A0A087YKJ2_POEFO Loading...

Retinoic acid receptor RXR

Receptor for retinoic acid that acts as a transcription factor. Forms homo- or heterodimers with retinoic acid receptors (rars) and binds to target response elements in response to their ligands, all-trans or 9-cis retinoic acid, to regulate gene expression in various biological processes.

AlphaFold DB , UniProt , Accession A0A087YKJ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 453 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	40.5	Very low	243 Å²	243	148.9 Å²	148.9	100%	1.197	77%	0.774	S	S	*	*				0	131.4	0	-85.9	174.9	166.2	0	0	107.1
2	D	35	Very low	40	Very low	150 Å²	150	145.1 Å²	145.1	80%	0.802	77%	0.77	S	S	*	*			trans	-70.3	147.4	-150.4	-66.2	-84.3	0	0	0	117.8
3	S	41.6	Very low	39.6	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	77%	0.771	S	S	*	*				49.4	119.7	129.2	-52.1	0	0	0	0	121.5
4	N	40.7	Very low	39.1	Very low	171 Å²	171	136.1 Å²	136.1	91%	0.914	77%	0.767	S	S	*	*				-167.4	122.6	122	-106.6	-5.1	0	0	0	113
5	D	47	Very low	39.8	Very low	145 Å²	145	134.5 Å²	134.5	78%	0.775	76%	0.764	S	S	*	*			trans	-71.7	-170.8	160.7	-114.2	-32.8	0	0	0	110.6
6	P	61.5	Low	39.5	Very low	98 Å²	98	137.2 Å²	137.2	64%	0.636	77%	0.771	S	S	*	*			cis	-142.4	173.9	-29	34.6	-13.7	0	0	0	115.5
7	Y	38.7	Very low	39.2	Very low	200 Å²	200	138.8 Å²	138.8	78%	0.784	78%	0.777	S	S	*	*			trans	67.4	122.5	135.4	-86	-123.8	0	0	0	126.3
8	L	38.9	Very low	39.2	Very low	122 Å²	122	136.2 Å²	136.2	64%	0.639	78%	0.776	S	S	*	*				77.2	130.8	129.6	-68.9	178.6	0	0	0	125.2
9	H	38.3	Very low	38.8	Very low	155 Å²	155	133.2 Å²	133.2	72%	0.718	78%	0.779	S	S	*	*				147.9	145.1	117.4	-93.8	-86.7	0	0	0	110.6
10	L	36.1	Very low	38.8	Very low	114 Å²	114	136.6 Å²	136.6	60%	0.597	79%	0.786	S	S	*	*			cis	-177.2	157.2	-12.4	-147.1	79	0	0	0	107.1
11	N	33.7	Very low	38.6	Very low	138 Å²	138	135 Å²	135	74%	0.738	79%	0.79	S	S	*	*			trans	71.6	146.9	151.6	-71.8	-3.2	0	0	0	119.9
12	S	34.1	Very low	38.9	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	77%	0.774	S	S	*	*			cis	-167.8	149.7	12.6	-133.5	0	0	0	0	112.4
13	A	34.8	Very low	39.6	Very low	95 Å²	95	130.3 Å²	130.3	79%	0.785	77%	0.769	S	S	*	*			trans	57.8	130.2	135.5	0	0	0	0	0	123.5
14	G	32.5	Very low	40	Very low	70 Å²	70	131.8 Å²	131.8	72%	0.722	78%	0.776	S	S	*	*			trans	-75.7	-145.8	165.2	0	0	0	0	0	113.9
15	P	50.3	Low	39.8	Very low	111 Å²	111	129 Å²	129	72%	0.721	77%	0.77	S	S	*	*			cis	-146.1	-177.1	9.9	40	-16.4	0	0	0	117.2
16	M	35.2	Very low	39.3	Very low	178 Å²	178	130.9 Å²	130.9	88%	0.877	78%	0.777	S	S	*	*			trans	66.6	128	153.5	-38.7	-152.7	174.1	0	0	122.2
17	N	34.4	Very low	38.1	Very low	164 Å²	164	131.1 Å²	131.1	88%	0.877	79%	0.787	S	S	*	*				-179.4	151.4	100.8	-151.3	6.4	0	0	0	113.1
18	A	38.7	Very low	37.9	Very low	92 Å²	92	125 Å²	125	76%	0.76	79%	0.785	S	S	*	*			trans	-94.6	163.2	-179.1	0	0	0	0	0	113.2
19	G	31.2	Very low	37.6	Very low	80 Å²	80	127.8 Å²	127.8	83%	0.825	80%	0.797	S	S	*	*			trans	-179.5	113.2	166.4	0	0	0	0	0	114.9
20	H	39.2	Very low	37.5	Very low	200 Å²	200	126.8 Å²	126.8	93%	0.926	80%	0.802	S	S	*	*			trans	-70.3	153.3	171.1	-74.6	-37.4	0	0	0	113.8
21	A	33.8	Very low	37.2	Very low	104 Å²	104	124.7 Å²	124.7	86%	0.86	81%	0.807	S	S	*	*			trans	-163.2	139.5	142.1	0	0	0	0	0	113.4
22	H	42	Very low	37.2	Very low	185 Å²	185	126.6 Å²	126.6	86%	0.856	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77	172.2	-177.9	-89.5	-86.9	0	0	0	115.2
23	P	48.3	Very low	37.8	Very low	109 Å²	109	127.1 Å²	127.1	71%	0.708	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-88.2	166.7	177.1	37.2	-33.9	0	0	0	112.8
24	P	50.7	Low	37.7	Very low	133 Å²	133	127.1 Å²	127.1	86%	0.864	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-92.3	154.5	176.1	35.3	-30	0	0	0	113.3
25	S	36	Very low	37.7	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	81%	0.808	S	S	*	*			trans	-129.4	155.4	174	66.1	0	0	0	0	110.3
26	M	37.7	Very low	36.8	Very low	184 Å²	184	131.8 Å²	131.8	91%	0.906	81%	0.812	S	S	*	*			trans	-151.6	116.4	149.9	-77.1	-142.6	171.8	0	0	106
27	A	36.4	Very low	36.5	Very low	103 Å²	103	128 Å²	128	85%	0.851	80%	0.803	S	S	*	*				61.7	130	70.9	0	0	0	0	0	112.7
28	G	32.8	Very low	36.3	Very low	73 Å²	73	124.6 Å²	124.6	75%	0.753	79%	0.792	S	S	*	*			cis	-158.5	-174.4	-0.4	0	0	0	0	0	106.3
29	M	34.6	Very low	35.9	Very low	180 Å²	180	125.4 Å²	125.4	89%	0.887	79%	0.792	S	S	*	*			cis	176.4	144.5	40.7	-126.7	-160.5	157.9	0	0	110.2
30	V	34.5	Very low	35.9	Very low	134 Å²	134	133 Å²	133	81%	0.812	80%	0.796	S	S	*	*			trans	55.2	138.6	145.2	-151.3	0	0	0	0	120.3
31	G	29.5	Very low	36	Very low	69 Å²	69	128.6 Å²	128.6	71%	0.711	79%	0.785	S	S	*	*			cis	175.6	168.8	4.5	0	0	0	0	0	111.6
32	H	34.3	Very low	35.9	Very low	178 Å²	178	130.8 Å²	130.8	82%	0.824	78%	0.781	S	S	*	*			trans	-62.4	173.2	172.9	-104.2	-89	0	0	0	113.2
33	P	47	Very low	35.9	Very low	115 Å²	115	127.5 Å²	127.5	75%	0.747	78%	0.776	S	S	*	*			cis	-145	161.2	32.8	34.3	-10	0	0	0	120.2
34	S	33.4	Very low	35.5	Very low	95 Å²	95	127.1 Å²	127.1	66%	0.664	78%	0.776	S	S	*	*			trans	17	142.3	142.6	-37.2	0	0	0	0	123.1
35	V	32.4	Very low	35.1	Very low	125 Å²	125	126.8 Å²	126.8	76%	0.758	77%	0.774	S	S	*	*				-180	119.6	116.3	169.1	0	0	0	0	112.2
36	I	31.3	Very low	34.9	Very low	154 Å²	154	129.9 Å²	129.9	79%	0.79	78%	0.778	S	S	*	*			trans	38	130.3	135.1	-48.8	171.2	0	0	0	121.6
37	S	29.4	Very low	34.6	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	77%	0.765	S	S	*	*				150.3	107.6	118.2	-137.4	0	0	0	0	110
38	S	30	Very low	34.3	Very low	92 Å²	92	126.5 Å²	126.5	64%	0.643	76%	0.761	S	S	*	*				101.1	125.1	76.8	63.1	0	0	0	0	113.5
39	S	29.9	Very low	34.3	Very low	109 Å²	109	131.4 Å²	131.4	76%	0.762	77%	0.769	S	S	*	*			trans	54.6	133.3	146.5	58.3	0	0	0	0	118.6
40	R	31.3	Very low	34	Very low	239 Å²	239	126.5 Å²	126.5	90%	0.902	76%	0.764	S	S	*	*			cis	-176.3	155.2	34.3	-137	176.7	-172.5	-154.4	1.6	107.5
41	P	41.3	Very low	34	Very low	107 Å²	107	126 Å²	126	70%	0.695	77%	0.767	S	S	*	*			trans	-106.1	173.4	176.7	35.4	-25.4	0	0	0	114.3
42	L	31.2	Very low	34.3	Very low	151 Å²	151	128.9 Å²	128.9	79%	0.791	77%	0.773	S	S	*	*			trans	82.4	162	161.1	-75	147	0	0	0	117.7
43	P	43	Very low	34.2	Very low	116 Å²	116	128.5 Å²	128.5	75%	0.753	77%	0.774	S	S	*	*			cis	-139.4	168.2	11.9	33.5	-11.1	0	0	0	118.4
44	S	39.4	Very low	33.6	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	78%	0.777	S	S	*	*			trans	-63.4	171.3	154.4	-32	0	0	0	0	112.9
45	P	42.8	Very low	33.3	Very low	127 Å²	127	129 Å²	129	83%	0.825	78%	0.779	S	S	*	*			trans	-139.3	135	142.8	33.1	-16.3	0	0	0	115.3
46	M	31.3	Very low	33.4	Very low	177 Å²	177	132 Å²	132	87%	0.872	79%	0.79	S	S	*	*			trans	-99.5	147.2	136.8	-73.6	173.2	54.2	0	0	105.3
47	S	31.4	Very low	33.5	Very low	90 Å²	90	129.4 Å²	129.4	63%	0.629	79%	0.791	S	S	*	*				-178.8	168.4	53.6	-43.6	0	0	0	0	110.1
48	T	30.6	Very low	33.5	Very low	127 Å²	127	130.1 Å²	130.1	78%	0.779	80%	0.796	S	S	*	*			trans	91.6	117.4	149.3	59.3	0	0	0	0	123.1
49	L	32.2	Very low	34	Very low	176 Å²	176	130.4 Å²	130.4	92%	0.921	80%	0.796	S	S	*	*			trans	53.8	125.1	140.8	-83.8	97.2	0	0	0	122.5
50	G	28.5	Very low	34.1	Very low	76 Å²	76	135.5 Å²	135.5	78%	0.784	80%	0.8	S	S	*	*			trans	149.7	95.6	147.7	0	0	0	0	0	114.8
51	S	33.3	Very low	34.5	Very low	124 Å²	124	129.5 Å²	129.5	87%	0.867	79%	0.792	S	S	*	*			trans	-65.6	153.8	162.9	-52.1	0	0	0	0	110.8
52	P	37	Very low	34	Very low	130 Å²	130	130.5 Å²	130.5	84%	0.844	80%	0.796	S	S	*	*				-141.7	169.4	98.3	33.1	-15.4	0	0	0	115.4
53	M	32.4	Very low	34.3	Very low	170 Å²	170	131 Å²	131	84%	0.837	80%	0.798	S	S	*	*			trans	-57.7	167.2	-173.7	-82.5	-172.1	69.2	0	0	118.4
54	N	33.5	Very low	33.6	Very low	152 Å²	152	131 Å²	131	81%	0.813	80%	0.796	S	S	*	*			trans	99.8	119.4	164.6	-62.2	-13.3	0	0	0	112.8
55	G	28.2	Very low	33.1	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	80%	0.801	S	S	*	*			cis	136.4	116.3	15.4	0	0	0	0	0	106.6
56	L	34.3	Very low	32.5	Very low	188 Å²	188	131.3 Å²	131.3	98%	0.984	80%	0.801	S	S	*	*			trans	178.8	140.7	151	-95.6	161.9	0	0	0	109.6
57	A	31.6	Very low	32.6	Very low	99 Å²	99	131.6 Å²	131.6	82%	0.818	81%	0.805	S	S	*	*			trans	-89.4	153.1	-156.9	0	0	0	0	0	114.8
58	S	30.5	Very low	32.5	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	81%	0.812	S	S	*	*			trans	-109.4	137.2	160.7	-177.7	0	0	0	0	109.3
59	P	40.8	Very low	32.5	Very low	98 Å²	98	130.6 Å²	130.6	64%	0.636	82%	0.815	S	S	*	*			trans	-91.7	130.9	-175.8	34.7	-29.5	0	0	0	111.4
60	Y	32.3	Very low	32.7	Very low	216 Å²	216	128.4 Å²	128.4	85%	0.847	81%	0.812	S	S	*	*			trans	157.9	140.4	133.9	-84.1	-68.4	0	0	0	110.4
61	P	39.3	Very low	32.8	Very low	114 Å²	114	129.8 Å²	129.8	74%	0.74	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-87.8	136.7	-154	32.4	-33.2	0	0	0	114.3
62	V	29.6	Very low	32.7	Very low	128 Å²	128	131.3 Å²	131.3	78%	0.776	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-101.6	123.1	164.7	178	0	0	0	0	107.9	T64	V62-T64 HydrophobicContact CG1-CG2 4.04Å
63	I	37.6	Very low	32.9	Very low	161 Å²	161	130.8 Å²	130.8	83%	0.826	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-96.7	120.7	165.8	-64	177.4	0	0	0	107.3
64	T	28.3	Very low	32.8	Very low	116 Å²	116	130.6 Å²	130.6	71%	0.712	80%	0.804	S	S	*	*			trans	-104.8	147	168.3	90	0	0	0	0	108.2	V62	V62-T64 HydrophobicContact CG1-CG2 4.04Å
65	S	30.3	Very low	32.5	Very low	117 Å²	117	132 Å²	132	82%	0.818	81%	0.806	S	S	*	*			trans	-157.4	137	147.2	33.7	0	0	0	0	111.1
66	S	30.3	Very low	32.5	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	81%	0.808	S	S	*	*			trans	-94.1	163.2	-165.7	36.5	0	0	0	0	113.6
67	L	32.2	Very low	32.4	Very low	182 Å²	182	131.3 Å²	131.3	95%	0.953	80%	0.801	S	S	*	*			trans	-56.1	150	175.4	-76.5	84	0	0	0	114.5
68	G	28.7	Very low	32.9	Very low	76 Å²	76	133 Å²	133	78%	0.784	80%	0.803	S	S	*	*			trans	-177.3	108	158.8	0	0	0	0	0	112.3
69	S	31.3	Very low	32.9	Very low	121 Å²	121	134 Å²	134	85%	0.846	80%	0.8	S	S	*	*			trans	-80.3	158.6	170.7	-51.7	0	0	0	0	111.8
70	P	36.9	Very low	32.5	Very low	130 Å²	130	136.6 Å²	136.6	84%	0.844	81%	0.805	S	S	*	*				-143.1	177.8	121.5	34.4	-16.9	0	0	0	114.4
71	S	30.1	Very low	32.3	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	80%	0.803	S	S	*	*			trans	-120.1	155.7	-152.6	-31.1	0	0	0	0	114.2
72	I	32.1	Very low	31.9	Very low	155 Å²	155	138 Å²	138	80%	0.795	81%	0.811	S	S	*	*			trans	81.5	152.5	150.5	-56.5	-157.5	0	0	0	118.8
73	P	40.3	Very low	31.9	Very low	120 Å²	120	135.2 Å²	135.2	78%	0.779	81%	0.808	S	S	*	*			cis	-129.2	175.9	-4	21.6	2.8	0	0	0	118.2
74	L	30.2	Very low	32.2	Very low	165 Å²	165	133.2 Å²	133.2	86%	0.864	81%	0.806	S	S	*	*			trans	-75.2	153.7	170.1	-127.6	86.3	0	0	0	115.4
75	Q	26.7	Very low	32.2	Very low	182 Å²	182	134.9 Å²	134.9	85%	0.85	81%	0.809	S	S	*	*			trans	177	114.9	141.8	-103.3	173.8	11	0	0	109.5
76	S	29.3	Very low	32.1	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	81%	0.807	S	S	*	*				108.5	133.4	80.5	59.8	0	0	0	0	112.5
77	T	32.8	Very low	32	Very low	134 Å²	134	134.4 Å²	134.4	82%	0.822	81%	0.805	S	S	*	*			trans	-73	172.4	-176	49.2	0	0	0	0	114.2
78	P	42.2	Very low	32.4	Very low	134 Å²	134	131 Å²	131	87%	0.87	79%	0.794	S	S	*	*				-143.1	-176	101.9	35.8	-17.7	0	0	0	115.8
79	N	29	Very low	32.4	Very low	136 Å²	136	136.4 Å²	136.4	73%	0.727	80%	0.799	S	S	*	*			trans	-107	-176.1	-144.3	-163.3	48.8	0	0	0	115.2
80	M	32.8	Very low	32.3	Very low	152 Å²	152	139.5 Å²	139.5	75%	0.749	80%	0.803	S	S	*	*			trans	101.8	134.2	162.1	-52.2	-57.7	-176.6	0	0	115
81	N	27.9	Very low	31.9	Very low	150 Å²	150	141 Å²	141	80%	0.802	80%	0.804	S	S	*	*			cis	-162.9	160.2	10.9	-151.2	54.1	0	0	0	111.3
82	F	31	Very low	31.8	Very low	209 Å²	209	140.3 Å²	140.3	92%	0.917	80%	0.799	S	S	*	*			trans	-78.6	158.3	-178.5	-98.9	-101.4	0	0	0	116.1
83	G	29.7	Very low	31.7	Very low	69 Å²	69	141.2 Å²	141.2	71%	0.711	80%	0.801	S	S	*	*			trans	-179.5	138.9	154.7	0	0	0	0	0	113.8
84	P	43.8	Very low	31.1	Very low	119 Å²	119	143.5 Å²	143.5	77%	0.773	81%	0.807	S	S	*	*			trans	-106.7	172.5	-154.8	38.7	-28.8	0	0	0	114.8
85	I	29.2	Very low	31	Very low	152 Å²	152	141.3 Å²	141.3	78%	0.779	81%	0.806	S	S	*	*			trans	163.8	124.3	135.3	-83.9	160.4	0	0	0	113.4
86	S	27.4	Very low	31.1	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	81%	0.805	S	S	*	*			trans	65	122.3	144.1	-54.8	0	0	0	0	124.9
87	S	28.1	Very low	31.1	Very low	113 Å²	113	139.4 Å²	139.4	79%	0.79	81%	0.807	S	S	*	*			trans	-61.5	167	151.7	-18.1	0	0	0	0	111.9
88	P	41.3	Very low	30.9	Very low	111 Å²	111	138.6 Å²	138.6	72%	0.721	81%	0.807	S	S	*	*				-152	176.2	54.3	41.8	-20	0	0	0	118.8
89	Q	29.1	Very low	30.4	Very low	190 Å²	190	137.6 Å²	137.6	89%	0.888	80%	0.803	S	S	*	*			trans	84.1	108.6	154.2	-77.2	175.9	-20.5	0	0	120.8
90	M	28.1	Very low	30.6	Very low	186 Å²	186	140.3 Å²	140.3	92%	0.916	81%	0.811	S	S	*	*			trans	-94.5	134.4	158.3	-75.4	-152	-68	0	0	110.4
