N480-N514 HydrophobicContact CB-CB 4.2Å; N480-N514 VanDerWaalsContact CG-ND2 3.29Å; N480-N514 PolarHBondContact ND2-ND2 3.07Å; N480-N514 VanDerWaalsContact ND2-ND2 3.14Å; N480-N514 WeakPolarHBondContact OD1-CB 3.44Å; N480-N514 PolarHBondContact OD1-ND2 3.34Å
481	L	98.1	Very high	80.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	115.4	178.2	-56.5	-178.3	0	0	0	109.6	T429 V430 L459 L478 L510 V512 L557	T429-L481 CarbonylContact C-O 3.57Å; T429-L481 VanDerWaalsContact CA-O 3.31Å; T429-L481 WeakPolarHBondContact CA-O 3.49Å; V430-L481 HydrophobicContact CB-CB 4.06Å; V430-L481 HydrophobicContact CG2-CB 3.53Å; V430-L481 HydrophobicContact CG2-CD1 4.4Å; V430-L481 PolarHBondContact N-O 3.26Å; L459-L481 HydrophobicContact CD1-CD1 4.42Å; L459-L481 HydrophobicContact CD1-CD2 3.91Å; L459-L481 HydrophobicContact CD2-CD1 4.23Å; L478-L481 PolarHBondContact O-N 2.88Å; L481-L510 HydrophobicContact CB-CD1 4.39Å; L481-L510 HydrophobicContact CD1-CD1 4.39Å; L481-V512 HydrophobicContact CD2-CB 4.41Å; L481-V512 HydrophobicContact CD2-CG1 4.43Å; L481-V512 HydrophobicContact CD2-CG2 3.99Å; L481-L557 HydrophobicContact CD1-CD1 3.92Å
482	L	97.4	Very high	78.1	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	140.8	-174.8	-49.2	176.9	0	0	0	110.9	A297 Y302 P426 T429 L510 I511	A297-L482 HydrophobicContact CB-CD2 3.78Å; Y302-L482 HydrophobicContact CE1-CD1 4.36Å; Y302-L482 HydrophobicContact CE2-CD1 4.37Å; Y302-L482 HydrophobicContact CE2-CD2 4.17Å; Y302-L482 WeakPolarHBondContact OH-CD1 3.23Å; P426-L482 HydrophobicContact CB-CB 4.1Å; P426-L482 HydrophobicContact CB-CD1 4.4Å; T429-L482 HydrophobicContact CG2-CD2 4.32Å; L482-L510 CarbonylContact O-C 3.54Å; L482-L510 WeakPolarHBondContact O-CA 3.49Å; L482-I511 HydrophobicContact CB-CB 4.37Å; L482-I511 PolarHBondContact N-O 2.93Å; L482-I511 PolarHBondContact O-N 3.16Å
483	L	96.4	Very high	75.5	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.4	171	-62.3	-170.3	0	0	0	110.9	P426 H427 L428 V430 F433 L455 T508 L510	P426-L483 WeakPolarHBondContact CA-O 3.2Å; H427-L483 PolarHBondContact CD2-O 3.45Å; H427-L483 PolarHBondContact N-O 2.94Å; L428-L483 HydrophobicContact CD1-CB 4.49Å; L428-L483 HydrophobicContact CD1-CD1 3.91Å; L428-L483 WeakPolarHBondContact O-CB 3.29Å; L428-L483 PolarHBondContact O-N 2.84Å; V430-L483 HydrophobicContact CG2-CD2 3.88Å; V430-L483 HydrophobicContact CG2-CG 4.09Å; F433-L483 HydrophobicContact CB-CD1 3.88Å; F433-L483 HydrophobicContact CD2-CD1 4.46Å; F433-L483 HydrophobicContact CG-CD1 4.14Å; L455-L483 HydrophobicContact CD2-CD2 3.67Å; L483-T508 HydrophobicContact CB-CG2 3.89Å; L483-L510 HydrophobicContact CD2-CB 4.1Å; L483-L510 HydrophobicContact CD2-CD1 4.45Å; L483-L510 HydrophobicContact CD2-CG 4.44Å
484	V	92.4	Very high	72.4	Confident	9 Å²	9	50.5 Å²	50.5	6%	0.055	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.5	-174.7	175.2	0	0	0	0	109.5	E424 P426 H486 T508 R509 I511	E424-V484 HydrophobicContact CB-CG1 4.48Å; E424-V484 HydrophobicContact CB-CG2 4.32Å; P426-V484 HydrophobicContact CB-CG2 4.42Å; V484-H486 PolarHBondContact O-N 3.19Å; V484-T508 VanDerWaalsContact O-CG2 3.26Å; V484-T508 WeakPolarHBondContact O-CG2 3.37Å; V484-R509 HydrophobicContact CB-CB 4.3Å; V484-R509 PolarHBondContact N-O 2.71Å; V484-R509 WeakPolarHBondContact O-CB 3.4Å; V484-R509 PolarHBondContact O-N 2.72Å; V484-I511 HydrophobicContact CB-CD1 4.37Å; V484-I511 HydrophobicContact CG2-CD1 3.74Å; V484-I511 HydrophobicContact CG2-CG1 4.22Å
485	Q	83.6	Confident	69.5	Low	152 Å²	152	57 Å²	57	71%	0.71	36%	0.364	S	S	*	.			trans	-77.5	121.9	174	-169.8	174.5	10.1	0	0	109.1	H427	H427-Q485 PolarHBondContact CD2-N 2.82Å
486	H	68.9	Low	66.3	Low	52 Å²	52	61.2 Å²	61.2	24%	0.241	40%	0.396	C	S	.	.			trans	-112.1	116.3	-179	-176.6	88.5	0	0	0	111.1	F268 V484 P488 R509	F268-H486 AromaticContact CD1-CD2 3.38Å; F268-H486 WeakPolarHBondContact CD1-CD2 3.33Å; F268-H486 AromaticContact CD1-CE1 3.99Å; F268-H486 AromaticContact CD1-NE2 3.22Å; F268-H486 WeakPolarHBondContact CD1-NE2 3.41Å; F268-H486 AromaticContact CE1-CD2 3.53Å; F268-H486 AromaticContact CE1-NE2 3.75Å; F268-H486 PolarHBondContact O-CE1 3.4Å; F268-H486 VanDerWaalsContact O-CE1 3.28Å; V484-H486 PolarHBondContact O-N 3.19Å; H486-P488 WeakPolarHBondContact NE2-CA 3.38Å; H486-R509 HydrophobicContact CB-CB 4.22Å
487	Q	60.8	Low	63.2	Low	102 Å²	102	66.9 Å²	66.9	48%	0.477	43%	0.433	S	S	.	.			trans	-101.7	115.5	165.6	-70.2	-173.8	-11.7	0	0	108.9	G489	Q487-G489 PolarHBondContact O-N 2.73Å
488	P	49.2	Very low	60.5	Low	61 Å²	61	68.7 Å²	68.7	40%	0.396	46%	0.46	S	S	.	.	S	Bend	trans	-79.1	109.3	-178.3	29.4	-31.7	0	0	0	111.2	F268 H486	F268-P488 HydrophobicContact CE1-CB 4.26Å; F268-P488 HydrophobicContact CE1-CG 4.44Å; F268-P488 HydrophobicContact CZ-CB 4.47Å; H486-P488 WeakPolarHBondContact NE2-CA 3.38Å
489	G	43.7	Very low	56.9	Low	45 Å²	45	75.3 Å²	75.3	46%	0.464	50%	0.496	S	S	.	.	S	Bend	trans	94.8	136.6	179.4	0	0	0	0	0	113.2	Q487 A491	Q487-G489 PolarHBondContact O-N 2.73Å; G489-A491 PolarHBondContact O-N 2.71Å
490	G	37.4	Very low	54	Low	88 Å²	88	78.3 Å²	78.3	91%	0.907	52%	0.52	S	S	*	.			trans	-74	59.2	-171.2	0	0	0	0	0	115.6	A492	G490-A492 PolarHBondContact O-N 3.2Å; G490-A492 VanDerWaalsContact O-N 3.11Å
491	A	29.8	Very low	50.5	Low	74 Å²	74	83.1 Å²	83.1	61%	0.612	55%	0.552	S	S	*	*			trans	-72.2	93.8	162.6	0	0	0	0	0	108.7	G489 Q493	G489-A491 PolarHBondContact O-N 2.71Å; A491-Q493 PolarHBondContact O-N 3.33Å
492	A	33.3	Very low	47.4	Very low	99 Å²	99	88.2 Å²	88.2	82%	0.818	59%	0.586	S	S	*	*			trans	-60.8	103	-178.1	0	0	0	0	0	111.4	G490	G490-A492 PolarHBondContact O-N 3.2Å; G490-A492 VanDerWaalsContact O-N 3.11Å
493	Q	37.2	Very low	44.1	Very low	153 Å²	153	93.4 Å²	93.4	72%	0.715	62%	0.618	S	S	*	*			trans	-85.1	126.4	170.8	-68.3	-169.6	-28.6	0	0	109.6	A491	A491-Q493 PolarHBondContact O-N 3.33Å
494	G	27.2	Very low	41.2	Very low	60 Å²	60	100.9 Å²	100.9	62%	0.619	66%	0.657	S	S	*	*			trans	-67.8	171.1	165.9	0	0	0	0	0	111.5	S496	G494-S496 PolarHBondContact O-N 3.23Å
495	P	29.4	Very low	38.9	Very low	142 Å²	142	104.7 Å²	104.7	92%	0.922	69%	0.689	S	S	*	*			trans	-67.1	101.6	-176	27.7	-34.9	0	0	0	111.5
496	S	25.6	Very low	37.3	Very low	112 Å²	112	102.9 Å²	102.9	78%	0.783	69%	0.692	S	S	*	*			trans	-80.9	138.7	162.5	-121.1	0	0	0	0	109.5	G494	G494-S496 PolarHBondContact O-N 3.23Å
497	P	30.2	Very low	36.9	Very low	119 Å²	119	101.8 Å²	101.8	77%	0.773	69%	0.689	S	S	*	*			trans	-66.6	155.6	174.5	29.7	-34.8	0	0	0	111.2	D499	P497-D499 PolarHBondContact O-N 3.47Å
498	A	38.9	Very low	38	Very low	97 Å²	97	98.4 Å²	98.4	80%	0.802	68%	0.676	S	S	*	*			trans	-80.5	114.8	-173.8	0	0	0	0	0	112.7
499	D	23.6	Very low	40.2	Very low	154 Å²	154	95.9 Å²	95.9	82%	0.824	66%	0.659	S	S	*	*			trans	-136.3	101.4	159.8	-97.2	-44.5	0	0	0	108.8	P497 C501	P497-D499 PolarHBondContact O-N 3.47Å; D499-C501 PolarHBondContact O-N 2.98Å
500	P	34.5	Very low	42.8	Very low	120 Å²	120	93.8 Å²	93.8	78%	0.779	64%	0.637	S	S	*	*			trans	-80.1	84.2	-178.3	31.9	-33.9	0	0	0	111.1	P502	P500-P502 WeakPolarHBondContact O-CD 3.21Å
501	C	23.1	Very low	45.6	Very low	100 Å²	100	89.7 Å²	89.7	68%	0.676	59%	0.594	S	S	*	*			trans	-70.5	117.4	172.3	-162.8	0	0	0	0	110.3	D499 T503	D499-C501 PolarHBondContact O-N 2.98Å; C501-T503 VanDerWaalsContact C-N 3.34Å; C501-T503 PolarHBondContact O-N 3.32Å
502	P	32.2	Very low	48.8	Very low	108 Å²	108	86.2 Å²	86.2	70%	0.701	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	2.8	-163.6	33.7	-37.5	0	0	0	115.2	P500	P500-P502 WeakPolarHBondContact O-CD 3.21Å
503	T	29.5	Very low	51.8	Low	111 Å²	111	81.5 Å²	81.5	68%	0.681	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-14.8	-163.9	41.8	0	0	0	0	116	C501	C501-T503 VanDerWaalsContact C-N 3.34Å; C501-T503 PolarHBondContact O-N 3.32Å
504	L	35.4	Very low	54.4	Low	161 Å²	161	74.6 Å²	74.6	84%	0.843	49%	0.494	S	S	*	.	S	Bend	trans	-134.6	68.9	176.8	-75.5	173.4	0	0	0	111.2	C506	L504-C506 PolarHBondContact O-N 3.09Å
505	A	43.8	Very low	57.5	Low	89 Å²	89	71.7 Å²	71.7	74%	0.736	47%	0.465	S	S	*	.			trans	-65	100.5	177.1	0	0	0	0	0	111.5
506	C	50.5	Low	60.3	Low	113 Å²	113	65.9 Å²	65.9	76%	0.764	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-60.6	127.7	169.5	-73.6	0	0	0	0	109.6	L504 T508	L504-C506 PolarHBondContact O-N 3.09Å; C506-T508 PolarHBondContact O-N 3.29Å; C506-T508 VanDerWaalsContact O-N 3.13Å
507	P	60.5	Low	63.3	Low	29 Å²	29	62.1 Å²	62.1	19%	0.188	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-61	117.9	-171.4	18.8	-30.4	0	0	0	112.2	L454 L678 E679	L454-P507 HydrophobicContact CD1-CB 4.45Å; P507-L678 HydrophobicContact CG-CB 4.2Å; P507-L678 WeakPolarHBondContact O-CD2 3.5Å; P507-E679 HydrophobicContact CG-CB 4.25Å
508	T	84.1	Confident	66	Low	32 Å²	32	56.5 Å²	56.5	20%	0.196	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-70.2	144.5	-172.5	-33.2	0	0	0	0	112.8	H427 Q458 L483 V484 C506 L510	H427-T508 VanDerWaalsContact NE2-CG2 3.32Å; H427-T508 WeakPolarHBondContact NE2-CG2 3.32Å; Q458-T508 PolarHBondContact NE2-O 3.24Å; L483-T508 HydrophobicContact CB-CG2 3.89Å; V484-T508 VanDerWaalsContact O-CG2 3.26Å; V484-T508 WeakPolarHBondContact O-CG2 3.37Å; C506-T508 PolarHBondContact O-N 3.29Å; C506-T508 VanDerWaalsContact O-N 3.13Å; T508-L510 PolarHBondContact O-N 3.1Å
509	R	94.3	Very high	68.2	Low	8 Å²	8	53.5 Å²	53.5	3%	0.03	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.9	173.7	175.1	-177.5	-172.7	-179.1	9	109.4	Q272 F344 V484 H486 I511	Q272-R509 VanDerWaalsContact NE2-NH1 3.12Å; Q272-R509 VanDerWaalsContact NE2-NH2 3.15Å; F344-R509 HydrophobicContact CD1-CG 4.31Å; F344-R509 HydrophobicContact CE1-CB 4.18Å; F344-R509 HydrophobicContact CE1-CG 3.65Å; F344-R509 HydrophobicContact CE2-CG 4.21Å; F344-R509 HydrophobicContact CZ-CB 3.99Å; F344-R509 HydrophobicContact CZ-CG 3.6Å; F344-R509 VanDerWaalsContact O-CZ 3.23Å; F344-R509 PolarHBondContact O-NE 2.87Å; F344-R509 PolarHBondContact O-NH2 3.23Å; V484-R509 HydrophobicContact CB-CB 4.3Å; V484-R509 PolarHBondContact N-O 2.71Å; V484-R509 WeakPolarHBondContact O-CB 3.4Å; V484-R509 PolarHBondContact O-N 2.72Å; H486-R509 HydrophobicContact CB-CB 4.22Å; R509-I511 HydrophobicContact CG-CD1 4.39Å; R509-I511 HydrophobicContact CG-CG1 4Å
510	L	97.4	Very high	70.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	137.1	170.5	179.5	148.3	0	0	0	110.4	N345 V430 L455 Q458 L459 L481 L482 L483 T508 V512	N345-L510 WeakPolarHBondContact CA-O 3.19Å; N345-L510 PolarHBondContact ND2-O 2.86Å; V430-L510 HydrophobicContact CG2-CD1 3.89Å; L455-L510 HydrophobicContact CB-CD1 4.03Å; L455-L510 HydrophobicContact CD2-CB 4.1Å; L455-L510 HydrophobicContact CD2-CD1 4.1Å; Q458-L510 HydrophobicContact CB-CB 3.97Å; Q458-L510 HydrophobicContact CB-CD2 4.4Å; L459-L510 HydrophobicContact CB-CD2 4.21Å; L481-L510 HydrophobicContact CB-CD1 4.39Å; L481-L510 HydrophobicContact CD1-CD1 4.39Å; L482-L510 CarbonylContact O-C 3.54Å; L482-L510 WeakPolarHBondContact O-CA 3.49Å; L483-L510 HydrophobicContact CD2-CB 4.1Å; L483-L510 HydrophobicContact CD2-CD1 4.45Å; L483-L510 HydrophobicContact CD2-CG 4.44Å; T508-L510 PolarHBondContact O-N 3.1Å; L510-V512 HydrophobicContact CD2-CG2 4.37Å
511	I	97.3	Very high	72.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.5	178.1	-58.6	-168.6	0	0	0	110.2	Q347 E424 L482 V484 R509	Q347-I511 VanDerWaalsContact CA-CG2 3.41Å; Q347-I511 HydrophobicContact CB-CG2 3.73Å; E424-I511 HydrophobicContact CB-CD1 3.65Å; E424-I511 HydrophobicContact CG-CD1 3.74Å; L482-I511 HydrophobicContact CB-CB 4.37Å; L482-I511 PolarHBondContact N-O 2.93Å; L482-I511 PolarHBondContact O-N 3.16Å; V484-I511 HydrophobicContact CB-CD1 4.37Å; V484-I511 HydrophobicContact CG2-CD1 3.74Å; V484-I511 HydrophobicContact CG2-CG1 4.22Å; R509-I511 HydrophobicContact CG-CD1 4.39Å; R509-I511 HydrophobicContact CG-CG1 4Å
512	V	97.9	Very high	73.7	Confident	1 Å²	1	50 Å²	50	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.3	170.4	-175.5	0	0	0	0	109.6	N345 Q347 L459 L476 L481 L510 F515	N345-V512 WeakPolarHBondContact O-CG2 3.48Å; N345-V512 PolarHBondContact O-N 3.42Å; Q347-V512 WeakPolarHBondContact CB-O 3.42Å; Q347-V512 PolarHBondContact N-O 3.45Å; L459-V512 HydrophobicContact CD1-CG2 3.73Å; L476-V512 HydrophobicContact CD2-CG1 4.37Å; L481-V512 HydrophobicContact CD2-CB 4.41Å; L481-V512 HydrophobicContact CD2-CG1 4.43Å; L481-V512 HydrophobicContact CD2-CG2 3.99Å; L510-V512 HydrophobicContact CD2-CG2 4.37Å; V512-F515 HydrophobicContact CG1-CE2 4.08Å; V512-F515 HydrophobicContact CG1-CZ 4.11Å
513	S	95.1	Very high	74.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.291	C	S	.	.			trans	-135.6	178.9	178.9	76.1	0	0	0	0	111.1	H473 N480	H473-S513 PolarHBondContact CE1-O 3.06Å; H473-S513 PolarHBondContact NE2-O 3.48Å; H473-S513 VanDerWaalsContact NE2-O 3.09Å; N480-S513 PolarHBondContact O-N 3.34Å; N480-S513 PolarHBondContact O-OG 2.96Å
514	N	92.6	Very high	75.2	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.043	31%	0.305	C	S	.	.			trans	58.8	68	-176	-175.8	16.6	0	0	0	114.7	D299 H473 D475 N480 S516	D299-N514 HydrophobicContact CB-CB 3.79Å; D299-N514 WeakPolarHBondContact OD2-CA 3.22Å; H473-N514 PolarHBondContact CE1-O 2.98Å; H473-N514 PolarHBondContact NE2-O 3.1Å; D475-N514 PolarHBondContact OD2-ND2 3.43Å; N480-N514 HydrophobicContact CB-CB 4.2Å; N480-N514 VanDerWaalsContact CG-ND2 3.29Å; N480-N514 PolarHBondContact ND2-ND2 3.07Å; N480-N514 VanDerWaalsContact ND2-ND2 3.14Å; N480-N514 WeakPolarHBondContact OD1-CB 3.44Å; N480-N514 PolarHBondContact OD1-ND2 3.34Å; N514-S516 PolarHBondContact O-N 3.05Å; N514-S516 VanDerWaalsContact O-N 3.11Å; N514-S516 WeakPolarHBondContact OD1-CB 3.43Å; N514-S516 PolarHBondContact OD1-N 2.88Å; N514-S516 PolarHBondContact OD1-OG 3.47Å
515	F	92.4	Very high	75.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-79.2	19.6	174.5	-76	-105.2	0	0	0	113.2	S333 V336 R337 L340 I346 L466 H473 V512 Q517 A518	S333-F515 VanDerWaalsContact OG-C 3.28Å; S333-F515 WeakPolarHBondContact OG-CA 3.46Å; S333-F515 PolarHBondContact OG-N 3.29Å; S333-F515 VanDerWaalsContact OG-N 3.11Å; V336-F515 HydrophobicContact CG1-CD1 4.07Å; R337-F515 HydrophobicContact CB-CD2 4.46Å; R337-F515 HydrophobicContact CB-CG 4.42Å; R337-F515 HydrophobicContact CG-CD2 4.21Å; R337-F515 HydrophobicContact CG-CE2 4.31Å; L340-F515 HydrophobicContact CD1-CE1 4.21Å; I346-F515 HydrophobicContact CG2-CE2 4.08Å; I346-F515 HydrophobicContact CG2-CZ 3.9Å; L466-F515 HydrophobicContact CD1-CE1 4.03Å; L466-F515 HydrophobicContact CD2-CE1 3.81Å; L466-F515 HydrophobicContact CD2-CZ 4.2Å; H473-F515 AromaticContact CD2-CD1 3.88Å; H473-F515 AromaticContact CD2-CE1 3.77Å; H473-F515 AromaticContact CD2-CZ 3.87Å; H473-F515 AromaticContact NE2-CD2 3.93Å; V512-F515 HydrophobicContact CG1-CE2 4.08Å; V512-F515 HydrophobicContact CG1-CZ 4.11Å; F515-Q517 VanDerWaalsContact C-N 3.27Å; F515-Q517 PolarHBondContact O-N 3.36Å; F515-A518 HydrophobicContact CB-CB 4.02Å; F515-A518 HydrophobicContact CD1-CB 3.92Å; F515-A518 HydrophobicContact CG-CB 4.43Å; F515-A518 WeakPolarHBondContact O-CB 3.35Å; F515-A518 PolarHBondContact O-N 2.9Å
516	S	88	Confident	75.6	Confident	20 Å²	20	50.7 Å²	50.7	14%	0.14	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-71.9	-19.5	-166.4	-43.2	0	0	0	0	113.9	S333 N514	S333-S516 WeakPolarHBondContact CB-OG 3.41Å; S333-S516 PolarHBondContact OG-N 3.5Å; S333-S516 PolarHBondContact OG-OG 2.83Å; N514-S516 PolarHBondContact O-N 3.05Å; N514-S516 VanDerWaalsContact O-N 3.11Å; N514-S516 WeakPolarHBondContact OD1-CB 3.43Å; N514-S516 PolarHBondContact OD1-N 2.88Å; N514-S516 PolarHBondContact OD1-OG 3.47Å
517	Q	87.4	Confident	75.3	Confident	33 Å²	33	48.2 Å²	48.2	15%	0.154	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-106.8	2.3	171.7	-64.4	-70.5	1.8	0	0	113	D475 F515 K519 I529 L530	D475-Q517 HydrophobicContact CB-CB 3.96Å; D475-Q517 HydrophobicContact CB-CG 4.17Å; F515-Q517 VanDerWaalsContact C-N 3.27Å; F515-Q517 PolarHBondContact O-N 3.36Å; Q517-K519 PolarHBondContact O-N 2.95Å; Q517-I529 PolarHBondContact NE2-O 3.48Å; Q517-L530 HydrophobicContact CB-CD2 4.47Å
518	A	87.9	Confident	74.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.			trans	-63.5	131.6	-172.6	0	0	0	0	0	110.9	H332 V336 V471 T472 H473 F515	H332-A518 PolarHBondContact CE1-O 2.86Å; H332-A518 PolarHBondContact NE2-O 3.13Å; V336-A518 HydrophobicContact CG1-CB 4.09Å; V471-A518 HydrophobicContact CG1-CB 4.29Å; T472-A518 CarbonylContact O-C 3.57Å; T472-A518 WeakPolarHBondContact O-CA 3.41Å; T472-A518 WeakPolarHBondContact O-CB 3.05Å; H473-A518 WeakPolarHBondContact O-CA 3.38Å; F515-A518 HydrophobicContact CB-CB 4.02Å; F515-A518 HydrophobicContact CD1-CB 3.92Å; F515-A518 HydrophobicContact CG-CB 4.43Å; F515-A518 WeakPolarHBondContact O-CB 3.35Å; F515-A518 PolarHBondContact O-N 2.9Å
519	K	84.9	Confident	73.2	Confident	34 Å²	34	57.2 Å²	57.2	15%	0.148	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.4	-179.3	-61.4	-72.5	-174.6	163.8	0	109	V471 T472 Q517 V525	V471-K519 WeakPolarHBondContact CA-O 3.39Å; T472-K519 PolarHBondContact N-O 3.21Å; T472-K519 PolarHBondContact O-N 3.2Å; Q517-K519 PolarHBondContact O-N 2.95Å; K519-V525 PolarHBondContact NZ-O 2.67Å
520	Q	79.4	Confident	71.3	Confident	52 Å²	52	57.9 Å²	57.9	24%	0.243	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.9	170.7	-169.2	170.9	41.2	0	0	109	S339 V471 S522 H523	S339-Q520 PolarHBondContact OG-NE2 3.1Å; V471-Q520 HydrophobicContact CG2-CB 4.22Å; V471-Q520 HydrophobicContact CG2-CG 3.96Å; Q520-S522 PolarHBondContact O-N 3.49Å; Q520-H523 PolarHBondContact O-N 3Å
521	K	64.4	Low	69.2	Low	163 Å²	163	69.5 Å²	69.5	71%	0.709	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-6.4	-167.7	-166.1	-176.1	168.6	-154.8	0	116	H470	H470-K521 HydrophobicContact CB-CB 3.79Å; H470-K521 HydrophobicContact CB-CD 4.26Å; H470-K521 PolarHBondContact O-N 3.46Å
522	S	53	Low	67.4	Low	85 Å²	85	72.5 Å²	72.5	59%	0.594	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.2	172.4	43.5	0	0	0	0	114.2	Q520	Q520-S522 PolarHBondContact O-N 3.49Å
523	H	48.8	Very low	65.7	Low	136 Å²	136	80 Å²	80	63%	0.63	39%	0.394	S	S	*	.			trans	-114.4	107.3	-177.4	-72.6	-86.8	0	0	0	111.9	Q520 V525	Q520-H523 PolarHBondContact O-N 3Å; H523-V525 HydrophobicContact CB-CG2 4.14Å; H523-V525 PolarHBondContact O-N 3.46Å