91	N	29.4	Very low	30.8	Very low	161 Å²	161	141 Å²	141	86%	0.861	82%	0.817	S	S	*	*			trans	-145.7	133.3	154.1	-108.5	-13.1	0	0	0	110.1
92	S	28.3	Very low	31.5	Very low	90 Å²	90	141.6 Å²	141.6	63%	0.629	82%	0.819	S	S	*	*			trans	74.1	107.4	149.6	-77.6	0	0	0	0	122.9
93	M	29.4	Very low	31.7	Very low	174 Å²	174	140.8 Å²	140.8	86%	0.857	82%	0.815	S	S	*	*				62.7	102	125.2	-39.3	-160.5	-152.9	0	0	119.1
94	N	28.3	Very low	32.2	Very low	168 Å²	168	142.6 Å²	142.6	90%	0.898	81%	0.814	S	S	*	*			trans	-105.8	114.7	160.6	-85.4	-17.4	0	0	0	110.2
95	S	27.6	Very low	31.9	Very low	120 Å²	120	142.7 Å²	142.7	84%	0.839	82%	0.815	S	S	*	*			trans	-96.4	121.9	160.2	-178.7	0	0	0	0	107.8
96	V	29.2	Very low	32.3	Very low	136 Å²	136	142 Å²	142	82%	0.824	82%	0.821	S	S	*	*			trans	-84.4	118.8	178.6	-76.6	0	0	0	0	109.5
97	S	27.9	Very low	32.8	Very low	114 Å²	114	140.2 Å²	140.2	80%	0.797	82%	0.82	S	S	*	*			trans	-111.9	113.7	168.6	-173.5	0	0	0	0	108.2
98	S	29.3	Very low	33.3	Very low	117 Å²	117	143.1 Å²	143.1	82%	0.818	83%	0.825	S	S	*	*			trans	-88.8	113.6	174.5	21.5	0	0	0	0	109.5
99	S	31.9	Very low	32.9	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	84%	0.835	S	S	*	*			trans	-123.8	113.8	160.2	-89.9	0	0	0	0	107.5
100	E	33.6	Very low	33.2	Very low	192 Å²	192	143.5 Å²	143.5	90%	0.897	83%	0.83	S	S	*	*			trans	-82.6	135	167.7	-69.9	-168.1	132.7	0	0	109.9
101	D	35.6	Very low	33.6	Very low	166 Å²	166	141.7 Å²	141.7	89%	0.888	82%	0.823	S	S	*	*			trans	-67.3	126.6	-177.2	-76	-64.9	0	0	0	113.4
102	I	42.7	Very low	33.7	Very low	164 Å²	164	137 Å²	137	84%	0.841	81%	0.812	S	S	*	*			trans	-101.3	114.9	162	-62.3	173.2	0	0	0	108.5
103	K	35	Very low	34.1	Very low	192 Å²	192	140.4 Å²	140.4	84%	0.835	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-76.3	137.5	178.5	-161.7	174.2	-174.8	176.1	0	111.2
104	P	40.9	Very low	34.5	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.7	155.5	175	30.1	-32.7	0	0	0	111.9
105	P	38.3	Very low	34.8	Very low	121 Å²	121	133.9 Å²	133.9	79%	0.786	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.1	147.9	-179.7	28.6	-32.4	0	0	0	112
106	P	36.4	Very low	35.4	Very low	139 Å²	139	137.8 Å²	137.8	90%	0.903	79%	0.789	S	S	*	*	S	Bend	trans	-83.4	124.9	-176.2	31.4	-31	0	0	0	111.4
107	G	38.2	Very low	35.6	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	78%	0.784	S	S	*	*			trans	171.6	-0.5	175.1	0	0	0	0	0	119.2
108	L	39.7	Very low	36	Very low	173 Å²	173	138.5 Å²	138.5	91%	0.906	78%	0.782	S	S	*	*			trans	-139.6	93.2	170.3	-113.6	103.8	0	0	0	110.2
109	Q	32.9	Very low	36.5	Very low	197 Å²	197	139.5 Å²	139.5	92%	0.921	78%	0.783	S	S	*	*			trans	-91	133.6	164.5	-78.6	-176.3	-9.5	0	0	109.8
110	S	34.1	Very low	36.7	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	78%	0.775	S	S	*	*			trans	74.4	77.3	165.9	-149	0	0	0	0	117.6
111	L	37.4	Very low	37.3	Very low	147 Å²	147	136 Å²	136	77%	0.77	78%	0.777	S	S	*	*			trans	-129.6	79.6	136	-136.3	79.7	0	0	0	107.9	I114	L111-I114 HydrophobicContact CD2-CD1 3.73Å; L111-I114 HydrophobicContact CD2-CG1 4.37Å
112	G	32	Very low	37.7	Very low	62 Å²	62	132.1 Å²	132.1	64%	0.639	78%	0.776	S	S	*	*			trans	-59.5	140.2	170.6	0	0	0	0	0	110.8	I114	G112-I114 PolarHBondContact O-N 2.88Å
113	N	36.7	Very low	37.7	Very low	163 Å²	163	127.4 Å²	127.4	87%	0.872	77%	0.768	S	S	*	*			trans	24	82.2	162.6	-78.7	11.6	0	0	0	116.5	N115	N113-N115 PolarHBondContact O-N 2.91Å
114	I	36.3	Very low	38.2	Very low	96 Å²	96	126.3 Å²	126.3	49%	0.492	77%	0.768	S	S	.	*			trans	-79.6	87.8	152.7	-55.5	-175.2	0	0	0	107.5	L111 G112 Y116	L111-I114 HydrophobicContact CD2-CD1 3.73Å; L111-I114 HydrophobicContact CD2-CG1 4.37Å; G112-I114 PolarHBondContact O-N 2.88Å; I114-Y116 HydrophobicContact CB-CD2 4.45Å; I114-Y116 HydrophobicContact CB-CE2 4.11Å; I114-Y116 HydrophobicContact CG2-CD1 4.03Å; I114-Y116 HydrophobicContact CG2-CD2 3.66Å; I114-Y116 HydrophobicContact CG2-CE1 3.78Å; I114-Y116 HydrophobicContact CG2-CE2 3.4Å; I114-Y116 HydrophobicContact CG2-CG 3.98Å; I114-Y116 VanDerWaalsContact CG2-CZ 3.46Å; I114-Y116 PolarHBondContact O-N 3.28Å; I114-Y116 VanDerWaalsContact O-N 3.08Å
115	N	34.7	Very low	39	Very low	108 Å²	108	125.4 Å²	125.4	58%	0.578	76%	0.764	S	S	*	*			trans	-67.1	95.3	161.5	-167.1	23.8	0	0	0	107.3	N113 Q117	N113-N115 PolarHBondContact O-N 2.91Å; N115-Q117 PolarHBondContact ND2-NE2 3.28Å; N115-Q117 PolarHBondContact ND2-OE1 2.85Å; N115-Q117 PolarHBondContact O-N 3.05Å
116	Y	40.1	Very low	40.3	Very low	202 Å²	202	127 Å²	127	79%	0.792	76%	0.758	S	S	*	*			trans	-73.3	71.4	166.1	-70.5	-76.5	0	0	0	109	I114 C118	I114-Y116 HydrophobicContact CB-CD2 4.45Å; I114-Y116 HydrophobicContact CB-CE2 4.11Å; I114-Y116 HydrophobicContact CG2-CD1 4.03Å; I114-Y116 HydrophobicContact CG2-CD2 3.66Å; I114-Y116 HydrophobicContact CG2-CE1 3.78Å; I114-Y116 HydrophobicContact CG2-CE2 3.4Å; I114-Y116 HydrophobicContact CG2-CG 3.98Å; I114-Y116 VanDerWaalsContact CG2-CZ 3.46Å; I114-Y116 PolarHBondContact O-N 3.28Å; I114-Y116 VanDerWaalsContact O-N 3.08Å; Y116-C118 PolarHBondContact O-N 3.37Å
117	Q	34.1	Very low	42.7	Very low	153 Å²	153	124.1 Å²	124.1	72%	0.715	73%	0.733	S	S	*	*			trans	-79.9	109.4	160	-91.1	173.5	-8.6	0	0	107.6	N115	N115-Q117 PolarHBondContact ND2-NE2 3.28Å; N115-Q117 PolarHBondContact ND2-OE1 2.85Å; N115-Q117 PolarHBondContact O-N 3.05Å
118	C	35.9	Very low	45.5	Very low	113 Å²	113	125.5 Å²	125.5	76%	0.764	72%	0.722	S	S	*	*			trans	-100.5	105.9	165.1	-167.3	0	0	0	0	107.5	Y116 S120	Y116-C118 PolarHBondContact O-N 3.37Å; C118-S120 PolarHBondContact O-N 3.13Å
119	T	40.7	Very low	48.2	Very low	137 Å²	137	117.4 Å²	117.4	84%	0.84	68%	0.68	S	S	*	*			trans	-75.6	87.8	169	28.5	0	0	0	0	109
120	S	36	Very low	51.3	Low	88 Å²	88	110.2 Å²	110.2	62%	0.615	65%	0.654	S	S	*	*			trans	-157.8	122	162.5	-76.5	0	0	0	0	110.2	C118 G122	C118-S120 PolarHBondContact O-N 3.13Å; S120-G122 PolarHBondContact O-N 2.58Å
121	P	45.8	Very low	54.4	Low	144 Å²	144	104.9 Å²	104.9	94%	0.935	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	105.3	174.4	27.4	-22.8	0	0	0	108.9
122	G	44	Very low	57.3	Low	85 Å²	85	98.1 Å²	98.1	88%	0.876	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	144.1	-3	167.2	0	0	0	0	0	119	S120	S120-G122 PolarHBondContact O-N 2.58Å
123	G	42.2	Very low	60.3	Low	64 Å²	64	97.5 Å²	97.5	66%	0.66	58%	0.576	S	S	*	*			trans	-115.2	123.9	-177.9	0	0	0	0	0	113.4	S125	G123-S125 PolarHBondContact O-N 3.21Å
124	M	46.7	Very low	63.2	Low	170 Å²	170	91 Å²	91	84%	0.837	54%	0.541	S	S	*	.			trans	-57	109.3	173.1	-61.1	-135.8	-65.9	0	0	110.4	K126	M124-K126 PolarHBondContact O-N 2.99Å
125	S	56.2	Low	66.1	Low	87 Å²	87	93.8 Å²	93.8	61%	0.608	55%	0.545	S	S	*	.			trans	-60.7	109.5	174.6	46.7	0	0	0	0	109.3	G123 H127	G123-S125 PolarHBondContact O-N 3.21Å; S125-H127 VanDerWaalsContact C-N 3.32Å; S125-H127 PolarHBondContact O-CD2 3.43Å; S125-H127 PolarHBondContact O-N 2.92Å
126	K	66.4	Low	69.1	Low	154 Å²	154	89.3 Å²	89.3	67%	0.67	52%	0.522	S	S	*	.			trans	-73.9	87.3	178.4	-71.3	178.5	-175.7	170.7	0	108.9	M124	M124-K126 PolarHBondContact O-N 2.99Å
127	H	86.9	Confident	71.7	Confident	78 Å²	78	82.8 Å²	82.8	36%	0.361	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-56.8	141.3	171.7	-68.1	-77.7	0	0	0	110.8	S125 S136 Y144	S125-H127 VanDerWaalsContact C-N 3.32Å; S125-H127 PolarHBondContact O-CD2 3.43Å; S125-H127 PolarHBondContact O-N 2.92Å; H127-S136 WeakPolarHBondContact O-CA 3.36Å; H127-S136 WeakPolarHBondContact O-CB 3.37Å; H127-S136 PolarHBondContact O-N 3.42Å; H127-Y144 HydrophobicContact CB-CD1 3.71Å; H127-Y144 HydrophobicContact CB-CE1 4.06Å; H127-Y144 HydrophobicContact CB-CG 4.24Å; H127-Y144 AromaticContact CD2-CE1 3.53Å; H127-Y144 AromaticContact CE1-CE1 3.75Å; H127-Y144 AromaticContact CE1-CZ 3.5Å; H127-Y144 PolarHBondContact CE1-OH 3.32Å; H127-Y144 AromaticContact CG-CD1 3.66Å; H127-Y144 AromaticContact CG-CE1 3.48Å; H127-Y144 VanDerWaalsContact CG-CE1 3.48Å; H127-Y144 AromaticContact ND1-CD1 3.96Å; H127-Y144 AromaticContact ND1-CE1 3.63Å; H127-Y144 AromaticContact ND1-CE2 4Å; H127-Y144 AromaticContact ND1-CZ 3.65Å; H127-Y144 AromaticContact NE2-CE1 3.68Å; H127-Y144 AromaticContact NE2-CZ 3.76Å
128	I	96.2	Very high	74.6	Confident	102 Å²	102	76.5 Å²	76.5	52%	0.523	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-101	145.2	176.8	-58.8	-61	0	0	0	109.3	A130 G133	I128-A130 PolarHBondContact O-N 3.38Å; I128-G133 WeakPolarHBondContact CG2-O 3.37Å
129	C	98.1	Very high	77.4	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.014	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-68.4	116.9	177.1	176.3	0	0	0	0	110.2	I131 G133 D134 C146	C129-I131 PolarHBondContact O-N 3.18Å; C129-G133 WeakPolarHBondContact O-CA 3.49Å; C129-G133 PolarHBondContact O-N 3.1Å; C129-D134 WeakPolarHBondContact CB-O 3.46Å; C129-D134 PolarHBondContact N-O 3.25Å; C129-C146 HydrophobicContact CB-CB 3.98Å; C129-C146 PolarHBondContact SG-N 2.92Å
130	A	97.4	Very high	80.1	Confident	47 Å²	47	72.7 Å²	72.7	39%	0.388	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.2	-178.8	0	0	0	0	0	113.9	I128 V143 Y144 M192	I128-A130 PolarHBondContact O-N 3.38Å; A130-V143 HydrophobicContact CB-CG1 3.77Å; A130-Y144 PolarHBondContact N-O 3.05Å; A130-M192 HydrophobicContact CB-CB 4.49Å; A130-M192 HydrophobicContact CB-CG 4.42Å; A130-M192 HydrophobicContact CB-SD 4.49Å
131	I	98.4	Very high	83	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-49	-175.8	-62.3	80.9	0	0	0	111.5	C129 V143 C149 I173 K188 M194	C129-I131 PolarHBondContact O-N 3.18Å; I131-V143 HydrophobicContact CD1-CG1 4.26Å; I131-C149 HydrophobicContact CB-CB 4.27Å; I131-C149 HydrophobicContact CG1-CB 4.48Å; I131-C149 HydrophobicContact CG2-CB 4.39Å; I131-I173 HydrophobicContact CG2-CG2 4.04Å; I131-K188 HydrophobicContact CG2-CD 4.44Å; I131-K188 HydrophobicContact CG2-CG 4.44Å; I131-K188 VanDerWaalsContact O-CD 3.27Å; I131-K188 WeakPolarHBondContact O-CD 3.38Å; I131-K188 WeakPolarHBondContact O-CE 3.48Å; I131-K188 PolarHBondContact O-NZ 3.46Å; I131-M194 HydrophobicContact CD1-CE 3.7Å; I131-M194 HydrophobicContact CD1-SD 4.28Å
132	C	97.7	Very high	85.3	Confident	6 Å²	6	66 Å²	66	4%	0.041	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	2.2	-170.7	65.7	0	0	0	0	114.6	D134 C146 C149 I173 D174 K175 R178	C132-D134 PolarHBondContact O-N 2.95Å; C132-C146 VanDerWaalsContact SG-SG 3.6Å; C132-C149 VanDerWaalsContact SG-SG 3.68Å; C132-I173 HydrophobicContact CB-CG2 4.16Å; C132-D174 CarbonylContact O-C 3.31Å; C132-D174 VanDerWaalsContact O-C 3.31Å; C132-D174 WeakPolarHBondContact O-CA 3.41Å; C132-K175 PolarHBondContact O-N 2.94Å; C132-R178 HydrophobicContact CB-CB 4.16Å; C132-R178 PolarHBondContact SG-NH1 3.5Å
133	G	96.4	Very high	87.9	Confident	49 Å²	49	62.8 Å²	62.8	51%	0.505	37%	0.365	S	S	.	.	S	Bend	trans	74.4	2.8	179.7	0	0	0	0	0	115.4	I128 C129	I128-G133 WeakPolarHBondContact CG2-O 3.37Å; C129-G133 WeakPolarHBondContact O-CA 3.49Å; C129-G133 PolarHBondContact O-N 3.1Å
134	D	97.1	Very high	90.5	Very high	27 Å²	27	63.5 Å²	63.5	14%	0.144	35%	0.348	C	S	.	.	S	Bend	trans	-72.5	168.9	174.4	-161.2	8.1	0	0	0	111.9	C129 C132 S136 C146 K175 R178	C129-D134 WeakPolarHBondContact CB-O 3.46Å; C129-D134 PolarHBondContact N-O 3.25Å; C132-D134 PolarHBondContact O-N 2.95Å; D134-S136 PolarHBondContact O-N 3.45Å; D134-C146 HydrophobicContact CB-CB 4.07Å; D134-K175 HydrophobicContact CB-CB 4.4Å; D134-K175 HydrophobicContact CB-CD 4.22Å; D134-K175 HydrophobicContact CB-CG 4.22Å; D134-K175 WeakPolarHBondContact OD1-CD 3.45Å; D134-K175 VanDerWaalsContact OD1-CE 3.27Å; D134-K175 WeakPolarHBondContact OD1-CE 3.45Å; D134-K175 IonicContact OD1-NZ 3.36Å; D134-K175 PolarHBondContact OD1-NZ 2.95Å; D134-R178 IonicContact OD2-CZ 2.78Å; D134-R178 IonicContact OD2-NH1 3.25Å; D134-R178 PolarHBondContact OD2-NH1 3.36Å; D134-R178 IonicContact OD2-NH2 3.97Å
135	R	97.2	Very high	92.9	Very high	154 Å²	154	55.4 Å²	55.4	58%	0.581	31%	0.308	S	S	*	.	B	Isolated β-bridge	trans	-62.3	126.5	177.1	-172.4	177.6	178.5	-161.5	-1.6	110.4	C146	R135-C146 VanDerWaalsContact O-CB 3.27Å; R135-C146 WeakPolarHBondContact O-CB 3.5Å
136	S	96.9	Very high	94.9	Very high	14 Å²	14	51.4 Å²	51.4	10%	0.098	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-75.2	142.4	176.1	-172.8	0	0	0	0	110.8	H127 D134 G138 S145	H127-S136 WeakPolarHBondContact O-CA 3.36Å; H127-S136 WeakPolarHBondContact O-CB 3.37Å; H127-S136 PolarHBondContact O-N 3.42Å; D134-S136 PolarHBondContact O-N 3.45Å; S136-G138 PolarHBondContact OG-N 3Å; S136-G138 PolarHBondContact OG-O 3.45Å; S136-G138 VanDerWaalsContact OG-O 3.06Å; S136-S145 PolarHBondContact OG-N 3.32Å; S136-S145 VanDerWaalsContact OG-N 3.15Å; S136-S145 PolarHBondContact OG-O 3.01Å