524	L	43.5	Very low	64.3	Low	185 Å²	185	81 Å²	81	97%	0.969	40%	0.402	S	S	*	.			trans	-68.8	113.2	163.4	-75.6	161.2	0	0	0	108.5
525	V	44.8	Very low	63.3	Low	77 Å²	77	82.3 Å²	82.3	47%	0.467	41%	0.406	S	S	.	.			trans	-141.3	133.1	176.5	-172.8	0	0	0	0	109.9	K519 H523 I529	K519-V525 PolarHBondContact NZ-O 2.67Å; H523-V525 HydrophobicContact CB-CG2 4.14Å; H523-V525 PolarHBondContact O-N 3.46Å; V525-I529 HydrophobicContact CG1-CD1 3.61Å
526	D	43.1	Very low	62.3	Low	86 Å²	86	83.3 Å²	83.3	46%	0.46	41%	0.411	S	S	.	.			trans	-37.2	137.8	-174.2	-150	-59.6	0	0	0	115.9	Q528	D526-Q528 PolarHBondContact O-N 3.42Å; D526-Q528 WeakPolarHBondContact OD1-CG 3.41Å; D526-Q528 PolarHBondContact OD1-N 2.88Å; D526-Q528 VanDerWaalsContact OD1-N 3.09Å
527	P	45.1	Very low	60.8	Low	62 Å²	62	82.4 Å²	82.4	40%	0.403	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-58.9	-25.5	171.9	-26.3	35.9	0	0	0	115.5	I529 L530	P527-I529 PolarHBondContact O-N 3.33Å; P527-L530 PolarHBondContact O-N 2.91Å
528	Q	48.3	Very low	59.3	Low	176 Å²	176	82.4 Å²	82.4	82%	0.822	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-64.6	-7.8	-170.9	-67.4	-175.2	30.7	0	0	115.9	D526	D526-Q528 PolarHBondContact O-N 3.42Å; D526-Q528 WeakPolarHBondContact OD1-CG 3.41Å; D526-Q528 PolarHBondContact OD1-N 2.88Å; D526-Q528 VanDerWaalsContact OD1-N 3.09Å
529	I	51.9	Low	58.1	Low	74 Å²	74	82.8 Å²	82.8	38%	0.379	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-80.6	-14.5	-175.4	-57.8	179.8	0	0	0	113	Q517 V525 P527 R531	Q517-I529 PolarHBondContact NE2-O 3.48Å; V525-I529 HydrophobicContact CG1-CD1 3.61Å; P527-I529 PolarHBondContact O-N 3.33Å; I529-R531 PolarHBondContact O-N 3.34Å
530	L	53.6	Low	56.8	Low	21 Å²	21	81.6 Å²	81.6	11%	0.11	41%	0.405	C	S	.	.			trans	-83	98.9	-175.6	-62.6	172.1	0	0	0	111.4	Q517 P527 D532 L536 I540 Y546	Q517-L530 HydrophobicContact CB-CD2 4.47Å; P527-L530 PolarHBondContact O-N 2.91Å; L530-D532 VanDerWaalsContact C-N 3.32Å; L530-D532 PolarHBondContact O-N 2.97Å; L530-L536 HydrophobicContact CB-CD1 4.34Å; L530-L536 HydrophobicContact CB-CD2 4.1Å; L530-L536 HydrophobicContact CD1-CD1 4.47Å; L530-L536 HydrophobicContact CD1-CD2 3.73Å; L530-L536 HydrophobicContact CG-CD2 4.41Å; L530-I540 HydrophobicContact CD1-CG2 4.12Å; L530-Y546 HydrophobicContact CD1-CE1 4.45Å
531	R	54.6	Low	55.6	Low	245 Å²	245	84.5 Å²	84.5	93%	0.925	42%	0.421	S	S	*	.			trans	-67.5	-16.3	-171.7	-79.2	-163.7	174.3	-150.2	1.7	117	I529	I529-R531 PolarHBondContact O-N 3.34Å
532	D	59.4	Low	55	Low	65 Å²	65	81.1 Å²	81.1	35%	0.348	41%	0.414	S	S	.	.			trans	-123.9	108.8	-176.9	179	6.3	0	0	0	110.5	L530 S534 R535 L536	L530-D532 VanDerWaalsContact C-N 3.32Å; L530-D532 PolarHBondContact O-N 2.97Å; D532-S534 VanDerWaalsContact CG-OG 3.24Å; D532-S534 VanDerWaalsContact OD1-CB 3.31Å; D532-S534 WeakPolarHBondContact OD1-CB 3.44Å; D532-S534 PolarHBondContact OD1-N 3.02Å; D532-S534 PolarHBondContact OD1-OG 3.38Å; D532-S534 PolarHBondContact OD2-OG 3.15Å; D532-R535 VanDerWaalsContact OD2-CD 3.23Å; D532-R535 WeakPolarHBondContact OD2-CD 3.48Å; D532-R535 WeakPolarHBondContact OD2-CG 3.44Å; D532-R535 IonicContact OD2-NE 2.67Å; D532-R535 PolarHBondContact OD2-NE 2.93Å; D532-L536 WeakPolarHBondContact O-CG 3.22Å
533	Q	60.7	Low	54.9	Low	157 Å²	157	80 Å²	80	73%	0.734	41%	0.41	S	S	*	.	S	Bend	trans	-78.4	-20.4	-179.1	-62.1	-178	4.6	0	0	112.8	R535 L536 K575	Q533-R535 VanDerWaalsContact C-N 3.29Å; Q533-R535 PolarHBondContact O-N 3.26Å; Q533-L536 PolarHBondContact O-N 2.89Å; Q533-K575 PolarHBondContact O-NZ 3.26Å; Q533-K575 VanDerWaalsContact O-NZ 3.08Å
534	S	67.6	Low	55	Low	23 Å²	23	78.3 Å²	78.3	16%	0.161	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-37.9	178.6	73.4	0	0	0	0	111.1	D532 L536 D569 K575	D532-S534 VanDerWaalsContact CG-OG 3.24Å; D532-S534 VanDerWaalsContact OD1-CB 3.31Å; D532-S534 WeakPolarHBondContact OD1-CB 3.44Å; D532-S534 PolarHBondContact OD1-N 3.02Å; D532-S534 PolarHBondContact OD1-OG 3.38Å; D532-S534 PolarHBondContact OD2-OG 3.15Å; S534-L536 PolarHBondContact O-N 3Å; S534-D569 VanDerWaalsContact CB-OD1 3.23Å; S534-D569 WeakPolarHBondContact CB-OD1 3.38Å; S534-K575 WeakPolarHBondContact O-CE 3.46Å; S534-K575 PolarHBondContact O-NZ 3.46Å
535	R	70.2	Confident	55.6	Low	35 Å²	35	73.8 Å²	73.8	13%	0.132	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	6.3	-177.6	-63.6	178	-167.2	-86.8	-17.6	114.7	D532 Q533 Q553 I556 E560	D532-R535 VanDerWaalsContact OD2-CD 3.23Å; D532-R535 WeakPolarHBondContact OD2-CD 3.48Å; D532-R535 WeakPolarHBondContact OD2-CG 3.44Å; D532-R535 IonicContact OD2-NE 2.67Å; D532-R535 PolarHBondContact OD2-NE 2.93Å; Q533-R535 VanDerWaalsContact C-N 3.29Å; Q533-R535 PolarHBondContact O-N 3.26Å; R535-Q553 WeakPolarHBondContact O-CG 3.44Å; R535-Q553 PolarHBondContact O-NE2 2.85Å; R535-I556 HydrophobicContact CG-CD1 4.44Å; R535-E560 IonicContact CZ-OE1 3.6Å; R535-E560 IonicContact NH1-OE1 2.69Å; R535-E560 PolarHBondContact NH1-OE1 3.27Å; R535-E560 IonicContact NH1-OE2 2.78Å; R535-E560 PolarHBondContact NH1-OE2 3.18Å; R535-E560 VanDerWaalsContact NH1-OE2 3.14Å; R535-E560 IonicContact NH2-OE1 3.34Å; R535-E560 PolarHBondContact NH2-OE1 2.92Å
536	L	71.5	Confident	56.3	Low	21 Å²	21	73 Å²	73	11%	0.11	37%	0.372	C	S	.	.	S	Bend	trans	-85.6	133.6	174.4	-58.4	-173.6	0	0	0	111.7	L530 D532 Q533 S534 I540 F552 K575	L530-L536 HydrophobicContact CB-CD1 4.34Å; L530-L536 HydrophobicContact CB-CD2 4.1Å; L530-L536 HydrophobicContact CD1-CD1 4.47Å; L530-L536 HydrophobicContact CD1-CD2 3.73Å; L530-L536 HydrophobicContact CG-CD2 4.41Å; D532-L536 WeakPolarHBondContact O-CG 3.22Å; Q533-L536 PolarHBondContact O-N 2.89Å; S534-L536 PolarHBondContact O-N 3Å; L536-I540 HydrophobicContact CB-CB 4.48Å; L536-I540 HydrophobicContact CD1-CG2 4.32Å; L536-I540 HydrophobicContact CD2-CD1 4.34Å; L536-I540 HydrophobicContact CD2-CG2 4.42Å; L536-F552 WeakPolarHBondContact O-CE1 3.25Å; L536-K575 PolarHBondContact O-NZ 3.19Å
537	A	56.8	Low	57.5	Low	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.379	C	S	.	.			trans	-68.2	145.7	170.2	0	0	0	0	0	110.2	E539 I540 F552	A537-E539 VanDerWaalsContact CB-OE2 3.24Å; A537-E539 WeakPolarHBondContact CB-OE2 3.21Å; A537-E539 PolarHBondContact O-N 2.66Å; A537-E539 VanDerWaalsContact O-N 3.07Å; A537-I540 HydrophobicContact CB-CD1 4.1Å; A537-I540 HydrophobicContact CB-CG1 4.29Å; A537-I540 WeakPolarHBondContact O-CB 3.45Å; A537-I540 PolarHBondContact O-N 3.26Å; A537-F552 HydrophobicContact CB-CB 3.76Å; A537-F552 HydrophobicContact CB-CD1 3.66Å; A537-F552 HydrophobicContact CB-CD2 4.14Å; A537-F552 HydrophobicContact CB-CE1 4.27Å; A537-F552 HydrophobicContact CB-CG 3.58Å
538	P	56.1	Low	59.5	Low	33 Å²	33	74.3 Å²	74.3	21%	0.214	37%	0.367	C	S	.	.	H	α-helix	trans	-54.5	-33	-173.2	-28.5	36.3	0	0	0	114.6	I540 I541 Y579 P607	P538-I540 VanDerWaalsContact C-N 3.26Å; P538-I540 PolarHBondContact O-N 3.32Å; P538-I541 WeakPolarHBondContact O-CB 3.49Å; P538-I541 PolarHBondContact O-N 3.39Å; P538-Y579 HydrophobicContact CG-CE1 4.47Å; P538-P607 HydrophobicContact CG-CB 4.27Å
539	E	62.4	Low	61.5	Low	9 Å²	9	66 Å²	66	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-74.8	-9.4	179.7	76.3	-80.1	-167.3	0	0	115.3	A537 T542 A543 T544 Q545 P609 R612	A537-E539 VanDerWaalsContact CB-OE2 3.24Å; A537-E539 WeakPolarHBondContact CB-OE2 3.21Å; A537-E539 PolarHBondContact O-N 2.66Å; A537-E539 VanDerWaalsContact O-N 3.07Å; E539-T542 WeakPolarHBondContact CA-OG1 3.41Å; E539-T542 PolarHBondContact O-OG1 2.89Å; E539-A543 PolarHBondContact O-N 3.39Å; E539-T544 PolarHBondContact O-N 3.35Å; E539-Q545 WeakPolarHBondContact CG-O 3.48Å; E539-P609 HydrophobicContact CB-CG 3.51Å; E539-P609 VanDerWaalsContact CD-CG 3.46Å; E539-P609 HydrophobicContact CG-CB 4.16Å; E539-P609 HydrophobicContact CG-CG 3.5Å; E539-P609 VanDerWaalsContact CG-CG 3.5Å; E539-R612 IonicContact OE1-CZ 3.8Å; E539-R612 IonicContact OE1-NH1 2.84Å; E539-R612 PolarHBondContact OE1-NH1 3.01Å; E539-R612 IonicContact OE1-NH2 3.73Å; E539-R612 IonicContact OE2-CZ 3.84Å; E539-R612 IonicContact OE2-NH1 3.85Å; E539-R612 PolarHBondContact OE2-NH1 3.08Å; E539-R612 IonicContact OE2-NH2 2.71Å; E539-R612 PolarHBondContact OE2-NH2 3.26Å
540	I	57.4	Low	63.6	Low	9 Å²	9	62.5 Å²	62.5	5%	0.046	31%	0.311	C	S	.	.	H	α-helix	trans	-79.7	-35	172.7	-57.7	175.7	0	0	0	109.5	L530 L536 A537 P538 T542 A543 Y546 C549	L530-I540 HydrophobicContact CD1-CG2 4.12Å; L536-I540 HydrophobicContact CB-CB 4.48Å; L536-I540 HydrophobicContact CD1-CG2 4.32Å; L536-I540 HydrophobicContact CD2-CD1 4.34Å; L536-I540 HydrophobicContact CD2-CG2 4.42Å; A537-I540 HydrophobicContact CB-CD1 4.1Å; A537-I540 HydrophobicContact CB-CG1 4.29Å; A537-I540 WeakPolarHBondContact O-CB 3.45Å; A537-I540 PolarHBondContact O-N 3.26Å; P538-I540 VanDerWaalsContact C-N 3.26Å; P538-I540 PolarHBondContact O-N 3.32Å; I540-T542 PolarHBondContact O-N 3.06Å; I540-A543 WeakPolarHBondContact O-CA 3.29Å; I540-A543 PolarHBondContact O-N 3.31Å; I540-Y546 HydrophobicContact CD1-CD1 4.36Å; I540-Y546 HydrophobicContact CG1-CD1 4.29Å; I540-Y546 HydrophobicContact CG1-CE1 4.45Å; I540-Y546 HydrophobicContact CG2-CE1 3.86Å; I540-C549 HydrophobicContact CD1-CB 3.94Å; I540-C549 VanDerWaalsContact CD1-SG 3.58Å
541	I	54.9	Low	65.6	Low	113 Å²	113	61.7 Å²	61.7	58%	0.579	31%	0.306	S	S	*	.	H	α-helix	trans	-62	-34.8	172.3	-48.1	177.3	0	0	0	110.1	P538	P538-I541 WeakPolarHBondContact O-CB 3.49Å; P538-I541 PolarHBondContact O-N 3.39Å
542	T	51.6	Low	67.6	Low	92 Å²	92	50 Å²	50	56%	0.564	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	8.4	173.6	67.2	0	0	0	0	114.1	E539 I540 T544	E539-T542 WeakPolarHBondContact CA-OG1 3.41Å; E539-T542 PolarHBondContact O-OG1 2.89Å; I540-T542 PolarHBondContact O-N 3.06Å; T542-T544 WeakPolarHBondContact O-CG2 3.48Å; T542-T544 PolarHBondContact O-N 3Å
543	A	50.9	Low	69.4	Low	62 Å²	62	47.1 Å²	47.1	51%	0.512	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	14	172.5	0	0	0	0	0	117.8	E539 I540	E539-A543 PolarHBondContact O-N 3.39Å; I540-A543 WeakPolarHBondContact O-CA 3.29Å; I540-A543 PolarHBondContact O-N 3.31Å
544	T	51.8	Low	71.2	Confident	100 Å²	100	39.7 Å²	39.7	61%	0.613	21%	0.212	S	C	*	.	S	Bend	trans	-90.1	-43.3	-169.3	51	0	0	0	0	115.6	E539 T542	E539-T544 PolarHBondContact O-N 3.35Å; T542-T544 WeakPolarHBondContact O-CG2 3.48Å; T542-T544 PolarHBondContact O-N 3Å
545	Q	56.1	Low	72.6	Confident	89 Å²	89	38.6 Å²	38.6	42%	0.416	20%	0.204	S	C	.	.			trans	-150.1	101.1	-173	-66.9	-166.7	67.1	0	0	115.4	E539 K547	E539-Q545 WeakPolarHBondContact CG-O 3.48Å; Q545-K547 PolarHBondContact O-N 2.8Å; Q545-K547 VanDerWaalsContact O-N 3.07Å
546	Y	58.5	Low	74	Confident	60 Å²	60	37 Å²	37	24%	0.235	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-64.2	-9	172.6	-68.6	-81.6	0	0	0	116.1	L530 I540 K548 C549	L530-Y546 HydrophobicContact CD1-CE1 4.45Å; I540-Y546 HydrophobicContact CD1-CD1 4.36Å; I540-Y546 HydrophobicContact CG1-CD1 4.29Å; I540-Y546 HydrophobicContact CG1-CE1 4.45Å; I540-Y546 HydrophobicContact CG2-CE1 3.86Å; Y546-K548 VanDerWaalsContact C-N 3.27Å; Y546-K548 PolarHBondContact O-N 3.17Å; Y546-C549 WeakPolarHBondContact O-CB 3.43Å; Y546-C549 PolarHBondContact O-N 2.75Å; Y546-C549 VanDerWaalsContact O-N 3.12Å
547	K	69.1	Low	75.2	Confident	141 Å²	141	36 Å²	36	61%	0.613	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-56.7	-30.2	-162.9	-69.1	178.7	-172.6	152.5	0	115.8	K467 Q545	K467-K547 PolarHBondContact NZ-O 2.82Å; Q545-K547 PolarHBondContact O-N 2.8Å; Q545-K547 VanDerWaalsContact O-N 3.07Å
548	K	86.6	Confident	77.2	Confident	35 Å²	35	36 Å²	36	15%	0.152	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-119.7	29.4	-178.1	-58.9	-170	-167.3	170.1	0	113.1	Y546 E551 F552 P609 S610 R612	Y546-K548 VanDerWaalsContact C-N 3.27Å; Y546-K548 PolarHBondContact O-N 3.17Å; K548-E551 WeakPolarHBondContact CA-OE2 3.37Å; K548-E551 HydrophobicContact CB-CB 4.29Å; K548-F552 PolarHBondContact O-N 2.98Å; K548-P609 VanDerWaalsContact CD-O 3.29Å; K548-P609 WeakPolarHBondContact CD-O 3.13Å; K548-P609 VanDerWaalsContact CE-O 3.23Å; K548-P609 WeakPolarHBondContact CE-O 3.35Å; K548-P609 PolarHBondContact NZ-O 3.41Å; K548-S610 PolarHBondContact NZ-O 2.85Å; K548-R612 HydrophobicContact CD-CB 4.13Å; K548-R612 PolarHBondContact NZ-O 3.01Å; K548-R612 PolarHBondContact O-NH1 2.98Å
549	C	90.6	Very high	79.3	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.014	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-47.8	173.1	177.7	0	0	0	0	111.5	I540 Y546 E551 F552 Q553	I540-C549 HydrophobicContact CD1-CB 3.94Å; I540-C549 VanDerWaalsContact CD1-SG 3.58Å; Y546-C549 WeakPolarHBondContact O-CB 3.43Å; Y546-C549 PolarHBondContact O-N 2.75Å; Y546-C549 VanDerWaalsContact O-N 3.12Å; C549-E551 VanDerWaalsContact C-N 3.32Å; C549-E551 PolarHBondContact O-N 3.39Å; C549-F552 WeakPolarHBondContact O-CB 3.47Å; C549-F552 PolarHBondContact O-N 3.26Å; C549-F552 VanDerWaalsContact O-N 3.13Å; C549-Q553 PolarHBondContact O-N 3.42Å
550	D	94.9	Very high	81	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-40.5	-178.4	-45.5	-50.4	0	0	0	111.7	L463 K467 T472 H473 C474 L476 Q553 T554	L463-D550 HydrophobicContact CD1-CB 4.22Å; L463-D550 HydrophobicContact CD2-CB 4.17Å; K467-D550 IonicContact NZ-OD2 2.66Å; K467-D550 PolarHBondContact NZ-OD2 3.42Å; T472-D550 WeakPolarHBondContact CA-OD2 3.4Å; T472-D550 WeakPolarHBondContact CB-OD2 3.28Å; T472-D550 WeakPolarHBondContact CG2-OD2 3.42Å; H473-D550 PolarHBondContact N-OD1 2.92Å; C474-D550 PolarHBondContact N-OD1 3.29Å; L476-D550 HydrophobicContact CD1-CB 3.92Å; D550-Q553 PolarHBondContact O-N 2.95Å; D550-T554 WeakPolarHBondContact O-CB 3.18Å; D550-T554 PolarHBondContact O-N 3.46Å; D550-T554 PolarHBondContact O-OG1 3.03Å
551	E	96.9	Very high	82.9	Confident	4 Å²	4	35 Å²	35	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-46.7	174	-74.3	82.4	166.6	0	0	111.2	K467 K548 C549 T554 G555 L604 I615	K467-E551 WeakPolarHBondContact CE-OE1 3.18Å; K467-E551 VanDerWaalsContact NZ-CD 3.33Å; K467-E551 IonicContact NZ-OE1 2.74Å; K467-E551 PolarHBondContact NZ-OE1 2.89Å; K467-E551 IonicContact NZ-OE2 2.75Å; K467-E551 PolarHBondContact NZ-OE2 3.37Å; K548-E551 WeakPolarHBondContact CA-OE2 3.37Å; K548-E551 HydrophobicContact CB-CB 4.29Å; C549-E551 VanDerWaalsContact C-N 3.32Å; C549-E551 PolarHBondContact O-N 3.39Å; E551-T554 WeakPolarHBondContact O-CB 3.23Å; E551-T554 PolarHBondContact O-N 3.49Å; E551-G555 PolarHBondContact O-N 3.15Å; E551-G555 VanDerWaalsContact O-N 3.08Å; E551-L604 HydrophobicContact CB-CD2 3.88Å; E551-L604 HydrophobicContact CG-CD2 4.28Å; E551-L604 WeakPolarHBondContact O-CB 3.45Å; E551-I615 HydrophobicContact CG-CB 3.98Å; E551-I615 HydrophobicContact CG-CD1 4.38Å; E551-I615 PolarHBondContact OE1-N 3.06Å
552	F	95.6	Very high	85	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-47	177.5	-175.2	-99.1	0	0	0	112.1	L536 A537 K548 C549 T554 G555 I556 F568 Y579 L605	L536-F552 WeakPolarHBondContact O-CE1 3.25Å; A537-F552 HydrophobicContact CB-CB 3.76Å; A537-F552 HydrophobicContact CB-CD1 3.66Å; A537-F552 HydrophobicContact CB-CD2 4.14Å; A537-F552 HydrophobicContact CB-CE1 4.27Å; A537-F552 HydrophobicContact CB-CG 3.58Å; K548-F552 PolarHBondContact O-N 2.98Å; C549-F552 WeakPolarHBondContact O-CB 3.47Å; C549-F552 PolarHBondContact O-N 3.26Å; C549-F552 VanDerWaalsContact O-N 3.13Å; F552-T554 VanDerWaalsContact C-N 3.33Å; F552-T554 PolarHBondContact O-N 3.01Å; F552-G555 WeakPolarHBondContact O-CA 3.36Å; F552-G555 PolarHBondContact O-N 3.45Å; F552-I556 HydrophobicContact CD1-CD1 4.37Å; F552-I556 HydrophobicContact CE1-CD1 3.99Å; F552-I556 PolarHBondContact O-N 3.49Å; F552-F568 HydrophobicContact CE1-CE2 4.11Å; F552-F568 HydrophobicContact CE2-CE2 4.13Å; F552-F568 AromaticContact CE2-CZ 3.92Å; F552-F568 HydrophobicContact CE2-CZ 3.92Å; F552-F568 HydrophobicContact CZ-CD2 4.23Å; F552-F568 HydrophobicContact CZ-CE1 4.31Å; F552-F568 AromaticContact CZ-CE2 3.44Å; F552-F568 HydrophobicContact CZ-CE2 3.44Å; F552-F568 VanDerWaalsContact CZ-CE2 3.44Å; F552-F568 AromaticContact CZ-CZ 3.5Å; F552-F568 HydrophobicContact CZ-CZ 3.5Å; F552-Y579 WeakPolarHBondContact CE2-OH 3.27Å; F552-L605 HydrophobicContact CD2-CD2 3.77Å; F552-L605 HydrophobicContact CE2-CD2 3.7Å; F552-L605 HydrophobicContact CG-CD2 4.24Å; F552-L605 HydrophobicContact CZ-CD2 4.13Å; F552-L605 VanDerWaalsContact O-CD2 3.25Å; F552-L605 WeakPolarHBondContact O-CD2 3.38Å
553	Q	96.8	Very high	87.2	Confident	5 Å²	5	27.7 Å²	27.7	2%	0.023	14%	0.142	C	C	.	.	H	α-helix	trans	-63.8	-38.7	177.7	-67	-178.5	-21.6	0	0	111.6	C474 L476 R535 C549 D550 G555 I556 L557	C474-Q553 VanDerWaalsContact C-OE1 3.24Å; C474-Q553 PolarHBondContact O-NE2 3.36Å; C474-Q553 PolarHBondContact O-OE1 3.35Å; L476-Q553 HydrophobicContact CB-CB 3.85Å; L476-Q553 HydrophobicContact CD1-CB 4.27Å; R535-Q553 WeakPolarHBondContact O-CG 3.44Å; R535-Q553 PolarHBondContact O-NE2 2.85Å; C549-Q553 PolarHBondContact O-N 3.42Å; D550-Q553 PolarHBondContact O-N 2.95Å; Q553-G555 PolarHBondContact O-N 3.14Å; Q553-I556 WeakPolarHBondContact O-CA 3.34Å; Q553-I556 WeakPolarHBondContact O-CB 3.5Å; Q553-I556 PolarHBondContact O-N 2.85Å; Q553-L557 WeakPolarHBondContact O-CG 3.47Å; Q553-L557 PolarHBondContact O-N 2.92Å
554	T	98.5	Very high	89.5	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-57.9	-34.1	171.7	-54.8	0	0	0	0	111.7	L456 L459 L463 D550 E551 F552 L557 I558 L604 I615	L456-T554 HydrophobicContact CD2-CG2 4.48Å; L459-T554 HydrophobicContact CD2-CG2 4.16Å; L463-T554 WeakPolarHBondContact CD1-OG1 3.22Å; D550-T554 WeakPolarHBondContact O-CB 3.18Å; D550-T554 PolarHBondContact O-N 3.46Å; D550-T554 PolarHBondContact O-OG1 3.03Å; E551-T554 WeakPolarHBondContact O-CB 3.23Å; E551-T554 PolarHBondContact O-N 3.49Å; F552-T554 VanDerWaalsContact C-N 3.33Å; F552-T554 PolarHBondContact O-N 3.01Å; T554-L557 PolarHBondContact O-N 3.25Å; T554-I558 WeakPolarHBondContact O-CG1 3.36Å; T554-I558 PolarHBondContact O-N 3.4Å; T554-L604 HydrophobicContact CG2-CD1 4Å; T554-I615 HydrophobicContact CG2-CD1 4.29Å
555	G	98.1	Very high	91.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.6	-38.7	171.8	0	0	0	0	0	113.8	E551 F552 Q553	E551-G555 PolarHBondContact O-N 3.15Å; E551-G555 VanDerWaalsContact O-N 3.08Å; F552-G555 WeakPolarHBondContact O-CA 3.36Å; F552-G555 PolarHBondContact O-N 3.45Å; Q553-G555 PolarHBondContact O-N 3.14Å
556	I	98.1	Very high	93.5	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-67.9	-45.7	173.7	-58.8	176.8	0	0	0	110.1	R535 F552 Q553 I558 Y559 E560 N566 F568 L605	R535-I556 HydrophobicContact CG-CD1 4.44Å; F552-I556 HydrophobicContact CD1-CD1 4.37Å; F552-I556 HydrophobicContact CE1-CD1 3.99Å; F552-I556 PolarHBondContact O-N 3.49Å; Q553-I556 WeakPolarHBondContact O-CA 3.34Å; Q553-I556 WeakPolarHBondContact O-CB 3.5Å; Q553-I556 PolarHBondContact O-N 2.85Å; I556-I558 PolarHBondContact O-N 2.98Å; I556-I558 VanDerWaalsContact O-N 3.1Å; I556-Y559 PolarHBondContact O-N 3.26Å; I556-E560 HydrophobicContact CG2-CG 4.22Å; I556-E560 PolarHBondContact O-N 2.8Å; I556-N566 HydrophobicContact CG2-CB 3.99Å; I556-N566 WeakPolarHBondContact CG2-OD1 3.48Å; I556-F568 HydrophobicContact CD1-CD2 4.07Å; I556-F568 HydrophobicContact CD1-CE2 4.31Å; I556-F568 HydrophobicContact CG1-CD2 4.24Å; I556-F568 HydrophobicContact CG1-CE2 4.16Å; I556-L605 HydrophobicContact CG1-CD2 4.01Å
557	L	98.6	Very high	95.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-56.8	-29.5	-179.8	-61	-172.8	0	0	0	112.9	L459 L476 L478 L481 Q553 T554 Y559 E560 M561	L459-L557 HydrophobicContact CD2-CD1 3.61Å; L476-L557 HydrophobicContact CB-CD1 4.33Å; L478-L557 HydrophobicContact CD2-CB 4.37Å; L478-L557 HydrophobicContact CD2-CD2 3.82Å; L478-L557 HydrophobicContact CD2-CG 4.49Å; L478-L557 HydrophobicContact CG-CD2 4.24Å; L481-L557 HydrophobicContact CD1-CD1 3.92Å; Q553-L557 WeakPolarHBondContact O-CG 3.47Å; Q553-L557 PolarHBondContact O-N 2.92Å; T554-L557 PolarHBondContact O-N 3.25Å; L557-Y559 VanDerWaalsContact C-N 3.34Å; L557-Y559 PolarHBondContact O-N 3.14Å; L557-E560 VanDerWaalsContact CD2-OE2 3.32Å; L557-E560 WeakPolarHBondContact CD2-OE2 3.49Å; L557-E560 PolarHBondContact O-N 2.97Å; L557-M561 VanDerWaalsContact O-CB 3.23Å; L557-M561 WeakPolarHBondContact O-CB 3.43Å; L557-M561 WeakPolarHBondContact O-CG 3.43Å; L557-M561 PolarHBondContact O-N 3.21Å
558	I	98.7	Very high	96.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.8	-40.3	176.3	-68	163.8	0	0	0	111.5	L456 T554 I556 L562 I587 L597 L600 A601 L604	L456-I558 HydrophobicContact CD1-CG1 3.82Å; L456-I558 HydrophobicContact CD2-CG1 4.09Å; T554-I558 WeakPolarHBondContact O-CG1 3.36Å; T554-I558 PolarHBondContact O-N 3.4Å; I556-I558 PolarHBondContact O-N 2.98Å; I556-I558 VanDerWaalsContact O-N 3.1Å; I558-L562 HydrophobicContact CG2-CD1 3.98Å; I558-L562 WeakPolarHBondContact O-CB 3.23Å; I558-L562 WeakPolarHBondContact O-CD1 3.31Å; I558-L562 WeakPolarHBondContact O-CG 3.39Å; I558-L562 PolarHBondContact O-N 3.43Å; I558-I587 HydrophobicContact CG2-CD1 4.12Å; I558-L597 HydrophobicContact CG2-CB 4.11Å; I558-L597 HydrophobicContact CG2-CD2 4.43Å; I558-L600 HydrophobicContact CD1-CB 4.34Å; I558-L600 HydrophobicContact CD1-CD2 3.77Å; I558-L600 HydrophobicContact CD1-CG 3.71Å; I558-A601 HydrophobicContact CB-CB 4.17Å; I558-A601 HydrophobicContact CD1-CB 4.02Å; I558-A601 HydrophobicContact CG2-CB 4Å; I558-L604 HydrophobicContact CD1-CD1 3.83Å
559	Y	98.6	Very high	96.7	Very high	1 Å²	1	14.1 Å²	14.1	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-68.4	-49.8	176	-76.7	-94.9	0	0	0	110.7	I556 L557 M561 L562 H563 L564 P567 P585 I587 Q598 A601 L605	I556-Y559 PolarHBondContact O-N 3.26Å; L557-Y559 VanDerWaalsContact C-N 3.34Å; L557-Y559 PolarHBondContact O-N 3.14Å; Y559-M561 VanDerWaalsContact C-N 3.33Å; Y559-M561 PolarHBondContact O-N 2.69Å; Y559-L562 CarbonylContact O-C 3.51Å; Y559-L562 PolarHBondContact O-N 3.36Å; Y559-H563 PolarHBondContact O-N 3.04Å; Y559-L564 CarbonylContact C-O 3.59Å; Y559-L564 HydrophobicContact CD1-CB 4.02Å; Y559-L564 HydrophobicContact CD1-CD1 3.71Å; Y559-L564 HydrophobicContact CE1-CD1 4.24Å; Y559-L564 WeakPolarHBondContact O-CB 3.32Å; Y559-L564 PolarHBondContact O-N 2.91Å; Y559-P567 HydrophobicContact CD1-CG 3.85Å; Y559-P567 HydrophobicContact CD2-CG 3.46Å; Y559-P567 VanDerWaalsContact CD2-CG 3.46Å; Y559-P567 HydrophobicContact CE1-CG 4.01Å; Y559-P567 HydrophobicContact CE2-CG 3.62Å; Y559-P567 HydrophobicContact CG-CG 3.58Å; Y559-P585 HydrophobicContact CE1-CB 4.1Å; Y559-P585 WeakPolarHBondContact CE1-O 3.42Å; Y559-P585 PolarHBondContact OH-O 2.96Å; Y559-I587 HydrophobicContact CD1-CG1 4.16Å; Y559-I587 HydrophobicContact CE1-CD1 4.21Å; Y559-I587 HydrophobicContact CE1-CG1 3.65Å; Y559-I587 HydrophobicContact CE2-CD1 4.45Å; Y559-Q598 PolarHBondContact OH-NE2 2.71Å; Y559-A601 HydrophobicContact CD2-CB 4.3Å; Y559-A601 HydrophobicContact CE2-CB 3.72Å; Y559-L605 HydrophobicContact CD2-CD1 4.25Å; Y559-L605 HydrophobicContact CE2-CD1 3.86Å
560	E	98.5	Very high	96.6	Very high	28 Å²	28	18.8 Å²	18.8	13%	0.131	10%	0.097	C	C	.	.	H	α-helix	trans	-58.5	-44.2	-179.8	-59.4	-179	143.4	0	0	111.5	V434 L478 R535 I556 L557 L562 H563 L564	V434-E560 WeakPolarHBondContact CG1-O 3.41Å; L478-E560 HydrophobicContact CD1-CB 3.71Å; L478-E560 HydrophobicContact CG-CB 4.28Å; R535-E560 IonicContact CZ-OE1 3.6Å; R535-E560 IonicContact NH1-OE1 2.69Å; R535-E560 PolarHBondContact NH1-OE1 3.27Å; R535-E560 IonicContact NH1-OE2 2.78Å; R535-E560 PolarHBondContact NH1-OE2 3.18Å; R535-E560 VanDerWaalsContact NH1-OE2 3.14Å; R535-E560 IonicContact NH2-OE1 3.34Å; R535-E560 PolarHBondContact NH2-OE1 2.92Å; I556-E560 HydrophobicContact CG2-CG 4.22Å; I556-E560 PolarHBondContact O-N 2.8Å; L557-E560 VanDerWaalsContact CD2-OE2 3.32Å; L557-E560 WeakPolarHBondContact CD2-OE2 3.49Å; L557-E560 PolarHBondContact O-N 2.97Å; E560-L562 PolarHBondContact O-N 3.43Å; E560-H563 PolarHBondContact O-N 2.84Å; E560-H563 VanDerWaalsContact O-N 3.16Å; E560-L564 WeakPolarHBondContact CA-O 3.43Å
561	M	98.6	Very high	96.4	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-68	-16.3	176.7	-69.9	-176.9	74.1	0	0	114.3	V430 V434 Y448 V452 L455 L456 L478 L557 Y559	V430-M561 HydrophobicContact CG1-CE 3.77Å; V430-M561 HydrophobicContact CG1-CG 4.21Å; V430-M561 HydrophobicContact CG1-SD 4.17Å; V434-M561 HydrophobicContact CG2-CB 4.4Å; V434-M561 HydrophobicContact CG2-CG 4.25Å; Y448-M561 WeakPolarHBondContact CE1-O 3.45Å; Y448-M561 PolarHBondContact OH-O 2.86Å; V452-M561 HydrophobicContact CB-CE 4.41Å; V452-M561 HydrophobicContact CG1-CB 4Å; V452-M561 HydrophobicContact CG1-CE 4.12Å; V452-M561 HydrophobicContact CG2-CB 4.3Å; V452-M561 HydrophobicContact CG2-CE 4.28Å; L455-M561 HydrophobicContact CB-CE 3.78Å; L455-M561 HydrophobicContact CD1-CE 3.78Å; L455-M561 HydrophobicContact CG-CE 4.44Å; L456-M561 HydrophobicContact CD2-SD 3.86Å; L456-M561 HydrophobicContact CG-SD 4.13Å; L478-M561 HydrophobicContact CD1-CG 4.48Å; L478-M561 HydrophobicContact CD2-CG 3.53Å; L478-M561 HydrophobicContact CD2-SD 4.18Å; L557-M561 VanDerWaalsContact O-CB 3.23Å; L557-M561 WeakPolarHBondContact O-CB 3.43Å; L557-M561 WeakPolarHBondContact O-CG 3.43Å; L557-M561 PolarHBondContact O-N 3.21Å; Y559-M561 VanDerWaalsContact C-N 3.33Å; Y559-M561 PolarHBondContact O-N 2.69Å
562	L	98.4	Very high	96	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	15.8	175.3	-67.7	172.3	0	0	0	112.8	H441 E449 V452 I558 Y559 E560 L564 I587 L597	H441-L562 PolarHBondContact CE1-O 2.98Å; E449-L562 HydrophobicContact CG-CD2 3.66Å; V452-L562 HydrophobicContact CG1-CD2 4.44Å; I558-L562 HydrophobicContact CG2-CD1 3.98Å; I558-L562 WeakPolarHBondContact O-CB 3.23Å; I558-L562 WeakPolarHBondContact O-CD1 3.31Å; I558-L562 WeakPolarHBondContact O-CG 3.39Å; I558-L562 PolarHBondContact O-N 3.43Å; Y559-L562 CarbonylContact O-C 3.51Å; Y559-L562 PolarHBondContact O-N 3.36Å; E560-L562 PolarHBondContact O-N 3.43Å; L562-L564 VanDerWaalsContact C-N 3.26Å; L562-L564 HydrophobicContact CB-CD1 4.49Å; L562-L564 HydrophobicContact CB-CG 4.49Å; L562-L564 PolarHBondContact O-N 3.38Å; L562-I587 HydrophobicContact CD1-CD1 3.95Å; L562-I587 HydrophobicContact CD1-CG2 3.73Å; L562-L597 HydrophobicContact CD1-CB 4.16Å; L562-L597 HydrophobicContact CD1-CD1 4.01Å; L562-L597 HydrophobicContact CD2-CD1 4.09Å
563	H	98.3	Very high	95.5	Very high	49 Å²	49	31 Å²	31	23%	0.227	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	29.2	-177.3	-48.1	91.9	0	0	0	113.8	V434 L438 H441 Y448 Y559 E560	V434-H563 PolarHBondContact O-NE2 2.93Å; L438-H563 WeakPolarHBondContact CA-NE2 3.45Å; L438-H563 HydrophobicContact CD1-CB 3.82Å; L438-H563 PolarHBondContact N-NE2 3.12Å; H441-H563 VanDerWaalsContact CB-CE1 3.44Å; H441-H563 WeakPolarHBondContact CB-CE1 3.36Å; H441-H563 AromaticContact CG-CE1 3.86Å; H441-H563 AromaticContact CG-ND1 3.58Å; H441-H563 AromaticContact ND1-CE1 3.66Å; H441-H563 AromaticContact ND1-CG 3.98Å; H441-H563 AromaticContact ND1-ND1 2.92Å; H441-H563 PolarHBondContact ND1-ND1 3.17Å; Y448-H563 AromaticContact CE1-CE1 3.58Å; Y448-H563 AromaticContact CE1-ND1 3.95Å; Y448-H563 AromaticContact CE2-CE1 3.94Å; Y448-H563 AromaticContact CZ-CE1 3.36Å; Y448-H563 PolarHBondContact OH-CE1 2.61Å; Y559-H563 PolarHBondContact O-N 3.04Å; E560-H563 PolarHBondContact O-N 2.84Å; E560-H563 VanDerWaalsContact O-N 3.16Å
564	L	97.7	Very high	95.1	Very high	42 Å²	42	31.5 Å²	31.5	22%	0.22	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-103.3	152.9	172.1	-56.5	174.6	0	0	0	109.5	Y559 E560 L562 I587 P588	Y559-L564 CarbonylContact C-O 3.59Å; Y559-L564 HydrophobicContact CD1-CB 4.02Å; Y559-L564 HydrophobicContact CD1-CD1 3.71Å; Y559-L564 HydrophobicContact CE1-CD1 4.24Å; Y559-L564 WeakPolarHBondContact O-CB 3.32Å; Y559-L564 PolarHBondContact O-N 2.91Å; E560-L564 WeakPolarHBondContact CA-O 3.43Å; L562-L564 VanDerWaalsContact C-N 3.26Å; L562-L564 HydrophobicContact CB-CD1 4.49Å; L562-L564 HydrophobicContact CB-CG 4.49Å; L562-L564 PolarHBondContact O-N 3.38Å; L564-I587 HydrophobicContact CD1-CB 4.19Å; L564-I587 HydrophobicContact CD1-CG1 3.9Å; L564-I587 HydrophobicContact CD1-CG2 4.15Å; L564-P588 HydrophobicContact CD2-CG 4.43Å
565	P	96.4	Very high	94.1	Very high	63 Å²	63	34 Å²	34	41%	0.409	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-63.5	161.8	171.8	29.5	-36.4	0	0	0	111.3	P567 E570	P565-P567 WeakPolarHBondContact O-CD 3.35Å; P565-E570 HydrophobicContact CB-CB 4.22Å; P565-E570 HydrophobicContact CG-CB 3.84Å; P565-E570 HydrophobicContact CG-CG 3.98Å
566	N	96.6	Very high	93.2	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.027	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-57.4	123.5	163.8	169.2	14.2	0	0	0	109	I556 F568 D569 E570	I556-N566 HydrophobicContact CG2-CB 3.99Å; I556-N566 WeakPolarHBondContact CG2-OD1 3.48Å; N566-F568 PolarHBondContact O-N 3.25Å; N566-F568 WeakPolarHBondContact OD1-CD2 3.36Å; N566-F568 PolarHBondContact OD1-N 3.39Å; N566-D569 HydrophobicContact CB-CB 4.16Å; N566-D569 VanDerWaalsContact CB-OD2 3.28Å; N566-D569 WeakPolarHBondContact CB-OD2 3.46Å; N566-D569 PolarHBondContact ND2-OD1 3.04Å; N566-D569 PolarHBondContact ND2-OD2 3.07Å; N566-D569 PolarHBondContact O-N 3.35Å; N566-E570 PolarHBondContact O-N 3.27Å
567	P	95.6	Very high	92.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-51.2	-33	-178.7	-33.6	38.8	0	0	0	115.1	Y559 P565 N571 L584 P585 L605	Y559-P567 HydrophobicContact CD1-CG 3.85Å; Y559-P567 HydrophobicContact CD2-CG 3.46Å; Y559-P567 VanDerWaalsContact CD2-CG 3.46Å; Y559-P567 HydrophobicContact CE1-CG 4.01Å; Y559-P567 HydrophobicContact CE2-CG 3.62Å; Y559-P567 HydrophobicContact CG-CG 3.58Å; P565-P567 WeakPolarHBondContact O-CD 3.35Å; P567-N571 PolarHBondContact O-N 3Å; P567-L584 HydrophobicContact CB-CD2 4.31Å; P567-P585 HydrophobicContact CB-CG 4.1Å; P567-L605 HydrophobicContact CG-CD1 4.13Å
568	F	93.9	Very high	91.3	Very high	5 Å²	5	56.6 Å²	56.6	2%	0.022	28%	0.281	C	S	.	.	H	α-helix	trans	-86.2	-12	-177.2	-54.8	-76	0	0	0	113.7	F552 I556 N566 P572 L574 K575 Y579 L584 L605	F552-F568 HydrophobicContact CE1-CE2 4.11Å; F552-F568 HydrophobicContact CE2-CE2 4.13Å; F552-F568 AromaticContact CE2-CZ 3.92Å; F552-F568 HydrophobicContact CE2-CZ 3.92Å; F552-F568 HydrophobicContact CZ-CD2 4.23Å; F552-F568 HydrophobicContact CZ-CE1 4.31Å; F552-F568 AromaticContact CZ-CE2 3.44Å; F552-F568 HydrophobicContact CZ-CE2 3.44Å; F552-F568 VanDerWaalsContact CZ-CE2 3.44Å; F552-F568 AromaticContact CZ-CZ 3.5Å; F552-F568 HydrophobicContact CZ-CZ 3.5Å; I556-F568 HydrophobicContact CD1-CD2 4.07Å; I556-F568 HydrophobicContact CD1-CE2 4.31Å; I556-F568 HydrophobicContact CG1-CD2 4.24Å; I556-F568 HydrophobicContact CG1-CE2 4.16Å; N566-F568 PolarHBondContact O-N 3.25Å; N566-F568 WeakPolarHBondContact OD1-CD2 3.36Å; N566-F568 PolarHBondContact OD1-N 3.39Å; F568-P572 WeakPolarHBondContact O-CA 3.48Å; F568-L574 HydrophobicContact CD1-CB 3.71Å; F568-L574 HydrophobicContact CD1-CD1 4.47Å; F568-L574 HydrophobicContact CE1-CB 3.86Å; F568-L574 HydrophobicContact CE1-CD1 4.49Å; F568-K575 HydrophobicContact CB-CD 4.42Å; F568-K575 HydrophobicContact CB-CG 4.23Å; F568-K575 HydrophobicContact CD1-CD 3.61Å; F568-K575 HydrophobicContact CD1-CG 3.96Å; F568-K575 HydrophobicContact CE1-CD 4.14Å; F568-K575 HydrophobicContact CG-CD 4.09Å; F568-K575 HydrophobicContact CG-CG 4.37Å; F568-Y579 AromaticContact CE1-CE1 3.98Å; F568-Y579 HydrophobicContact CE1-CE1 3.98Å; F568-Y579 HydrophobicContact CE1-CE2 4.32Å; F568-Y579 AromaticContact CE1-CZ 3.79Å; F568-Y579 HydrophobicContact CZ-CE2 4.36Å; F568-Y579 AromaticContact CZ-CZ 3.91Å; F568-L584 HydrophobicContact CZ-CD2 4.37Å; F568-L605 HydrophobicContact CE2-CD1 4.18Å; F568-L605 HydrophobicContact CE2-CD2 3.98Å; F568-L605 HydrophobicContact CZ-CD1 4.48Å; F568-L605 HydrophobicContact CZ-CD2 4.38Å
569	D	91.1	Very high	90.8	Very high	87 Å²	87	57.1 Å²	57.1	47%	0.465	28%	0.282	S	S	.	.	H	α-helix	trans	-93.4	-32.1	170.1	-60	-27	0	0	0	110.6	S534 N566	S534-D569 VanDerWaalsContact CB-OD1 3.23Å; S534-D569 WeakPolarHBondContact CB-OD1 3.38Å; N566-D569 HydrophobicContact CB-CB 4.16Å; N566-D569 VanDerWaalsContact CB-OD2 3.28Å; N566-D569 WeakPolarHBondContact CB-OD2 3.46Å; N566-D569 PolarHBondContact ND2-OD1 3.04Å; N566-D569 PolarHBondContact ND2-OD2 3.07Å; N566-D569 PolarHBondContact O-N 3.35Å
570	E	89.8	Confident	90.3	Very high	100 Å²	100	60.2 Å²	60.2	47%	0.467	30%	0.302	S	S	.	.	H	α-helix	trans	-70.2	-41.6	171.7	-169.7	-177.5	-153.6	0	0	111.9	P565 N566 P585	P565-E570 HydrophobicContact CB-CB 4.22Å; P565-E570 HydrophobicContact CG-CB 3.84Å; P565-E570 HydrophobicContact CG-CG 3.98Å; N566-E570 PolarHBondContact O-N 3.27Å; E570-P585 WeakPolarHBondContact OE2-CB 3.44Å; E570-P585 WeakPolarHBondContact OE2-CG 3.48Å
571	N	89.5	Confident	89.7	Confident	72 Å²	72	63.7 Å²	63.7	39%	0.385	31%	0.314	S	S	.	.			trans	-129.8	79.5	179.1	-64.8	-86.4	0	0	0	110.9	P567 E573 L574	P567-N571 PolarHBondContact O-N 3Å; N571-E573 PolarHBondContact O-N 3.28Å; N571-E573 VanDerWaalsContact O-N 3.12Å; N571-L574 HydrophobicContact CB-CD1 3.77Å; N571-L574 HydrophobicContact CB-CG 3.88Å; N571-L574 VanDerWaalsContact O-CB 3.31Å; N571-L574 WeakPolarHBondContact O-CB 3.39Å; N571-L574 WeakPolarHBondContact O-CG 3.4Å; N571-L574 PolarHBondContact O-N 3.16Å
572	P	88	Confident	89	Confident	76 Å²	76	68 Å²	68	49%	0.494	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.1	-178.6	-28.3	36.9	0	0	0	114.8	F568 L574 K575	F568-P572 WeakPolarHBondContact O-CA 3.48Å; P572-L574 PolarHBondContact O-N 2.84Å; P572-K575 PolarHBondContact O-N 3.35Å
573	E	86.8	Confident	88.7	Confident	113 Å²	113	71.9 Å²	71.9	53%	0.528	36%	0.361	S	S	.	.	H	α-helix	trans	-55.8	-22.6	175.6	-56.2	-169.3	166.2	0	0	113.4	N571 K575 E576 K577	N571-E573 PolarHBondContact O-N 3.28Å; N571-E573 VanDerWaalsContact O-N 3.12Å; E573-K575 PolarHBondContact O-N 3.13Å; E573-E576 PolarHBondContact O-N 3.18Å; E573-E576 VanDerWaalsContact O-N 3.12Å; E573-K577 HydrophobicContact CB-CD 4.25Å; E573-K577 WeakPolarHBondContact O-CB 3.29Å; E573-K577 WeakPolarHBondContact O-CG 3.36Å; E573-K577 PolarHBondContact O-N 2.85Å; E573-K577 IonicContact OE1-NZ 3.93Å; E573-K577 IonicContact OE2-NZ 2.6Å; E573-K577 PolarHBondContact OE2-NZ 2.85Å
574	L	86.8	Confident	88.5	Confident	15 Å²	15	69.8 Å²	69.8	8%	0.079	35%	0.352	C	S	.	.	H	α-helix	trans	-66.7	-13.6	174.3	-62.8	176.5	0	0	0	113.5	F568 N571 P572 Y579 D583 L584	F568-L574 HydrophobicContact CD1-CB 3.71Å; F568-L574 HydrophobicContact CD1-CD1 4.47Å; F568-L574 HydrophobicContact CE1-CB 3.86Å; F568-L574 HydrophobicContact CE1-CD1 4.49Å; N571-L574 HydrophobicContact CB-CD1 3.77Å; N571-L574 HydrophobicContact CB-CG 3.88Å; N571-L574 VanDerWaalsContact O-CB 3.31Å; N571-L574 WeakPolarHBondContact O-CB 3.39Å; N571-L574 WeakPolarHBondContact O-CG 3.4Å; N571-L574 PolarHBondContact O-N 3.16Å; P572-L574 PolarHBondContact O-N 2.84Å; L574-Y579 HydrophobicContact CB-CD1 4.41Å; L574-Y579 HydrophobicContact CB-CG 4.41Å; L574-Y579 HydrophobicContact CD2-CD2 4.4Å; L574-Y579 HydrophobicContact CD2-CG 4.05Å; L574-Y579 WeakPolarHBondContact O-CD1 3.35Å; L574-Y579 VanDerWaalsContact O-CE1 3.28Å; L574-Y579 WeakPolarHBondContact O-CE1 3.36Å; L574-D583 HydrophobicContact CD2-CB 4.06Å; L574-L584 HydrophobicContact CD1-CD2 4.38Å
575	K	78.3	Confident	88.4	Confident	54 Å²	54	68.9 Å²	68.9	24%	0.235	35%	0.348	C	S	.	.	H	α-helix	trans	-91.8	-22.8	169.6	-67.4	-55.2	-168.4	83.5	0	113.3	Q533 S534 L536 F568 P572 E573	Q533-K575 PolarHBondContact O-NZ 3.26Å; Q533-K575 VanDerWaalsContact O-NZ 3.08Å; S534-K575 WeakPolarHBondContact O-CE 3.46Å; S534-K575 PolarHBondContact O-NZ 3.46Å; L536-K575 PolarHBondContact O-NZ 3.19Å; F568-K575 HydrophobicContact CB-CD 4.42Å; F568-K575 HydrophobicContact CB-CG 4.23Å; F568-K575 HydrophobicContact CD1-CD 3.61Å; F568-K575 HydrophobicContact CD1-CG 3.96Å; F568-K575 HydrophobicContact CE1-CD 4.14Å; F568-K575 HydrophobicContact CG-CD 4.09Å; F568-K575 HydrophobicContact CG-CG 4.37Å; P572-K575 PolarHBondContact O-N 3.35Å; E573-K575 PolarHBondContact O-N 3.13Å
576	E	78.2	Confident	88.3	Confident	163 Å²	163	73.9 Å²	73.9	76%	0.762	36%	0.359	S	S	*	.	H	α-helix	trans	-92	-19.2	-176.7	-58.7	-176.6	164.5	0	0	112.8	E573	E573-E576 PolarHBondContact O-N 3.18Å; E573-E576 VanDerWaalsContact O-N 3.12Å
577	K	77.4	Confident	88.4	Confident	119 Å²	119	73.9 Å²	73.9	52%	0.517	36%	0.359	S	S	.	.	S	Bend	trans	-116.2	151.9	-177	-61.4	172	-175.2	175.6	0	111	E573 Y579	E573-K577 HydrophobicContact CB-CD 4.25Å; E573-K577 WeakPolarHBondContact O-CB 3.29Å; E573-K577 WeakPolarHBondContact O-CG 3.36Å; E573-K577 PolarHBondContact O-N 2.85Å; E573-K577 IonicContact OE1-NZ 3.93Å; E573-K577 IonicContact OE2-NZ 2.6Å; E573-K577 PolarHBondContact OE2-NZ 2.85Å; K577-Y579 PolarHBondContact O-N 3.23Å