137	S	95.6	Very high	96.4	Very high	64 Å²	64	48.8 Å²	48.8	45%	0.448	27%	0.271	S	S	.	.			trans	-95	-3	169.5	53.8	0	0	0	0	112.6	H140 S145 E147	S137-H140 PolarHBondContact OG-NE2 3.47Å; S137-S145 PolarHBondContact N-O 3.08Å; S137-S145 PolarHBondContact OG-O 3.12Å; S137-E147 WeakPolarHBondContact CB-OE1 3.49Å; S137-E147 PolarHBondContact OG-OE1 3.31Å
138	G	94.3	Very high	97	Very high	22 Å²	22	46.2 Å²	46.2	23%	0.227	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.7	-167.6	-177.4	0	0	0	0	0	112	S136 Y144 S145	S136-G138 PolarHBondContact OG-N 3Å; S136-G138 PolarHBondContact OG-O 3.45Å; S136-G138 VanDerWaalsContact OG-O 3.06Å; G138-Y144 WeakPolarHBondContact O-CA 3.24Å; G138-S145 PolarHBondContact O-N 3.44Å
139	K	95.6	Very high	97.1	Very high	138 Å²	138	41.4 Å²	41.4	60%	0.6	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.1	172.7	-68.7	-174.1	-179.1	-179.4	0	109.7	V143 Y144	K139-V143 WeakPolarHBondContact CA-O 3.13Å; K139-Y144 HydrophobicContact CD-CE2 4.29Å; K139-Y144 WeakPolarHBondContact CE-OH 3.46Å; K139-Y144 HydrophobicContact CG-CD1 3.88Å; K139-Y144 HydrophobicContact CG-CD2 4.15Å; K139-Y144 HydrophobicContact CG-CE1 3.72Å; K139-Y144 HydrophobicContact CG-CE2 3.99Å; K139-Y144 HydrophobicContact CG-CG 4.11Å
140	H	96.4	Very high	97.1	Very high	32 Å²	32	43.9 Å²	43.9	15%	0.148	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.8	171.6	-53.8	-70.8	0	0	0	108.7	S137 G142 V143 S145 E147 K150	S137-H140 PolarHBondContact OG-NE2 3.47Å; H140-G142 PolarHBondContact O-N 3.11Å; H140-G142 VanDerWaalsContact O-N 3.16Å; H140-V143 PolarHBondContact N-O 3.05Å; H140-V143 PolarHBondContact O-N 3.16Å; H140-V143 VanDerWaalsContact O-N 3.14Å; H140-V143 VanDerWaalsContact O-O 3.1Å; H140-S145 WeakPolarHBondContact CB-OG 3.4Å; H140-S145 PolarHBondContact CD2-O 2.92Å; H140-S145 PolarHBondContact CD2-OG 3.21Å; H140-E147 IonicContact CE1-OE1 3.75Å; H140-E147 IonicContact NE2-OE1 3.52Å; H140-K150 HydrophobicContact CB-CB 4.04Å; H140-K150 HydrophobicContact CB-CD 4.33Å; H140-K150 HydrophobicContact CB-CG 3.83Å; H140-K150 WeakPolarHBondContact ND1-CD 3.42Å; H140-K150 WeakPolarHBondContact ND1-CE 3.34Å
141	Y	97.1	Very high	97.1	Very high	37 Å²	37	42.3 Å²	42.3	15%	0.145	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	32.7	-179.4	-45.3	-62.2	0	0	0	113.6	K150 F153 K154 M194 K195 A198 V199	Y141-K150 HydrophobicContact CE2-CG 3.89Å; Y141-F153 HydrophobicContact CD2-CB 4.42Å; Y141-F153 AromaticContact CD2-CD1 3.58Å; Y141-F153 HydrophobicContact CD2-CD1 3.58Å; Y141-F153 HydrophobicContact CD2-CE1 4.3Å; Y141-F153 HydrophobicContact CD2-CG 4.35Å; Y141-F153 HydrophobicContact CE2-CD1 4.1Å; Y141-F153 AromaticContact CG-CD1 3.85Å; Y141-F153 HydrophobicContact CG-CD1 3.85Å; Y141-F153 HydrophobicContact CG-CE1 4.11Å; Y141-K154 HydrophobicContact CE2-CB 4.35Å; Y141-K154 WeakPolarHBondContact OH-CB 3.3Å; Y141-K154 WeakPolarHBondContact OH-CD 3.21Å; Y141-K154 VanDerWaalsContact OH-CG 3.28Å; Y141-K154 WeakPolarHBondContact OH-CG 3.42Å; Y141-M194 WeakPolarHBondContact O-CA 3.43Å; Y141-K195 PolarHBondContact O-N 2.87Å; Y141-A198 HydrophobicContact CD1-CB 4.03Å; Y141-V199 HydrophobicContact CD1-CG2 3.68Å; Y141-V199 HydrophobicContact CE1-CB 4.21Å; Y141-V199 HydrophobicContact CE1-CG2 3.59Å; Y141-V199 HydrophobicContact CG-CG2 4.28Å
142	G	95.2	Very high	97.1	Very high	55 Å²	55	42.7 Å²	42.7	57%	0.567	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.9	-13.2	178.7	0	0	0	0	0	115.6	H140	H140-G142 PolarHBondContact O-N 3.11Å; H140-G142 VanDerWaalsContact O-N 3.16Å
143	V	96.9	Very high	97.1	Very high	17 Å²	17	42.4 Å²	42.4	10%	0.103	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.8	-171.2	-173.3	0	0	0	0	111.9	A130 I131 K139 H140 S145 M192 G193 M194	A130-V143 HydrophobicContact CB-CG1 3.77Å; I131-V143 HydrophobicContact CD1-CG1 4.26Å; K139-V143 WeakPolarHBondContact CA-O 3.13Å; H140-V143 PolarHBondContact N-O 3.05Å; H140-V143 PolarHBondContact O-N 3.16Å; H140-V143 VanDerWaalsContact O-N 3.14Å; H140-V143 VanDerWaalsContact O-O 3.1Å; V143-S145 PolarHBondContact O-N 3.46Å; V143-M192 HydrophobicContact CG1-CB 4.4Å; V143-M192 WeakPolarHBondContact CG2-O 3.05Å; V143-G193 WeakPolarHBondContact CG2-O 3.34Å; V143-M194 HydrophobicContact CB-CG 4.11Å; V143-M194 HydrophobicContact CG2-CG 3.95Å
144	Y	97.8	Very high	97.1	Very high	78 Å²	78	44.1 Å²	44.1	31%	0.306	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	115.6	169.9	-74	-77.6	0	0	0	110.8	H127 A130 G138 K139	H127-Y144 HydrophobicContact CB-CD1 3.71Å; H127-Y144 HydrophobicContact CB-CE1 4.06Å; H127-Y144 HydrophobicContact CB-CG 4.24Å; H127-Y144 AromaticContact CD2-CE1 3.53Å; H127-Y144 AromaticContact CE1-CE1 3.75Å; H127-Y144 AromaticContact CE1-CZ 3.5Å; H127-Y144 PolarHBondContact CE1-OH 3.32Å; H127-Y144 AromaticContact CG-CD1 3.66Å; H127-Y144 AromaticContact CG-CE1 3.48Å; H127-Y144 VanDerWaalsContact CG-CE1 3.48Å; H127-Y144 AromaticContact ND1-CD1 3.96Å; H127-Y144 AromaticContact ND1-CE1 3.63Å; H127-Y144 AromaticContact ND1-CE2 4Å; H127-Y144 AromaticContact ND1-CZ 3.65Å; H127-Y144 AromaticContact NE2-CE1 3.68Å; H127-Y144 AromaticContact NE2-CZ 3.76Å; A130-Y144 PolarHBondContact N-O 3.05Å; G138-Y144 WeakPolarHBondContact O-CA 3.24Å; K139-Y144 HydrophobicContact CD-CE2 4.29Å; K139-Y144 WeakPolarHBondContact CE-OH 3.46Å; K139-Y144 HydrophobicContact CG-CD1 3.88Å; K139-Y144 HydrophobicContact CG-CD2 4.15Å; K139-Y144 HydrophobicContact CG-CE1 3.72Å; K139-Y144 HydrophobicContact CG-CE2 3.99Å; K139-Y144 HydrophobicContact CG-CG 4.11Å
145	S	97.9	Very high	97.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	154.9	-176	60	0	0	0	0	113.3	S136 S137 G138 H140 V143 M194	S136-S145 PolarHBondContact OG-N 3.32Å; S136-S145 VanDerWaalsContact OG-N 3.15Å; S136-S145 PolarHBondContact OG-O 3.01Å; S137-S145 PolarHBondContact N-O 3.08Å; S137-S145 PolarHBondContact OG-O 3.12Å; G138-S145 PolarHBondContact O-N 3.44Å; H140-S145 WeakPolarHBondContact CB-OG 3.4Å; H140-S145 PolarHBondContact CD2-O 2.92Å; H140-S145 PolarHBondContact CD2-OG 3.21Å; V143-S145 PolarHBondContact O-N 3.46Å; S145-M194 WeakPolarHBondContact OG-CE 3.44Å
146	C	98.3	Very high	97.1	Very high	3 Å²	3	42 Å²	42	2%	0.02	22%	0.223	C	C	.	.			trans	-76.2	160	171.9	66.9	0	0	0	0	110.9	C129 C132 D134 R135 G148 C149 K150 R178	C129-C146 HydrophobicContact CB-CB 3.98Å; C129-C146 PolarHBondContact SG-N 2.92Å; C132-C146 VanDerWaalsContact SG-SG 3.6Å; D134-C146 HydrophobicContact CB-CB 4.07Å; R135-C146 VanDerWaalsContact O-CB 3.27Å; R135-C146 WeakPolarHBondContact O-CB 3.5Å; C146-G148 PolarHBondContact O-N 3.34Å; C146-G148 VanDerWaalsContact O-N 3.1Å; C146-C149 PolarHBondContact O-N 3.35Å; C146-C149 VanDerWaalsContact O-N 3.1Å; C146-C149 PolarHBondContact SG-N 3.43Å; C146-C149 VanDerWaalsContact SG-N 3.43Å; C146-K150 PolarHBondContact O-N 3.37Å; C146-R178 PolarHBondContact SG-NH1 2.9Å
147	E	97.9	Very high	97.1	Very high	99 Å²	99	42.8 Å²	42.8	46%	0.463	23%	0.227	S	C	.	.	H	α-helix	trans	-54.4	-32.5	176.5	-70.1	-57.9	128.5	0	0	113.3	S137 H140 K150 G151	S137-E147 WeakPolarHBondContact CB-OE1 3.49Å; S137-E147 PolarHBondContact OG-OE1 3.31Å; H140-E147 IonicContact CE1-OE1 3.75Å; H140-E147 IonicContact NE2-OE1 3.52Å; E147-K150 IonicContact OE1-NZ 3.12Å; E147-K150 PolarHBondContact OE1-NZ 2.92Å; E147-K150 VanDerWaalsContact OE1-NZ 3.12Å; E147-K150 VanDerWaalsContact OE2-CD 3.24Å; E147-K150 WeakPolarHBondContact OE2-CD 3.25Å; E147-K150 IonicContact OE2-NZ 2.82Å; E147-K150 PolarHBondContact OE2-NZ 2.89Å; E147-G151 PolarHBondContact O-N 2.81Å
148	G	97.9	Very high	96.9	Very high	25 Å²	25	44.3 Å²	44.3	26%	0.258	22%	0.223	S	C	.	.	H	α-helix	trans	-64.4	-44.9	177.7	0	0	0	0	0	113.6	C146 F152 R185	C146-G148 PolarHBondContact O-N 3.34Å; C146-G148 VanDerWaalsContact O-N 3.1Å; G148-F152 VanDerWaalsContact O-CB 3.26Å; G148-F152 WeakPolarHBondContact O-CB 3.48Å; G148-F152 PolarHBondContact O-N 3.46Å; G148-R185 VanDerWaalsContact C-NH2 3.3Å; G148-R185 PolarHBondContact O-NH2 3.41Å; G148-R185 VanDerWaalsContact O-NH2 3.17Å
149	C	98.5	Very high	96.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-77.2	-35.4	179	-67.7	0	0	0	0	112.1	I131 C132 C146 F152 F153 R185	I131-C149 HydrophobicContact CB-CB 4.27Å; I131-C149 HydrophobicContact CG1-CB 4.48Å; I131-C149 HydrophobicContact CG2-CB 4.39Å; C132-C149 VanDerWaalsContact SG-SG 3.68Å; C146-C149 PolarHBondContact O-N 3.35Å; C146-C149 VanDerWaalsContact O-N 3.1Å; C146-C149 PolarHBondContact SG-N 3.43Å; C146-C149 VanDerWaalsContact SG-N 3.43Å; C149-F152 PolarHBondContact O-N 3.34Å; C149-F153 WeakPolarHBondContact O-CB 3.14Å; C149-F153 PolarHBondContact O-N 3.46Å; C149-R185 PolarHBondContact SG-NH2 2.94Å
150	K	98	Very high	96.6	Very high	55 Å²	55	49.9 Å²	49.9	24%	0.239	25%	0.247	C	C	.	.	H	α-helix	trans	-55.2	-55.8	168.9	172.8	-160.4	-174.5	-177.9	0	111.1	H140 Y141 C146 E147 F152 F153 K154	H140-K150 HydrophobicContact CB-CB 4.04Å; H140-K150 HydrophobicContact CB-CD 4.33Å; H140-K150 HydrophobicContact CB-CG 3.83Å; H140-K150 WeakPolarHBondContact ND1-CD 3.42Å; H140-K150 WeakPolarHBondContact ND1-CE 3.34Å; Y141-K150 HydrophobicContact CE2-CG 3.89Å; C146-K150 PolarHBondContact O-N 3.37Å; E147-K150 IonicContact OE1-NZ 3.12Å; E147-K150 PolarHBondContact OE1-NZ 2.92Å; E147-K150 VanDerWaalsContact OE1-NZ 3.12Å; E147-K150 VanDerWaalsContact OE2-CD 3.24Å; E147-K150 WeakPolarHBondContact OE2-CD 3.25Å; E147-K150 IonicContact OE2-NZ 2.82Å; E147-K150 PolarHBondContact OE2-NZ 2.89Å; K150-F152 VanDerWaalsContact C-N 3.33Å; K150-F152 PolarHBondContact O-N 3.35Å; K150-F153 PolarHBondContact O-N 3.47Å; K150-K154 VanDerWaalsContact O-CB 3.3Å; K150-K154 WeakPolarHBondContact O-CB 3.2Å; K150-K154 PolarHBondContact O-N 3.12Å
151	G	97.6	Very high	96.5	Very high	14 Å²	14	51.6 Å²	51.6	14%	0.144	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-37.2	-178.7	0	0	0	0	0	113.1	E147 R155	E147-G151 PolarHBondContact O-N 2.81Å; G151-R155 WeakPolarHBondContact O-CG 3.39Å; G151-R155 VanDerWaalsContact O-CZ 3.32Å; G151-R155 PolarHBondContact O-N 2.77Å; G151-R155 VanDerWaalsContact O-N 3.1Å; G151-R155 PolarHBondContact O-NH1 3.15Å
152	F	98.5	Very high	96.3	Very high	8 Å²	8	56 Å²	56	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-54.5	173.7	171.9	-101.6	0	0	0	111.7	G148 C149 K150 K154 R155 T156 Y163 Q182 R185 Y186	G148-F152 VanDerWaalsContact O-CB 3.26Å; G148-F152 WeakPolarHBondContact O-CB 3.48Å; G148-F152 PolarHBondContact O-N 3.46Å; C149-F152 PolarHBondContact O-N 3.34Å; K150-F152 VanDerWaalsContact C-N 3.33Å; K150-F152 PolarHBondContact O-N 3.35Å; F152-K154 VanDerWaalsContact C-N 3.3Å; F152-K154 PolarHBondContact O-N 2.92Å; F152-R155 PolarHBondContact O-N 3.01Å; F152-T156 PolarHBondContact O-N 2.87Å; F152-T156 PolarHBondContact O-OG1 3.37Å; F152-Y163 HydrophobicContact CE2-CE2 4.04Å; F152-Y163 HydrophobicContact CZ-CD2 4.48Å; F152-Y163 AromaticContact CZ-CE2 3.8Å; F152-Y163 HydrophobicContact CZ-CE2 3.8Å; F152-Q182 HydrophobicContact CE2-CB 4.03Å; F152-Q182 HydrophobicContact CE2-CG 4.08Å; F152-Q182 HydrophobicContact CZ-CB 4.16Å; F152-Q182 WeakPolarHBondContact CZ-O 2.89Å; F152-R185 VanDerWaalsContact CD1-CD 3.5Å; F152-R185 HydrophobicContact CD1-CG 3.97Å; F152-R185 HydrophobicContact CE1-CB 3.98Å; F152-R185 HydrophobicContact CE1-CG 3.78Å; F152-R185 HydrophobicContact CZ-CB 4.17Å; F152-R185 HydrophobicContact CZ-CG 4.34Å; F152-Y186 HydrophobicContact CE1-CD2 4.29Å
153	F	98.3	Very high	96.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.2	-44.1	179.2	-169.9	-97.5	0	0	0	111.6	Y141 C149 K150 R155 T156 V157 Y186 C189 L190 M194 K195 V199	Y141-F153 HydrophobicContact CD2-CB 4.42Å; Y141-F153 AromaticContact CD2-CD1 3.58Å; Y141-F153 HydrophobicContact CD2-CD1 3.58Å; Y141-F153 HydrophobicContact CD2-CE1 4.3Å; Y141-F153 HydrophobicContact CD2-CG 4.35Å; Y141-F153 HydrophobicContact CE2-CD1 4.1Å; Y141-F153 AromaticContact CG-CD1 3.85Å; Y141-F153 HydrophobicContact CG-CD1 3.85Å; Y141-F153 HydrophobicContact CG-CE1 4.11Å; C149-F153 WeakPolarHBondContact O-CB 3.14Å; C149-F153 PolarHBondContact O-N 3.46Å; K150-F153 PolarHBondContact O-N 3.47Å; F153-R155 PolarHBondContact O-N 2.84Å; F153-T156 PolarHBondContact O-N 3.09Å; F153-V157 HydrophobicContact CD1-CG2 4.14Å; F153-V157 HydrophobicContact CE1-CG2 3.84Å; F153-V157 HydrophobicContact CE2-CG2 4.41Å; F153-V157 HydrophobicContact CZ-CG2 3.99Å; F153-V157 WeakPolarHBondContact O-CG2 3.27Å; F153-V157 PolarHBondContact O-N 3.05Å; F153-Y186 AromaticContact CD2-CD2 3.97Å; F153-Y186 HydrophobicContact CD2-CD2 3.97Å; F153-Y186 AromaticContact CD2-CE2 3.67Å; F153-Y186 HydrophobicContact CD2-CE2 3.67Å; F153-Y186 HydrophobicContact CE2-CD2 4.24Å; F153-Y186 AromaticContact CE2-CE2 3.6Å; F153-Y186 HydrophobicContact CE2-CE2 3.6Å; F153-C189 HydrophobicContact CD2-CB 3.58Å; F153-C189 HydrophobicContact CE2-CB 4.02Å; F153-L190 HydrophobicContact CE2-CD2 3.89Å; F153-L190 HydrophobicContact CZ-CD2 4.26Å; F153-M194 HydrophobicContact CB-SD 3.89Å; F153-M194 HydrophobicContact CD1-CB 4.34Å; F153-M194 HydrophobicContact CD1-SD 4.34Å; F153-M194 HydrophobicContact CD2-CB 3.93Å; F153-M194 HydrophobicContact CD2-SD 3.84Å; F153-M194 HydrophobicContact CE1-CB 4.02Å; F153-M194 HydrophobicContact CE2-CB 3.57Å; F153-M194 HydrophobicContact CE2-SD 4.46Å; F153-M194 HydrophobicContact CG-CB 4.3Å; F153-M194 HydrophobicContact CG-SD 3.76Å; F153-M194 HydrophobicContact CZ-CB 3.62Å; F153-M194 WeakPolarHBondContact CZ-O 3.46Å; F153-K195 WeakPolarHBondContact CE1-O 3.38Å; F153-V199 HydrophobicContact CD1-CG2 3.85Å; F153-V199 HydrophobicContact CE1-CG2 3.72Å