578	E	79.4	Confident	88.4	Confident	194 Å²	194	76.8 Å²	76.8	91%	0.907	38%	0.378	S	S	*	.			trans	-72.3	75.7	166.1	-67.3	-168.8	160.1	0	0	110.1
579	Y	89.9	Confident	88.5	Confident	10 Å²	10	82.7 Å²	82.7	4%	0.039	41%	0.409	C	S	.	.			trans	-65.3	154.4	179.5	70.1	-80.3	0	0	0	112.5	P538 F552 F568 L574 K577 L584 L605 P607	P538-Y579 HydrophobicContact CG-CE1 4.47Å; F552-Y579 WeakPolarHBondContact CE2-OH 3.27Å; F568-Y579 AromaticContact CE1-CE1 3.98Å; F568-Y579 HydrophobicContact CE1-CE1 3.98Å; F568-Y579 HydrophobicContact CE1-CE2 4.32Å; F568-Y579 AromaticContact CE1-CZ 3.79Å; F568-Y579 HydrophobicContact CZ-CE2 4.36Å; F568-Y579 AromaticContact CZ-CZ 3.91Å; L574-Y579 HydrophobicContact CB-CD1 4.41Å; L574-Y579 HydrophobicContact CB-CG 4.41Å; L574-Y579 HydrophobicContact CD2-CD2 4.4Å; L574-Y579 HydrophobicContact CD2-CG 4.05Å; L574-Y579 WeakPolarHBondContact O-CD1 3.35Å; L574-Y579 VanDerWaalsContact O-CE1 3.28Å; L574-Y579 WeakPolarHBondContact O-CE1 3.36Å; K577-Y579 PolarHBondContact O-N 3.23Å; Y579-L584 HydrophobicContact CD2-CD2 4.23Å; Y579-L584 HydrophobicContact CD2-CG 4.35Å; Y579-L584 HydrophobicContact CE2-CD2 3.93Å; Y579-L584 HydrophobicContact CE2-CG 4.28Å; Y579-L605 VanDerWaalsContact CE2-O 3.3Å; Y579-L605 WeakPolarHBondContact CE2-O 3.36Å; Y579-L605 PolarHBondContact OH-O 3.42Å; Y579-P607 HydrophobicContact CD1-CB 4.38Å; Y579-P607 HydrophobicContact CD1-CG 4.46Å; Y579-P607 HydrophobicContact CE1-CB 3.77Å; Y579-P607 HydrophobicContact CE1-CG 4.17Å; Y579-P607 HydrophobicContact CE2-CG 4.4Å; Y579-P607 WeakPolarHBondContact O-CG 3.44Å
580	T	87.9	Confident	88.8	Confident	67 Å²	67	82.8 Å²	82.8	41%	0.411	40%	0.402	S	S	.	.			trans	-107.3	168.1	176.7	72.1	0	0	0	0	111	T582 D583	T580-T582 PolarHBondContact O-N 2.97Å; T580-T582 PolarHBondContact OG1-OG1 2.81Å; T580-D583 WeakPolarHBondContact CA-OD2 2.96Å; T580-D583 WeakPolarHBondContact CB-OD2 3.28Å; T580-D583 PolarHBondContact N-OD2 2.87Å; T580-D583 PolarHBondContact O-N 3.35Å; T580-D583 PolarHBondContact OG1-OD1 3.32Å; T580-D583 PolarHBondContact OG1-OD2 2.94Å
581	R	84.5	Confident	89.1	Confident	100 Å²	100	78.9 Å²	78.9	38%	0.377	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.8	179.2	-57.6	-173.8	-158	173.6	10.9	113.6	S602 N606 E611	R581-S602 WeakPolarHBondContact CD-O 3.42Å; R581-N606 PolarHBondContact NE-ND2 2.78Å; R581-N606 PolarHBondContact NH2-ND2 2.92Å; R581-E611 IonicContact NH2-OE2 2.98Å; R581-E611 PolarHBondContact NH2-OE2 3.04Å
582	T	85.6	Confident	89.3	Confident	92 Å²	92	80 Å²	80	56%	0.564	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-15.6	176.8	34.9	0	0	0	0	114.3	T580	T580-T582 PolarHBondContact O-N 2.97Å; T580-T582 PolarHBondContact OG1-OG1 2.81Å
583	D	91.7	Very high	89.8	Confident	84 Å²	84	77.3 Å²	77.3	45%	0.449	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-8.7	-177	-48.3	-37.5	0	0	0	112.1	L574 T580	L574-D583 HydrophobicContact CD2-CB 4.06Å; T580-D583 WeakPolarHBondContact CA-OD2 2.96Å; T580-D583 WeakPolarHBondContact CB-OD2 3.28Å; T580-D583 PolarHBondContact N-OD2 2.87Å; T580-D583 PolarHBondContact O-N 3.35Å; T580-D583 PolarHBondContact OG1-OD1 3.32Å; T580-D583 PolarHBondContact OG1-OD2 2.94Å
584	L	93.7	Very high	90.2	Very high	5 Å²	5	71.9 Å²	71.9	3%	0.026	35%	0.352	C	S	.	.	S	Bend	trans	-68.4	143.2	170.6	-68.7	168	0	0	0	110.8	P567 F568 L574 Y579 L605	P567-L584 HydrophobicContact CB-CD2 4.31Å; F568-L584 HydrophobicContact CZ-CD2 4.37Å; L574-L584 HydrophobicContact CD1-CD2 4.38Å; Y579-L584 HydrophobicContact CD2-CD2 4.23Å; Y579-L584 HydrophobicContact CD2-CG 4.35Å; Y579-L584 HydrophobicContact CE2-CD2 3.93Å; Y579-L584 HydrophobicContact CE2-CG 4.28Å; L584-L605 HydrophobicContact CD1-CB 3.83Å; L584-L605 HydrophobicContact CD1-CD1 4.42Å; L584-L605 HydrophobicContact CD2-CB 4.26Å; L584-L605 HydrophobicContact CD2-CD1 4Å
585	P	94.8	Very high	90.6	Very high	22 Å²	22	73.9 Å²	73.9	14%	0.143	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-54.9	144.6	177.1	-25.1	34.3	0	0	0	112.6	Y559 P567 E570 Q598	Y559-P585 HydrophobicContact CE1-CB 4.1Å; Y559-P585 WeakPolarHBondContact CE1-O 3.42Å; Y559-P585 PolarHBondContact OH-O 2.96Å; P567-P585 HydrophobicContact CB-CG 4.1Å; E570-P585 WeakPolarHBondContact OE2-CB 3.44Å; E570-P585 WeakPolarHBondContact OE2-CG 3.48Å; P585-Q598 PolarHBondContact O-OE1 3.31Å
586	R	95.4	Very high	91.5	Very high	168 Å²	168	71.3 Å²	71.3	63%	0.634	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-85.3	118	-177.9	-67.3	-64	-175.3	142.4	1.5	111.4	P588	R586-P588 WeakPolarHBondContact O-CD 3.42Å
587	I	97.3	Very high	92.4	Very high	6 Å²	6	63.6 Å²	63.6	3%	0.031	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-64.7	124.9	171	-56.7	-173.5	0	0	0	108.7	I558 Y559 L562 L564 L589 Q598 A601	I558-I587 HydrophobicContact CG2-CD1 4.12Å; Y559-I587 HydrophobicContact CD1-CG1 4.16Å; Y559-I587 HydrophobicContact CE1-CD1 4.21Å; Y559-I587 HydrophobicContact CE1-CG1 3.65Å; Y559-I587 HydrophobicContact CE2-CD1 4.45Å; L562-I587 HydrophobicContact CD1-CD1 3.95Å; L562-I587 HydrophobicContact CD1-CG2 3.73Å; L564-I587 HydrophobicContact CD1-CB 4.19Å; L564-I587 HydrophobicContact CD1-CG1 3.9Å; L564-I587 HydrophobicContact CD1-CG2 4.15Å; I587-L589 PolarHBondContact O-N 3.2Å; I587-Q598 HydrophobicContact CB-CB 4.3Å; I587-Q598 HydrophobicContact CD1-CB 4.25Å; I587-Q598 HydrophobicContact CG1-CB 4.42Å; I587-A601 HydrophobicContact CD1-CB 4.48Å
588	P	96.9	Very high	93.3	Very high	61 Å²	61	58.3 Å²	58.3	40%	0.396	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-58.8	135	177.9	-26.7	36.4	0	0	0	112	L564 R586 R590 S594	L564-P588 HydrophobicContact CD2-CG 4.43Å; R586-P588 WeakPolarHBondContact O-CD 3.42Å; P588-R590 HydrophobicContact CB-CG 3.87Å; P588-R590 PolarHBondContact O-N 2.8Å; P588-R590 VanDerWaalsContact O-N 3.13Å; P588-S594 WeakPolarHBondContact O-CB 3.5Å
589	L	96.3	Very high	94.1	Very high	129 Å²	129	50.3 Å²	50.3	68%	0.675	25%	0.251	S	S	*	.			trans	-80.9	94.4	178	-61.3	-177.6	0	0	0	110	I587 W595	I587-L589 PolarHBondContact O-N 3.2Å; L589-W595 HydrophobicContact CD2-CB 3.86Å
590	R	96.1	Very high	94.5	Very high	88 Å²	88	49.9 Å²	49.9	33%	0.332	25%	0.25	S	C	.	.			trans	-116.2	-18.9	-172.3	-56.4	-173.3	69.4	-132.2	-16.3	114	H441 G442 P445 P588 S594	H441-R590 PolarHBondContact CD2-NH1 3.32Å; H441-R590 VanDerWaalsContact CG-NH1 3.27Å; H441-R590 PolarHBondContact ND1-NH1 3.4Å; H441-R590 PolarHBondContact O-NH1 3.11Å; H441-R590 PolarHBondContact O-NH2 3.31Å; G442-R590 PolarHBondContact O-NH2 3.23Å; P445-R590 HydrophobicContact CB-CB 3.88Å; P445-R590 HydrophobicContact CG-CB 4.33Å; P445-R590 VanDerWaalsContact CG-O 3.27Å; P445-R590 WeakPolarHBondContact CG-O 3.35Å; P588-R590 HydrophobicContact CB-CG 3.87Å; P588-R590 PolarHBondContact O-N 2.8Å; P588-R590 VanDerWaalsContact O-N 3.13Å; R590-S594 PolarHBondContact N-OG 1.77Å
591	S	96.2	Very high	94.9	Very high	18 Å²	18	46.7 Å²	46.7	13%	0.126	23%	0.23	C	C	.	.	S	Bend	trans	-146.4	172.3	-179.3	86.7	0	0	0	0	111.6	D446 E449 Y593 S594	D446-S591 WeakPolarHBondContact OD1-CA 3.48Å; D446-S591 VanDerWaalsContact OD1-CB 3.31Å; D446-S591 WeakPolarHBondContact OD1-CB 3.27Å; E449-S591 WeakPolarHBondContact OE2-CB 3.36Å; E449-S591 PolarHBondContact OE2-OG 3.24Å; S591-Y593 PolarHBondContact O-N 2.92Å; S591-Y593 VanDerWaalsContact O-N 3.12Å; S591-Y593 WeakPolarHBondContact OG-CB 3.48Å; S591-Y593 WeakPolarHBondContact OG-CD2 3.18Å; S591-Y593 PolarHBondContact OG-N 3.5Å; S591-S594 PolarHBondContact N-OG 3.38Å; S591-S594 PolarHBondContact O-N 3.29Å; S591-S594 PolarHBondContact O-OG 2.94Å; S591-S594 PolarHBondContact OG-N 3.05Å; S591-S594 PolarHBondContact OG-OG 2.96Å
592	P	94.8	Very high	95.5	Very high	95 Å²	95	42.3 Å²	42.3	62%	0.617	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14	168.9	-23.7	35.2	0	0	0	114.9	D446	D446-P592 VanDerWaalsContact CG-CD 3.44Å; D446-P592 WeakPolarHBondContact OD1-CD 3.49Å; D446-P592 WeakPolarHBondContact OD2-CD 3.45Å; D446-P592 WeakPolarHBondContact OD2-CG 3.49Å
593	Y	97.1	Very high	96	Very high	20 Å²	20	38.5 Å²	38.5	8%	0.078	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-28	-179.3	-51.6	-84	0	0	0	112.7	D446 E449 R450 S591 W595 G596 L597 L625	D446-Y593 WeakPolarHBondContact O-CE2 3.37Å; E449-Y593 HydrophobicContact CB-CD2 4.09Å; E449-Y593 HydrophobicContact CB-CG 4.38Å; R450-Y593 HydrophobicContact CB-CE1 4.38Å; R450-Y593 HydrophobicContact CB-CE2 3.79Å; R450-Y593 HydrophobicContact CG-CE1 4.46Å; R450-Y593 PolarHBondContact NH1-OH 3.36Å; S591-Y593 PolarHBondContact O-N 2.92Å; S591-Y593 VanDerWaalsContact O-N 3.12Å; S591-Y593 WeakPolarHBondContact OG-CB 3.48Å; S591-Y593 WeakPolarHBondContact OG-CD2 3.18Å; S591-Y593 PolarHBondContact OG-N 3.5Å; Y593-W595 VanDerWaalsContact C-N 3.35Å; Y593-W595 PolarHBondContact O-N 3.43Å; Y593-G596 WeakPolarHBondContact O-CA 3.33Å; Y593-G596 PolarHBondContact O-N 3.32Å; Y593-L597 PolarHBondContact O-N 3.34Å; Y593-L625 HydrophobicContact CD1-CB 4.37Å; Y593-L625 WeakPolarHBondContact CE1-O 3.45Å
594	S	96.9	Very high	96.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-42.3	-167.8	-36.2	0	0	0	0	113.2	E449 P588 R590 S591 L597 Q598	E449-S594 PolarHBondContact OE1-OG 2.88Å; E449-S594 WeakPolarHBondContact OE2-CA 3.21Å; E449-S594 WeakPolarHBondContact OE2-CB 3.45Å; E449-S594 PolarHBondContact OE2-N 2.75Å; E449-S594 PolarHBondContact OE2-OG 2.91Å; P588-S594 WeakPolarHBondContact O-CB 3.5Å; R590-S594 PolarHBondContact N-OG 1.77Å; S591-S594 PolarHBondContact N-OG 3.38Å; S591-S594 PolarHBondContact O-N 3.29Å; S591-S594 PolarHBondContact O-OG 2.94Å; S591-S594 PolarHBondContact OG-N 3.05Å; S591-S594 PolarHBondContact OG-OG 2.96Å; S594-L597 PolarHBondContact O-N 2.93Å; S594-Q598 PolarHBondContact O-N 3.43Å
595	W	94.8	Very high	96.3	Very high	56 Å²	56	34.2 Å²	34.2	21%	0.212	17%	0.169	C	C	.	.	H	α-helix	trans	-66.2	-40	177	-177.1	84.2	0	0	0	112.2	L589 Y593 L597 Q598 Q599 L702 Y704 R705	L589-W595 HydrophobicContact CD2-CB 3.86Å; Y593-W595 VanDerWaalsContact C-N 3.35Å; Y593-W595 PolarHBondContact O-N 3.43Å; W595-L597 VanDerWaalsContact C-N 3.33Å; W595-L597 PolarHBondContact O-N 3.16Å; W595-Q598 WeakPolarHBondContact O-CB 3.24Å; W595-Q598 PolarHBondContact O-N 3.43Å; W595-Q599 HydrophobicContact CD2-CG 4.08Å; W595-Q599 HydrophobicContact CE3-CG 4.28Å; W595-Q599 HydrophobicContact CH2-CG 3.7Å; W595-Q599 HydrophobicContact CZ2-CG 3.44Å; W595-Q599 VanDerWaalsContact CZ2-CG 3.44Å; W595-Q599 HydrophobicContact CZ3-CG 4.11Å; W595-Q599 WeakPolarHBondContact O-CG 3.48Å; W595-Q599 PolarHBondContact O-N 2.99Å; W595-L702 WeakPolarHBondContact CH2-O 3.45Å; W595-L702 HydrophobicContact CZ3-CB 4.36Å; W595-L702 HydrophobicContact CZ3-CD2 4.16Å; W595-L702 WeakPolarHBondContact CZ3-O 3.37Å; W595-Y704 WeakPolarHBondContact CZ2-O 3.25Å; W595-R705 HydrophobicContact CH2-CG 4.2Å; W595-R705 HydrophobicContact CZ2-CB 4.4Å; W595-R705 HydrophobicContact CZ2-CG 3.44Å; W595-R705 VanDerWaalsContact CZ2-CG 3.44Å
596	G	95.8	Very high	96.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-37.6	175.9	0	0	0	0	0	112.7	Y593 L600	Y593-G596 WeakPolarHBondContact O-CA 3.33Å; Y593-G596 PolarHBondContact O-N 3.32Å; G596-L600 VanDerWaalsContact O-CB 3.27Å; G596-L600 WeakPolarHBondContact O-CB 3.3Å; G596-L600 PolarHBondContact O-N 3.45Å
597	L	97.9	Very high	95.9	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.9	-37.3	174.4	-69.9	172.3	0	0	0	111.9	E449 V452 L456 I558 L562 Y593 S594 W595 L600 A601 L622	E449-L597 HydrophobicContact CB-CD1 4.5Å; V452-L597 HydrophobicContact CG1-CD1 4.42Å; L456-L597 HydrophobicContact CD1-CD2 3.88Å; I558-L597 HydrophobicContact CG2-CB 4.11Å; I558-L597 HydrophobicContact CG2-CD2 4.43Å; L562-L597 HydrophobicContact CD1-CB 4.16Å; L562-L597 HydrophobicContact CD1-CD1 4.01Å; L562-L597 HydrophobicContact CD2-CD1 4.09Å; Y593-L597 PolarHBondContact O-N 3.34Å; S594-L597 PolarHBondContact O-N 2.93Å; W595-L597 VanDerWaalsContact C-N 3.33Å; W595-L597 PolarHBondContact O-N 3.16Å; L597-L600 HydrophobicContact CD2-CD2 4.36Å; L597-L600 PolarHBondContact O-N 3.42Å; L597-A601 WeakPolarHBondContact O-CB 3.43Å; L597-A601 PolarHBondContact O-N 2.58Å; L597-L622 HydrophobicContact CD2-CD2 4.18Å
598	Q	96.9	Very high	95.5	Very high	9 Å²	9	29.6 Å²	29.6	4%	0.042	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-52.7	170.7	175.9	68.8	84.4	0	0	111.7	Y559 P585 I587 S594 W595 L600 A601 S602	Y559-Q598 PolarHBondContact OH-NE2 2.71Å; P585-Q598 PolarHBondContact O-OE1 3.31Å; I587-Q598 HydrophobicContact CB-CB 4.3Å; I587-Q598 HydrophobicContact CD1-CB 4.25Å; I587-Q598 HydrophobicContact CG1-CB 4.42Å; S594-Q598 PolarHBondContact O-N 3.43Å; W595-Q598 WeakPolarHBondContact O-CB 3.24Å; W595-Q598 PolarHBondContact O-N 3.43Å; Q598-L600 VanDerWaalsContact C-N 3.3Å; Q598-L600 PolarHBondContact O-N 3.41Å; Q598-A601 PolarHBondContact O-N 2.92Å; Q598-S602 PolarHBondContact NE2-OG 3.46Å; Q598-S602 VanDerWaalsContact NE2-OG 3.07Å; Q598-S602 WeakPolarHBondContact O-CB 3.29Å; Q598-S602 PolarHBondContact O-N 3.26Å; Q598-S602 PolarHBondContact O-OG 2.98Å
599	Q	95.6	Very high	95.1	Very high	25 Å²	25	28.3 Å²	28.3	12%	0.117	15%	0.149	C	C	.	.	H	α-helix	trans	-67.1	-34.2	-178	-59.8	-50.6	77.9	0	0	111.8	W595 C603 Y704	W595-Q599 HydrophobicContact CD2-CG 4.08Å; W595-Q599 HydrophobicContact CE3-CG 4.28Å; W595-Q599 HydrophobicContact CH2-CG 3.7Å; W595-Q599 HydrophobicContact CZ2-CG 3.44Å; W595-Q599 VanDerWaalsContact CZ2-CG 3.44Å; W595-Q599 HydrophobicContact CZ3-CG 4.11Å; W595-Q599 WeakPolarHBondContact O-CG 3.48Å; W595-Q599 PolarHBondContact O-N 2.99Å; Q599-C603 WeakPolarHBondContact O-CB 3.39Å; Q599-C603 PolarHBondContact O-N 3.32Å; Q599-Y704 PolarHBondContact NE2-O 3.19Å
600	L	97.7	Very high	94.7	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-50.7	171.7	178.7	60.3	0	0	0	111.4	I558 G596 L597 Q598 C603 L604 I613 A618 I621 L622	I558-L600 HydrophobicContact CD1-CB 4.34Å; I558-L600 HydrophobicContact CD1-CD2 3.77Å; I558-L600 HydrophobicContact CD1-CG 3.71Å; G596-L600 VanDerWaalsContact O-CB 3.27Å; G596-L600 WeakPolarHBondContact O-CB 3.3Å; G596-L600 PolarHBondContact O-N 3.45Å; L597-L600 HydrophobicContact CD2-CD2 4.36Å; L597-L600 PolarHBondContact O-N 3.42Å; Q598-L600 VanDerWaalsContact C-N 3.3Å; Q598-L600 PolarHBondContact O-N 3.41Å; L600-C603 PolarHBondContact O-N 2.78Å; L600-C603 VanDerWaalsContact O-N 3.16Å; L600-L604 HydrophobicContact CD1-CD1 3.93Å; L600-L604 HydrophobicContact CD1-CG 4.25Å; L600-L604 HydrophobicContact CG-CD1 3.97Å; L600-L604 WeakPolarHBondContact O-CG 3.41Å; L600-L604 PolarHBondContact O-N 2.69Å; L600-I613 HydrophobicContact CD1-CD1 3.87Å; L600-A618 HydrophobicContact CD1-CB 3.73Å; L600-I621 HydrophobicContact CB-CG2 4.13Å; L600-I621 HydrophobicContact CD1-CB 4.17Å; L600-I621 HydrophobicContact CD1-CD1 3.79Å; L600-I621 HydrophobicContact CD1-CG2 4.04Å; L600-I621 HydrophobicContact CD2-CG2 4.35Å; L600-I621 HydrophobicContact CG-CG2 4.41Å; L600-L622 HydrophobicContact CD2-CD1 4.15Å; L600-L622 HydrophobicContact CD2-CD2 3.69Å; L600-L622 HydrophobicContact CD2-CG 3.75Å
601	A	97.8	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-45.4	179	0	0	0	0	0	111.5	I558 Y559 I587 L597 Q598 C603 L604 L605	I558-A601 HydrophobicContact CB-CB 4.17Å; I558-A601 HydrophobicContact CD1-CB 4.02Å; I558-A601 HydrophobicContact CG2-CB 4Å; Y559-A601 HydrophobicContact CD2-CB 4.3Å; Y559-A601 HydrophobicContact CE2-CB 3.72Å; I587-A601 HydrophobicContact CD1-CB 4.48Å; L597-A601 WeakPolarHBondContact O-CB 3.43Å; L597-A601 PolarHBondContact O-N 2.58Å; Q598-A601 PolarHBondContact O-N 2.92Å; A601-C603 PolarHBondContact O-N 3.44Å; A601-L604 PolarHBondContact O-N 3.36Å; A601-L604 VanDerWaalsContact O-N 3.14Å; A601-L605 VanDerWaalsContact O-CB 3.32Å; A601-L605 WeakPolarHBondContact O-CB 3.45Å; A601-L605 WeakPolarHBondContact O-CG 3.46Å; A601-L605 PolarHBondContact O-N 2.89Å
602	S	95.7	Very high	94.3	Very high	8 Å²	8	26.9 Å²	26.9	6%	0.056	15%	0.152	C	C	.	.	H	α-helix	trans	-64.9	-20	175.8	-62.8	0	0	0	0	114.1	R581 Q598	R581-S602 WeakPolarHBondContact CD-O 3.42Å; Q598-S602 PolarHBondContact NE2-OG 3.46Å; Q598-S602 VanDerWaalsContact NE2-OG 3.07Å; Q598-S602 WeakPolarHBondContact O-CB 3.29Å; Q598-S602 PolarHBondContact O-N 3.26Å; Q598-S602 PolarHBondContact O-OG 2.98Å
603	C	95.8	Very high	94.3	Very high	12 Å²	12	23 Å²	23	8%	0.081	13%	0.126	C	C	.	.	H	α-helix	trans	-88.8	-27.8	172.4	-86.5	0	0	0	0	113.7	Q599 L600 A601 I613	Q599-C603 WeakPolarHBondContact O-CB 3.39Å; Q599-C603 PolarHBondContact O-N 3.32Å; L600-C603 PolarHBondContact O-N 2.78Å; L600-C603 VanDerWaalsContact O-N 3.16Å; A601-C603 PolarHBondContact O-N 3.44Å; C603-I613 HydrophobicContact CB-CD1 3.92Å; C603-I613 HydrophobicContact CB-CG1 4.08Å; C603-I613 HydrophobicContact CB-CG2 3.83Å; C603-I613 PolarHBondContact O-N 3.01Å
604	L	96.9	Very high	94.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-82	-33	173.5	-72.1	173.1	0	0	0	112.3	E551 T554 I558 L600 A601 N606 R612 I613 A618	E551-L604 HydrophobicContact CB-CD2 3.88Å; E551-L604 HydrophobicContact CG-CD2 4.28Å; E551-L604 WeakPolarHBondContact O-CB 3.45Å; T554-L604 HydrophobicContact CG2-CD1 4Å; I558-L604 HydrophobicContact CD1-CD1 3.83Å; L600-L604 HydrophobicContact CD1-CD1 3.93Å; L600-L604 HydrophobicContact CD1-CG 4.25Å; L600-L604 HydrophobicContact CG-CD1 3.97Å; L600-L604 WeakPolarHBondContact O-CG 3.41Å; L600-L604 PolarHBondContact O-N 2.69Å; A601-L604 PolarHBondContact O-N 3.36Å; A601-L604 VanDerWaalsContact O-N 3.14Å; L604-N606 VanDerWaalsContact C-N 3.29Å; L604-N606 PolarHBondContact O-N 2.98Å; L604-R612 WeakPolarHBondContact O-CD 3.45Å; L604-R612 WeakPolarHBondContact O-CG 3.3Å; L604-R612 PolarHBondContact O-NE 2.87Å; L604-I613 HydrophobicContact CD2-CD1 4.11Å; L604-I613 HydrophobicContact CD2-CG1 3.74Å; L604-I613 HydrophobicContact CG-CD1 4.24Å; L604-I613 HydrophobicContact CG-CG1 4.2Å; L604-A618 HydrophobicContact CD1-CB 4.46Å; L604-A618 HydrophobicContact CD2-CB 4.21Å
605	L	95.4	Very high	94.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-92.1	31.5	174	-59.5	-176.1	0	0	0	112.3	F552 I556 Y559 P567 F568 Y579 L584 A601	F552-L605 HydrophobicContact CD2-CD2 3.77Å; F552-L605 HydrophobicContact CE2-CD2 3.7Å; F552-L605 HydrophobicContact CG-CD2 4.24Å; F552-L605 HydrophobicContact CZ-CD2 4.13Å; F552-L605 VanDerWaalsContact O-CD2 3.25Å; F552-L605 WeakPolarHBondContact O-CD2 3.38Å; I556-L605 HydrophobicContact CG1-CD2 4.01Å; Y559-L605 HydrophobicContact CD2-CD1 4.25Å; Y559-L605 HydrophobicContact CE2-CD1 3.86Å; P567-L605 HydrophobicContact CG-CD1 4.13Å; F568-L605 HydrophobicContact CE2-CD1 4.18Å; F568-L605 HydrophobicContact CE2-CD2 3.98Å; F568-L605 HydrophobicContact CZ-CD1 4.48Å; F568-L605 HydrophobicContact CZ-CD2 4.38Å; Y579-L605 VanDerWaalsContact CE2-O 3.3Å; Y579-L605 WeakPolarHBondContact CE2-O 3.36Å; Y579-L605 PolarHBondContact OH-O 3.42Å; L584-L605 HydrophobicContact CD1-CB 3.83Å; L584-L605 HydrophobicContact CD1-CD1 4.42Å; L584-L605 HydrophobicContact CD2-CB 4.26Å; L584-L605 HydrophobicContact CD2-CD1 4Å; A601-L605 VanDerWaalsContact O-CB 3.32Å; A601-L605 WeakPolarHBondContact O-CB 3.45Å; A601-L605 WeakPolarHBondContact O-CG 3.46Å; A601-L605 PolarHBondContact O-N 2.89Å
606	N	92.8	Very high	94.4	Very high	5 Å²	5	25.6 Å²	25.6	3%	0.027	15%	0.149	C	C	.	.			trans	-74.2	125.6	167.5	-170	-31.5	0	0	0	108.7	R581 L604 N608 E611 R612	R581-N606 PolarHBondContact NE-ND2 2.78Å; R581-N606 PolarHBondContact NH2-ND2 2.92Å; L604-N606 VanDerWaalsContact C-N 3.29Å; L604-N606 PolarHBondContact O-N 2.98Å; N606-N608 VanDerWaalsContact C-N 3.29Å; N606-N608 PolarHBondContact O-N 3.27Å; N606-N608 WeakPolarHBondContact OD1-CB 3.39Å; N606-N608 PolarHBondContact OD1-N 3.1Å; N606-E611 WeakPolarHBondContact ND2-CB 3.5Å; N606-E611 PolarHBondContact ND2-OE2 3.22Å; N606-R612 HydrophobicContact CB-CB 4.14Å; N606-R612 HydrophobicContact CB-CG 4.48Å; N606-R612 PolarHBondContact O-NE 2.84Å; N606-R612 PolarHBondContact O-NH2 3.21Å; N606-R612 VanDerWaalsContact O-NH2 3.09Å
607	P	89.6	Confident	94.4	Very high	33 Å²	33	26.9 Å²	26.9	21%	0.214	16%	0.155	C	C	.	.	S	Bend	trans	-62	-37.3	177.4	24.6	-34.3	0	0	0	112	P538 Y579 P609 R612	P538-P607 HydrophobicContact CG-CB 4.27Å; Y579-P607 HydrophobicContact CD1-CB 4.38Å; Y579-P607 HydrophobicContact CD1-CG 4.46Å; Y579-P607 HydrophobicContact CE1-CB 3.77Å; Y579-P607 HydrophobicContact CE1-CG 4.17Å; Y579-P607 HydrophobicContact CE2-CG 4.4Å; Y579-P607 WeakPolarHBondContact O-CG 3.44Å; P607-P609 WeakPolarHBondContact O-CD 3.47Å; P607-R612 PolarHBondContact O-NH2 3.32Å
608	N	88.3	Confident	94.4	Very high	60 Å²	60	26.9 Å²	26.9	32%	0.321	16%	0.155	S	C	.	.	S	Bend	trans	-71.2	111.1	176.9	-178.4	-4.2	0	0	0	110.3	N606 S610 E611 R612	N606-N608 VanDerWaalsContact C-N 3.29Å; N606-N608 PolarHBondContact O-N 3.27Å; N606-N608 WeakPolarHBondContact OD1-CB 3.39Å; N606-N608 PolarHBondContact OD1-N 3.1Å; N608-S610 PolarHBondContact O-N 3.23Å; N608-S610 VanDerWaalsContact O-N 3.15Å; N608-S610 VanDerWaalsContact OD1-CB 3.25Å; N608-S610 WeakPolarHBondContact OD1-CB 3.28Å; N608-S610 PolarHBondContact OD1-N 3.3Å; N608-S610 PolarHBondContact OD1-OG 3.37Å; N608-E611 HydrophobicContact CB-CB 4.31Å; N608-E611 HydrophobicContact CB-CG 4.46Å; N608-E611 PolarHBondContact ND2-OE1 3.5Å; N608-E611 PolarHBondContact O-N 2.98Å; N608-E611 VanDerWaalsContact O-N 3.16Å; N608-R612 PolarHBondContact O-N 3.28Å
609	P	88.1	Confident	94.5	Very high	34 Å²	34	27.9 Å²	27.9	22%	0.221	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.6	-177.3	-13.9	29.3	0	0	0	112.3	E539 K548 P607	E539-P609 HydrophobicContact CB-CG 3.51Å; E539-P609 VanDerWaalsContact CD-CG 3.46Å; E539-P609 HydrophobicContact CG-CB 4.16Å; E539-P609 HydrophobicContact CG-CG 3.5Å; E539-P609 VanDerWaalsContact CG-CG 3.5Å; K548-P609 VanDerWaalsContact CD-O 3.29Å; K548-P609 WeakPolarHBondContact CD-O 3.13Å; K548-P609 VanDerWaalsContact CE-O 3.23Å; K548-P609 WeakPolarHBondContact CE-O 3.35Å; K548-P609 PolarHBondContact NZ-O 3.41Å; P607-P609 WeakPolarHBondContact O-CD 3.47Å
610	S	88.9	Confident	94.6	Very high	101 Å²	101	27.3 Å²	27.3	71%	0.706	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-41.8	175.5	-51.2	0	0	0	0	111	K548 N608	K548-S610 PolarHBondContact NZ-O 2.85Å; N608-S610 PolarHBondContact O-N 3.23Å; N608-S610 VanDerWaalsContact O-N 3.15Å; N608-S610 VanDerWaalsContact OD1-CB 3.25Å; N608-S610 WeakPolarHBondContact OD1-CB 3.28Å; N608-S610 PolarHBondContact OD1-N 3.3Å; N608-S610 PolarHBondContact OD1-OG 3.37Å
611	E	90.6	Very high	94.6	Very high	102 Å²	102	27.3 Å²	27.3	48%	0.477	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-24.8	-179.5	-73.4	175.2	-131.9	0	0	114.9	R581 N606 N608 I613	R581-E611 IonicContact NH2-OE2 2.98Å; R581-E611 PolarHBondContact NH2-OE2 3.04Å; N606-E611 WeakPolarHBondContact ND2-CB 3.5Å; N606-E611 PolarHBondContact ND2-OE2 3.22Å; N608-E611 HydrophobicContact CB-CB 4.31Å; N608-E611 HydrophobicContact CB-CG 4.46Å; N608-E611 PolarHBondContact ND2-OE1 3.5Å; N608-E611 PolarHBondContact O-N 2.98Å; N608-E611 VanDerWaalsContact O-N 3.16Å; E611-I613 PolarHBondContact O-N 2.77Å
612	R	93.2	Very high	94.6	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.008	16%	0.16	C	C	.	.	S	Bend	trans	-51.9	129.5	173.8	-166.5	-177.8	-57.9	146.5	11.5	109.3	E539 K548 L604 N606 P607 N608	E539-R612 IonicContact OE1-CZ 3.8Å; E539-R612 IonicContact OE1-NH1 2.84Å; E539-R612 PolarHBondContact OE1-NH1 3.01Å; E539-R612 IonicContact OE1-NH2 3.73Å; E539-R612 IonicContact OE2-CZ 3.84Å; E539-R612 IonicContact OE2-NH1 3.85Å; E539-R612 PolarHBondContact OE2-NH1 3.08Å; E539-R612 IonicContact OE2-NH2 2.71Å; E539-R612 PolarHBondContact OE2-NH2 3.26Å; K548-R612 HydrophobicContact CD-CB 4.13Å; K548-R612 PolarHBondContact NZ-O 3.01Å; K548-R612 PolarHBondContact O-NH1 2.98Å; L604-R612 WeakPolarHBondContact O-CD 3.45Å; L604-R612 WeakPolarHBondContact O-CG 3.3Å; L604-R612 PolarHBondContact O-NE 2.87Å; N606-R612 HydrophobicContact CB-CB 4.14Å; N606-R612 HydrophobicContact CB-CG 4.48Å; N606-R612 PolarHBondContact O-NE 2.84Å; N606-R612 PolarHBondContact O-NH2 3.21Å; N606-R612 VanDerWaalsContact O-NH2 3.09Å; P607-R612 PolarHBondContact O-NH2 3.32Å; N608-R612 PolarHBondContact O-N 3.28Å
613	I	95	Very high	94.7	Very high	13 Å²	13	28.1 Å²	28.1	7%	0.067	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-65.4	163.3	-176.1	65.1	171.3	0	0	0	111.7	L600 C603 L604 E611 D617 A618 I621	L600-I613 HydrophobicContact CD1-CD1 3.87Å; C603-I613 HydrophobicContact CB-CD1 3.92Å; C603-I613 HydrophobicContact CB-CG1 4.08Å; C603-I613 HydrophobicContact CB-CG2 3.83Å; C603-I613 PolarHBondContact O-N 3.01Å; L604-I613 HydrophobicContact CD2-CD1 4.11Å; L604-I613 HydrophobicContact CD2-CG1 3.74Å; L604-I613 HydrophobicContact CG-CD1 4.24Å; L604-I613 HydrophobicContact CG-CG1 4.2Å; E611-I613 PolarHBondContact O-N 2.77Å; I613-D617 HydrophobicContact CB-CB 4.05Å; I613-D617 HydrophobicContact CD1-CB 4.31Å; I613-A618 HydrophobicContact CD1-CB 4.12Å; I613-I621 HydrophobicContact CD1-CD1 3.73Å
614	L	95.9	Very high	94.8	Very high	82 Å²	82	27.6 Å²	27.6	43%	0.429	16%	0.16	S	C	.	.	P	Polyproline II helix	trans	-82	156.7	172.1	-61.1	171	0	0	0	110.8	S616 D617 A618	L614-S616 WeakPolarHBondContact CB-OG 3.34Å; L614-S616 PolarHBondContact O-N 2.95Å; L614-D617 WeakPolarHBondContact CB-OD2 3.06Å; L614-D617 PolarHBondContact N-OD2 2.86Å; L614-D617 WeakPolarHBondContact O-CB 3.38Å; L614-D617 PolarHBondContact O-N 3.08Å; L614-A618 PolarHBondContact O-N 3.42Å; L614-A618 VanDerWaalsContact O-N 3.08Å
615	I	97.2	Very high	94.8	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-25.2	175.3	-157.7	66.9	0	0	0	113.2	C460 L463 E464 K467 E551 T554 A618 K619	C460-I615 HydrophobicContact CB-CD1 4.24Å; C460-I615 HydrophobicContact CB-CG1 4.03Å; L463-I615 HydrophobicContact CB-CG1 3.86Å; L463-I615 HydrophobicContact CD1-CD1 3.92Å; L463-I615 HydrophobicContact CD1-CG1 4.18Å; E464-I615 HydrophobicContact CB-CG2 4.2Å; K467-I615 HydrophobicContact CG-CG2 4.27Å; E551-I615 HydrophobicContact CG-CB 3.98Å; E551-I615 HydrophobicContact CG-CD1 4.38Å; E551-I615 PolarHBondContact OE1-N 3.06Å; T554-I615 HydrophobicContact CG2-CD1 4.29Å; I615-A618 HydrophobicContact CD1-CB 4.33Å; I615-K619 WeakPolarHBondContact O-CB 3.18Å; I615-K619 PolarHBondContact O-N 3.13Å
616	S	96.6	Very high	94.8	Very high	46 Å²	46	28.3 Å²	28.3	32%	0.322	16%	0.163	S	C	.	.	H	α-helix	trans	-67	-34	170.7	54.3	0	0	0	0	112.9	E464 L614 K619 G620	E464-S616 WeakPolarHBondContact OE1-CB 3.28Å; L614-S616 WeakPolarHBondContact CB-OG 3.34Å; L614-S616 PolarHBondContact O-N 2.95Å; S616-K619 WeakPolarHBondContact O-CB 3.48Å; S616-G620 PolarHBondContact O-N 3.5Å
617	D	97.1	Very high	95	Very high	28 Å²	28	29.2 Å²	29.2	15%	0.15	17%	0.166	C	C	.	.	H	α-helix	trans	-75.1	-40.8	177.5	-49.4	-36.5	0	0	0	109.6	I613 L614 K619 G620 I621 Y697 I698	I613-D617 HydrophobicContact CB-CB 4.05Å; I613-D617 HydrophobicContact CD1-CB 4.31Å; L614-D617 WeakPolarHBondContact CB-OD2 3.06Å; L614-D617 PolarHBondContact N-OD2 2.86Å; L614-D617 WeakPolarHBondContact O-CB 3.38Å; L614-D617 PolarHBondContact O-N 3.08Å; D617-K619 VanDerWaalsContact C-N 3.35Å; D617-K619 PolarHBondContact O-N 3.24Å; D617-G620 CarbonylContact O-C 3.58Å; D617-G620 PolarHBondContact O-N 3.31Å; D617-G620 VanDerWaalsContact O-N 3.15Å; D617-I621 WeakPolarHBondContact O-CG1 3.23Å; D617-I621 PolarHBondContact O-N 2.75Å; D617-Y697 HydrophobicContact CB-CE1 4.43Å; D617-I698 WeakPolarHBondContact O-CD1 3.41Å
618	A	98.3	Very high	95.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58	-45.3	171.2	0	0	0	0	0	112	L600 L604 I613 L614 I615 G620 I621 L622	L600-A618 HydrophobicContact CD1-CB 3.73Å; L604-A618 HydrophobicContact CD1-CB 4.46Å; L604-A618 HydrophobicContact CD2-CB 4.21Å; I613-A618 HydrophobicContact CD1-CB 4.12Å; L614-A618 PolarHBondContact O-N 3.42Å; L614-A618 VanDerWaalsContact O-N 3.08Å; I615-A618 HydrophobicContact CD1-CB 4.33Å; A618-G620 VanDerWaalsContact C-N 3.34Å; A618-G620 PolarHBondContact O-N 2.67Å; A618-I621 PolarHBondContact O-N 3.41Å; A618-L622 WeakPolarHBondContact O-CD1 3.29Å; A618-L622 WeakPolarHBondContact O-CG 3.23Å; A618-L622 PolarHBondContact O-N 3.38Å
619	K	98.4	Very high	95.3	Very high	30 Å²	30	25 Å²	25	13%	0.13	14%	0.143	C	C	.	.	H	α-helix	trans	-55.9	-46.5	171.8	-176.4	170.7	178.8	164.3	0	111.6	L457 C460 S461 E464 I615 S616 D617 L622 Q623	L457-K619 HydrophobicContact CD1-CG 3.76Å; C460-K619 HydrophobicContact CB-CB 3.95Å; S461-K619 VanDerWaalsContact OG-CE 3.23Å; S461-K619 WeakPolarHBondContact OG-CE 3.47Å; S461-K619 PolarHBondContact OG-NZ 3.4Å; E464-K619 VanDerWaalsContact OE2-CD 3.29Å; E464-K619 WeakPolarHBondContact OE2-CD 3.25Å; E464-K619 WeakPolarHBondContact OE2-CE 3.44Å; E464-K619 IonicContact OE2-NZ 3.43Å; E464-K619 PolarHBondContact OE2-NZ 2.76Å; I615-K619 WeakPolarHBondContact O-CB 3.18Å; I615-K619 PolarHBondContact O-N 3.13Å; S616-K619 WeakPolarHBondContact O-CB 3.48Å; D617-K619 VanDerWaalsContact C-N 3.35Å; D617-K619 PolarHBondContact O-N 3.24Å; K619-L622 PolarHBondContact O-N 3.09Å; K619-Q623 VanDerWaalsContact O-CG 3.27Å; K619-Q623 WeakPolarHBondContact O-CG 3.49Å; K619-Q623 PolarHBondContact O-N 3.34Å
620	G	97.6	Very high	95.3	Very high	13 Å²	13	27.7 Å²	27.7	13%	0.134	15%	0.149	C	C	.	.	H	α-helix	trans	-63.6	-40	176.2	0	0	0	0	0	113.8	S616 D617 A618 C624	S616-G620 PolarHBondContact O-N 3.5Å; D617-G620 CarbonylContact O-C 3.58Å; D617-G620 PolarHBondContact O-N 3.31Å; D617-G620 VanDerWaalsContact O-N 3.15Å; A618-G620 VanDerWaalsContact C-N 3.34Å; A618-G620 PolarHBondContact O-N 2.67Å; G620-C624 WeakPolarHBondContact O-CB 3.47Å; G620-C624 PolarHBondContact O-N 2.88Å
621	I	97.7	Very high	94.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-51.9	173.9	-71.7	162.5	0	0	0	109.9	L600 I613 D617 A618 Q623 C624 L625 I698 I701 L702	L600-I621 HydrophobicContact CB-CG2 4.13Å; L600-I621 HydrophobicContact CD1-CB 4.17Å; L600-I621 HydrophobicContact CD1-CD1 3.79Å; L600-I621 HydrophobicContact CD1-CG2 4.04Å; L600-I621 HydrophobicContact CD2-CG2 4.35Å; L600-I621 HydrophobicContact CG-CG2 4.41Å; I613-I621 HydrophobicContact CD1-CD1 3.73Å; D617-I621 WeakPolarHBondContact O-CG1 3.23Å; D617-I621 PolarHBondContact O-N 2.75Å; A618-I621 PolarHBondContact O-N 3.41Å; I621-Q623 VanDerWaalsContact C-N 3.35Å; I621-Q623 PolarHBondContact O-N 2.69Å; I621-C624 CarbonylContact O-C 3.6Å; I621-C624 WeakPolarHBondContact O-CA 3.24Å; I621-C624 VanDerWaalsContact O-CB 3.29Å; I621-C624 WeakPolarHBondContact O-CB 3.4Å; I621-C624 PolarHBondContact O-N 2.81Å; I621-L625 HydrophobicContact CG2-CD1 4.07Å; I621-L625 HydrophobicContact CG2-CG 4.33Å; I621-L625 WeakPolarHBondContact O-CG 3.49Å; I621-L625 PolarHBondContact O-N 3.08Å; I621-I698 HydrophobicContact CB-CG2 4.49Å; I621-I698 HydrophobicContact CG1-CD1 4.11Å; I621-I698 HydrophobicContact CG1-CG2 3.98Å; I621-I701 HydrophobicContact CD1-CD1 4.32Å; I621-I701 HydrophobicContact CD1-CG2 3.96Å; I621-L702 HydrophobicContact CG2-CD1 4.31Å; I621-L702 HydrophobicContact CG2-CD2 4.07Å; I621-L702 HydrophobicContact CG2-CG 4.4Å
622	L	98.4	Very high	94.4	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-41.3	-179.5	-70.7	161.7	0	0	0	112.3	C453 L456 L457 L597 L600 A618 K619 C624 L625 L626	C453-L622 HydrophobicContact CB-CD2 4.22Å; L456-L622 HydrophobicContact CB-CD1 3.69Å; L456-L622 HydrophobicContact CB-CD2 3.94Å; L456-L622 HydrophobicContact CB-CG 4.49Å; L456-L622 HydrophobicContact CD1-CD2 4.19Å; L457-L622 HydrophobicContact CB-CB 4.36Å; L457-L622 HydrophobicContact CD1-CB 4.4Å; L597-L622 HydrophobicContact CD2-CD2 4.18Å; L600-L622 HydrophobicContact CD2-CD1 4.15Å; L600-L622 HydrophobicContact CD2-CD2 3.69Å; L600-L622 HydrophobicContact CD2-CG 3.75Å; A618-L622 WeakPolarHBondContact O-CD1 3.29Å; A618-L622 WeakPolarHBondContact O-CG 3.23Å; A618-L622 PolarHBondContact O-N 3.38Å; K619-L622 PolarHBondContact O-N 3.09Å; L622-C624 VanDerWaalsContact C-N 3.29Å; L622-C624 PolarHBondContact O-N 3.23Å; L622-L625 PolarHBondContact O-N 2.78Å; L622-L626 WeakPolarHBondContact O-CB 3.02Å; L622-L626 WeakPolarHBondContact O-CG 3.49Å; L622-L626 PolarHBondContact O-N 3.32Å
623	Q	98	Very high	94	Very high	24 Å²	24	28.5 Å²	28.5	11%	0.112	15%	0.146	C	C	.	.	H	α-helix	trans	-60.3	-38.9	171.5	-72.3	174	-19.8	0	0	112.3	L457 K619 I621 L626 W627 G628 Y686	L457-Q623 HydrophobicContact CD1-CG 3.72Å; L457-Q623 HydrophobicContact CD2-CG 4.19Å; K619-Q623 VanDerWaalsContact O-CG 3.27Å; K619-Q623 WeakPolarHBondContact O-CG 3.49Å; K619-Q623 PolarHBondContact O-N 3.34Å; I621-Q623 VanDerWaalsContact C-N 3.35Å; I621-Q623 PolarHBondContact O-N 2.69Å; Q623-L626 PolarHBondContact O-N 2.95Å; Q623-W627 HydrophobicContact CB-CZ3 4.47Å; Q623-W627 HydrophobicContact CG-CZ3 4.2Å; Q623-W627 PolarHBondContact O-N 3.07Å; Q623-G628 PolarHBondContact O-N 3.27Å; Q623-Y686 HydrophobicContact CB-CD1 4.25Å; Q623-Y686 HydrophobicContact CB-CD2 3.53Å; Q623-Y686 HydrophobicContact CB-CE1 4.44Å; Q623-Y686 HydrophobicContact CB-CE2 3.74Å; Q623-Y686 HydrophobicContact CB-CG 3.78Å; Q623-Y686 HydrophobicContact CG-CD2 4.01Å; Q623-Y686 HydrophobicContact CG-CG 4.1Å; Q623-Y686 VanDerWaalsContact OE1-CD2 3.26Å
624	C	96.8	Very high	93.4	Very high	1 Å²	1	29 Å²	29	1%	0.007	15%	0.147	C	C	.	.	H	α-helix	trans	-67.9	-38.9	176.1	-162	0	0	0	0	112.2	G620 I621 L622 G628 R630 I698 L702	G620-C624 WeakPolarHBondContact O-CB 3.47Å; G620-C624 PolarHBondContact O-N 2.88Å; I621-C624 CarbonylContact O-C 3.6Å; I621-C624 WeakPolarHBondContact O-CA 3.24Å; I621-C624 VanDerWaalsContact O-CB 3.29Å; I621-C624 WeakPolarHBondContact O-CB 3.4Å; I621-C624 PolarHBondContact O-N 2.81Å; L622-C624 VanDerWaalsContact C-N 3.29Å; L622-C624 PolarHBondContact O-N 3.23Å; C624-G628 WeakPolarHBondContact O-CA 3.49Å; C624-G628 PolarHBondContact O-N 3Å; C624-R630 PolarHBondContact O-NH1 3.28Å; C624-I698 HydrophobicContact CB-CG2 3.76Å; C624-L702 HydrophobicContact CB-CD1 3.98Å
625	L	96.5	Very high	92.9	Very high	13 Å²	13	30.9 Å²	30.9	7%	0.068	15%	0.154	C	C	.	.	H	α-helix	trans	-67.9	-36.2	174.6	-62.3	178.5	0	0	0	111.9	Y593 I621 L622 R630 L702	Y593-L625 HydrophobicContact CD1-CB 4.37Å; Y593-L625 WeakPolarHBondContact CE1-O 3.45Å; I621-L625 HydrophobicContact CG2-CD1 4.07Å; I621-L625 HydrophobicContact CG2-CG 4.33Å; I621-L625 WeakPolarHBondContact O-CG 3.49Å; I621-L625 PolarHBondContact O-N 3.08Å; L622-L625 PolarHBondContact O-N 2.78Å; L625-R630 PolarHBondContact O-NH1 3.21Å; L625-R630 PolarHBondContact O-NH2 3.29Å; L625-L702 HydrophobicContact CD2-CD1 4.02Å; L625-L702 HydrophobicContact CD2-CD2 4.19Å; L625-L702 HydrophobicContact CG-CD1 4.47Å
626	L	96.9	Very high	92.2	Very high	3 Å²	3	35 Å²	35	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-76.7	-45.1	-178.6	-75	164.6	0	0	0	114.3	R450 C453 L454 L457 L622 Q623	R450-L626 HydrophobicContact CG-CD2 3.89Å; R450-L626 PolarHBondContact NH1-O 3.04Å; R450-L626 PolarHBondContact NH2-O 2.99Å; C453-L626 HydrophobicContact CB-CD1 4.14Å; C453-L626 HydrophobicContact CB-CD2 3.68Å; C453-L626 HydrophobicContact CB-CG 3.81Å; L454-L626 HydrophobicContact CD2-CD1 3.81Å; L454-L626 HydrophobicContact CD2-CD2 3.98Å; L454-L626 HydrophobicContact CG-CD1 4.29Å; L454-L626 HydrophobicContact CG-CD2 3.85Å; L457-L626 HydrophobicContact CB-CD1 4.29Å; L457-L626 HydrophobicContact CD2-CD1 3.69Å; L622-L626 WeakPolarHBondContact O-CB 3.02Å; L622-L626 WeakPolarHBondContact O-CG 3.49Å; L622-L626 PolarHBondContact O-N 3.32Å; Q623-L626 PolarHBondContact O-N 2.95Å
627	W	96.7	Very high	91.6	Very high	23 Å²	23	33.1 Å²	33.1	9%	0.087	16%	0.161	C	C	.	.	H	α-helix	trans	-139.3	0.6	-173.4	-46.5	-77	0	0	0	115.3	L454 L457 Q623 W653 E679 L682 C683 Y686	L454-W627 HydrophobicContact CD2-CH2 4.2Å; L454-W627 HydrophobicContact CD2-CZ2 3.94Å; L457-W627 HydrophobicContact CD2-CH2 3.5Å; L457-W627 VanDerWaalsContact CD2-CH2 3.5Å; L457-W627 HydrophobicContact CD2-CZ3 3.61Å; Q623-W627 HydrophobicContact CB-CZ3 4.47Å; Q623-W627 HydrophobicContact CG-CZ3 4.2Å; Q623-W627 PolarHBondContact O-N 3.07Å; W627-W653 WeakPolarHBondContact O-CZ2 3.23Å; W627-E679 HydrophobicContact CZ2-CG 3.6Å; W627-E679 PolarHBondContact NE1-OE1 3.28Å; W627-L682 HydrophobicContact CH2-CB 3.69Å; W627-L682 HydrophobicContact CZ2-CB 4.31Å; W627-C683 HydrophobicContact CD2-CB 3.99Å; W627-C683 HydrophobicContact CE3-CB 4.45Å; W627-C683 HydrophobicContact CG-CB 4.4Å; W627-C683 HydrophobicContact CZ2-CB 4.07Å; W627-Y686 HydrophobicContact CB-CD1 4.26Å; W627-Y686 HydrophobicContact CB-CE1 4.19Å; W627-Y686 AromaticContact CE3-CD1 3.93Å; W627-Y686 HydrophobicContact CE3-CD1 3.93Å; W627-Y686 HydrophobicContact CE3-CG 4.47Å