154	K	96.9	Very high	96.4	Very high	84 Å²	84	60.2 Å²	60.2	37%	0.365	30%	0.299	S	S	.	.	H	α-helix	trans	-54.9	-47.7	176.4	-166.3	179.6	81.4	165.4	0	113.3	Y141 K150 F152 R158 V199	Y141-K154 HydrophobicContact CE2-CB 4.35Å; Y141-K154 WeakPolarHBondContact OH-CB 3.3Å; Y141-K154 WeakPolarHBondContact OH-CD 3.21Å; Y141-K154 VanDerWaalsContact OH-CG 3.28Å; Y141-K154 WeakPolarHBondContact OH-CG 3.42Å; K150-K154 VanDerWaalsContact O-CB 3.3Å; K150-K154 WeakPolarHBondContact O-CB 3.2Å; K150-K154 PolarHBondContact O-N 3.12Å; F152-K154 VanDerWaalsContact C-N 3.3Å; F152-K154 PolarHBondContact O-N 2.92Å; K154-R158 VanDerWaalsContact CD-NH1 3.34Å; K154-R158 WeakPolarHBondContact O-CB 3.45Å; K154-R158 WeakPolarHBondContact O-CG 3.38Å; K154-R158 PolarHBondContact O-N 3.11Å; K154-V199 HydrophobicContact CG-CG1 4.25Å
155	R	96.8	Very high	96.3	Very high	137 Å²	137	57.2 Å²	57.2	52%	0.517	29%	0.289	S	S	.	.	H	α-helix	trans	-71.3	-40.8	-178.6	-74.3	-173.7	-60.2	-88.8	0.4	111.8	G151 F152 F153 V157 K159	G151-R155 WeakPolarHBondContact O-CG 3.39Å; G151-R155 VanDerWaalsContact O-CZ 3.32Å; G151-R155 PolarHBondContact O-N 2.77Å; G151-R155 VanDerWaalsContact O-N 3.1Å; G151-R155 PolarHBondContact O-NH1 3.15Å; F152-R155 PolarHBondContact O-N 3.01Å; F153-R155 PolarHBondContact O-N 2.84Å; R155-V157 VanDerWaalsContact C-N 3.35Å; R155-K159 WeakPolarHBondContact O-CB 3.44Å; R155-K159 PolarHBondContact O-N 3.16Å; R155-K159 VanDerWaalsContact O-N 3.16Å
156	T	97.2	Very high	96.3	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.006	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-48.5	176.3	-57.3	0	0	0	0	110.7	F152 F153 D160 L161 Y163 Y186	F152-T156 PolarHBondContact O-N 2.87Å; F152-T156 PolarHBondContact O-OG1 3.37Å; F153-T156 PolarHBondContact O-N 3.09Å; T156-D160 WeakPolarHBondContact O-CA 3.41Å; T156-D160 PolarHBondContact O-N 3.35Å; T156-L161 HydrophobicContact CG2-CB 4.36Å; T156-L161 PolarHBondContact O-N 2.93Å; T156-Y163 HydrophobicContact CG2-CD2 4.33Å; T156-Y163 HydrophobicContact CG2-CE2 3.48Å; T156-Y163 VanDerWaalsContact CG2-CE2 3.48Å; T156-Y163 WeakPolarHBondContact OG1-CE2 3.4Å; T156-Y163 PolarHBondContact OG1-OH 2.76Å; T156-Y186 HydrophobicContact CG2-CD1 4.13Å; T156-Y186 HydrophobicContact CG2-CD2 3.6Å; T156-Y186 HydrophobicContact CG2-CE1 4.06Å; T156-Y186 HydrophobicContact CG2-CE2 3.52Å; T156-Y186 HydrophobicContact CG2-CG 3.91Å
157	V	96	Very high	96.1	Very high	29 Å²	29	73.3 Å²	73.3	18%	0.176	36%	0.357	C	S	.	.	H	α-helix	trans	-70.6	-43.6	-178.4	176.5	0	0	0	0	112.2	F153 R155 K159 D160 Y186 R196 V199	F153-V157 HydrophobicContact CD1-CG2 4.14Å; F153-V157 HydrophobicContact CE1-CG2 3.84Å; F153-V157 HydrophobicContact CE2-CG2 4.41Å; F153-V157 HydrophobicContact CZ-CG2 3.99Å; F153-V157 WeakPolarHBondContact O-CG2 3.27Å; F153-V157 PolarHBondContact O-N 3.05Å; R155-V157 VanDerWaalsContact C-N 3.35Å; V157-K159 VanDerWaalsContact C-N 3.32Å; V157-K159 PolarHBondContact O-N 3.24Å; V157-D160 PolarHBondContact O-N 3.21Å; V157-Y186 HydrophobicContact CG2-CE2 4.34Å; V157-R196 HydrophobicContact CG1-CB 4.45Å; V157-R196 HydrophobicContact CG2-CB 4.36Å; V157-V199 HydrophobicContact CB-CB 4.22Å; V157-V199 HydrophobicContact CB-CG1 4.22Å; V157-V199 HydrophobicContact CB-CG2 3.96Å; V157-V199 HydrophobicContact CG1-CB 3.79Å; V157-V199 HydrophobicContact CG1-CG1 4.08Å; V157-V199 HydrophobicContact CG1-CG2 3.93Å; V157-V199 HydrophobicContact CG2-CG2 4.12Å
158	R	92	Very high	96	Very high	96 Å²	96	73.7 Å²	73.7	36%	0.362	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-33.3	-179.1	-86.2	-173.3	170.1	63.7	-0.7	114.4	K154 V199 Q200 E201	K154-R158 VanDerWaalsContact CD-NH1 3.34Å; K154-R158 WeakPolarHBondContact O-CB 3.45Å; K154-R158 WeakPolarHBondContact O-CG 3.38Å; K154-R158 PolarHBondContact O-N 3.11Å; R158-V199 HydrophobicContact CG-CG1 4.16Å; R158-Q200 PolarHBondContact NH1-O 3.08Å; R158-Q200 PolarHBondContact NH2-O 3.06Å; R158-E201 PolarHBondContact NH2-O 3.31Å
159	K	92	Very high	95.9	Very high	153 Å²	153	78.8 Å²	78.8	67%	0.665	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	10.8	-177.2	-66.5	-171.8	174.5	-160.7	0	112.2	R155 V157 L161	R155-K159 WeakPolarHBondContact O-CB 3.44Å; R155-K159 PolarHBondContact O-N 3.16Å; R155-K159 VanDerWaalsContact O-N 3.16Å; V157-K159 VanDerWaalsContact C-N 3.32Å; V157-K159 PolarHBondContact O-N 3.24Å; K159-L161 HydrophobicContact CB-CD1 4.16Å; K159-L161 HydrophobicContact CB-CD2 3.89Å; K159-L161 HydrophobicContact CB-CG 3.7Å; K159-L161 PolarHBondContact O-N 3.21Å; K159-L161 VanDerWaalsContact O-N 3.09Å
160	D	90.6	Very high	95.8	Very high	125 Å²	125	85.9 Å²	85.9	67%	0.668	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	39.6	48.2	-174.3	-156.6	36.6	0	0	0	113.8	T156 V157 T162	T156-D160 WeakPolarHBondContact O-CA 3.41Å; T156-D160 PolarHBondContact O-N 3.35Å; V157-D160 PolarHBondContact O-N 3.21Å; D160-T162 PolarHBondContact O-N 2.99Å
161	L	95.2	Very high	95.8	Very high	68 Å²	68	84.4 Å²	84.4	36%	0.356	41%	0.407	S	S	.	.			trans	-76.7	123.8	-172.2	-62	175.1	0	0	0	110.8	T156 K159 Y163	T156-L161 HydrophobicContact CG2-CB 4.36Å; T156-L161 PolarHBondContact O-N 2.93Å; K159-L161 HydrophobicContact CB-CD1 4.16Å; K159-L161 HydrophobicContact CB-CD2 3.89Å; K159-L161 HydrophobicContact CB-CG 3.7Å; K159-L161 PolarHBondContact O-N 3.21Å; K159-L161 VanDerWaalsContact O-N 3.09Å; L161-Y163 HydrophobicContact CB-CE1 4.08Å; L161-Y163 HydrophobicContact CB-CE2 4.4Å; L161-Y163 HydrophobicContact CD1-CE1 4.34Å; L161-Y163 WeakPolarHBondContact CD1-OH 3.35Å
162	T	93.7	Very high	95.7	Very high	129 Å²	129	90.1 Å²	90.1	79%	0.791	43%	0.433	S	S	*	.			trans	-93.9	129.2	168.5	-62.2	0	0	0	0	110	D160	D160-T162 PolarHBondContact O-N 2.99Å
163	Y	96.8	Very high	95.7	Very high	36 Å²	36	90.3 Å²	90.3	14%	0.141	44%	0.435	C	S	.	.			trans	-112.3	154	178.2	-55.9	-63.7	0	0	0	111.1	F152 T156 L161 Q182 Y183	F152-Y163 HydrophobicContact CE2-CE2 4.04Å; F152-Y163 HydrophobicContact CZ-CD2 4.48Å; F152-Y163 AromaticContact CZ-CE2 3.8Å; F152-Y163 HydrophobicContact CZ-CE2 3.8Å; T156-Y163 HydrophobicContact CG2-CD2 4.33Å; T156-Y163 HydrophobicContact CG2-CE2 3.48Å; T156-Y163 VanDerWaalsContact CG2-CE2 3.48Å; T156-Y163 WeakPolarHBondContact OG1-CE2 3.4Å; T156-Y163 PolarHBondContact OG1-OH 2.76Å; L161-Y163 HydrophobicContact CB-CE1 4.08Å; L161-Y163 HydrophobicContact CB-CE2 4.4Å; L161-Y163 HydrophobicContact CD1-CE1 4.34Å; L161-Y163 WeakPolarHBondContact CD1-OH 3.35Å; Y163-Q182 HydrophobicContact CD1-CB 3.71Å; Y163-Q182 HydrophobicContact CD1-CG 4.5Å; Y163-Q182 HydrophobicContact CD2-CB 3.98Å; Y163-Q182 HydrophobicContact CE1-CB 3.91Å; Y163-Q182 HydrophobicContact CE1-CG 4.36Å; Y163-Q182 HydrophobicContact CE2-CB 4.15Å; Y163-Q182 HydrophobicContact CG-CB 3.75Å; Y163-Y183 VanDerWaalsContact O-CD2 3.23Å; Y163-Y183 WeakPolarHBondContact O-CD2 3.44Å
164	T	95.9	Very high	95.7	Very high	124 Å²	124	92.9 Å²	92.9	76%	0.761	45%	0.449	S	S	*	.			trans	-119.6	131.9	173.7	-54.1	0	0	0	0	109.8
165	C	97	Very high	95.6	Very high	16 Å²	16	95 Å²	95	11%	0.108	46%	0.457	C	S	.	.			trans	-76.5	138.3	171.1	-166.8	0	0	0	0	109.7	D167 K169 Y183	C165-D167 PolarHBondContact SG-N 2.89Å; C165-D167 VanDerWaalsContact SG-N 3.42Å; C165-K169 HydrophobicContact CB-CG 3.88Å; C165-Y183 HydrophobicContact CB-CD1 3.56Å; C165-Y183 HydrophobicContact CB-CE1 4.25Å; C165-Y183 HydrophobicContact CB-CG 3.92Å
166	R	96.1	Very high	95.6	Very high	241 Å²	241	99.9 Å²	99.9	91%	0.909	48%	0.476	S	S	*	.	S	Bend	trans	-91.3	-10.2	174.9	-63.2	-176.2	179.9	-177.2	-1.7	113.3
167	D	94.9	Very high	95.5	Very high	100 Å²	100	103.9 Å²	103.9	54%	0.535	50%	0.495	S	S	.	.	S	Bend	trans	-111.3	-151.9	178.2	-54.2	-43	0	0	0	109.7	C165 K169 C171	C165-D167 PolarHBondContact SG-N 2.89Å; C165-D167 VanDerWaalsContact SG-N 3.42Å; D167-K169 VanDerWaalsContact C-N 3.31Å; D167-K169 PolarHBondContact O-N 3.15Å; D167-C171 PolarHBondContact OD2-SG 2.86Å
168	N	95.3	Very high	95.6	Very high	107 Å²	107	104.4 Å²	104.4	57%	0.572	49%	0.494	S	S	*	.	S	Bend	trans	-86.1	18.8	-175.9	71.7	-17.7	0	0	0	115.2	E170	N168-E170 PolarHBondContact ND2-OE2 3.22Å; N168-E170 PolarHBondContact O-N 2.81Å; N168-E170 WeakPolarHBondContact OD1-CB 3.38Å; N168-E170 PolarHBondContact OD1-N 3.17Å; N168-E170 VanDerWaalsContact OD1-N 3.11Å
169	K	96.3	Very high	95.8	Very high	132 Å²	132	105.5 Å²	105.5	57%	0.574	51%	0.507	S	S	*	.	S	Bend	trans	65	10.7	-174.4	-58.6	178	175	179.1	0	115.7	C165 D167 Y183 C184	C165-K169 HydrophobicContact CB-CG 3.88Å; D167-K169 VanDerWaalsContact C-N 3.31Å; D167-K169 PolarHBondContact O-N 3.15Å; K169-Y183 HydrophobicContact CB-CD1 4.45Å; K169-Y183 HydrophobicContact CB-CE1 3.79Å; K169-Y183 HydrophobicContact CD-CE1 3.76Å; K169-Y183 WeakPolarHBondContact CD-OH 3.11Å; K169-Y183 HydrophobicContact CG-CD1 4.18Å; K169-Y183 HydrophobicContact CG-CE1 3.51Å; K169-C184 PolarHBondContact O-SG 3.39Å
170	E	96.5	Very high	96.1	Very high	148 Å²	148	107.9 Å²	107.9	69%	0.692	51%	0.511	S	S	*	.			trans	-111.4	25.1	179	-57.5	-173.9	135.4	0	0	113.9	N168 L172	N168-E170 PolarHBondContact ND2-OE2 3.22Å; N168-E170 PolarHBondContact O-N 2.81Å; N168-E170 WeakPolarHBondContact OD1-CB 3.38Å; N168-E170 PolarHBondContact OD1-N 3.17Å; N168-E170 VanDerWaalsContact OD1-N 3.11Å; E170-L172 PolarHBondContact O-N 3.49Å
171	C	97.4	Very high	96.5	Very high	25 Å²	25	102.4 Å²	102.4	17%	0.169	48%	0.483	C	S	.	.			trans	-59.4	130.9	-177.4	-49.7	0	0	0	0	111.9	D167 I173 C181 C184	D167-C171 PolarHBondContact OD2-SG 2.86Å; C171-I173 PolarHBondContact O-N 2.89Å; C171-C181 HydrophobicContact CB-CB 3.81Å; C171-C184 HydrophobicContact CB-CB 3.8Å
172	L	96.8	Very high	96.6	Very high	133 Å²	133	104 Å²	104	70%	0.696	49%	0.489	S	S	*	.			trans	-65.6	127.9	177.3	-68.7	171.3	0	0	0	111.8	E170	E170-L172 PolarHBondContact O-N 3.49Å
173	I	98.2	Very high	96.8	Very high	12 Å²	12	100.1 Å²	100.1	6%	0.062	46%	0.46	C	S	.	.			trans	-109.7	99.9	179	-50.8	-58.1	0	0	0	109.8	I131 C132 C171 R178 C184 R185 K188	I131-I173 HydrophobicContact CG2-CG2 4.04Å; C132-I173 HydrophobicContact CB-CG2 4.16Å; C171-I173 PolarHBondContact O-N 2.89Å; I173-R178 HydrophobicContact CG2-CB 3.9Å; I173-C184 HydrophobicContact CD1-CB 4.03Å; I173-R185 HydrophobicContact CD1-CB 3.98Å; I173-R185 HydrophobicContact CG2-CG 4.18Å; I173-K188 HydrophobicContact CB-CD 3.66Å; I173-K188 HydrophobicContact CG1-CB 4.43Å; I173-K188 HydrophobicContact CG1-CD 3.91Å; I173-K188 HydrophobicContact CG2-CD 4.16Å; I173-K188 PolarHBondContact O-NZ 2.75Å; I173-K188 VanDerWaalsContact O-NZ 3.11Å
174	D	97.3	Very high	96.9	Very high	55 Å²	55	98.8 Å²	98.8	29%	0.294	46%	0.456	S	S	.	.			trans	-126	177.8	174.2	69.3	44.2	0	0	0	111.7	C132 R176 Q177 R178	C132-D174 CarbonylContact O-C 3.31Å; C132-D174 VanDerWaalsContact O-C 3.31Å; C132-D174 WeakPolarHBondContact O-CA 3.41Å; D174-R176 VanDerWaalsContact C-N 3.25Å; D174-R176 PolarHBondContact O-N 2.95Å; D174-R176 WeakPolarHBondContact OD1-CA 3.46Å; D174-R176 WeakPolarHBondContact OD1-CB 3.45Å; D174-R176 PolarHBondContact OD1-N 2.83Å; D174-Q177 VanDerWaalsContact CG-CG 3.49Å; D174-Q177 VanDerWaalsContact OD1-CG 3.26Å; D174-Q177 WeakPolarHBondContact OD1-CG 3.46Å; D174-Q177 PolarHBondContact OD1-N 3.25Å; D174-Q177 VanDerWaalsContact OD2-CG 3.29Å; D174-Q177 WeakPolarHBondContact OD2-CG 3.46Å; D174-Q177 PolarHBondContact OD2-NE2 3.22Å; D174-R178 WeakPolarHBondContact O-CB 3.43Å; D174-R178 PolarHBondContact O-N 3.03Å
175	K	96.3	Very high	97	Very high	127 Å²	127	93.3 Å²	93.3	55%	0.552	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-35.2	-178.2	178.7	174	179.1	155	0	113.6	C132 D134	C132-K175 PolarHBondContact O-N 2.94Å; D134-K175 HydrophobicContact CB-CB 4.4Å; D134-K175 HydrophobicContact CB-CD 4.22Å; D134-K175 HydrophobicContact CB-CG 4.22Å; D134-K175 WeakPolarHBondContact OD1-CD 3.45Å; D134-K175 VanDerWaalsContact OD1-CE 3.27Å; D134-K175 WeakPolarHBondContact OD1-CE 3.45Å; D134-K175 IonicContact OD1-NZ 3.36Å; D134-K175 PolarHBondContact OD1-NZ 2.95Å