628	G	93.4	Very high	90.9	Very high	3 Å²	3	35.6 Å²	35.6	3%	0.031	18%	0.177	C	C	.	.	S	Bend	trans	-74.8	-175.4	-170.8	0	0	0	0	0	116.3	Q623 C624 W653 Y686	Q623-G628 PolarHBondContact O-N 3.27Å; C624-G628 WeakPolarHBondContact O-CA 3.49Å; C624-G628 PolarHBondContact O-N 3Å; G628-W653 VanDerWaalsContact CA-CZ2 3.49Å; G628-Y686 WeakPolarHBondContact CA-OH 3.31Å
629	P	90.6	Very high	90.2	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.013	21%	0.21	C	C	.	.			trans	-57.6	142.9	167.5	22.3	-31.5	0	0	0	111.4	L633 F634 W653 V699	P629-L633 HydrophobicContact CB-CB 4.16Å; P629-L633 HydrophobicContact CB-CD1 4.15Å; P629-L633 HydrophobicContact CB-CD2 3.83Å; P629-L633 HydrophobicContact CB-CG 4.26Å; P629-F634 HydrophobicContact CB-CD1 4.5Å; P629-F634 HydrophobicContact CB-CE1 4Å; P629-F634 HydrophobicContact CG-CE1 4.04Å; P629-F634 WeakPolarHBondContact O-CE1 3.5Å; P629-W653 VanDerWaalsContact CD-CZ2 3.5Å; P629-W653 VanDerWaalsContact N-CZ2 3.26Å; P629-V699 HydrophobicContact CG-CG2 3.91Å
630	R	86.8	Confident	89.5	Confident	91 Å²	91	40.5 Å²	40.5	34%	0.343	21%	0.211	S	C	.	.			trans	-100.3	174	179.5	-61.1	-54.6	-172.8	-158.9	6.5	111.7	C624 L625 D632 L633 F634	C624-R630 PolarHBondContact O-NH1 3.28Å; L625-R630 PolarHBondContact O-NH1 3.21Å; L625-R630 PolarHBondContact O-NH2 3.29Å; R630-D632 PolarHBondContact O-N 2.98Å; R630-D632 VanDerWaalsContact O-N 3.15Å; R630-L633 WeakPolarHBondContact O-CB 3.49Å; R630-L633 PolarHBondContact O-N 3.38Å; R630-F634 WeakPolarHBondContact O-CD1 3.27Å; R630-F634 PolarHBondContact O-N 3.29Å; R630-F634 VanDerWaalsContact O-N 3.1Å
631	E	79.6	Confident	88.7	Confident	84 Å²	84	44.3 Å²	44.3	39%	0.393	24%	0.241	S	C	.	.	H	α-helix	trans	-56.8	-30.9	-174.2	-59.4	-154	123.3	0	0	113.8	L633 F634 Q635 R705	E631-L633 VanDerWaalsContact C-N 3.32Å; E631-L633 PolarHBondContact O-N 2.57Å; E631-F634 HydrophobicContact CG-CD2 4.47Å; E631-F634 CarbonylContact O-C 3.58Å; E631-F634 WeakPolarHBondContact O-CA 3.45Å; E631-F634 VanDerWaalsContact O-CB 3.31Å; E631-F634 WeakPolarHBondContact O-CB 3.44Å; E631-F634 PolarHBondContact O-N 2.92Å; E631-Q635 WeakPolarHBondContact O-CG 3.42Å; E631-Q635 PolarHBondContact O-N 2.88Å; E631-R705 VanDerWaalsContact CD-NH2 3.3Å; E631-R705 IonicContact OE1-CZ 3.75Å; E631-R705 IonicContact OE1-NH2 2.66Å; E631-R705 PolarHBondContact OE1-NH2 2.85Å; E631-R705 IonicContact OE2-NH2 3.26Å; E631-R705 PolarHBondContact OE2-NH2 3.2Å
632	D	82.8	Confident	88.2	Confident	114 Å²	114	47.5 Å²	47.5	61%	0.61	26%	0.261	S	S	*	.	H	α-helix	trans	-60.9	-42.9	175	-40.1	-63.4	0	0	0	111.4	R630 F634 Q635 I636	R630-D632 PolarHBondContact O-N 2.98Å; R630-D632 VanDerWaalsContact O-N 3.15Å; D632-F634 VanDerWaalsContact C-N 3.3Å; D632-Q635 PolarHBondContact O-N 3.41Å; D632-I636 WeakPolarHBondContact O-CG1 3.4Å; D632-I636 PolarHBondContact O-N 2.94Å
633	L	84.1	Confident	87.7	Confident	24 Å²	24	52.8 Å²	52.8	13%	0.126	29%	0.289	C	S	.	.	H	α-helix	trans	-70.7	-30.7	174.8	-162	149.6	0	0	0	110.6	P629 R630 E631 I636 F637 L649 L650 W653	P629-L633 HydrophobicContact CB-CB 4.16Å; P629-L633 HydrophobicContact CB-CD1 4.15Å; P629-L633 HydrophobicContact CB-CD2 3.83Å; P629-L633 HydrophobicContact CB-CG 4.26Å; R630-L633 WeakPolarHBondContact O-CB 3.49Å; R630-L633 PolarHBondContact O-N 3.38Å; E631-L633 VanDerWaalsContact C-N 3.32Å; E631-L633 PolarHBondContact O-N 2.57Å; L633-I636 PolarHBondContact O-N 3.34Å; L633-F637 WeakPolarHBondContact O-CB 3.34Å; L633-F637 PolarHBondContact O-N 3.12Å; L633-L649 HydrophobicContact CD1-CD1 4.42Å; L633-L649 HydrophobicContact CD1-CG 4.42Å; L633-L649 HydrophobicContact CD2-CD2 3.8Å; L633-L649 HydrophobicContact CD2-CG 4.01Å; L633-L649 HydrophobicContact CG-CD1 4.32Å; L633-L649 HydrophobicContact CG-CD2 4.04Å; L633-L649 HydrophobicContact CG-CG 4.12Å; L633-L650 HydrophobicContact CD2-CD2 3.96Å; L633-W653 HydrophobicContact CD1-CB 4.03Å; L633-W653 VanDerWaalsContact CD1-CD1 3.5Å; L633-W653 HydrophobicContact CD1-CG 3.91Å
634	F	83.3	Confident	87.3	Confident	22 Å²	22	55.3 Å²	55.3	10%	0.096	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-40.8	173.6	-63.9	1.1	0	0	0	111.3	P629 R630 E631 D632 F637 T638 V699 L702 Q703	P629-F634 HydrophobicContact CB-CD1 4.5Å; P629-F634 HydrophobicContact CB-CE1 4Å; P629-F634 HydrophobicContact CG-CE1 4.04Å; P629-F634 WeakPolarHBondContact O-CE1 3.5Å; R630-F634 WeakPolarHBondContact O-CD1 3.27Å; R630-F634 PolarHBondContact O-N 3.29Å; R630-F634 VanDerWaalsContact O-N 3.1Å; E631-F634 HydrophobicContact CG-CD2 4.47Å; E631-F634 CarbonylContact O-C 3.58Å; E631-F634 WeakPolarHBondContact O-CA 3.45Å; E631-F634 VanDerWaalsContact O-CB 3.31Å; E631-F634 WeakPolarHBondContact O-CB 3.44Å; E631-F634 PolarHBondContact O-N 2.92Å; D632-F634 VanDerWaalsContact C-N 3.3Å; F634-F637 CarbonylContact O-C 3.59Å; F634-F637 WeakPolarHBondContact O-CB 3.32Å; F634-F637 PolarHBondContact O-N 3.45Å; F634-T638 WeakPolarHBondContact O-CG2 3.43Å; F634-T638 PolarHBondContact O-N 3.48Å; F634-T638 PolarHBondContact O-OG1 3.48Å; F634-V699 HydrophobicContact CD1-CG1 3.77Å; F634-V699 HydrophobicContact CD1-CG2 4.34Å; F634-V699 HydrophobicContact CE1-CB 4.37Å; F634-V699 HydrophobicContact CE1-CG1 3.91Å; F634-V699 HydrophobicContact CE1-CG2 3.73Å; F634-V699 HydrophobicContact CG-CG1 4.31Å; F634-V699 HydrophobicContact CZ-CG2 4.32Å; F634-L702 HydrophobicContact CE2-CB 4.09Å; F634-L702 WeakPolarHBondContact CE2-O 2.98Å; F634-L702 HydrophobicContact CZ-CB 4.32Å; F634-Q703 HydrophobicContact CB-CG 4.34Å; F634-Q703 VanDerWaalsContact CB-NE2 3.32Å; F634-Q703 HydrophobicContact CD2-CG 4.15Å; F634-Q703 HydrophobicContact CG-CG 4.34Å; F634-Q703 PolarHBondContact O-NE2 3.4Å
635	Q	84.2	Confident	86.9	Confident	123 Å²	123	59.9 Å²	59.9	58%	0.575	34%	0.335	S	S	*	.	H	α-helix	trans	-64.1	-42.6	175.1	-66.1	173.8	41.7	0	0	112.1	E631 D632 F637 T638 T639	E631-Q635 WeakPolarHBondContact O-CG 3.42Å; E631-Q635 PolarHBondContact O-N 2.88Å; D632-Q635 PolarHBondContact O-N 3.41Å; Q635-F637 VanDerWaalsContact C-N 3.3Å; Q635-F637 PolarHBondContact O-N 3.24Å; Q635-T638 PolarHBondContact O-N 3.37Å; Q635-T638 PolarHBondContact O-OG1 2.91Å; Q635-T639 WeakPolarHBondContact O-CB 3.18Å; Q635-T639 WeakPolarHBondContact O-CG2 3.48Å; Q635-T639 PolarHBondContact O-N 3Å; Q635-T639 VanDerWaalsContact O-N 3.08Å; Q635-T639 PolarHBondContact O-OG1 2.92Å
636	I	83.4	Confident	86.6	Confident	91 Å²	91	61.4 Å²	61.4	47%	0.467	34%	0.341	S	S	.	.	H	α-helix	trans	-66.6	-35.6	174.5	-58.8	166.7	0	0	0	110.4	D632 L633 T639 S640 L649	D632-I636 WeakPolarHBondContact O-CG1 3.4Å; D632-I636 PolarHBondContact O-N 2.94Å; L633-I636 PolarHBondContact O-N 3.34Å; I636-T639 WeakPolarHBondContact CA-OG1 3.35Å; I636-T639 PolarHBondContact O-OG1 3.2Å; I636-S640 WeakPolarHBondContact O-CB 3.32Å; I636-S640 PolarHBondContact O-N 3.47Å; I636-S640 PolarHBondContact O-OG 3.31Å; I636-L649 HydrophobicContact CB-CD2 4.12Å; I636-L649 HydrophobicContact CG2-CD1 4.16Å; I636-L649 HydrophobicContact CG2-CD2 3.76Å
637	F	82.9	Confident	86.4	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-70.5	-36.4	177.7	-177	-89.4	0	0	0	112.7	L633 F634 Q635 K646 L649 L650 V699	L633-F637 WeakPolarHBondContact O-CB 3.34Å; L633-F637 PolarHBondContact O-N 3.12Å; F634-F637 CarbonylContact O-C 3.59Å; F634-F637 WeakPolarHBondContact O-CB 3.32Å; F634-F637 PolarHBondContact O-N 3.45Å; Q635-F637 VanDerWaalsContact C-N 3.3Å; Q635-F637 PolarHBondContact O-N 3.24Å; F637-K646 HydrophobicContact CD1-CD 4.45Å; F637-K646 HydrophobicContact CD2-CB 3.89Å; F637-K646 HydrophobicContact CD2-CD 4.42Å; F637-K646 HydrophobicContact CD2-CG 4.02Å; F637-K646 HydrophobicContact CE1-CD 4.18Å; F637-K646 HydrophobicContact CE2-CB 3.61Å; F637-K646 HydrophobicContact CE2-CD 4.15Å; F637-K646 HydrophobicContact CE2-CG 4.02Å; F637-K646 HydrophobicContact CG-CG 4.42Å; F637-K646 HydrophobicContact CZ-CB 4.26Å; F637-K646 HydrophobicContact CZ-CD 4.03Å; F637-K646 HydrophobicContact CZ-CG 4.42Å; F637-K646 PolarHBondContact O-NZ 2.92Å; F637-L649 HydrophobicContact CB-CD2 4.12Å; F637-L650 HydrophobicContact CD2-CD1 4.23Å; F637-L650 HydrophobicContact CD2-CG 4.21Å; F637-L650 HydrophobicContact CE2-CD1 3.59Å; F637-L650 HydrophobicContact CE2-CG 4.07Å; F637-L650 HydrophobicContact CZ-CD1 4.45Å; F637-V699 HydrophobicContact CD1-CG1 4.11Å; F637-V699 HydrophobicContact CE1-CG1 4.2Å
638	T	81.8	Confident	86.1	Confident	79 Å²	79	64.5 Å²	64.5	49%	0.485	37%	0.366	S	S	.	.	H	α-helix	trans	-71.8	-48.3	175.2	52.6	0	0	0	0	111	F634 Q635 S640 K646	F634-T638 WeakPolarHBondContact O-CG2 3.43Å; F634-T638 PolarHBondContact O-N 3.48Å; F634-T638 PolarHBondContact O-OG1 3.48Å; Q635-T638 PolarHBondContact O-N 3.37Å; Q635-T638 PolarHBondContact O-OG1 2.91Å; T638-S640 VanDerWaalsContact C-N 3.28Å; T638-S640 PolarHBondContact O-N 3.05Å; T638-K646 PolarHBondContact O-NZ 3.28Å
639	T	84.4	Confident	86.1	Confident	111 Å²	111	66.2 Å²	66.2	68%	0.681	37%	0.374	S	S	*	.	H	α-helix	trans	-64.9	-24.4	179.1	52.6	0	0	0	0	114.4	Q635 I636 A641	Q635-T639 WeakPolarHBondContact O-CB 3.18Å; Q635-T639 WeakPolarHBondContact O-CG2 3.48Å; Q635-T639 PolarHBondContact O-N 3Å; Q635-T639 VanDerWaalsContact O-N 3.08Å; Q635-T639 PolarHBondContact O-OG1 2.92Å; I636-T639 WeakPolarHBondContact CA-OG1 3.35Å; I636-T639 PolarHBondContact O-OG1 3.2Å; T639-A641 PolarHBondContact O-N 2.6Å
640	S	83.5	Confident	86.3	Confident	22 Å²	22	66.1 Å²	66.1	15%	0.154	37%	0.374	C	S	.	.			trans	-59.1	117	174.1	-72.1	0	0	0	0	111.9	I636 T638 K646	I636-S640 WeakPolarHBondContact O-CB 3.32Å; I636-S640 PolarHBondContact O-N 3.47Å; I636-S640 PolarHBondContact O-OG 3.31Å; T638-S640 VanDerWaalsContact C-N 3.28Å; T638-S640 PolarHBondContact O-N 3.05Å; S640-K646 WeakPolarHBondContact O-CE 3.45Å; S640-K646 PolarHBondContact O-NZ 2.86Å
641	A	79.9	Confident	86.8	Confident	94 Å²	94	63.6 Å²	63.6	78%	0.777	37%	0.365	S	S	*	.			trans	-71.4	-31.8	-173.8	0	0	0	0	0	114.3	T639	T639-A641 PolarHBondContact O-N 2.6Å
642	T	89	Confident	87.5	Confident	66 Å²	66	64 Å²	64	41%	0.405	37%	0.371	S	S	.	.	S	Bend	trans	-112.6	149.8	-175	69.3	0	0	0	0	113.3	A644 Q645 K646	T642-A644 PolarHBondContact O-N 2.88Å; T642-Q645 PolarHBondContact O-N 3.46Å; T642-Q645 WeakPolarHBondContact OG1-CB 3.27Å; T642-Q645 VanDerWaalsContact OG1-CG 3.26Å; T642-Q645 WeakPolarHBondContact OG1-CG 3.5Å; T642-Q645 PolarHBondContact OG1-N 3.49Å; T642-Q645 PolarHBondContact OG1-OE1 3.49Å; T642-K646 PolarHBondContact O-N 2.89Å; T642-K646 VanDerWaalsContact O-N 3.12Å
643	L	86.9	Confident	88.1	Confident	113 Å²	113	59.4 Å²	59.4	59%	0.592	35%	0.345	S	S	*	.	H	α-helix	trans	-61	-33.1	172.6	-177.9	60.2	0	0	0	112.1	K646 N647	L643-K646 PolarHBondContact O-N 3.07Å; L643-N647 WeakPolarHBondContact O-CB 3.33Å; L643-N647 PolarHBondContact O-N 3.18Å
644	A	89.6	Confident	88.7	Confident	76 Å²	76	58.3 Å²	58.3	63%	0.628	34%	0.339	S	S	*	.	H	α-helix	trans	-61.4	-44.6	175.1	0	0	0	0	0	112.3	T642 N647 A648	T642-A644 PolarHBondContact O-N 2.88Å; A644-N647 PolarHBondContact O-N 3.35Å; A644-A648 WeakPolarHBondContact O-CB 3.41Å; A644-A648 PolarHBondContact O-N 3.23Å
645	Q	89.4	Confident	89.4	Confident	98 Å²	98	58.4 Å²	58.4	46%	0.458	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-45.8	174.6	-73.2	158.7	-41	0	0	111.7	T642 N647 A648 L649	T642-Q645 PolarHBondContact O-N 3.46Å; T642-Q645 WeakPolarHBondContact OG1-CB 3.27Å; T642-Q645 VanDerWaalsContact OG1-CG 3.26Å; T642-Q645 WeakPolarHBondContact OG1-CG 3.5Å; T642-Q645 PolarHBondContact OG1-N 3.49Å; T642-Q645 PolarHBondContact OG1-OE1 3.49Å; Q645-N647 VanDerWaalsContact C-N 3.35Å; Q645-N647 PolarHBondContact O-N 2.98Å; Q645-A648 PolarHBondContact O-N 2.93Å; Q645-L649 WeakPolarHBondContact O-CB 3.41Å; Q645-L649 PolarHBondContact O-N 2.85Å
646	K	89.3	Confident	90	Very high	44 Å²	44	55.8 Å²	55.8	19%	0.191	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-43.3	177.6	-69.8	-178.1	-150.6	-91.2	0	112.1	F637 T638 S640 T642 L643 L650	F637-K646 HydrophobicContact CD1-CD 4.45Å; F637-K646 HydrophobicContact CD2-CB 3.89Å; F637-K646 HydrophobicContact CD2-CD 4.42Å; F637-K646 HydrophobicContact CD2-CG 4.02Å; F637-K646 HydrophobicContact CE1-CD 4.18Å; F637-K646 HydrophobicContact CE2-CB 3.61Å; F637-K646 HydrophobicContact CE2-CD 4.15Å; F637-K646 HydrophobicContact CE2-CG 4.02Å; F637-K646 HydrophobicContact CG-CG 4.42Å; F637-K646 HydrophobicContact CZ-CB 4.26Å; F637-K646 HydrophobicContact CZ-CD 4.03Å; F637-K646 HydrophobicContact CZ-CG 4.42Å; F637-K646 PolarHBondContact O-NZ 2.92Å; T638-K646 PolarHBondContact O-NZ 3.28Å; S640-K646 WeakPolarHBondContact O-CE 3.45Å; S640-K646 PolarHBondContact O-NZ 2.86Å; T642-K646 PolarHBondContact O-N 2.89Å; T642-K646 VanDerWaalsContact O-N 3.12Å; L643-K646 PolarHBondContact O-N 3.07Å; K646-L650 PolarHBondContact O-N 3.31Å
647	N	91.9	Very high	90.6	Very high	43 Å²	43	53.8 Å²	53.8	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-70.7	-38.8	177.3	-75.3	11	0	0	0	112.1	L643 A644 Q645 L650 Q651	L643-N647 WeakPolarHBondContact O-CB 3.33Å; L643-N647 PolarHBondContact O-N 3.18Å; A644-N647 PolarHBondContact O-N 3.35Å; Q645-N647 VanDerWaalsContact C-N 3.35Å; Q645-N647 PolarHBondContact O-N 2.98Å; N647-L650 PolarHBondContact O-N 3Å; N647-Q651 VanDerWaalsContact O-CB 3.24Å; N647-Q651 WeakPolarHBondContact O-CB 3.44Å; N647-Q651 PolarHBondContact O-N 3.5Å
648	A	92.2	Very high	91.3	Very high	49 Å²	49	54 Å²	54	41%	0.405	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-41.1	175	0	0	0	0	0	112.5	A644 Q645 Q651 N652	A644-A648 WeakPolarHBondContact O-CB 3.41Å; A644-A648 PolarHBondContact O-N 3.23Å; Q645-A648 PolarHBondContact O-N 2.93Å; A648-Q651 PolarHBondContact O-N 3.33Å; A648-N652 WeakPolarHBondContact O-CB 3.07Å; A648-N652 PolarHBondContact O-N 3.36Å; A648-N652 PolarHBondContact O-ND2 3.04Å; A648-N652 PolarHBondContact O-OD1 3.26Å
649	L	93.3	Very high	92.1	Very high	39 Å²	39	52.5 Å²	52.5	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-51.7	175.3	179.5	67.4	0	0	0	111.6	L633 I636 F637 Q645 Q651 N652 W653	L633-L649 HydrophobicContact CD1-CD1 4.42Å; L633-L649 HydrophobicContact CD1-CG 4.42Å; L633-L649 HydrophobicContact CD2-CD2 3.8Å; L633-L649 HydrophobicContact CD2-CG 4.01Å; L633-L649 HydrophobicContact CG-CD1 4.32Å; L633-L649 HydrophobicContact CG-CD2 4.04Å; L633-L649 HydrophobicContact CG-CG 4.12Å; I636-L649 HydrophobicContact CB-CD2 4.12Å; I636-L649 HydrophobicContact CG2-CD1 4.16Å; I636-L649 HydrophobicContact CG2-CD2 3.76Å; F637-L649 HydrophobicContact CB-CD2 4.12Å; Q645-L649 WeakPolarHBondContact O-CB 3.41Å; Q645-L649 PolarHBondContact O-N 2.85Å; L649-Q651 VanDerWaalsContact C-N 3.33Å; L649-Q651 PolarHBondContact O-N 3.19Å; L649-N652 PolarHBondContact O-N 3.32Å; L649-W653 WeakPolarHBondContact O-CB 3.21Å; L649-W653 PolarHBondContact O-N 2.96Å
650	L	94.6	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.2	-35	177.8	-69	177.8	0	0	0	112.5	L633 F637 K646 N647 L654 T692 L695	L633-L650 HydrophobicContact CD2-CD2 3.96Å; F637-L650 HydrophobicContact CD2-CD1 4.23Å; F637-L650 HydrophobicContact CD2-CG 4.21Å; F637-L650 HydrophobicContact CE2-CD1 3.59Å; F637-L650 HydrophobicContact CE2-CG 4.07Å; F637-L650 HydrophobicContact CZ-CD1 4.45Å; K646-L650 PolarHBondContact O-N 3.31Å; N647-L650 PolarHBondContact O-N 3Å; L650-L654 WeakPolarHBondContact O-CB 3.11Å; L650-L654 PolarHBondContact O-N 3.16Å; L650-T692 HydrophobicContact CB-CG2 4.24Å; L650-T692 WeakPolarHBondContact CD1-O 3.38Å; L650-L695 HydrophobicContact CD1-CB 4.05Å; L650-L695 HydrophobicContact CD2-CB 4.23Å; L650-L695 HydrophobicContact CD2-CD1 4.5Å
651	Q	95.9	Very high	93.3	Very high	37 Å²	37	51.4 Å²	51.4	17%	0.173	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-43.2	177.7	-174.2	61.4	86.2	0	0	112.1	N647 A648 L649 W653 L654 D655 T692	N647-Q651 VanDerWaalsContact O-CB 3.24Å; N647-Q651 WeakPolarHBondContact O-CB 3.44Å; N647-Q651 PolarHBondContact O-N 3.5Å; A648-Q651 PolarHBondContact O-N 3.33Å; L649-Q651 VanDerWaalsContact C-N 3.33Å; L649-Q651 PolarHBondContact O-N 3.19Å; Q651-W653 VanDerWaalsContact C-N 3.34Å; Q651-L654 PolarHBondContact O-N 3.41Å; Q651-D655 PolarHBondContact NE2-OD1 2.87Å; Q651-D655 WeakPolarHBondContact O-CB 3.46Å; Q651-D655 PolarHBondContact O-N 3.06Å; Q651-T692 HydrophobicContact CB-CG2 3.81Å
652	N	94.4	Very high	94.1	Very high	94 Å²	94	49 Å²	49	50%	0.503	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-42.4	175.7	-69.5	-11.9	0	0	0	111	A648 L649 D655 I656	A648-N652 WeakPolarHBondContact O-CB 3.07Å; A648-N652 PolarHBondContact O-N 3.36Å; A648-N652 PolarHBondContact O-ND2 3.04Å; A648-N652 PolarHBondContact O-OD1 3.26Å; L649-N652 PolarHBondContact O-N 3.32Å; N652-D655 PolarHBondContact O-N 3.17Å; N652-I656 VanDerWaalsContact O-CG1 3.29Å; N652-I656 WeakPolarHBondContact O-CG1 3.35Å; N652-I656 PolarHBondContact O-N 2.76Å
653	W	96.1	Very high	94.4	Very high	17 Å²	17	49.6 Å²	49.6	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-46.2	174.2	179.4	92	0	0	0	112.1	W627 G628 P629 L633 L649 Q651 I656 K657 Y686 L687 L695	W627-W653 WeakPolarHBondContact O-CZ2 3.23Å; G628-W653 VanDerWaalsContact CA-CZ2 3.49Å; P629-W653 VanDerWaalsContact CD-CZ2 3.5Å; P629-W653 VanDerWaalsContact N-CZ2 3.26Å; L633-W653 HydrophobicContact CD1-CB 4.03Å; L633-W653 VanDerWaalsContact CD1-CD1 3.5Å; L633-W653 HydrophobicContact CD1-CG 3.91Å; L649-W653 WeakPolarHBondContact O-CB 3.21Å; L649-W653 PolarHBondContact O-N 2.96Å; Q651-W653 VanDerWaalsContact C-N 3.34Å; W653-I656 PolarHBondContact O-N 3.14Å; W653-K657 HydrophobicContact CD2-CG 4.05Å; W653-K657 HydrophobicContact CE3-CG 4.39Å; W653-K657 HydrophobicContact CH2-CG 3.97Å; W653-K657 HydrophobicContact CZ2-CD 4.08Å; W653-K657 HydrophobicContact CZ2-CG 3.61Å; W653-K657 HydrophobicContact CZ3-CG 4.36Å; W653-K657 WeakPolarHBondContact O-CB 3.45Å; W653-K657 WeakPolarHBondContact O-CG 3.42Å; W653-K657 PolarHBondContact O-N 2.96Å; W653-Y686 HydrophobicContact CH2-CE1 4.09Å; W653-L687 HydrophobicContact CH2-CD2 4.31Å; W653-L687 HydrophobicContact CZ3-CD2 4.38Å; W653-L695 HydrophobicContact CE3-CD1 3.84Å; W653-L695 HydrophobicContact CZ3-CD1 3.75Å
654	L	97.1	Very high	94.8	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-47.9	174.9	-86.4	172	0	0	0	111.6	L650 Q651 I656 K657 R658 L687 A690 L695	L650-L654 WeakPolarHBondContact O-CB 3.11Å; L650-L654 PolarHBondContact O-N 3.16Å; Q651-L654 PolarHBondContact O-N 3.41Å; L654-I656 VanDerWaalsContact C-N 3.33Å; L654-I656 PolarHBondContact O-N 3.22Å; L654-K657 PolarHBondContact O-N 3.03Å; L654-R658 VanDerWaalsContact O-CB 3.29Å; L654-R658 WeakPolarHBondContact O-CB 3.32Å; L654-R658 WeakPolarHBondContact O-CG 3.13Å; L654-R658 PolarHBondContact O-N 2.95Å; L654-L687 HydrophobicContact CD2-CD2 4.39Å; L654-A690 HydrophobicContact CD2-CB 4.01Å; L654-L695 HydrophobicContact CD1-CD1 3.84Å; L654-L695 HydrophobicContact CD2-CD1 3.9Å; L654-L695 HydrophobicContact CG-CD1 3.67Å
655	D	96.7	Very high	94.9	Very high	24 Å²	24	45.4 Å²	45.4	13%	0.128	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-38.7	-176.6	-66.9	-10.4	0	0	0	111.6	R250 Q651 N652 T659	R250-D655 WeakPolarHBondContact CG-OD1 3.41Å; R250-D655 IonicContact CZ-OD2 3.72Å; R250-D655 IonicContact NE-OD1 2.73Å; R250-D655 PolarHBondContact NE-OD1 2.83Å; R250-D655 IonicContact NE-OD2 3.26Å; R250-D655 PolarHBondContact NE-OD2 2.94Å; R250-D655 IonicContact NH2-OD2 2.79Å; R250-D655 PolarHBondContact NH2-OD2 3.05Å; Q651-D655 PolarHBondContact NE2-OD1 2.87Å; Q651-D655 WeakPolarHBondContact O-CB 3.46Å; Q651-D655 PolarHBondContact O-N 3.06Å; N652-D655 PolarHBondContact O-N 3.17Å; D655-T659 WeakPolarHBondContact O-CB 3.3Å; D655-T659 PolarHBondContact O-N 3.17Å; D655-T659 VanDerWaalsContact O-N 3.1Å; D655-T659 PolarHBondContact O-OG1 3.41Å
656	I	96.7	Very high	95.1	Very high	69 Å²	69	43.3 Å²	43.3	35%	0.354	23%	0.232	S	C	.	.	H	α-helix	trans	-63.9	-54.1	173	-69	166.6	0	0	0	110.6	M142 N652 W653 L654 R658 T659 L660	M142-I656 HydrophobicContact CE-CD1 3.85Å; M142-I656 HydrophobicContact SD-CD1 4.42Å; M142-I656 HydrophobicContact SD-CG2 4.36Å; N652-I656 VanDerWaalsContact O-CG1 3.29Å; N652-I656 WeakPolarHBondContact O-CG1 3.35Å; N652-I656 PolarHBondContact O-N 2.76Å; W653-I656 PolarHBondContact O-N 3.14Å; L654-I656 VanDerWaalsContact C-N 3.33Å; L654-I656 PolarHBondContact O-N 3.22Å; I656-R658 VanDerWaalsContact C-N 3.31Å; I656-R658 PolarHBondContact O-N 3.21Å; I656-T659 WeakPolarHBondContact O-CB 3.39Å; I656-T659 PolarHBondContact O-N 3.03Å; I656-L660 HydrophobicContact CG2-CD1 3.89Å; I656-L660 HydrophobicContact CG2-CG 4.39Å; I656-L660 WeakPolarHBondContact O-CG 3.35Å; I656-L660 PolarHBondContact O-N 3.27Å
657	K	97.4	Very high	95.2	Very high	48 Å²	48	46.2 Å²	46.2	21%	0.209	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-39.8	-178.1	-71.8	-72.1	-172.3	174.5	0	112.4	W653 L654 T659 L660 L661 L687	W653-K657 HydrophobicContact CD2-CG 4.05Å; W653-K657 HydrophobicContact CE3-CG 4.39Å; W653-K657 HydrophobicContact CH2-CG 3.97Å; W653-K657 HydrophobicContact CZ2-CD 4.08Å; W653-K657 HydrophobicContact CZ2-CG 3.61Å; W653-K657 HydrophobicContact CZ3-CG 4.36Å; W653-K657 WeakPolarHBondContact O-CB 3.45Å; W653-K657 WeakPolarHBondContact O-CG 3.42Å; W653-K657 PolarHBondContact O-N 2.96Å; L654-K657 PolarHBondContact O-N 3.03Å; K657-T659 VanDerWaalsContact C-N 3.33Å; K657-T659 PolarHBondContact O-N 2.98Å; K657-L660 PolarHBondContact O-N 2.93Å; K657-L661 PolarHBondContact O-N 3.31Å; K657-L687 HydrophobicContact CB-CD1 3.91Å; K657-L687 HydrophobicContact CB-CD2 4.03Å
658	R	98	Very high	95.1	Very high	12 Å²	12	46.5 Å²	46.5	5%	0.045	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-40.3	174.1	-72.3	176.9	165.5	136.4	6.6	112.2	H253 L257 L654 I656 M662 L687 A690	H253-R658 HydrophobicContact CB-CB 4.3Å; L257-R658 HydrophobicContact CD1-CB 3.79Å; L257-R658 HydrophobicContact CD1-CG 3.56Å; L654-R658 VanDerWaalsContact O-CB 3.29Å; L654-R658 WeakPolarHBondContact O-CB 3.32Å; L654-R658 WeakPolarHBondContact O-CG 3.13Å; L654-R658 PolarHBondContact O-N 2.95Å; I656-R658 VanDerWaalsContact C-N 3.31Å; I656-R658 PolarHBondContact O-N 3.21Å; R658-M662 WeakPolarHBondContact O-CB 3.15Å; R658-M662 PolarHBondContact O-N 2.98Å; R658-L687 HydrophobicContact CG-CB 4.27Å; R658-L687 VanDerWaalsContact CZ-O 3.28Å; R658-L687 PolarHBondContact NE-O 2.87Å; R658-L687 PolarHBondContact NH2-O 2.98Å; R658-A690 PolarHBondContact NH2-O 3.23Å
659	T	97.6	Very high	94.8	Very high	46 Å²	46	48.6 Å²	48.6	28%	0.282	26%	0.257	S	S	.	.	H	α-helix	trans	-67.8	-46	178	-54.9	0	0	0	0	111.3	H253 D655 I656 K657 L661 M662 I663	H253-T659 PolarHBondContact CE1-OG1 3.13Å; H253-T659 PolarHBondContact ND1-OG1 2.85Å; H253-T659 VanDerWaalsContact ND1-OG1 3.09Å; D655-T659 WeakPolarHBondContact O-CB 3.3Å; D655-T659 PolarHBondContact O-N 3.17Å; D655-T659 VanDerWaalsContact O-N 3.1Å; D655-T659 PolarHBondContact O-OG1 3.41Å; I656-T659 WeakPolarHBondContact O-CB 3.39Å; I656-T659 PolarHBondContact O-N 3.03Å; K657-T659 VanDerWaalsContact C-N 3.33Å; K657-T659 PolarHBondContact O-N 2.98Å; T659-L661 PolarHBondContact O-N 3.16Å; T659-M662 WeakPolarHBondContact O-CB 3.45Å; T659-M662 PolarHBondContact O-N 3.15Å; T659-I663 HydrophobicContact CG2-CD1 4.14Å; T659-I663 WeakPolarHBondContact O-CG1 3.28Å; T659-I663 PolarHBondContact O-N 2.95Å
660	L	97.4	Very high	94.5	Very high	99 Å²	99	53.4 Å²	53.4	52%	0.518	28%	0.282	S	S	.	.	H	α-helix	trans	-60	-43.3	176.6	-67.3	170.8	0	0	0	112.1	I656 K657 M662 I663 K664	I656-L660 HydrophobicContact CG2-CD1 3.89Å; I656-L660 HydrophobicContact CG2-CG 4.39Å; I656-L660 WeakPolarHBondContact O-CG 3.35Å; I656-L660 PolarHBondContact O-N 3.27Å; K657-L660 PolarHBondContact O-N 2.93Å; L660-M662 VanDerWaalsContact C-N 3.35Å; L660-I663 PolarHBondContact O-N 3.17Å; L660-K664 PolarHBondContact O-N 2.88Å
661	L	96.5	Very high	94	Very high	12 Å²	12	57.9 Å²	57.9	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-67.4	-35.7	176.4	-173.5	58	0	0	0	112.1	L257 K657 T659 I663 K664 F665 A684 L687	L257-L661 HydrophobicContact CD2-CB 4.43Å; L257-L661 HydrophobicContact CD2-CD2 3.85Å; L257-L661 HydrophobicContact CD2-CG 4.05Å; K657-L661 PolarHBondContact O-N 3.31Å; T659-L661 PolarHBondContact O-N 3.16Å; L661-I663 VanDerWaalsContact C-N 3.33Å; L661-I663 PolarHBondContact O-N 3.48Å; L661-K664 HydrophobicContact CD1-CD 4.36Å; L661-K664 PolarHBondContact O-N 2.89Å; L661-F665 HydrophobicContact CD1-CD2 3.89Å; L661-F665 HydrophobicContact CD1-CE2 3.71Å; L661-F665 HydrophobicContact CD2-CE2 4.23Å; L661-F665 HydrophobicContact CG-CD2 3.89Å; L661-F665 HydrophobicContact CG-CE2 3.84Å; L661-F665 WeakPolarHBondContact O-CD2 3.37Å; L661-F665 PolarHBondContact O-N 3.03Å; L661-A684 HydrophobicContact CD2-CB 4.11Å; L661-L687 HydrophobicContact CB-CD1 4.17Å; L661-L687 HydrophobicContact CD2-CD1 3.89Å
662	M	96.3	Very high	92.5	Very high	43 Å²	43	67.7 Å²	67.7	21%	0.212	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-39.5	174.3	-161.9	61.9	48.9	0	0	112.2	A256 L257 L260 R658 T659 L660 A666	A256-M662 HydrophobicContact CB-CE 3.52Å; A256-M662 HydrophobicContact CB-SD 3.97Å; L257-M662 HydrophobicContact CD2-CE 3.68Å; L257-M662 HydrophobicContact CG-CE 3.59Å; L260-M662 HydrophobicContact CD1-CE 4.04Å; L260-M662 HydrophobicContact CD1-SD 3.91Å; R658-M662 WeakPolarHBondContact O-CB 3.15Å; R658-M662 PolarHBondContact O-N 2.98Å; T659-M662 WeakPolarHBondContact O-CB 3.45Å; T659-M662 PolarHBondContact O-N 3.15Å; L660-M662 VanDerWaalsContact C-N 3.35Å; M662-A666 PolarHBondContact O-N 3.13Å; M662-A666 VanDerWaalsContact O-N 3.09Å
663	I	95.7	Very high	90.9	Very high	78 Å²	78	72.7 Å²	72.7	40%	0.4	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-49.9	174.8	-68.7	164.1	0	0	0	110	T659 L660 L661 F665 A666 E667	T659-I663 HydrophobicContact CG2-CD1 4.14Å; T659-I663 WeakPolarHBondContact O-CG1 3.28Å; T659-I663 PolarHBondContact O-N 2.95Å; L660-I663 PolarHBondContact O-N 3.17Å; L661-I663 VanDerWaalsContact C-N 3.33Å; L661-I663 PolarHBondContact O-N 3.48Å; I663-F665 VanDerWaalsContact C-N 3.31Å; I663-F665 PolarHBondContact O-N 3.23Å; I663-A666 CarbonylContact O-C 3.59Å; I663-A666 WeakPolarHBondContact O-CA 3.41Å; I663-A666 WeakPolarHBondContact O-CB 3.16Å; I663-A666 PolarHBondContact O-N 3.03Å; I663-E667 HydrophobicContact CG2-CG 4.28Å; I663-E667 VanDerWaalsContact CG2-OE1 3.3Å; I663-E667 WeakPolarHBondContact CG2-OE1 3.31Å; I663-E667 WeakPolarHBondContact O-CG 3.43Å; I663-E667 PolarHBondContact O-N 3.05Å
664	K	93.9	Very high	89.2	Confident	79 Å²	79	73.1 Å²	73.1	34%	0.343	37%	0.371	S	S	.	.	H	α-helix	trans	-55.3	-41.3	176.8	-169.7	-175.4	-173.1	-172	0	113.3	L660 L661 A666 E667 K668 D680	L660-K664 PolarHBondContact O-N 2.88Å; L661-K664 HydrophobicContact CD1-CD 4.36Å; L661-K664 PolarHBondContact O-N 2.89Å; K664-A666 VanDerWaalsContact C-N 3.35Å; K664-E667 WeakPolarHBondContact CA-OE2 3.25Å; K664-K668 WeakPolarHBondContact O-CB 3.43Å; K664-K668 PolarHBondContact O-N 3.1Å; K664-K668 VanDerWaalsContact O-N 3.09Å; K664-D680 WeakPolarHBondContact CE-OD1 3.19Å; K664-D680 IonicContact NZ-OD1 2.8Å; K664-D680 PolarHBondContact NZ-OD1 3.37Å
665	F	93.1	Very high	88.4	Confident	23 Å²	23	75.7 Å²	75.7	10%	0.101	40%	0.398	C	S	.	.	H	α-helix	trans	-70.7	-27.2	175	-88.1	-74.6	0	0	0	113.4	L260 L661 I663 S669 I676 D680 A684	L260-F665 HydrophobicContact CD1-CB 4.19Å; L260-F665 HydrophobicContact CD1-CD2 4.03Å; L260-F665 HydrophobicContact CD1-CG 4.03Å; L260-F665 HydrophobicContact CD2-CD1 4.25Å; L260-F665 HydrophobicContact CD2-CG 4.46Å; L661-F665 HydrophobicContact CD1-CD2 3.89Å; L661-F665 HydrophobicContact CD1-CE2 3.71Å; L661-F665 HydrophobicContact CD2-CE2 4.23Å; L661-F665 HydrophobicContact CG-CD2 3.89Å; L661-F665 HydrophobicContact CG-CE2 3.84Å; L661-F665 WeakPolarHBondContact O-CD2 3.37Å; L661-F665 PolarHBondContact O-N 3.03Å; I663-F665 VanDerWaalsContact C-N 3.31Å; I663-F665 PolarHBondContact O-N 3.23Å; F665-S669 PolarHBondContact O-N 2.8Å; F665-I676 HydrophobicContact CD1-CD1 3.9Å; F665-I676 HydrophobicContact CE1-CD1 3.79Å; F665-I676 HydrophobicContact CE1-CG1 4.36Å; F665-I676 HydrophobicContact CE1-CG2 3.97Å; F665-I676 HydrophobicContact CZ-CG2 4.42Å; F665-D680 HydrophobicContact CZ-CB 4.19Å; F665-A684 HydrophobicContact CE2-CB 4.04Å; F665-A684 HydrophobicContact CZ-CB 4.2Å
666	A	93.3	Very high	88	Confident	53 Å²	53	76.4 Å²	76.4	44%	0.438	40%	0.401	S	S	.	.	H	α-helix	trans	-75.6	-42.7	174.5	0	0	0	0	0	111.4	M662 I663 K664 S669	M662-A666 PolarHBondContact O-N 3.13Å; M662-A666 VanDerWaalsContact O-N 3.09Å; I663-A666 CarbonylContact O-C 3.59Å; I663-A666 WeakPolarHBondContact O-CA 3.41Å; I663-A666 WeakPolarHBondContact O-CB 3.16Å; I663-A666 PolarHBondContact O-N 3.03Å; K664-A666 VanDerWaalsContact C-N 3.35Å; A666-S669 WeakPolarHBondContact O-CB 3.37Å; A666-S669 PolarHBondContact O-N 3.42Å; A666-S669 VanDerWaalsContact O-N 3.07Å; A666-S669 PolarHBondContact O-OG 3.35Å
667	E	91.4	Very high	87.7	Confident	106 Å²	106	74.9 Å²	74.9	50%	0.495	40%	0.397	S	S	.	.	H	α-helix	trans	-59.1	-53	175.3	-69.5	162.3	160.2	0	0	110.5	I663 K664 S669 L670 D671	I663-E667 HydrophobicContact CG2-CG 4.28Å; I663-E667 VanDerWaalsContact CG2-OE1 3.3Å; I663-E667 WeakPolarHBondContact CG2-OE1 3.31Å; I663-E667 WeakPolarHBondContact O-CG 3.43Å; I663-E667 PolarHBondContact O-N 3.05Å; K664-E667 WeakPolarHBondContact CA-OE2 3.25Å; E667-S669 PolarHBondContact O-N 2.96Å; E667-L670 WeakPolarHBondContact O-CB 3.46Å; E667-L670 PolarHBondContact O-N 3.18Å; E667-D671 PolarHBondContact O-N 2.92Å
668	K	89.3	Confident	87.4	Confident	48 Å²	48	73 Å²	73	21%	0.209	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-13.6	173	-77.1	-162.8	168.2	-166.7	0	115.4	K664 L670 G675 I676 D680	K664-K668 WeakPolarHBondContact O-CB 3.43Å; K664-K668 PolarHBondContact O-N 3.1Å; K664-K668 VanDerWaalsContact O-N 3.09Å; K668-L670 VanDerWaalsContact C-N 3.34Å; K668-G675 PolarHBondContact NZ-O 3.27Å; K668-I676 HydrophobicContact CB-CD1 4.31Å; K668-I676 HydrophobicContact CD-CD1 4.01Å; K668-D680 IonicContact NZ-OD2 2.63Å; K668-D680 PolarHBondContact NZ-OD2 3.38Å
669	S	85.8	Confident	87.2	Confident	93 Å²	93	74.8 Å²	74.8	65%	0.65	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.7	173.7	80	0	0	0	0	113.7	F665 A666 E667	F665-S669 PolarHBondContact O-N 2.8Å; A666-S669 WeakPolarHBondContact O-CB 3.37Å; A666-S669 PolarHBondContact O-N 3.42Å; A666-S669 VanDerWaalsContact O-N 3.07Å; A666-S669 PolarHBondContact O-OG 3.35Å; E667-S669 PolarHBondContact O-N 2.96Å
670	L	87.6	Confident	87	Confident	140 Å²	140	72.8 Å²	72.8	73%	0.733	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-33.8	172.7	-54	177.8	0	0	0	111.3	E667 K668 R672	E667-L670 WeakPolarHBondContact O-CB 3.46Å; E667-L670 PolarHBondContact O-N 3.18Å; K668-L670 VanDerWaalsContact C-N 3.34Å; L670-R672 PolarHBondContact O-N 3.15Å
671	D	84.1	Confident	86.9	Confident	95 Å²	95	68.5 Å²	68.5	51%	0.508	36%	0.362	S	S	.	.			trans	-69.8	109.3	179.5	-61.8	-35.5	0	0	0	112	E667 E673 G674	E667-D671 PolarHBondContact O-N 2.92Å; D671-E673 PolarHBondContact O-N 3.26Å; D671-E673 VanDerWaalsContact O-N 3.15Å; D671-G674 PolarHBondContact O-N 3.44Å
672	R	64.1	Low	86.9	Confident	243 Å²	243	68.2 Å²	68.2	92%	0.917	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.1	179.1	-84.4	179	156.6	-107.8	-2.3	114.9	L670	L670-R672 PolarHBondContact O-N 3.15Å
673	E	61.6	Low	87	Confident	199 Å²	199	67 Å²	67	93%	0.93	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-8.5	-177.2	-65.4	168.4	-167.6	0	0	111.7	D671 G675	D671-E673 PolarHBondContact O-N 3.26Å; D671-E673 VanDerWaalsContact O-N 3.15Å; E673-G675 PolarHBondContact O-N 2.66Å
674	G	60.3	Low	87	Confident	25 Å²	25	63.2 Å²	63.2	26%	0.258	34%	0.337	S	S	.	.			trans	-82.3	69.8	-171.6	0	0	0	0	0	114.7	D671	D671-G674 PolarHBondContact O-N 3.44Å
675	G	79.3	Confident	87.1	Confident	54 Å²	54	61.4 Å²	61.4	56%	0.557	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-54.4	149.9	176.2	0	0	0	0	0	114.3	K668 E673	K668-G675 PolarHBondContact NZ-O 3.27Å; E673-G675 PolarHBondContact O-N 2.66Å
676	I	87.9	Confident	87.4	Confident	40 Å²	40	60.6 Å²	60.6	21%	0.205	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-74.2	126.8	173.5	-54.4	-53.9	0	0	0	108.9	F268 F665 K668 D680	F268-I676 HydrophobicContact CE2-CG2 4.39Å; F665-I676 HydrophobicContact CD1-CD1 3.9Å; F665-I676 HydrophobicContact CE1-CD1 3.79Å; F665-I676 HydrophobicContact CE1-CG1 4.36Å; F665-I676 HydrophobicContact CE1-CG2 3.97Å; F665-I676 HydrophobicContact CZ-CG2 4.42Å; K668-I676 HydrophobicContact CB-CD1 4.31Å; K668-I676 HydrophobicContact CD-CD1 4.01Å; I676-D680 HydrophobicContact CG2-CB 3.85Å
677	S	90.7	Very high	87.6	Confident	37 Å²	37	58.2 Å²	58.2	26%	0.259	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-84.9	161.4	179.1	81.2	0	0	0	0	112	E679 D680 W681	S677-E679 PolarHBondContact O-N 3.42Å; S677-E679 PolarHBondContact OG-N 3.23Å; S677-D680 PolarHBondContact N-OD2 3.12Å; S677-D680 WeakPolarHBondContact O-CB 3.26Å; S677-D680 PolarHBondContact O-N 2.84Å; S677-D680 VanDerWaalsContact OG-CG 3.24Å; S677-D680 PolarHBondContact OG-N 3.49Å; S677-D680 PolarHBondContact OG-OD2 3.24Å; S677-W681 PolarHBondContact O-N 3.48Å
678	L	91.9	Very high	87.9	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-33	171.1	176.1	57.5	0	0	0	111.3	F268 F344 P507 W681 L682	F268-L678 HydrophobicContact CE1-CB 4.12Å; F268-L678 HydrophobicContact CE1-CD1 4.48Å; F268-L678 HydrophobicContact CZ-CB 4.39Å; F344-L678 HydrophobicContact CD1-CD1 4.44Å; F344-L678 HydrophobicContact CE1-CD1 3.57Å; F344-L678 HydrophobicContact CE1-CD2 4Å; F344-L678 HydrophobicContact CE1-CG 4.47Å; F344-L678 HydrophobicContact CZ-CD1 3.96Å; F344-L678 HydrophobicContact CZ-CD2 4.34Å; P507-L678 HydrophobicContact CG-CB 4.2Å; P507-L678 WeakPolarHBondContact O-CD2 3.5Å; L678-W681 HydrophobicContact CD1-CE3 3.59Å; L678-W681 HydrophobicContact CD1-CZ3 4.02Å; L678-W681 PolarHBondContact O-N 3.18Å; L678-L682 HydrophobicContact CD1-CD1 4.21Å; L678-L682 HydrophobicContact CD1-CG 4.16Å; L678-L682 HydrophobicContact CG-CD1 4.05Å; L678-L682 HydrophobicContact CG-CG 4.47Å; L678-L682 VanDerWaalsContact O-CG 3.32Å; L678-L682 WeakPolarHBondContact O-CG 3.42Å; L678-L682 PolarHBondContact O-N 3.08Å
679	E	93.6	Very high	88.2	Confident	49 Å²	49	57.5 Å²	57.5	23%	0.229	30%	0.302	C	S	.	.	H	α-helix	trans	-65.8	-40.4	174.3	-157.3	-170.9	134.5	0	0	112.1	R450 L454 P507 W627 S677 W681 L682 C683	R450-E679 IonicContact CZ-OE1 1.77Å; R450-E679 IonicContact NE-OE2 3.16Å; R450-E679 IonicContact NH2-OE1 3.83Å; R450-E679 PolarHBondContact NH2-OE1 3.48Å; R450-E679 IonicContact NH2-OE2 3.69Å; L454-E679 HydrophobicContact CD2-CG 4.08Å; P507-E679 HydrophobicContact CG-CB 4.25Å; W627-E679 HydrophobicContact CZ2-CG 3.6Å; W627-E679 PolarHBondContact NE1-OE1 3.28Å; S677-E679 PolarHBondContact O-N 3.42Å; S677-E679 PolarHBondContact OG-N 3.23Å; E679-W681 VanDerWaalsContact C-N 3.25Å; E679-W681 PolarHBondContact O-N 3.35Å; E679-L682 PolarHBondContact O-N 3.1Å; E679-C683 VanDerWaalsContact O-CB 3.22Å; E679-C683 WeakPolarHBondContact O-CB 3.49Å; E679-C683 PolarHBondContact O-N 3.42Å
680	D	93.8	Very high	88.7	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.027	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-38.7	176.8	-64.3	-34.9	0	0	0	111.1	K664 F665 K668 I676 S677 A684	K664-D680 WeakPolarHBondContact CE-OD1 3.19Å; K664-D680 IonicContact NZ-OD1 2.8Å; K664-D680 PolarHBondContact NZ-OD1 3.37Å; F665-D680 HydrophobicContact CZ-CB 4.19Å; K668-D680 IonicContact NZ-OD2 2.63Å; K668-D680 PolarHBondContact NZ-OD2 3.38Å; I676-D680 HydrophobicContact CG2-CB 3.85Å; S677-D680 PolarHBondContact N-OD2 3.12Å; S677-D680 WeakPolarHBondContact O-CB 3.26Å; S677-D680 PolarHBondContact O-N 2.84Å; S677-D680 VanDerWaalsContact OG-CG 3.24Å; S677-D680 PolarHBondContact OG-N 3.49Å; S677-D680 PolarHBondContact OG-OD2 3.24Å; D680-A684 VanDerWaalsContact O-CB 3.24Å; D680-A684 WeakPolarHBondContact O-CB 3.5Å; D680-A684 PolarHBondContact O-N 2.71Å