176	R	96.4	Very high	97.1	Very high	240 Å²	240	94.5 Å²	94.5	91%	0.906	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-42.8	-174	-62.8	-177.3	179.5	-165.2	0	111.5	D174	D174-R176 VanDerWaalsContact C-N 3.25Å; D174-R176 PolarHBondContact O-N 2.95Å; D174-R176 WeakPolarHBondContact OD1-CA 3.46Å; D174-R176 WeakPolarHBondContact OD1-CB 3.45Å; D174-R176 PolarHBondContact OD1-N 2.83Å
177	Q	95.5	Very high	97.2	Very high	85 Å²	85	86.8 Å²	86.8	40%	0.397	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	12.3	-172	55.6	178.8	-20.6	0	0	115.3	D174 N179 R180	D174-Q177 VanDerWaalsContact CG-CG 3.49Å; D174-Q177 VanDerWaalsContact OD1-CG 3.26Å; D174-Q177 WeakPolarHBondContact OD1-CG 3.46Å; D174-Q177 PolarHBondContact OD1-N 3.25Å; D174-Q177 VanDerWaalsContact OD2-CG 3.29Å; D174-Q177 WeakPolarHBondContact OD2-CG 3.46Å; D174-Q177 PolarHBondContact OD2-NE2 3.22Å; Q177-N179 PolarHBondContact O-N 3.33Å; Q177-R180 HydrophobicContact CB-CB 4.4Å; Q177-R180 VanDerWaalsContact O-CB 3.25Å; Q177-R180 WeakPolarHBondContact O-CB 3.49Å; Q177-R180 PolarHBondContact O-N 3.5Å
178	R	97.3	Very high	97.4	Very high	41 Å²	41	85.4 Å²	85.4	16%	0.155	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-17.3	173.9	61.9	-173	-170.8	-160.2	-4.3	115.5	C132 D134 C146 I173 D174 R185	C132-R178 HydrophobicContact CB-CB 4.16Å; C132-R178 PolarHBondContact SG-NH1 3.5Å; D134-R178 IonicContact OD2-CZ 2.78Å; D134-R178 IonicContact OD2-NH1 3.25Å; D134-R178 PolarHBondContact OD2-NH1 3.36Å; D134-R178 IonicContact OD2-NH2 3.97Å; C146-R178 PolarHBondContact SG-NH1 2.9Å; I173-R178 HydrophobicContact CG2-CB 3.9Å; D174-R178 WeakPolarHBondContact O-CB 3.43Å; D174-R178 PolarHBondContact O-N 3.03Å; R178-R185 VanDerWaalsContact O-CD 3.26Å; R178-R185 WeakPolarHBondContact O-CD 3.48Å; R178-R185 PolarHBondContact O-NH1 3.28Å
179	N	97.3	Very high	97.5	Very high	119 Å²	119	80.3 Å²	80.3	64%	0.636	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-6.1	177.3	-65.3	-24.2	0	0	0	113.4	Q177 R185	Q177-N179 PolarHBondContact O-N 3.33Å; N179-R185 PolarHBondContact OD1-NH1 2.86Å
180	R	97.3	Very high	97.6	Very high	202 Å²	202	77.2 Å²	77.2	76%	0.762	35%	0.349	S	S	*	.	S	Bend	trans	-65.4	-40.9	-177.6	179.4	62.1	173.8	-169.7	-1.2	112.5	Q177	Q177-R180 HydrophobicContact CB-CB 4.4Å; Q177-R180 VanDerWaalsContact O-CB 3.25Å; Q177-R180 WeakPolarHBondContact O-CB 3.49Å; Q177-R180 PolarHBondContact O-N 3.5Å
181	C	98.1	Very high	97.7	Very high	11 Å²	11	73.8 Å²	73.8	7%	0.074	35%	0.346	C	S	.	.			trans	-135.7	108.9	-179.3	-177.4	0	0	0	0	110.6	C171 C184 R185	C171-C181 HydrophobicContact CB-CB 3.81Å; C181-C184 HydrophobicContact CB-CB 4.3Å; C181-C184 PolarHBondContact SG-N 3.36Å; C181-C184 VanDerWaalsContact SG-N 3.43Å; C181-C184 VanDerWaalsContact SG-SG 3.64Å; C181-R185 WeakPolarHBondContact O-CB 3.3Å; C181-R185 PolarHBondContact O-N 3.03Å
182	Q	98.2	Very high	97.7	Very high	102 Å²	102	76.9 Å²	76.9	48%	0.477	36%	0.359	S	S	.	.	H	α-helix	trans	-68.3	-36.3	178.7	-65.8	171.8	-68	0	0	111.6	F152 Y163 R185 Y186	F152-Q182 HydrophobicContact CE2-CB 4.03Å; F152-Q182 HydrophobicContact CE2-CG 4.08Å; F152-Q182 HydrophobicContact CZ-CB 4.16Å; F152-Q182 WeakPolarHBondContact CZ-O 2.89Å; Y163-Q182 HydrophobicContact CD1-CB 3.71Å; Y163-Q182 HydrophobicContact CD1-CG 4.5Å; Y163-Q182 HydrophobicContact CD2-CB 3.98Å; Y163-Q182 HydrophobicContact CE1-CB 3.91Å; Y163-Q182 HydrophobicContact CE1-CG 4.36Å; Y163-Q182 HydrophobicContact CE2-CB 4.15Å; Y163-Q182 HydrophobicContact CG-CB 3.75Å; Q182-R185 PolarHBondContact O-N 2.66Å; Q182-Y186 WeakPolarHBondContact O-CB 3.37Å; Q182-Y186 PolarHBondContact O-N 3.06Å
183	Y	98.5	Very high	97.7	Very high	47 Å²	47	72.4 Å²	72.4	18%	0.184	35%	0.345	C	S	.	.	H	α-helix	trans	-57.1	-60.8	176.3	176.2	-92.4	0	0	0	111.4	Y163 C165 K169 R185 Y186 Q187	Y163-Y183 VanDerWaalsContact O-CD2 3.23Å; Y163-Y183 WeakPolarHBondContact O-CD2 3.44Å; C165-Y183 HydrophobicContact CB-CD1 3.56Å; C165-Y183 HydrophobicContact CB-CE1 4.25Å; C165-Y183 HydrophobicContact CB-CG 3.92Å; K169-Y183 HydrophobicContact CB-CD1 4.45Å; K169-Y183 HydrophobicContact CB-CE1 3.79Å; K169-Y183 HydrophobicContact CD-CE1 3.76Å; K169-Y183 WeakPolarHBondContact CD-OH 3.11Å; K169-Y183 HydrophobicContact CG-CD1 4.18Å; K169-Y183 HydrophobicContact CG-CE1 3.51Å; Y183-R185 PolarHBondContact O-N 3.37Å; Y183-Y186 PolarHBondContact O-N 3.15Å; Y183-Y186 VanDerWaalsContact O-N 3.07Å; Y183-Q187 HydrophobicContact CD1-CG 4.11Å; Y183-Q187 HydrophobicContact CD2-CG 4.38Å; Y183-Q187 HydrophobicContact CE1-CG 3.73Å; Y183-Q187 HydrophobicContact CE2-CG 4.04Å; Y183-Q187 HydrophobicContact CG-CG 4.44Å; Y183-Q187 WeakPolarHBondContact O-CG 3.48Å; Y183-Q187 PolarHBondContact O-N 3.01Å
184	C	98.4	Very high	97.7	Very high	8 Å²	8	72.1 Å²	72.1	5%	0.054	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-32.5	-177.7	-65.4	0	0	0	0	112	K169 C171 I173 C181 K188	K169-C184 PolarHBondContact O-SG 3.39Å; C171-C184 HydrophobicContact CB-CB 3.8Å; I173-C184 HydrophobicContact CD1-CB 4.03Å; C181-C184 HydrophobicContact CB-CB 4.3Å; C181-C184 PolarHBondContact SG-N 3.36Å; C181-C184 VanDerWaalsContact SG-N 3.43Å; C181-C184 VanDerWaalsContact SG-SG 3.64Å; C184-K188 VanDerWaalsContact O-CB 3.3Å; C184-K188 WeakPolarHBondContact O-CB 3.41Å; C184-K188 PolarHBondContact O-N 3.32Å
185	R	98.6	Very high	97.6	Very high	9 Å²	9	74.9 Å²	74.9	3%	0.034	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-45.3	173.6	-169.4	-168.4	-170.3	162.2	-2.8	112	G148 C149 F152 I173 R178 N179 C181 Q182 Y183 K188 C189	G148-R185 VanDerWaalsContact C-NH2 3.3Å; G148-R185 PolarHBondContact O-NH2 3.41Å; G148-R185 VanDerWaalsContact O-NH2 3.17Å; C149-R185 PolarHBondContact SG-NH2 2.94Å; F152-R185 VanDerWaalsContact CD1-CD 3.5Å; F152-R185 HydrophobicContact CD1-CG 3.97Å; F152-R185 HydrophobicContact CE1-CB 3.98Å; F152-R185 HydrophobicContact CE1-CG 3.78Å; F152-R185 HydrophobicContact CZ-CB 4.17Å; F152-R185 HydrophobicContact CZ-CG 4.34Å; I173-R185 HydrophobicContact CD1-CB 3.98Å; I173-R185 HydrophobicContact CG2-CG 4.18Å; R178-R185 VanDerWaalsContact O-CD 3.26Å; R178-R185 WeakPolarHBondContact O-CD 3.48Å; R178-R185 PolarHBondContact O-NH1 3.28Å; N179-R185 PolarHBondContact OD1-NH1 2.86Å; C181-R185 WeakPolarHBondContact O-CB 3.3Å; C181-R185 PolarHBondContact O-N 3.03Å; Q182-R185 PolarHBondContact O-N 2.66Å; Y183-R185 PolarHBondContact O-N 3.37Å; R185-K188 PolarHBondContact O-N 3.12Å; R185-C189 PolarHBondContact O-N 2.94Å; R185-C189 PolarHBondContact O-SG 3.36Å
186	Y	98.6	Very high	97.6	Very high	40 Å²	40	76.5 Å²	76.5	16%	0.157	36%	0.356	C	S	.	.	H	α-helix	trans	-67.9	-43.8	179.4	-175.8	-120.5	0	0	0	111.7	F152 F153 T156 V157 Q182 Y183 K188 C189 L190	F152-Y186 HydrophobicContact CE1-CD2 4.29Å; F153-Y186 AromaticContact CD2-CD2 3.97Å; F153-Y186 HydrophobicContact CD2-CD2 3.97Å; F153-Y186 AromaticContact CD2-CE2 3.67Å; F153-Y186 HydrophobicContact CD2-CE2 3.67Å; F153-Y186 HydrophobicContact CE2-CD2 4.24Å; F153-Y186 AromaticContact CE2-CE2 3.6Å; F153-Y186 HydrophobicContact CE2-CE2 3.6Å; T156-Y186 HydrophobicContact CG2-CD1 4.13Å; T156-Y186 HydrophobicContact CG2-CD2 3.6Å; T156-Y186 HydrophobicContact CG2-CE1 4.06Å; T156-Y186 HydrophobicContact CG2-CE2 3.52Å; T156-Y186 HydrophobicContact CG2-CG 3.91Å; V157-Y186 HydrophobicContact CG2-CE2 4.34Å; Q182-Y186 WeakPolarHBondContact O-CB 3.37Å; Q182-Y186 PolarHBondContact O-N 3.06Å; Y183-Y186 PolarHBondContact O-N 3.15Å; Y183-Y186 VanDerWaalsContact O-N 3.07Å; Y186-K188 VanDerWaalsContact C-N 3.28Å; Y186-K188 PolarHBondContact O-N 2.98Å; Y186-C189 VanDerWaalsContact O-CB 3.31Å; Y186-C189 WeakPolarHBondContact O-CB 3.36Å; Y186-C189 PolarHBondContact O-N 3.13Å; Y186-L190 HydrophobicContact CD1-CD1 4.23Å; Y186-L190 HydrophobicContact CE1-CD1 3.8Å; Y186-L190 HydrophobicContact CE1-CG 4.43Å; Y186-L190 PolarHBondContact O-N 3.11Å; Y186-L190 VanDerWaalsContact O-N 3.08Å
187	Q	98.3	Very high	97.4	Very high	80 Å²	80	71.4 Å²	71.4	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-42	173.1	-66.9	-55.9	-40.1	0	0	111.6	Y183 C189 L190 A191	Y183-Q187 HydrophobicContact CD1-CG 4.11Å; Y183-Q187 HydrophobicContact CD2-CG 4.38Å; Y183-Q187 HydrophobicContact CE1-CG 3.73Å; Y183-Q187 HydrophobicContact CE2-CG 4.04Å; Y183-Q187 HydrophobicContact CG-CG 4.44Å; Y183-Q187 WeakPolarHBondContact O-CG 3.48Å; Y183-Q187 PolarHBondContact O-N 3.01Å; Q187-C189 PolarHBondContact O-N 2.68Å; Q187-L190 PolarHBondContact O-N 2.84Å; Q187-A191 WeakPolarHBondContact O-CB 3.34Å; Q187-A191 PolarHBondContact O-N 3.2Å
188	K	98.3	Very high	97.2	Very high	71 Å²	71	69.5 Å²	69.5	31%	0.309	34%	0.341	S	S	.	.	H	α-helix	trans	-66	-34.5	174.8	-165.9	174	-175	-176	0	113	I131 I173 C184 R185 Y186 M192	I131-K188 HydrophobicContact CG2-CD 4.44Å; I131-K188 HydrophobicContact CG2-CG 4.44Å; I131-K188 VanDerWaalsContact O-CD 3.27Å; I131-K188 WeakPolarHBondContact O-CD 3.38Å; I131-K188 WeakPolarHBondContact O-CE 3.48Å; I131-K188 PolarHBondContact O-NZ 3.46Å; I173-K188 HydrophobicContact CB-CD 3.66Å; I173-K188 HydrophobicContact CG1-CB 4.43Å; I173-K188 HydrophobicContact CG1-CD 3.91Å; I173-K188 HydrophobicContact CG2-CD 4.16Å; I173-K188 PolarHBondContact O-NZ 2.75Å; I173-K188 VanDerWaalsContact O-NZ 3.11Å; C184-K188 VanDerWaalsContact O-CB 3.3Å; C184-K188 WeakPolarHBondContact O-CB 3.41Å; C184-K188 PolarHBondContact O-N 3.32Å; R185-K188 PolarHBondContact O-N 3.12Å; Y186-K188 VanDerWaalsContact C-N 3.28Å; Y186-K188 PolarHBondContact O-N 2.98Å; K188-M192 HydrophobicContact CG-CG 4.32Å; K188-M192 WeakPolarHBondContact O-CB 3.46Å; K188-M192 WeakPolarHBondContact O-CG 3.43Å; K188-M192 PolarHBondContact O-N 3.21Å
189	C	98.4	Very high	96.9	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.8	-47.4	172.2	-69.6	0	0	0	0	111.4	F153 R185 Y186 Q187 M192 G193 M194	F153-C189 HydrophobicContact CD2-CB 3.58Å; F153-C189 HydrophobicContact CE2-CB 4.02Å; R185-C189 PolarHBondContact O-N 2.94Å; R185-C189 PolarHBondContact O-SG 3.36Å; Y186-C189 VanDerWaalsContact O-CB 3.31Å; Y186-C189 WeakPolarHBondContact O-CB 3.36Å; Y186-C189 PolarHBondContact O-N 3.13Å; Q187-C189 PolarHBondContact O-N 2.68Å; C189-M192 PolarHBondContact O-N 2.89Å; C189-G193 PolarHBondContact O-N 2.91Å; C189-M194 HydrophobicContact CB-CB 4.22Å; C189-M194 HydrophobicContact CB-CG 4.22Å; C189-M194 HydrophobicContact CB-SD 3.62Å; C189-M194 VanDerWaalsContact O-CB 3.3Å; C189-M194 WeakPolarHBondContact O-CB 3.38Å; C189-M194 PolarHBondContact O-N 2.83Å
190	L	98.1	Very high	96.3	Very high	66 Å²	66	69.2 Å²	69.2	35%	0.346	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-47	178.1	-64.2	174.3	0	0	0	111.5	F153 Y186 Q187 M192 G193	F153-L190 HydrophobicContact CE2-CD2 3.89Å; F153-L190 HydrophobicContact CZ-CD2 4.26Å; Y186-L190 HydrophobicContact CD1-CD1 4.23Å; Y186-L190 HydrophobicContact CE1-CD1 3.8Å; Y186-L190 HydrophobicContact CE1-CG 4.43Å; Y186-L190 PolarHBondContact O-N 3.11Å; Y186-L190 VanDerWaalsContact O-N 3.08Å; Q187-L190 PolarHBondContact O-N 2.84Å; L190-M192 PolarHBondContact O-N 3.46Å; L190-G193 WeakPolarHBondContact O-CA 3.41Å; L190-G193 PolarHBondContact O-N 2.97Å
191	A	97.9	Very high	95.4	Very high	77 Å²	77	68 Å²	68	64%	0.636	34%	0.342	S	S	*	.	H	α-helix	trans	-60.2	-32.2	179.2	0	0	0	0	0	113	Q187 G193	Q187-A191 WeakPolarHBondContact O-CB 3.34Å; Q187-A191 PolarHBondContact O-N 3.2Å; A191-G193 VanDerWaalsContact C-N 3.26Å; A191-G193 PolarHBondContact O-N 3.45Å
192	M	97.8	Very high	94.2	Very high	89 Å²	89	74.3 Å²	74.3	44%	0.438	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-0.1	175.1	-63.7	-63.8	95.4	0	0	113.5	A130 V143 K188 C189 L190	A130-M192 HydrophobicContact CB-CB 4.49Å; A130-M192 HydrophobicContact CB-CG 4.42Å; A130-M192 HydrophobicContact CB-SD 4.49Å; V143-M192 HydrophobicContact CG1-CB 4.4Å; V143-M192 WeakPolarHBondContact CG2-O 3.05Å; K188-M192 HydrophobicContact CG-CG 4.32Å; K188-M192 WeakPolarHBondContact O-CB 3.46Å; K188-M192 WeakPolarHBondContact O-CG 3.43Å; K188-M192 PolarHBondContact O-N 3.21Å; C189-M192 PolarHBondContact O-N 2.89Å; L190-M192 PolarHBondContact O-N 3.46Å
193	G	97.1	Very high	92.9	Very high	39 Å²	39	79.6 Å²	79.6	40%	0.402	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	21.4	174	0	0	0	0	0	115.5	V143 C189 L190 A191 K195	V143-G193 WeakPolarHBondContact CG2-O 3.34Å; C189-G193 PolarHBondContact O-N 2.91Å; L190-G193 WeakPolarHBondContact O-CA 3.41Å; L190-G193 PolarHBondContact O-N 2.97Å; A191-G193 VanDerWaalsContact C-N 3.26Å; A191-G193 PolarHBondContact O-N 3.45Å; G193-K195 PolarHBondContact O-N 3.48Å