681	W	95.2	Very high	89.1	Confident	8 Å²	8	49.9 Å²	49.9	3%	0.03	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-47.6	176.8	179.1	31.1	0	0	0	112.9	A261 C264 E265 F268 F344 S677 L678 E679 C683 A684 Q685	A261-W681 PolarHBondContact O-NE1 3.47Å; C264-W681 HydrophobicContact CB-CB 3.88Å; C264-W681 HydrophobicContact CB-CD2 4.19Å; C264-W681 HydrophobicContact CB-CG 3.5Å; C264-W681 VanDerWaalsContact CB-CG 3.5Å; E265-W681 HydrophobicContact CB-CZ2 3.61Å; E265-W681 HydrophobicContact CG-CH2 4.46Å; E265-W681 HydrophobicContact CG-CZ2 3.81Å; F268-W681 HydrophobicContact CB-CE3 3.77Å; F268-W681 HydrophobicContact CB-CH2 4.05Å; F268-W681 HydrophobicContact CB-CZ3 3.47Å; F268-W681 VanDerWaalsContact CB-CZ3 3.47Å; F268-W681 HydrophobicContact CD1-CE3 4.1Å; F268-W681 HydrophobicContact CD1-CZ3 4.32Å; F268-W681 HydrophobicContact CD2-CB 4.17Å; F268-W681 AromaticContact CD2-CD2 3.73Å; F268-W681 HydrophobicContact CD2-CD2 3.73Å; F268-W681 AromaticContact CD2-CE3 3.34Å; F268-W681 HydrophobicContact CD2-CE3 3.34Å; F268-W681 HydrophobicContact CD2-CG 4.09Å; F268-W681 HydrophobicContact CD2-CZ3 4.01Å; F268-W681 HydrophobicContact CE2-CB 3.82Å; F268-W681 HydrophobicContact CE2-CD2 4.28Å; F268-W681 AromaticContact CE2-CE3 4Å; F268-W681 HydrophobicContact CE2-CE3 4Å; F268-W681 HydrophobicContact CE2-CG 4.25Å; F268-W681 HydrophobicContact CG-CD2 4.27Å; F268-W681 AromaticContact CG-CE3 3.46Å; F268-W681 HydrophobicContact CG-CE3 3.46Å; F268-W681 VanDerWaalsContact CG-CE3 3.46Å; F268-W681 AromaticContact CG-CZ3 3.68Å; F268-W681 HydrophobicContact CG-CZ3 3.68Å; F344-W681 HydrophobicContact CB-CH2 3.85Å; F344-W681 HydrophobicContact CB-CZ3 4.23Å; F344-W681 HydrophobicContact CD1-CH2 4.14Å; F344-W681 AromaticContact CD1-CZ3 3.67Å; F344-W681 HydrophobicContact CD1-CZ3 3.67Å; F344-W681 HydrophobicContact CD2-CH2 4.11Å; F344-W681 AromaticContact CD2-CZ3 3.81Å; F344-W681 HydrophobicContact CD2-CZ3 3.81Å; F344-W681 AromaticContact CE1-CZ3 3.89Å; F344-W681 HydrophobicContact CE1-CZ3 3.89Å; F344-W681 HydrophobicContact CE2-CZ3 4.02Å; F344-W681 AromaticContact CG-CH2 3.77Å; F344-W681 HydrophobicContact CG-CH2 3.77Å; F344-W681 AromaticContact CG-CZ3 3.63Å; F344-W681 HydrophobicContact CG-CZ3 3.63Å; F344-W681 HydrophobicContact CZ-CZ3 4.05Å; S677-W681 PolarHBondContact O-N 3.48Å; L678-W681 HydrophobicContact CD1-CE3 3.59Å; L678-W681 HydrophobicContact CD1-CZ3 4.02Å; L678-W681 PolarHBondContact O-N 3.18Å; E679-W681 VanDerWaalsContact C-N 3.25Å; E679-W681 PolarHBondContact O-N 3.35Å; W681-C683 VanDerWaalsContact C-N 3.31Å; W681-C683 PolarHBondContact O-N 2.78Å; W681-A684 WeakPolarHBondContact O-CB 3.46Å; W681-A684 PolarHBondContact O-N 3.28Å; W681-A684 VanDerWaalsContact O-N 3.17Å; W681-Q685 PolarHBondContact O-N 3.23Å
682	L	96.6	Very high	89.6	Confident	7 Å²	7	46.3 Å²	46.3	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-38.8	178.3	-66.7	168.9	0	0	0	111.8	L454 L457 Q458 W627 L678 E679 Q685 Y686	L454-L682 HydrophobicContact CD2-CD1 4.29Å; L457-L682 HydrophobicContact CD2-CB 4.22Å; L457-L682 HydrophobicContact CD2-CD1 4.43Å; L457-L682 HydrophobicContact CD2-CD2 4.44Å; Q458-L682 HydrophobicContact CG-CD1 4.27Å; W627-L682 HydrophobicContact CH2-CB 3.69Å; W627-L682 HydrophobicContact CZ2-CB 4.31Å; L678-L682 HydrophobicContact CD1-CD1 4.21Å; L678-L682 HydrophobicContact CD1-CG 4.16Å; L678-L682 HydrophobicContact CG-CD1 4.05Å; L678-L682 HydrophobicContact CG-CG 4.47Å; L678-L682 VanDerWaalsContact O-CG 3.32Å; L678-L682 WeakPolarHBondContact O-CG 3.42Å; L678-L682 PolarHBondContact O-N 3.08Å; E679-L682 PolarHBondContact O-N 3.1Å; L682-Q685 PolarHBondContact O-N 3.07Å; L682-Y686 PolarHBondContact O-N 3.03Å; L682-Y686 VanDerWaalsContact O-N 3.1Å
683	C	97.1	Very high	91.1	Very high	16 Å²	16	39.5 Å²	39.5	11%	0.108	22%	0.221	C	C	.	.	H	α-helix	trans	-68.2	-39	173.8	-172	0	0	0	0	112	W627 E679 W681 Y686 L687	W627-C683 HydrophobicContact CD2-CB 3.99Å; W627-C683 HydrophobicContact CE3-CB 4.45Å; W627-C683 HydrophobicContact CG-CB 4.4Å; W627-C683 HydrophobicContact CZ2-CB 4.07Å; E679-C683 VanDerWaalsContact O-CB 3.22Å; E679-C683 WeakPolarHBondContact O-CB 3.49Å; E679-C683 PolarHBondContact O-N 3.42Å; W681-C683 VanDerWaalsContact C-N 3.31Å; W681-C683 PolarHBondContact O-N 2.78Å; C683-Y686 PolarHBondContact O-N 3.35Å; C683-L687 PolarHBondContact O-N 3.07Å
684	A	96.9	Very high	92.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-42.4	173.3	0	0	0	0	0	112.3	A261 L661 F665 D680 W681 A688	A261-A684 HydrophobicContact CB-CB 4.4Å; L661-A684 HydrophobicContact CD2-CB 4.11Å; F665-A684 HydrophobicContact CE2-CB 4.04Å; F665-A684 HydrophobicContact CZ-CB 4.2Å; D680-A684 VanDerWaalsContact O-CB 3.24Å; D680-A684 WeakPolarHBondContact O-CB 3.5Å; D680-A684 PolarHBondContact O-N 2.71Å; W681-A684 WeakPolarHBondContact O-CB 3.46Å; W681-A684 PolarHBondContact O-N 3.28Å; W681-A684 VanDerWaalsContact O-N 3.17Å; A684-A688 WeakPolarHBondContact O-CB 3.37Å; A684-A688 PolarHBondContact O-N 3.04Å
685	Q	96.8	Very high	94.3	Very high	40 Å²	40	31.3 Å²	31.3	19%	0.187	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-49	173.3	-74.1	179.3	-21.4	0	0	111.2	A261 W681 L682 A688 F689	A261-Q685 HydrophobicContact CB-CG 4.18Å; W681-Q685 PolarHBondContact O-N 3.23Å; L682-Q685 PolarHBondContact O-N 3.07Å; Q685-A688 PolarHBondContact O-N 2.85Å; Q685-F689 VanDerWaalsContact O-CD2 3.31Å; Q685-F689 WeakPolarHBondContact O-CD2 3.13Å; Q685-F689 PolarHBondContact O-N 3.05Å
686	Y	97.9	Very high	94.9	Very high	6 Å²	6	29 Å²	29	2%	0.024	16%	0.157	C	C	.	.	H	α-helix	trans	-55.7	-56.3	177	172.2	-136.7	0	0	0	112.1	Q623 W627 G628 W653 L682 C683 A688 F689 A690 L695	Q623-Y686 HydrophobicContact CB-CD1 4.25Å; Q623-Y686 HydrophobicContact CB-CD2 3.53Å; Q623-Y686 HydrophobicContact CB-CE1 4.44Å; Q623-Y686 HydrophobicContact CB-CE2 3.74Å; Q623-Y686 HydrophobicContact CB-CG 3.78Å; Q623-Y686 HydrophobicContact CG-CD2 4.01Å; Q623-Y686 HydrophobicContact CG-CG 4.1Å; Q623-Y686 VanDerWaalsContact OE1-CD2 3.26Å; W627-Y686 HydrophobicContact CB-CD1 4.26Å; W627-Y686 HydrophobicContact CB-CE1 4.19Å; W627-Y686 AromaticContact CE3-CD1 3.93Å; W627-Y686 HydrophobicContact CE3-CD1 3.93Å; W627-Y686 HydrophobicContact CE3-CG 4.47Å; G628-Y686 WeakPolarHBondContact CA-OH 3.31Å; W653-Y686 HydrophobicContact CH2-CE1 4.09Å; L682-Y686 PolarHBondContact O-N 3.03Å; L682-Y686 VanDerWaalsContact O-N 3.1Å; C683-Y686 PolarHBondContact O-N 3.35Å; Y686-A688 VanDerWaalsContact C-N 3.32Å; Y686-A688 PolarHBondContact O-N 3.05Å; Y686-F689 PolarHBondContact O-N 3.03Å; Y686-A690 HydrophobicContact CD2-CB 4.03Å; Y686-A690 HydrophobicContact CE2-CB 3.94Å; Y686-A690 VanDerWaalsContact O-CB 3.25Å; Y686-A690 WeakPolarHBondContact O-CB 3.48Å; Y686-A690 PolarHBondContact O-N 3.12Å; Y686-L695 HydrophobicContact CE2-CD2 4.06Å; Y686-L695 VanDerWaalsContact OH-CD2 3.25Å; Y686-L695 WeakPolarHBondContact OH-CD2 3.37Å
687	L	97.9	Very high	95.1	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-72.9	-21.5	-175.2	-63.4	-177.6	0	0	0	113.4	L257 W653 L654 K657 R658 L661 C683	L257-L687 HydrophobicContact CD1-CB 3.96Å; W653-L687 HydrophobicContact CH2-CD2 4.31Å; W653-L687 HydrophobicContact CZ3-CD2 4.38Å; L654-L687 HydrophobicContact CD2-CD2 4.39Å; K657-L687 HydrophobicContact CB-CD1 3.91Å; K657-L687 HydrophobicContact CB-CD2 4.03Å; R658-L687 HydrophobicContact CG-CB 4.27Å; R658-L687 VanDerWaalsContact CZ-O 3.28Å; R658-L687 PolarHBondContact NE-O 2.87Å; R658-L687 PolarHBondContact NH2-O 2.98Å; L661-L687 HydrophobicContact CB-CD1 4.17Å; L661-L687 HydrophobicContact CD2-CD1 3.89Å; C683-L687 PolarHBondContact O-N 3.07Å
688	A	96.8	Very high	95.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-69.2	-33.3	172.9	0	0	0	0	0	113.4	L257 K258 A684 Q685 Y686	L257-A688 HydrophobicContact CB-CB 3.97Å; K258-A688 WeakPolarHBondContact CE-O 3.35Å; K258-A688 HydrophobicContact CG-CB 3.85Å; A684-A688 WeakPolarHBondContact O-CB 3.37Å; A684-A688 PolarHBondContact O-N 3.04Å; Q685-A688 PolarHBondContact O-N 2.85Å; Y686-A688 VanDerWaalsContact C-N 3.32Å; Y686-A688 PolarHBondContact O-N 3.05Å
689	F	96.5	Very high	95.2	Very high	138 Å²	138	30.9 Å²	30.9	61%	0.605	16%	0.157	S	C	*	.	H	α-helix	trans	-114.5	-19.5	-170.9	-66	-70.5	0	0	0	115.3	K258 Q685 Y686	K258-F689 HydrophobicContact CD-CE1 4.45Å; K258-F689 HydrophobicContact CG-CE1 4.22Å; K258-F689 HydrophobicContact CG-CZ 4.28Å; Q685-F689 VanDerWaalsContact O-CD2 3.31Å; Q685-F689 WeakPolarHBondContact O-CD2 3.13Å; Q685-F689 PolarHBondContact O-N 3.05Å; Y686-F689 PolarHBondContact O-N 3.03Å
690	A	96.5	Very high	95	Very high	8 Å²	8	33.9 Å²	33.9	7%	0.066	17%	0.169	C	C	.	.			trans	-61.4	139.2	178.4	0	0	0	0	0	113.6	L654 R658 Y686 L695	L654-A690 HydrophobicContact CD2-CB 4.01Å; R658-A690 PolarHBondContact NH2-O 3.23Å; Y686-A690 HydrophobicContact CD2-CB 4.03Å; Y686-A690 HydrophobicContact CE2-CB 3.94Å; Y686-A690 VanDerWaalsContact O-CB 3.25Å; Y686-A690 WeakPolarHBondContact O-CB 3.48Å; Y686-A690 PolarHBondContact O-N 3.12Å; A690-L695 HydrophobicContact CB-CD2 4.49Å
691	T	96.1	Very high	94.9	Very high	65 Å²	65	34.9 Å²	34.9	40%	0.399	17%	0.174	S	C	.	.			trans	-119.4	167.7	176.2	70.3	0	0	0	0	111.1	D693 S694 L695	T691-D693 PolarHBondContact O-N 3.1Å; T691-D693 PolarHBondContact OG1-N 3.48Å; T691-S694 PolarHBondContact N-OG 3.12Å; T691-S694 PolarHBondContact O-N 2.88Å; T691-S694 PolarHBondContact O-OG 3.2Å; T691-S694 PolarHBondContact OG1-N 3.1Å; T691-L695 WeakPolarHBondContact O-CB 3.32Å; T691-L695 VanDerWaalsContact O-CG 3.3Å; T691-L695 WeakPolarHBondContact O-CG 3.31Å; T691-L695 PolarHBondContact O-N 3.43Å
692	T	95.3	Very high	94.5	Very high	19 Å²	19	34.7 Å²	34.7	12%	0.117	17%	0.174	C	C	.	.	H	α-helix	trans	-56.9	-36.4	171.3	46.4	0	0	0	0	111.9	L650 Q651 S696	L650-T692 HydrophobicContact CB-CG2 4.24Å; L650-T692 WeakPolarHBondContact CD1-O 3.38Å; Q651-T692 HydrophobicContact CB-CG2 3.81Å; T692-S696 WeakPolarHBondContact O-CB 3.11Å; T692-S696 PolarHBondContact O-N 3.44Å
693	D	94.8	Very high	93.7	Very high	100 Å²	100	36.9 Å²	36.9	54%	0.535	18%	0.184	S	C	.	.	H	α-helix	trans	-78.7	-40.1	-174.2	-48.4	-42	0	0	0	111.2	T691 S696 Y697	T691-D693 PolarHBondContact O-N 3.1Å; T691-D693 PolarHBondContact OG1-N 3.48Å; D693-S696 PolarHBondContact O-N 2.74Å; D693-Y697 WeakPolarHBondContact O-CB 3.28Å; D693-Y697 PolarHBondContact O-N 3.32Å
694	S	94.4	Very high	92.1	Very high	50 Å²	50	44.6 Å²	44.6	35%	0.35	21%	0.212	S	C	.	.	H	α-helix	trans	-64.7	-43.8	173.7	75.1	0	0	0	0	110.9	T691 Y697 I698	T691-S694 PolarHBondContact N-OG 3.12Å; T691-S694 PolarHBondContact O-N 2.88Å; T691-S694 PolarHBondContact O-OG 3.2Å; T691-S694 PolarHBondContact OG1-N 3.1Å; S694-Y697 PolarHBondContact O-N 3.16Å; S694-I698 VanDerWaalsContact O-CG1 3.3Å; S694-I698 WeakPolarHBondContact O-CG1 3.34Å; S694-I698 PolarHBondContact O-N 2.7Å
695	L	93.6	Very high	90.1	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-45	173.7	-67.1	179.7	0	0	0	111.6	L650 W653 L654 Y686 A690 T691 Y697 I698 V699	L650-L695 HydrophobicContact CD1-CB 4.05Å; L650-L695 HydrophobicContact CD2-CB 4.23Å; L650-L695 HydrophobicContact CD2-CD1 4.5Å; W653-L695 HydrophobicContact CE3-CD1 3.84Å; W653-L695 HydrophobicContact CZ3-CD1 3.75Å; L654-L695 HydrophobicContact CD1-CD1 3.84Å; L654-L695 HydrophobicContact CD2-CD1 3.9Å; L654-L695 HydrophobicContact CG-CD1 3.67Å; Y686-L695 HydrophobicContact CE2-CD2 4.06Å; Y686-L695 VanDerWaalsContact OH-CD2 3.25Å; Y686-L695 WeakPolarHBondContact OH-CD2 3.37Å; A690-L695 HydrophobicContact CB-CD2 4.49Å; T691-L695 WeakPolarHBondContact O-CB 3.32Å; T691-L695 VanDerWaalsContact O-CG 3.3Å; T691-L695 WeakPolarHBondContact O-CG 3.31Å; T691-L695 PolarHBondContact O-N 3.43Å; L695-Y697 PolarHBondContact O-N 3.32Å; L695-I698 PolarHBondContact O-N 3.03Å; L695-V699 WeakPolarHBondContact O-CB 3.4Å; L695-V699 WeakPolarHBondContact O-CG2 3.36Å; L695-V699 PolarHBondContact O-N 3.19Å
696	S	92.9	Very high	89.8	Confident	6 Å²	6	55.7 Å²	55.7	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-26.2	177	-178	0	0	0	0	113.2	T692 D693 K700	T692-S696 WeakPolarHBondContact O-CB 3.11Å; T692-S696 PolarHBondContact O-N 3.44Å; D693-S696 PolarHBondContact O-N 2.74Å; S696-K700 WeakPolarHBondContact O-CD 3.5Å; S696-K700 WeakPolarHBondContact O-CE 3.47Å; S696-K700 VanDerWaalsContact O-CG 3.23Å; S696-K700 WeakPolarHBondContact O-CG 2.95Å; S696-K700 PolarHBondContact O-NZ 3.08Å; S696-K700 PolarHBondContact OG-NZ 3.23Å; S696-K700 VanDerWaalsContact OG-NZ 3.07Å
697	Y	93	Very high	89.4	Confident	112 Å²	112	58.3 Å²	58.3	44%	0.439	27%	0.266	S	S	.	.	H	α-helix	trans	-77.8	-55.1	172.2	178	-114.6	0	0	0	111.8	D617 D693 S694 L695 V699 K700 I701	D617-Y697 HydrophobicContact CB-CE1 4.43Å; D693-Y697 WeakPolarHBondContact O-CB 3.28Å; D693-Y697 PolarHBondContact O-N 3.32Å; S694-Y697 PolarHBondContact O-N 3.16Å; L695-Y697 PolarHBondContact O-N 3.32Å; Y697-V699 VanDerWaalsContact C-N 3.31Å; Y697-V699 PolarHBondContact O-N 2.78Å; Y697-K700 WeakPolarHBondContact O-CB 3.49Å; Y697-K700 PolarHBondContact O-N 2.68Å; Y697-I701 HydrophobicContact CD1-CD1 4.34Å; Y697-I701 HydrophobicContact CE1-CD1 3.83Å; Y697-I701 HydrophobicContact CE2-CD1 4.44Å; Y697-I701 PolarHBondContact O-N 3.02Å
698	I	93.4	Very high	88.9	Confident	11 Å²	11	61.3 Å²	61.3	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-40.6	-179.2	-62.2	-63.2	0	0	0	111.8	D617 I621 C624 S694 L695 K700 I701 L702	D617-I698 WeakPolarHBondContact O-CD1 3.41Å; I621-I698 HydrophobicContact CB-CG2 4.49Å; I621-I698 HydrophobicContact CG1-CD1 4.11Å; I621-I698 HydrophobicContact CG1-CG2 3.98Å; C624-I698 HydrophobicContact CB-CG2 3.76Å; S694-I698 VanDerWaalsContact O-CG1 3.3Å; S694-I698 WeakPolarHBondContact O-CG1 3.34Å; S694-I698 PolarHBondContact O-N 2.7Å; L695-I698 PolarHBondContact O-N 3.03Å; I698-K700 VanDerWaalsContact C-N 3.28Å; I698-K700 PolarHBondContact O-N 3.46Å; I698-I701 PolarHBondContact O-N 2.73Å; I698-L702 HydrophobicContact CG2-CD1 4.17Å; I698-L702 PolarHBondContact O-N 2.86Å
699	V	90.5	Very high	88.5	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-30.3	177.1	168.9	0	0	0	0	112.2	P629 F634 F637 L695 Y697 L702 Q703	P629-V699 HydrophobicContact CG-CG2 3.91Å; F634-V699 HydrophobicContact CD1-CG1 3.77Å; F634-V699 HydrophobicContact CD1-CG2 4.34Å; F634-V699 HydrophobicContact CE1-CB 4.37Å; F634-V699 HydrophobicContact CE1-CG1 3.91Å; F634-V699 HydrophobicContact CE1-CG2 3.73Å; F634-V699 HydrophobicContact CG-CG1 4.31Å; F634-V699 HydrophobicContact CZ-CG2 4.32Å; F637-V699 HydrophobicContact CD1-CG1 4.11Å; F637-V699 HydrophobicContact CE1-CG1 4.2Å; L695-V699 WeakPolarHBondContact O-CB 3.4Å; L695-V699 WeakPolarHBondContact O-CG2 3.36Å; L695-V699 PolarHBondContact O-N 3.19Å; Y697-V699 VanDerWaalsContact C-N 3.31Å; Y697-V699 PolarHBondContact O-N 2.78Å; V699-L702 CarbonylContact O-C 3.32Å; V699-L702 PolarHBondContact O-N 2.64Å; V699-Q703 HydrophobicContact CG1-CG 4.31Å; V699-Q703 VanDerWaalsContact O-CB 3.28Å; V699-Q703 WeakPolarHBondContact O-CB 3.36Å; V699-Q703 WeakPolarHBondContact O-CG 3.45Å; V699-Q703 PolarHBondContact O-N 3.37Å; V699-Q703 VanDerWaalsContact O-N 3.08Å
700	K	89.8	Confident	88	Confident	113 Å²	113	60.3 Å²	60.3	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-71.5	-36.6	174.4	-71.7	163	-166.8	145.9	0	112.2	S696 Y697 I698 Q703 Y704	S696-K700 WeakPolarHBondContact O-CD 3.5Å; S696-K700 WeakPolarHBondContact O-CE 3.47Å; S696-K700 VanDerWaalsContact O-CG 3.23Å; S696-K700 WeakPolarHBondContact O-CG 2.95Å; S696-K700 PolarHBondContact O-NZ 3.08Å; S696-K700 PolarHBondContact OG-NZ 3.23Å; S696-K700 VanDerWaalsContact OG-NZ 3.07Å; Y697-K700 WeakPolarHBondContact O-CB 3.49Å; Y697-K700 PolarHBondContact O-N 2.68Å; I698-K700 VanDerWaalsContact C-N 3.28Å; I698-K700 PolarHBondContact O-N 3.46Å; K700-Q703 PolarHBondContact O-N 2.74Å; K700-Y704 PolarHBondContact O-N 3.25Å
701	I	90.1	Very high	87.4	Confident	26 Å²	26	63.7 Å²	63.7	13%	0.133	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-47.9	173.4	-56.6	171.5	0	0	0	108.9	I621 Y697 I698 Q703 Y704	I621-I701 HydrophobicContact CD1-CD1 4.32Å; I621-I701 HydrophobicContact CD1-CG2 3.96Å; Y697-I701 HydrophobicContact CD1-CD1 4.34Å; Y697-I701 HydrophobicContact CE1-CD1 3.83Å; Y697-I701 HydrophobicContact CE2-CD1 4.44Å; Y697-I701 PolarHBondContact O-N 3.02Å; I698-I701 PolarHBondContact O-N 2.73Å; I701-Q703 PolarHBondContact O-N 2.6Å; I701-Q703 VanDerWaalsContact O-N 3.1Å; I701-Y704 PolarHBondContact O-N 3.17Å
702	L	87.3	Confident	86.8	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.021	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	18.3	174.2	-66.4	176	0	0	0	114.7	W595 I621 C624 L625 F634 I698 V699	W595-L702 WeakPolarHBondContact CH2-O 3.45Å; W595-L702 HydrophobicContact CZ3-CB 4.36Å; W595-L702 HydrophobicContact CZ3-CD2 4.16Å; W595-L702 WeakPolarHBondContact CZ3-O 3.37Å; I621-L702 HydrophobicContact CG2-CD1 4.31Å; I621-L702 HydrophobicContact CG2-CD2 4.07Å; I621-L702 HydrophobicContact CG2-CG 4.4Å; C624-L702 HydrophobicContact CB-CD1 3.98Å; L625-L702 HydrophobicContact CD2-CD1 4.02Å; L625-L702 HydrophobicContact CD2-CD2 4.19Å; L625-L702 HydrophobicContact CG-CD1 4.47Å; F634-L702 HydrophobicContact CE2-CB 4.09Å; F634-L702 WeakPolarHBondContact CE2-O 2.98Å; F634-L702 HydrophobicContact CZ-CB 4.32Å; I698-L702 HydrophobicContact CG2-CD1 4.17Å; I698-L702 PolarHBondContact O-N 2.86Å; V699-L702 CarbonylContact O-C 3.32Å; V699-L702 PolarHBondContact O-N 2.64Å
703	Q	79.6	Confident	86.1	Confident	52 Å²	52	67.1 Å²	67.1	24%	0.243	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-10.1	170.9	-84.1	173.8	3.8	0	0	113.4	F634 V699 K700 I701 R705	F634-Q703 HydrophobicContact CB-CG 4.34Å; F634-Q703 VanDerWaalsContact CB-NE2 3.32Å; F634-Q703 HydrophobicContact CD2-CG 4.15Å; F634-Q703 HydrophobicContact CG-CG 4.34Å; F634-Q703 PolarHBondContact O-NE2 3.4Å; V699-Q703 HydrophobicContact CG1-CG 4.31Å; V699-Q703 VanDerWaalsContact O-CB 3.28Å; V699-Q703 WeakPolarHBondContact O-CB 3.36Å; V699-Q703 WeakPolarHBondContact O-CG 3.45Å; V699-Q703 PolarHBondContact O-N 3.37Å; V699-Q703 VanDerWaalsContact O-N 3.08Å; K700-Q703 PolarHBondContact O-N 2.74Å; I701-Q703 PolarHBondContact O-N 2.6Å; I701-Q703 VanDerWaalsContact O-N 3.1Å; Q703-R705 PolarHBondContact O-N 3.17Å
704	Y	63.9	Low	85.4	Confident	179 Å²	179	64.3 Å²	64.3	70%	0.702	28%	0.276	S	S	*	.			trans	-73.2	111.2	171.8	-155.1	-86.7	0	0	0	108.1	W595 Q599 K700 I701	W595-Y704 WeakPolarHBondContact CZ2-O 3.25Å; Q599-Y704 PolarHBondContact NE2-O 3.19Å; K700-Y704 PolarHBondContact O-N 3.25Å; I701-Y704 PolarHBondContact O-N 3.17Å
705	R	56	Low	84.6	Confident	216 Å²	216	65.6 Å²	65.6	82%	0.815	27%	0.269	S	S	*	.			trans	-112.5	0	179	-83.2	-176.8	173.8	-164.6	0.8	110.2	W595 E631 Q703	W595-R705 HydrophobicContact CH2-CG 4.2Å; W595-R705 HydrophobicContact CZ2-CB 4.4Å; W595-R705 HydrophobicContact CZ2-CG 3.44Å; W595-R705 VanDerWaalsContact CZ2-CG 3.44Å; E631-R705 VanDerWaalsContact CD-NH2 3.3Å; E631-R705 IonicContact OE1-CZ 3.75Å; E631-R705 IonicContact OE1-NH2 2.66Å; E631-R705 PolarHBondContact OE1-NH2 2.85Å; E631-R705 IonicContact OE2-NH2 3.26Å; E631-R705 PolarHBondContact OE2-NH2 3.2Å; Q703-R705 PolarHBondContact O-N 3.17Å

Retrieved 705 of 705 residues in 175.7 ms (Link to these results)

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