194	M	98.1	Very high	90.8	Very high	6 Å²	6	85.9 Å²	85.9	3%	0.03	42%	0.417	C	S	.	.			trans	-67.8	122.4	171.1	-74	-170.7	155.6	0	0	110.5	I131 Y141 V143 S145 F153 C189	I131-M194 HydrophobicContact CD1-CE 3.7Å; I131-M194 HydrophobicContact CD1-SD 4.28Å; Y141-M194 WeakPolarHBondContact O-CA 3.43Å; V143-M194 HydrophobicContact CB-CG 4.11Å; V143-M194 HydrophobicContact CG2-CG 3.95Å; S145-M194 WeakPolarHBondContact OG-CE 3.44Å; F153-M194 HydrophobicContact CB-SD 3.89Å; F153-M194 HydrophobicContact CD1-CB 4.34Å; F153-M194 HydrophobicContact CD1-SD 4.34Å; F153-M194 HydrophobicContact CD2-CB 3.93Å; F153-M194 HydrophobicContact CD2-SD 3.84Å; F153-M194 HydrophobicContact CE1-CB 4.02Å; F153-M194 HydrophobicContact CE2-CB 3.57Å; F153-M194 HydrophobicContact CE2-SD 4.46Å; F153-M194 HydrophobicContact CG-CB 4.3Å; F153-M194 HydrophobicContact CG-SD 3.76Å; F153-M194 HydrophobicContact CZ-CB 3.62Å; F153-M194 WeakPolarHBondContact CZ-O 3.46Å; C189-M194 HydrophobicContact CB-CB 4.22Å; C189-M194 HydrophobicContact CB-CG 4.22Å; C189-M194 HydrophobicContact CB-SD 3.62Å; C189-M194 VanDerWaalsContact O-CB 3.3Å; C189-M194 WeakPolarHBondContact O-CB 3.38Å; C189-M194 PolarHBondContact O-N 2.83Å
195	K	95.8	Very high	88.7	Confident	113 Å²	113	97.3 Å²	97.3	49%	0.491	46%	0.459	S	S	.	.			trans	-85.9	121	-175.3	-72.2	-176.3	171.9	-156.4	0	111.9	Y141 F153 G193 E197 A198	Y141-K195 PolarHBondContact O-N 2.87Å; F153-K195 WeakPolarHBondContact CE1-O 3.38Å; G193-K195 PolarHBondContact O-N 3.48Å; K195-E197 VanDerWaalsContact C-N 3.34Å; K195-E197 WeakPolarHBondContact CB-OE1 3.44Å; K195-E197 VanDerWaalsContact CD-OE1 3.28Å; K195-E197 WeakPolarHBondContact CD-OE1 3.31Å; K195-E197 VanDerWaalsContact CG-OE1 3.31Å; K195-E197 WeakPolarHBondContact CG-OE1 3.3Å; K195-A198 HydrophobicContact CB-CB 3.86Å; K195-A198 PolarHBondContact O-N 3.5Å
196	R	95.2	Very high	86.7	Confident	161 Å²	161	100.3 Å²	100.3	61%	0.608	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-65.1	-40.5	179.4	68.8	-175.7	-70	-128	4.4	111.2	V157 A198 V199	V157-R196 HydrophobicContact CG1-CB 4.45Å; V157-R196 HydrophobicContact CG2-CB 4.36Å; R196-A198 PolarHBondContact O-N 3.42Å; R196-V199 VanDerWaalsContact O-CB 3.32Å; R196-V199 WeakPolarHBondContact O-CB 3.42Å; R196-V199 WeakPolarHBondContact O-CG2 3.29Å; R196-V199 PolarHBondContact O-N 3.23Å
197	E	91.7	Very high	84.3	Confident	134 Å²	134	108.4 Å²	108.4	63%	0.626	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-66.7	-20.1	180	70.1	-78.6	-174.4	0	0	113	K195 V199	K195-E197 VanDerWaalsContact C-N 3.34Å; K195-E197 WeakPolarHBondContact CB-OE1 3.44Å; K195-E197 VanDerWaalsContact CD-OE1 3.28Å; K195-E197 WeakPolarHBondContact CD-OE1 3.31Å; K195-E197 VanDerWaalsContact CG-OE1 3.31Å; K195-E197 WeakPolarHBondContact CG-OE1 3.3Å; E197-V199 PolarHBondContact O-N 3.28Å
198	A	91.8	Very high	82	Confident	45 Å²	45	113.2 Å²	113.2	37%	0.372	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-76.8	-8.4	174	0	0	0	0	0	112.8	Y141 K195 R196 Q200	Y141-A198 HydrophobicContact CD1-CB 4.03Å; K195-A198 HydrophobicContact CB-CB 3.86Å; K195-A198 PolarHBondContact O-N 3.5Å; R196-A198 PolarHBondContact O-N 3.42Å; A198-Q200 PolarHBondContact O-N 2.93Å
199	V	91.4	Very high	79.8	Confident	18 Å²	18	121.9 Å²	121.9	11%	0.109	58%	0.582	C	S	.	*	S	Bend	trans	-83.7	96.1	174.1	-174.1	0	0	0	0	108.2	Y141 F153 K154 V157 R158 R196 E197	Y141-V199 HydrophobicContact CD1-CG2 3.68Å; Y141-V199 HydrophobicContact CE1-CB 4.21Å; Y141-V199 HydrophobicContact CE1-CG2 3.59Å; Y141-V199 HydrophobicContact CG-CG2 4.28Å; F153-V199 HydrophobicContact CD1-CG2 3.85Å; F153-V199 HydrophobicContact CE1-CG2 3.72Å; K154-V199 HydrophobicContact CG-CG1 4.25Å; V157-V199 HydrophobicContact CB-CB 4.22Å; V157-V199 HydrophobicContact CB-CG1 4.22Å; V157-V199 HydrophobicContact CB-CG2 3.96Å; V157-V199 HydrophobicContact CG1-CB 3.79Å; V157-V199 HydrophobicContact CG1-CG1 4.08Å; V157-V199 HydrophobicContact CG1-CG2 3.93Å; V157-V199 HydrophobicContact CG2-CG2 4.12Å; R158-V199 HydrophobicContact CG-CG1 4.16Å; R196-V199 VanDerWaalsContact O-CB 3.32Å; R196-V199 WeakPolarHBondContact O-CB 3.42Å; R196-V199 WeakPolarHBondContact O-CG2 3.29Å; R196-V199 PolarHBondContact O-N 3.23Å; E197-V199 PolarHBondContact O-N 3.28Å
200	Q	85.3	Confident	77.6	Confident	135 Å²	135	125.3 Å²	125.3	63%	0.631	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-56.5	144.7	171.2	-67.6	178.2	-5	0	0	110.5	R158 A198	R158-Q200 PolarHBondContact NH1-O 3.08Å; R158-Q200 PolarHBondContact NH2-O 3.06Å; A198-Q200 PolarHBondContact O-N 2.93Å
201	E	76.9	Confident	75.1	Confident	177 Å²	177	130.9 Å²	130.9	83%	0.827	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-58	161.5	171	-164.7	149	-138.1	0	0	111.1	R158 R203	R158-E201 PolarHBondContact NH2-O 3.31Å; E201-R203 PolarHBondContact O-N 3.32Å
202	E	74.1	Confident	72.6	Confident	144 Å²	144	135.8 Å²	135.8	67%	0.673	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-61.3	126.2	177.3	-174.9	159.3	-143.3	0	0	110.2	Q204	E202-Q204 VanDerWaalsContact C-N 3.28Å; E202-Q204 PolarHBondContact O-N 3.06Å
203	R	69.9	Low	70.2	Confident	212 Å²	212	140 Å²	140	80%	0.8	68%	0.675	S	S	*	*			trans	-67.6	96.6	165.3	-70.6	-175.9	-174.9	-178	-0.7	106.4	E201 R205	E201-R203 PolarHBondContact O-N 3.32Å; R203-R205 PolarHBondContact O-N 3.34Å
204	Q	55.5	Low	67.8	Low	180 Å²	180	144.7 Å²	144.7	84%	0.841	70%	0.696	S	S	*	*			trans	-59	111.3	168.4	-75.2	173.3	1.6	0	0	107.2	E202 G206	E202-Q204 VanDerWaalsContact C-N 3.28Å; E202-Q204 PolarHBondContact O-N 3.06Å; Q204-G206 PolarHBondContact O-N 3.04Å
205	R	53.5	Low	65.4	Low	247 Å²	247	152 Å²	152	93%	0.932	73%	0.73	S	S	*	*			trans	-77	109	168.5	-157.2	174	-179.5	-179.3	-1.5	104.8	R203 K207	R203-R205 PolarHBondContact O-N 3.34Å; R205-K207 PolarHBondContact O-N 3Å
206	G	56.2	Low	62.7	Low	72 Å²	72	150.1 Å²	150.1	74%	0.742	73%	0.731	S	S	*	*			trans	-29.2	115.5	-168.4	0	0	0	0	0	115.2	Q204 E208	Q204-G206 PolarHBondContact O-N 3.04Å; G206-E208 VanDerWaalsContact C-N 3.26Å
207	K	48.7	Very low	60.5	Low	211 Å²	211	148.4 Å²	148.4	92%	0.917	74%	0.738	S	S	*	*			trans	-101.4	44.3	154.2	-157.1	-173.5	179.9	-169.1	0	108.6	R205	R205-K207 PolarHBondContact O-N 3Å
208	E	50.5	Low	58.5	Low	181 Å²	181	146.4 Å²	146.4	85%	0.846	74%	0.74	S	S	*	*			trans	-112.6	86.5	166.5	-73.3	-175.3	-175.4	0	0	107.6	G206	G206-E208 VanDerWaalsContact C-N 3.26Å
209	R	52.3	Low	56.3	Low	253 Å²	253	147.5 Å²	147.5	96%	0.955	75%	0.745	S	S	*	*	S	Bend	trans	-145.4	81.1	153.9	-101.4	-174.5	174.6	174.4	-2.4	104.9
210	G	51.2	Low	54.4	Low	71 Å²	71	153 Å²	153	73%	0.732	77%	0.767	S	S	*	*	S	Bend	trans	-175.7	-19.8	-177.5	0	0	0	0	0	117
211	E	46.4	Very low	53.1	Low	184 Å²	184	149.8 Å²	149.8	86%	0.86	75%	0.754	S	S	*	*			trans	-141.5	69.9	-177.7	-68.2	177.3	175.6	0	0	110.2
212	N	44.2	Very low	52.6	Low	180 Å²	180	148.2 Å²	148.2	96%	0.963	75%	0.751	S	S	*	*			trans	-92.2	63	153.7	-92.8	-2.7	0	0	0	107.3
213	E	47.8	Very low	53	Low	176 Å²	176	144.6 Å²	144.6	82%	0.822	74%	0.737	S	S	*	*			trans	-119.6	114.2	152.8	-122.3	177.1	173.5	0	0	104.9	E215	E213-E215 PolarHBondContact O-N 3.18Å
214	V	47.7	Very low	54.2	Low	138 Å²	138	134.5 Å²	134.5	84%	0.836	70%	0.699	S	S	*	*			trans	-62	93.8	170.9	-80.1	0	0	0	0	106.9	S216	V214-S216 PolarHBondContact O-N 3.3Å
215	E	47.8	Very low	56.1	Low	161 Å²	161	126.5 Å²	126.5	75%	0.752	66%	0.663	S	S	*	*			trans	-59.2	111.6	170.3	-167.3	163.5	-160.1	0	0	106.5	E213 T217	E213-E215 PolarHBondContact O-N 3.18Å; E215-T217 PolarHBondContact O-N 2.72Å
216	S	38.4	Very low	58.2	Low	73 Å²	73	115.6 Å²	115.6	51%	0.51	62%	0.623	S	S	.	*			trans	-59.4	128.9	-171.1	-71.8	0	0	0	0	108.9	V214 S218 S219	V214-S216 PolarHBondContact O-N 3.3Å; S216-S218 WeakPolarHBondContact CB-OG 3.47Å; S216-S218 PolarHBondContact O-N 3.39Å; S216-S219 PolarHBondContact O-N 3.49Å; S216-S219 VanDerWaalsContact O-N 3.09Å
217	T	48.7	Very low	60.1	Low	124 Å²	124	117.7 Å²	117.7	76%	0.761	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-2.1	178.5	51.3	0	0	0	0	114.2	E215 S219 F220	E215-T217 PolarHBondContact O-N 2.72Å; T217-S219 VanDerWaalsContact C-N 3.34Å; T217-F220 HydrophobicContact CG2-CE2 4.18Å
218	S	49.3	Very low	62.4	Low	93 Å²	93	113.4 Å²	113.4	65%	0.65	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-16.5	171.7	52.4	0	0	0	0	114.4	S216	S216-S218 WeakPolarHBondContact CB-OG 3.47Å; S216-S218 PolarHBondContact O-N 3.39Å
219	S	45.9	Very low	64.7	Low	68 Å²	68	104.8 Å²	104.8	48%	0.476	56%	0.555	S	S	.	*	S	Bend	trans	-99.9	-3.4	-169.5	-54.1	0	0	0	0	115.6	S216 T217 N221 D222	S216-S219 PolarHBondContact O-N 3.49Å; S216-S219 VanDerWaalsContact O-N 3.09Å; T217-S219 VanDerWaalsContact C-N 3.34Å; S219-N221 PolarHBondContact O-N 3.49Å; S219-N221 VanDerWaalsContact O-N 3.16Å; S219-D222 PolarHBondContact O-N 2.96Å
220	F	52.8	Low	66.9	Low	133 Å²	133	95.2 Å²	95.2	58%	0.583	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.4	-179	-73	-73.7	0	0	0	114.5	T217	T217-F220 HydrophobicContact CG2-CE2 4.18Å
221	N	56.8	Low	69.1	Low	68 Å²	68	96.6 Å²	96.6	36%	0.364	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.6	-177.6	-68.2	-29.2	0	0	0	113.7	S219 S393	S219-N221 PolarHBondContact O-N 3.49Å; S219-N221 VanDerWaalsContact O-N 3.16Å; N221-S393 PolarHBondContact ND2-OG 2.88Å; N221-S393 WeakPolarHBondContact OD1-CB 3.26Å; N221-S393 PolarHBondContact OD1-OG 3.03Å
222	D	67.3	Low	71.6	Confident	143 Å²	143	87.9 Å²	87.9	77%	0.765	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-19.8	-169.2	-137.2	12.7	0	0	0	113.2	S219	S219-D222 PolarHBondContact O-N 2.96Å
223	D	82.8	Confident	74.1	Confident	68 Å²	68	79.7 Å²	79.7	36%	0.364	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-43.3	-178.3	-157.2	39.1	0	0	0	111.1	P225 H279 K386	D223-P225 WeakPolarHBondContact O-CD 3.42Å; D223-H279 PolarHBondContact O-NE2 3.24Å; D223-H279 IonicContact OD1-CE1 2.85Å; D223-H279 PolarHBondContact OD1-CE1 3.29Å; D223-H279 IonicContact OD1-NE2 3.9Å; D223-H279 PolarHBondContact OD1-NE2 3.09Å; D223-H279 IonicContact OD2-NE2 2.94Å; D223-K386 WeakPolarHBondContact OD2-CD 3.25Å; D223-K386 WeakPolarHBondContact OD2-CE 3.48Å; D223-K386 IonicContact OD2-NZ 2.74Å; D223-K386 PolarHBondContact OD2-NZ 2.83Å
224	M	95	Very high	76.4	Confident	0 Å²	0	75 Å²	75	0%	0	41%	0.409	C	S	.	.	S	Bend	trans	-116.4	72.2	174.8	-172.1	63	67.6	0	0	111.5	V226 I229 P278 F367 L383 K386 V387 S390	M224-V226 PolarHBondContact O-N 3.17Å; M224-I229 HydrophobicContact CG-CD1 4.22Å; M224-I229 HydrophobicContact SD-CD1 4.13Å; M224-P278 HydrophobicContact CE-CB 4.34Å; M224-P278 HydrophobicContact SD-CB 3.76Å; M224-P278 HydrophobicContact SD-CG 3.9Å; M224-F367 HydrophobicContact CE-CE2 4.03Å; M224-F367 HydrophobicContact CE-CZ 4.48Å; M224-L383 HydrophobicContact CE-CD2 4.25Å; M224-K386 HydrophobicContact CB-CB 3.78Å; M224-K386 HydrophobicContact CG-CB 4.35Å; M224-V387 HydrophobicContact CE-CG2 3.95Å; M224-V387 HydrophobicContact CG-CB 4.45Å; M224-V387 HydrophobicContact CG-CG2 3.72Å; M224-V387 HydrophobicContact SD-CG2 3.87Å; M224-S390 VanDerWaalsContact O-CB 3.31Å; M224-S390 WeakPolarHBondContact O-CB 3.49Å; M224-S390 PolarHBondContact O-OG 3.43Å
225	P	95.4	Very high	78.7	Confident	13 Å²	13	71.4 Å²	71.4	8%	0.084	39%	0.393	C	S	.	.			trans	-71.2	128.4	-173.8	28.2	-35.4	0	0	0	111.8	D223 E227 K228 I229 P278	D223-P225 WeakPolarHBondContact O-CD 3.42Å; P225-E227 PolarHBondContact O-N 3.11Å; P225-K228 HydrophobicContact CG-CB 4.07Å; P225-K228 HydrophobicContact CG-CD 3.68Å; P225-K228 HydrophobicContact CG-CG 3.76Å; P225-K228 PolarHBondContact O-N 3.32Å; P225-I229 PolarHBondContact O-N 3.21Å; P225-P278 HydrophobicContact CG-CG 4.31Å
226	V	96.8	Very high	80.8	Confident	17 Å²	17	64.8 Å²	64.8	10%	0.103	36%	0.364	C	S	.	.	H	α-helix	trans	-67.8	-21.8	-179.1	-63.6	0	0	0	0	112.7	M224 I229 L230 T356 Y394	M224-V226 PolarHBondContact O-N 3.17Å; V226-I229 PolarHBondContact O-N 3.29Å; V226-L230 WeakPolarHBondContact O-CB 3.31Å; V226-L230 PolarHBondContact O-N 2.98Å; V226-T356 HydrophobicContact CB-CG2 3.76Å; V226-T356 HydrophobicContact CG2-CG2 4.35Å; V226-Y394 HydrophobicContact CB-CD2 4.46Å; V226-Y394 HydrophobicContact CG2-CD2 3.88Å; V226-Y394 HydrophobicContact CG2-CE2 4.45Å
227	E	96.7	Very high	83.1	Confident	117 Å²	117	65.4 Å²	65.4	55%	0.547	36%	0.358	S	S	.	.	H	α-helix	trans	-65.6	-45.6	175.2	-62.4	70.6	-154.7	0	0	110.5	P225 I229 L230 D231	P225-E227 PolarHBondContact O-N 3.11Å; E227-I229 VanDerWaalsContact C-N 3.3Å; E227-I229 PolarHBondContact O-N 3.25Å; E227-L230 WeakPolarHBondContact O-CB 3.29Å; E227-L230 PolarHBondContact O-N 3.32Å; E227-D231 VanDerWaalsContact O-CG 3.3Å; E227-D231 PolarHBondContact O-N 3Å
228	K	97.6	Very high	84.6	Confident	121 Å²	121	60.9 Å²	60.9	53%	0.526	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-35.2	176.2	-68.2	-171.1	-177.1	169.4	0	111.8	P225 D231 A232 P278	P225-K228 HydrophobicContact CG-CB 4.07Å; P225-K228 HydrophobicContact CG-CD 3.68Å; P225-K228 HydrophobicContact CG-CG 3.76Å; P225-K228 PolarHBondContact O-N 3.32Å; K228-D231 PolarHBondContact O-N 3.06Å; K228-A232 WeakPolarHBondContact O-CB 3.04Å; K228-A232 PolarHBondContact O-N 3.21Å; K228-P278 HydrophobicContact CB-CG 3.85Å; K228-P278 HydrophobicContact CD-CG 4.14Å
229	I	98.2	Very high	85.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.5	-43.1	174	-63.7	175.6	0	0	0	110.3	M224 P225 V226 E227 A232 E233 I277	M224-I229 HydrophobicContact CG-CD1 4.22Å; M224-I229 HydrophobicContact SD-CD1 4.13Å; P225-I229 PolarHBondContact O-N 3.21Å; V226-I229 PolarHBondContact O-N 3.29Å; E227-I229 VanDerWaalsContact C-N 3.3Å; E227-I229 PolarHBondContact O-N 3.25Å; I229-A232 WeakPolarHBondContact O-CB 3.15Å; I229-A232 PolarHBondContact O-N 2.82Å; I229-E233 PolarHBondContact O-N 3.22Å; I229-E233 VanDerWaalsContact O-N 3.11Å; I229-I277 HydrophobicContact CG1-CD1 4.46Å; I229-I277 HydrophobicContact CG2-CD1 4.43Å
230	L	98.2	Very high	86.6	Confident	51 Å²	51	65 Å²	65	27%	0.267	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-46	174.7	175.5	62	0	0	0	111.6	V226 E227 A232 E233 L234 K355	V226-L230 WeakPolarHBondContact O-CB 3.31Å; V226-L230 PolarHBondContact O-N 2.98Å; E227-L230 WeakPolarHBondContact O-CB 3.29Å; E227-L230 PolarHBondContact O-N 3.32Å; L230-A232 VanDerWaalsContact C-N 3.26Å; L230-A232 PolarHBondContact O-N 3.01Å; L230-E233 WeakPolarHBondContact O-CB 3.47Å; L230-E233 PolarHBondContact O-N 3.33Å; L230-E233 VanDerWaalsContact O-N 3.13Å; L230-L234 HydrophobicContact CD1-CD1 4.14Å; L230-L234 HydrophobicContact CD1-CG 4.11Å; L230-L234 HydrophobicContact CG-CD1 4Å; L230-L234 HydrophobicContact CG-CG 4.38Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 2.94Å; L230-K355 HydrophobicContact CD1-CB 3.75Å
231	D	97.8	Very high	86.4	Confident	101 Å²	101	67.5 Å²	67.5	54%	0.54	35%	0.348	S	S	.	.	H	α-helix	trans	-59.8	-39.1	177.4	-71.5	-18.7	0	0	0	111.4	E227 K228 L234 A235	E227-D231 VanDerWaalsContact O-CG 3.3Å; E227-D231 PolarHBondContact O-N 3Å; K228-D231 PolarHBondContact O-N 3.06Å; D231-L234 PolarHBondContact O-N 3.24Å; D231-A235 VanDerWaalsContact O-CB 3.25Å; D231-A235 WeakPolarHBondContact O-CB 3.49Å; D231-A235 PolarHBondContact O-N 3.23Å
232	A	97.9	Very high	85.7	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.008	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-43.2	174.6	0	0	0	0	0	112	K228 I229 L230 V236 R276 I277	K228-A232 WeakPolarHBondContact O-CB 3.04Å; K228-A232 PolarHBondContact O-N 3.21Å; I229-A232 WeakPolarHBondContact O-CB 3.15Å; I229-A232 PolarHBondContact O-N 2.82Å; L230-A232 VanDerWaalsContact C-N 3.26Å; L230-A232 PolarHBondContact O-N 3.01Å; A232-V236 WeakPolarHBondContact O-CG2 3.41Å; A232-R276 HydrophobicContact CB-CB 3.61Å; A232-I277 HydrophobicContact CB-CD1 3.85Å
233	E	97.1	Very high	84.5	Confident	7 Å²	7	72.3 Å²	72.3	3%	0.033	36%	0.364	C	S	.	.	H	α-helix	trans	-62.5	-48.5	175	-73.8	-62.2	147.3	0	0	111.8	I229 L230 A235 V236 E237 W273 G359 R362	I229-E233 PolarHBondContact O-N 3.22Å; I229-E233 VanDerWaalsContact O-N 3.11Å; L230-E233 WeakPolarHBondContact O-CB 3.47Å; L230-E233 PolarHBondContact O-N 3.33Å; L230-E233 VanDerWaalsContact O-N 3.13Å; E233-A235 VanDerWaalsContact C-N 3.31Å; E233-A235 PolarHBondContact O-N 3.05Å; E233-V236 WeakPolarHBondContact O-CG2 3.2Å; E233-V236 PolarHBondContact O-N 3.29Å; E233-E237 VanDerWaalsContact O-CG 3.3Å; E233-E237 WeakPolarHBondContact O-CG 3.42Å; E233-E237 PolarHBondContact O-N 3.1Å; E233-W273 PolarHBondContact OE1-NE1 3.26Å; E233-G359 WeakPolarHBondContact OE1-CA 3.28Å; E233-R362 VanDerWaalsContact OE1-CD 3.32Å; E233-R362 WeakPolarHBondContact OE1-CD 3.46Å; E233-R362 IonicContact OE1-CZ 2.84Å; E233-R362 VanDerWaalsContact OE1-CZ 3.3Å; E233-R362 IonicContact OE1-NE 2.76Å; E233-R362 PolarHBondContact OE1-NE 2.94Å; E233-R362 IonicContact OE1-NH1 2.68Å; E233-R362 PolarHBondContact OE1-NH1 3.42Å; E233-R362 IonicContact OE2-CZ 3.76Å; E233-R362 IonicContact OE2-NH1 2.66Å; E233-R362 PolarHBondContact OE2-NH1 3.45Å
234	L	96.1	Very high	82.6	Confident	79 Å²	79	74.7 Å²	74.7	41%	0.414	39%	0.386	S	S	.	.	H	α-helix	trans	-63.5	-35.8	-179.3	-66.4	176	0	0	0	112.5	L230 D231 V236 K355	L230-L234 HydrophobicContact CD1-CD1 4.14Å; L230-L234 HydrophobicContact CD1-CG 4.11Å; L230-L234 HydrophobicContact CG-CD1 4Å; L230-L234 HydrophobicContact CG-CG 4.38Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 2.94Å; D231-L234 PolarHBondContact O-N 3.24Å; L234-V236 VanDerWaalsContact C-N 3.28Å; L234-V236 PolarHBondContact O-N 3.39Å; L234-K355 HydrophobicContact CD2-CD 3.71Å
235	A	95.4	Very high	79.8	Confident	62 Å²	62	81.9 Å²	81.9	51%	0.512	42%	0.424	S	S	.	.	H	α-helix	trans	-67.4	-25.5	-178.4	0	0	0	0	0	113.9	D231 E233	D231-A235 VanDerWaalsContact O-CB 3.25Å; D231-A235 WeakPolarHBondContact O-CB 3.49Å; D231-A235 PolarHBondContact O-N 3.23Å; E233-A235 VanDerWaalsContact C-N 3.31Å; E233-A235 PolarHBondContact O-N 3.05Å
236	V	93.5	Very high	77.2	Confident	22 Å²	22	84.7 Å²	84.7	13%	0.133	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	6.4	-176.3	-57.5	0	0	0	0	113.6	A232 E233 L234 W273	A232-V236 WeakPolarHBondContact O-CG2 3.41Å; E233-V236 WeakPolarHBondContact O-CG2 3.2Å; E233-V236 PolarHBondContact O-N 3.29Å; L234-V236 VanDerWaalsContact C-N 3.28Å; L234-V236 PolarHBondContact O-N 3.39Å; V236-W273 HydrophobicContact CB-CB 4.41Å; V236-W273 HydrophobicContact CG1-CB 3.79Å; V236-W273 HydrophobicContact CG2-CB 4.01Å; V236-W273 HydrophobicContact CG2-CG 4.26Å
237	E	85.8	Confident	74.2	Confident	85 Å²	85	89.1 Å²	89.1	40%	0.397	49%	0.487	S	S	.	.			trans	-64.2	127.6	177.8	-67.5	-159.6	132.3	0	0	111.4	E233 K239 K355	E233-E237 VanDerWaalsContact O-CG 3.3Å; E233-E237 WeakPolarHBondContact O-CG 3.42Å; E233-E237 PolarHBondContact O-N 3.1Å; E237-K239 PolarHBondContact O-N 3.37Å; E237-K355 WeakPolarHBondContact OE1-CD 3.45Å; E237-K355 WeakPolarHBondContact OE1-CE 3.34Å; E237-K355 IonicContact OE1-NZ 2.69Å; E237-K355 PolarHBondContact OE1-NZ 2.89Å; E237-K355 IonicContact OE2-NZ 3.76Å; E237-K355 PolarHBondContact OE2-NZ 2.99Å
238	P	81.4	Confident	71.8	Confident	29 Å²	29	89.6 Å²	89.6	19%	0.188	50%	0.501	C	S	.	.			trans	-64.7	127.6	174.2	25.2	-30.7	0	0	0	109.1	T240 A318	P238-T240 VanDerWaalsContact C-N 3.29Å; P238-T240 HydrophobicContact CB-CG2 4.38Å; P238-T240 HydrophobicContact CG-CG2 4.39Å; P238-T240 PolarHBondContact O-N 3.33Å; P238-A318 HydrophobicContact CB-CB 4.14Å; P238-A318 HydrophobicContact CG-CB 4.1Å
239	K	70.9	Confident	69.1	Low	189 Å²	189	86.7 Å²	86.7	82%	0.822	51%	0.505	S	S	*	.			trans	-69.2	85.8	173.6	-63.5	179.8	-178	179.4	0	109.3	E237 E241	E237-K239 PolarHBondContact O-N 3.37Å; K239-E241 VanDerWaalsContact C-N 3.34Å
240	T	64.5	Low	66.5	Low	59 Å²	59	94.4 Å²	94.4	36%	0.362	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-81.7	-7.4	-176.1	40.8	0	0	0	0	114	P238 T242 L316	P238-T240 VanDerWaalsContact C-N 3.29Å; P238-T240 HydrophobicContact CB-CG2 4.38Å; P238-T240 HydrophobicContact CG-CG2 4.39Å; P238-T240 PolarHBondContact O-N 3.33Å; T240-T242 PolarHBondContact O-N 2.95Å; T240-L316 HydrophobicContact CG2-CD2 4.24Å
241	E	48.9	Very low	64.3	Low	186 Å²	186	95.3 Å²	95.3	87%	0.869	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-80	-3	-173.3	-63.5	-159.4	159.8	0	0	115.7	K239	K239-E241 VanDerWaalsContact C-N 3.34Å
242	T	41.6	Very low	62.3	Low	113 Å²	113	93.3 Å²	93.3	69%	0.693	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-110.5	6	-171	-23.6	0	0	0	0	115.7	T240	T240-T242 PolarHBondContact O-N 2.95Å
243	Y	43.9	Very low	60.9	Low	198 Å²	198	100.9 Å²	100.9	78%	0.776	59%	0.589	S	S	*	*			trans	-115.7	52	177.9	-71.7	-83.2	0	0	0	112.2
244	S	41.8	Very low	60.4	Low	119 Å²	119	102.9 Å²	102.9	83%	0.832	60%	0.6	S	S	*	*			trans	-103.1	62.2	159.3	-70.6	0	0	0	0	108.9
245	D	35.5	Very low	60	Low	150 Å²	150	99.5 Å²	99.5	80%	0.802	58%	0.582	S	S	*	*	S	Bend	trans	-153.7	100.4	158.5	-153	5.9	0	0	0	112	S247	D245-S247 PolarHBondContact O-N 3.45Å
246	G	41.6	Very low	59.8	Low	72 Å²	72	97.1 Å²	97.1	74%	0.742	56%	0.561	S	S	*	*				59.9	19.5	119	0	0	0	0	0	121.6
247	S	33.5	Very low	59.6	Low	110 Å²	110	96.6 Å²	96.6	77%	0.769	56%	0.558	S	S	*	*			trans	-119.1	103.1	168	-82.3	0	0	0	0	112.4	D245 G249	D245-S247 PolarHBondContact O-N 3.45Å; S247-G249 PolarHBondContact O-N 3.49Å
248	P	46.2	Very low	59.8	Low	127 Å²	127	93.3 Å²	93.3	83%	0.825	54%	0.544	S	S	*	.			trans	-76.8	64.4	168.4	33.8	-31.3	0	0	0	108.9
249	G	40.4	Very low	60.3	Low	60 Å²	60	94.3 Å²	94.3	62%	0.619	55%	0.547	S	S	*	.			trans	-105.8	102.6	176.2	0	0	0	0	0	109.9	S247	S247-G249 PolarHBondContact O-N 3.49Å
250	N	45.2	Very low	61.3	Low	162 Å²	162	85.6 Å²	85.6	87%	0.866	51%	0.51	S	S	*	.	S	Bend	trans	70.8	30.8	170.7	-71.4	0.2	0	0	0	118.7	T252	N250-T252 PolarHBondContact O-N 3.46Å
251	S	51.1	Low	62.5	Low	70 Å²	70	86.6 Å²	86.6	49%	0.49	51%	0.51	S	S	.	.			trans	-69.9	103	161.3	58.8	0	0	0	0	109.2	N253	S251-N253 PolarHBondContact O-N 2.94Å
252	T	56.2	Low	64.5	Low	60 Å²	60	78 Å²	78	37%	0.368	47%	0.471	S	S	.	.			trans	-57.3	127.3	164.1	43.5	0	0	0	0	107.9	N250 D254 N258	N250-T252 PolarHBondContact O-N 3.46Å; T252-D254 PolarHBondContact O-N 3.15Å; T252-N258 PolarHBondContact O-ND2 3.45Å; T252-N258 PolarHBondContact OG1-OD1 3.04Å; T252-N258 VanDerWaalsContact OG1-OD1 3.05Å
253	N	67.9	Low	66.9	Low	160 Å²	160	73.6 Å²	73.6	86%	0.856	45%	0.446	S	S	*	.	S	Bend	trans	-64.7	-2.6	178.2	-81.7	-39.8	0	0	0	113.3	S251 P255	S251-N253 PolarHBondContact O-N 2.94Å; N253-P255 WeakPolarHBondContact O-CD 3.49Å
254	D	87.3	Confident	69	Low	49 Å²	49	65.3 Å²	65.3	26%	0.262	42%	0.415	S	S	.	.			trans	-87.8	111.9	178.3	175.9	31.2	0	0	0	111.5	T252 V256 T257 N258	T252-D254 PolarHBondContact O-N 3.15Å; D254-V256 PolarHBondContact O-N 3.41Å; D254-V256 PolarHBondContact OD1-N 2.65Å; D254-V256 VanDerWaalsContact OD1-N 3.09Å; D254-T257 PolarHBondContact O-N 3.46Å; D254-T257 VanDerWaalsContact OD2-CB 3.27Å; D254-T257 WeakPolarHBondContact OD2-CB 3.43Å; D254-T257 PolarHBondContact OD2-N 3Å; D254-T257 PolarHBondContact OD2-OG1 2.93Å; D254-N258 PolarHBondContact O-N 2.79Å; D254-N258 PolarHBondContact O-ND2 3.12Å; D254-N258 VanDerWaalsContact O-ND2 3.1Å
255	P	88.2	Confident	71.2	Confident	7 Å²	7	65.5 Å²	65.5	5%	0.045	40%	0.401	C	S	.	.	H	α-helix	trans	-63	-28.2	177.4	28.3	-36.9	0	0	0	112.8	N253 N258 I259 V323 S327 A331	N253-P255 WeakPolarHBondContact O-CD 3.49Å; P255-N258 PolarHBondContact O-N 3.43Å; P255-I259 WeakPolarHBondContact O-CD1 3.29Å; P255-I259 WeakPolarHBondContact O-CG1 3.39Å; P255-I259 PolarHBondContact O-N 3.37Å; P255-V323 HydrophobicContact CB-CG1 3.78Å; P255-S327 WeakPolarHBondContact CG-OG 3.41Å; P255-A331 HydrophobicContact CG-CB 3.43Å; P255-A331 VanDerWaalsContact CG-CB 3.43Å
256	V	90.3	Very high	74	Confident	12 Å²	12	59.1 Å²	59.1	7%	0.073	37%	0.367	C	S	.	.	H	α-helix	trans	-69.7	-47.2	-178.7	-177.4	0	0	0	0	110.3	D254 N258 I259 C260 A331 V333 F430 T436	D254-V256 PolarHBondContact O-N 3.41Å; D254-V256 PolarHBondContact OD1-N 2.65Å; D254-V256 VanDerWaalsContact OD1-N 3.09Å; V256-N258 VanDerWaalsContact C-N 3.32Å; V256-N258 PolarHBondContact O-N 3.37Å; V256-I259 PolarHBondContact O-N 2.91Å; V256-C260 PolarHBondContact O-N 2.96Å; V256-C260 PolarHBondContact O-SG 3.43Å; V256-A331 HydrophobicContact CG2-CB 4.21Å; V256-V333 HydrophobicContact CG2-CG1 4.04Å; V256-V333 HydrophobicContact CG2-CG2 4.02Å; V256-F430 HydrophobicContact CG1-CD2 4.07Å; V256-F430 HydrophobicContact CG1-CE2 3.78Å; V256-F430 HydrophobicContact CG1-CZ 4.19Å; V256-F430 HydrophobicContact CG2-CZ 4.45Å; V256-T436 HydrophobicContact CG1-CG2 4.26Å
257	T	89.1	Confident	76.4	Confident	11 Å²	11	55.9 Å²	55.9	7%	0.067	33%	0.332	C	S	.	.	H	α-helix	trans	-55.8	-46.6	172.7	-62.5	0	0	0	0	111.3	D254 I259 C260 Q261 P437	D254-T257 PolarHBondContact O-N 3.46Å; D254-T257 VanDerWaalsContact OD2-CB 3.27Å; D254-T257 WeakPolarHBondContact OD2-CB 3.43Å; D254-T257 PolarHBondContact OD2-N 3Å; D254-T257 PolarHBondContact OD2-OG1 2.93Å; T257-I259 VanDerWaalsContact C-N 3.33Å; T257-I259 PolarHBondContact O-N 3.24Å; T257-C260 PolarHBondContact O-N 3.11Å; T257-Q261 HydrophobicContact CG2-CG 4.39Å; T257-Q261 WeakPolarHBondContact O-CG 3.39Å; T257-Q261 PolarHBondContact O-N 3.47Å; T257-P437 HydrophobicContact CG2-CG 4.2Å
258	N	90.5	Very high	79.1	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-40.1	179.2	-66.3	-35.1	0	0	0	112.1	T252 D254 P255 V256 A262 L317 L321	T252-N258 PolarHBondContact O-ND2 3.45Å; T252-N258 PolarHBondContact OG1-OD1 3.04Å; T252-N258 VanDerWaalsContact OG1-OD1 3.05Å; D254-N258 PolarHBondContact O-N 2.79Å; D254-N258 PolarHBondContact O-ND2 3.12Å; D254-N258 VanDerWaalsContact O-ND2 3.1Å; P255-N258 PolarHBondContact O-N 3.43Å; V256-N258 VanDerWaalsContact C-N 3.32Å; V256-N258 PolarHBondContact O-N 3.37Å; N258-A262 WeakPolarHBondContact O-CB 3.39Å; N258-A262 PolarHBondContact O-N 3.07Å; N258-L317 HydrophobicContact CB-CD1 3.95Å; N258-L317 WeakPolarHBondContact O-CD1 3.32Å; N258-L321 HydrophobicContact CB-CD1 4.2Å
259	I	92.6	Very high	81.4	Confident	49 Å²	49	52.4 Å²	52.4	25%	0.251	29%	0.294	S	S	.	.	H	α-helix	trans	-64.4	-44.5	175.1	-70.3	163	0	0	0	110.7	P255 V256 T257 A262 A263 L317 V323	P255-I259 WeakPolarHBondContact O-CD1 3.29Å; P255-I259 WeakPolarHBondContact O-CG1 3.39Å; P255-I259 PolarHBondContact O-N 3.37Å; V256-I259 PolarHBondContact O-N 2.91Å; T257-I259 VanDerWaalsContact C-N 3.33Å; T257-I259 PolarHBondContact O-N 3.24Å; I259-A262 PolarHBondContact O-N 3.44Å; I259-A263 WeakPolarHBondContact O-CB 3.37Å; I259-A263 PolarHBondContact O-N 3.22Å; I259-L317 HydrophobicContact CG1-CD1 4.34Å; I259-L317 HydrophobicContact CG1-CD2 4.02Å; I259-V323 HydrophobicContact CG1-CG2 4.32Å
260	C	91	Very high	84.1	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.041	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-44.5	-179.8	-64.8	0	0	0	0	111.8	V256 T257 A262 A263 D264 L442	V256-C260 PolarHBondContact O-N 2.96Å; V256-C260 PolarHBondContact O-SG 3.43Å; T257-C260 PolarHBondContact O-N 3.11Å; C260-A262 VanDerWaalsContact C-N 3.33Å; C260-A262 PolarHBondContact O-N 2.67Å; C260-A263 WeakPolarHBondContact O-CB 3.45Å; C260-A263 PolarHBondContact O-N 3.38Å; C260-A263 VanDerWaalsContact O-N 3.15Å; C260-D264 PolarHBondContact O-N 3.08Å; C260-L442 HydrophobicContact CB-CD2 4.16Å
261	Q	89.5	Confident	86.5	Confident	80 Å²	80	44.1 Å²	44.1	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-61.6	-41.1	175.1	-72.1	174.8	-7.8	0	0	112.1	T257 A263 K265	T257-Q261 HydrophobicContact CG2-CG 4.39Å; T257-Q261 WeakPolarHBondContact O-CG 3.39Å; T257-Q261 PolarHBondContact O-N 3.47Å; Q261-A263 VanDerWaalsContact C-N 3.33Å; Q261-K265 PolarHBondContact O-N 2.96Å; Q261-K265 VanDerWaalsContact O-N 3.11Å
262	A	91.6	Very high	88.6	Confident	6 Å²	6	44.2 Å²	44.2	5%	0.05	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-37.9	175	0	0	0	0	0	111.8	N258 I259 C260 Q266 L317 T319	N258-A262 WeakPolarHBondContact O-CB 3.39Å; N258-A262 PolarHBondContact O-N 3.07Å; I259-A262 PolarHBondContact O-N 3.44Å; C260-A262 VanDerWaalsContact C-N 3.33Å; C260-A262 PolarHBondContact O-N 2.67Å; A262-Q266 WeakPolarHBondContact O-CB 3.24Å; A262-Q266 WeakPolarHBondContact O-CG 3.19Å; A262-Q266 PolarHBondContact O-N 3.15Å; A262-Q266 VanDerWaalsContact O-N 3.08Å; A262-L317 HydrophobicContact CB-CB 3.9Å; A262-L317 HydrophobicContact CB-CD1 4.14Å; A262-L317 HydrophobicContact CB-CD2 4.33Å; A262-L317 HydrophobicContact CB-CG 4.35Å; A262-T319 HydrophobicContact CB-CG2 4.06Å
263	A	92.1	Very high	90.6	Very high	20 Å²	20	41.4 Å²	41.4	17%	0.165	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-47.6	175.9	0	0	0	0	0	111.4	I259 C260 Q261 K265 Q266 L267 L300	I259-A263 WeakPolarHBondContact O-CB 3.37Å; I259-A263 PolarHBondContact O-N 3.22Å; C260-A263 WeakPolarHBondContact O-CB 3.45Å; C260-A263 PolarHBondContact O-N 3.38Å; C260-A263 VanDerWaalsContact O-N 3.15Å; Q261-A263 VanDerWaalsContact C-N 3.33Å; A263-K265 PolarHBondContact O-N 3.13Å; A263-Q266 CarbonylContact O-C 3.42Å; A263-Q266 WeakPolarHBondContact O-CA 3.12Å; A263-Q266 PolarHBondContact O-N 3.29Å; A263-L267 WeakPolarHBondContact O-CG 3.34Å; A263-L267 PolarHBondContact O-N 3.38Å; A263-L300 HydrophobicContact CB-CD1 4.07Å
264	D	88.6	Confident	92.1	Very high	25 Å²	25	33.8 Å²	33.8	13%	0.134	17%	0.172	C	C	.	.	H	α-helix	trans	-57.4	-49.5	178.5	-171	78	0	0	0	111.6	C260 Q266 L267 F268 D439 L442	C260-D264 PolarHBondContact O-N 3.08Å; D264-Q266 PolarHBondContact O-N 3.06Å; D264-L267 WeakPolarHBondContact O-CB 3.46Å; D264-L267 PolarHBondContact O-N 3.48Å; D264-L267 VanDerWaalsContact O-N 3.16Å; D264-F268 WeakPolarHBondContact O-CD2 3.38Å; D264-D439 HydrophobicContact CB-CB 4.05Å; D264-D439 VanDerWaalsContact CG-CB 3.44Å; D264-D439 WeakPolarHBondContact OD1-CB 3.34Å; D264-L442 PolarHBondContact OD1-N 3.14Å
265	K	88	Confident	92.6	Very high	122 Å²	122	36.1 Å²	36.1	53%	0.53	18%	0.18	S	C	.	.	H	α-helix	trans	-57.3	-36.9	174.1	-175.5	177.3	-179.2	-178.3	0	112.5	Q261 A263	Q261-K265 PolarHBondContact O-N 2.96Å; Q261-K265 VanDerWaalsContact O-N 3.11Å; A263-K265 PolarHBondContact O-N 3.13Å
266	Q	93.1	Very high	93	Very high	17 Å²	17	41.1 Å²	41.1	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-82.3	-18.3	-177.6	-69.5	-72.7	-91	0	0	113.9	A262 A263 D264 F268 T269 L270 L300 A318	A262-Q266 WeakPolarHBondContact O-CB 3.24Å; A262-Q266 WeakPolarHBondContact O-CG 3.19Å; A262-Q266 PolarHBondContact O-N 3.15Å; A262-Q266 VanDerWaalsContact O-N 3.08Å; A263-Q266 CarbonylContact O-C 3.42Å; A263-Q266 WeakPolarHBondContact O-CA 3.12Å; A263-Q266 PolarHBondContact O-N 3.29Å; D264-Q266 PolarHBondContact O-N 3.06Å; Q266-F268 VanDerWaalsContact C-N 3.32Å; Q266-F268 PolarHBondContact O-N 2.72Å; Q266-T269 VanDerWaalsContact CA-OG1 3.24Å; Q266-T269 WeakPolarHBondContact CA-OG1 3.5Å; Q266-T269 PolarHBondContact NE2-OG1 3.46Å; Q266-T269 VanDerWaalsContact NE2-OG1 3.12Å; Q266-T269 PolarHBondContact O-N 3.46Å; Q266-T269 PolarHBondContact O-OG1 3.26Å; Q266-L270 WeakPolarHBondContact O-CB 3.42Å; Q266-L270 PolarHBondContact O-N 3.11Å; Q266-L300 HydrophobicContact CB-CD2 3.61Å; Q266-A318 HydrophobicContact CG-CB 3.39Å
267	L	92.4	Very high	93.4	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-40.9	174.4	-77	173.4	0	0	0	111.4	A263 D264 T269 L270 V271 W296 L300 F441 L442 M445	A263-L267 WeakPolarHBondContact O-CG 3.34Å; A263-L267 PolarHBondContact O-N 3.38Å; D264-L267 WeakPolarHBondContact O-CB 3.46Å; D264-L267 PolarHBondContact O-N 3.48Å; D264-L267 VanDerWaalsContact O-N 3.16Å; L267-T269 PolarHBondContact O-N 2.94Å; L267-L270 HydrophobicContact CD2-CD2 4.5Å; L267-L270 WeakPolarHBondContact O-CB 3.21Å; L267-L270 PolarHBondContact O-N 3.27Å; L267-V271 PolarHBondContact O-N 3.03Å; L267-W296 HydrophobicContact CD2-CB 3.86Å; L267-W296 HydrophobicContact CD2-CD2 4.02Å; L267-W296 HydrophobicContact CD2-CE3 3.66Å; L267-W296 HydrophobicContact CD2-CG 4.14Å; L267-L300 HydrophobicContact CD2-CD1 4.05Å; L267-L300 HydrophobicContact CG-CD1 4.23Å; L267-F441 HydrophobicContact CB-CD1 3.6Å; L267-F441 HydrophobicContact CB-CE1 3.54Å; L267-F441 HydrophobicContact CD1-CD1 3.81Å; L267-F441 HydrophobicContact CD1-CE1 4.3Å; L267-F441 HydrophobicContact CG-CD1 4.35Å; L267-F441 HydrophobicContact CG-CE1 4.48Å; L267-L442 HydrophobicContact CD1-CB 4.28Å; L267-L442 HydrophobicContact CD1-CD1 3.92Å; L267-M445 HydrophobicContact CD1-CG 4.02Å; L267-M445 HydrophobicContact CD2-CE 4.48Å; L267-M445 HydrophobicContact CD2-CG 4.39Å
268	F	89.9	Confident	93.8	Very high	119 Å²	119	40.8 Å²	40.8	52%	0.522	20%	0.196	S	C	.	.	H	α-helix	trans	-62.7	-43.5	174.4	-66.6	-81.1	0	0	0	112.1	D264 Q266 L270 V271 E272 F441	D264-F268 WeakPolarHBondContact O-CD2 3.38Å; Q266-F268 VanDerWaalsContact C-N 3.32Å; Q266-F268 PolarHBondContact O-N 2.72Å; F268-L270 PolarHBondContact O-N 2.7Å; F268-V271 PolarHBondContact O-N 2.94Å; F268-E272 PolarHBondContact O-N 2.85Å; F268-F441 HydrophobicContact CD1-CE1 4.45Å; F268-F441 HydrophobicContact CD2-CD1 4.33Å; F268-F441 HydrophobicContact CE1-CD1 4.27Å; F268-F441 HydrophobicContact CE1-CE1 4.33Å; F268-F441 HydrophobicContact CE2-CB 4.43Å; F268-F441 AromaticContact CE2-CD1 3.89Å; F268-F441 HydrophobicContact CE2-CD1 3.89Å; F268-F441 HydrophobicContact CE2-CG 4.39Å; F268-F441 HydrophobicContact CZ-CB 4.25Å; F268-F441 AromaticContact CZ-CD1 3.86Å; F268-F441 HydrophobicContact CZ-CD1 3.86Å; F268-F441 HydrophobicContact CZ-CE1 4.37Å; F268-F441 HydrophobicContact CZ-CG 4.06Å
269	T	94	Very high	94.2	Very high	44 Å²	44	41.6 Å²	41.6	27%	0.27	20%	0.199	S	C	.	.	H	α-helix	trans	-68	-25.9	176.1	55.9	0	0	0	0	112.6	Q266 L267 E272 W273	Q266-T269 VanDerWaalsContact CA-OG1 3.24Å; Q266-T269 WeakPolarHBondContact CA-OG1 3.5Å; Q266-T269 PolarHBondContact NE2-OG1 3.46Å; Q266-T269 VanDerWaalsContact NE2-OG1 3.12Å; Q266-T269 PolarHBondContact O-N 3.46Å; Q266-T269 PolarHBondContact O-OG1 3.26Å; L267-T269 PolarHBondContact O-N 2.94Å; T269-E272 PolarHBondContact O-N 3.19Å; T269-W273 WeakPolarHBondContact O-CB 3.4Å; T269-W273 PolarHBondContact O-N 2.85Å
270	L	96.8	Very high	94.5	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-68.6	-39.5	176.7	-178.8	65.8	0	0	0	111.5	Q266 L267 F268 E272 W273 A274 L292 W296 L299 L300	Q266-L270 WeakPolarHBondContact O-CB 3.42Å; Q266-L270 PolarHBondContact O-N 3.11Å; L267-L270 HydrophobicContact CD2-CD2 4.5Å; L267-L270 WeakPolarHBondContact O-CB 3.21Å; L267-L270 PolarHBondContact O-N 3.27Å; F268-L270 PolarHBondContact O-N 2.7Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.91Å; L270-W273 HydrophobicContact CD1-CD2 4.43Å; L270-W273 HydrophobicContact CD1-CE3 3.69Å; L270-W273 HydrophobicContact CD1-CZ3 4.19Å; L270-W273 WeakPolarHBondContact O-CB 3.24Å; L270-W273 PolarHBondContact O-N 3.43Å; L270-A274 WeakPolarHBondContact O-CB 3.36Å; L270-A274 PolarHBondContact O-N 3.41Å; L270-L292 HydrophobicContact CD2-CD2 4.46Å; L270-L292 HydrophobicContact CG-CD2 4.26Å; L270-W296 HydrophobicContact CD2-CB 3.85Å; L270-L299 HydrophobicContact CD1-CB 3.74Å; L270-L299 HydrophobicContact CD1-CD1 4Å; L270-L299 HydrophobicContact CD1-CG 4.4Å; L270-L299 HydrophobicContact CD2-CB 4.15Å; L270-L299 HydrophobicContact CD2-CD1 4.12Å; L270-L299 HydrophobicContact CG-CD1 4.48Å; L270-L300 HydrophobicContact CB-CD2 4.44Å; L270-L300 HydrophobicContact CD2-CD2 4.48Å
271	V	96	Very high	94.8	Very high	44 Å²	44	42.2 Å²	42.2	27%	0.267	21%	0.207	S	C	.	.	H	α-helix	trans	-61.2	-44	173.2	178.4	0	0	0	0	110.2	L267 F268 A274 K275 L292	L267-V271 PolarHBondContact O-N 3.03Å; F268-V271 PolarHBondContact O-N 2.94Å; V271-A274 PolarHBondContact O-N 3.41Å; V271-K275 WeakPolarHBondContact O-CG 3.33Å; V271-K275 PolarHBondContact O-N 3.45Å; V271-L292 HydrophobicContact CG2-CD1 4.26Å
272	E	95.9	Very high	95.1	Very high	73 Å²	73	45.2 Å²	45.2	34%	0.341	22%	0.221	S	C	.	.	H	α-helix	trans	-65.5	-37.3	177.5	-74.1	-57	123.6	0	0	113.1	F268 T269 L270 K275 R276	F268-E272 PolarHBondContact O-N 2.85Å; T269-E272 PolarHBondContact O-N 3.19Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.91Å; E272-K275 IonicContact OE1-NZ 2.89Å; E272-K275 PolarHBondContact OE1-NZ 3.04Å; E272-R276 WeakPolarHBondContact O-CG 3.49Å; E272-R276 PolarHBondContact O-NH1 3.27Å; E272-R276 IonicContact OE2-CZ 2.7Å; E272-R276 IonicContact OE2-NH1 2.81Å; E272-R276 PolarHBondContact OE2-NH1 3.2Å; E272-R276 IonicContact OE2-NH2 3.62Å
273	W	98.3	Very high	95.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-50.3	170.7	171.8	83.5	0	0	0	111	E233 V236 T269 L270 K275 R276 I277 L299 R362 L366	E233-W273 PolarHBondContact OE1-NE1 3.26Å; V236-W273 HydrophobicContact CB-CB 4.41Å; V236-W273 HydrophobicContact CG1-CB 3.79Å; V236-W273 HydrophobicContact CG2-CB 4.01Å; V236-W273 HydrophobicContact CG2-CG 4.26Å; T269-W273 WeakPolarHBondContact O-CB 3.4Å; T269-W273 PolarHBondContact O-N 2.85Å; L270-W273 HydrophobicContact CD1-CD2 4.43Å; L270-W273 HydrophobicContact CD1-CE3 3.69Å; L270-W273 HydrophobicContact CD1-CZ3 4.19Å; L270-W273 WeakPolarHBondContact O-CB 3.24Å; L270-W273 PolarHBondContact O-N 3.43Å; W273-K275 VanDerWaalsContact C-N 3.34Å; W273-K275 PolarHBondContact O-N 3.28Å; W273-R276 WeakPolarHBondContact O-CB 3.47Å; W273-R276 PolarHBondContact O-N 3.2Å; W273-I277 HydrophobicContact CD2-CD1 4.43Å; W273-I277 HydrophobicContact CD2-CG1 4.23Å; W273-I277 HydrophobicContact CE3-CG1 4.42Å; W273-I277 HydrophobicContact CH2-CD1 4.31Å; W273-I277 HydrophobicContact CH2-CG1 4.06Å; W273-I277 HydrophobicContact CZ2-CD1 3.66Å; W273-I277 HydrophobicContact CZ2-CG1 3.88Å; W273-I277 HydrophobicContact CZ3-CG1 4.34Å; W273-I277 PolarHBondContact O-N 2.88Å; W273-L299 HydrophobicContact CH2-CD2 3.87Å; W273-L299 HydrophobicContact CZ3-CD1 4.24Å; W273-L299 HydrophobicContact CZ3-CD2 3.92Å; W273-R362 HydrophobicContact CH2-CB 3.68Å; W273-R362 HydrophobicContact CZ2-CB 3.5Å; W273-L366 HydrophobicContact CH2-CB 4.15Å; W273-L366 HydrophobicContact CH2-CD2 4.04Å; W273-L366 HydrophobicContact CZ3-CB 4.19Å; W273-L366 HydrophobicContact CZ3-CD1 4.31Å; W273-L366 HydrophobicContact CZ3-CD2 3.77Å; W273-L366 HydrophobicContact CZ3-CG 4.31Å
274	A	98.4	Very high	95.7	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-41.2	-176.6	0	0	0	0	0	112	L270 V271 R276 I277 F280 L292 L366	L270-A274 WeakPolarHBondContact O-CB 3.36Å; L270-A274 PolarHBondContact O-N 3.41Å; V271-A274 PolarHBondContact O-N 3.41Å; A274-R276 PolarHBondContact O-N 3.05Å; A274-R276 VanDerWaalsContact O-N 3.15Å; A274-I277 WeakPolarHBondContact O-CB 3.45Å; A274-I277 PolarHBondContact O-N 3.37Å; A274-F280 VanDerWaalsContact C-CD1 3.44Å; A274-F280 HydrophobicContact CB-CD1 3.84Å; A274-F280 HydrophobicContact CB-CE1 3.62Å; A274-F280 HydrophobicContact CB-CE2 4.47Å; A274-F280 HydrophobicContact CB-CG 4.35Å; A274-F280 HydrophobicContact CB-CZ 3.96Å; A274-F280 VanDerWaalsContact O-CB 3.29Å; A274-F280 WeakPolarHBondContact O-CB 3.49Å; A274-F280 WeakPolarHBondContact O-CD1 3.27Å; A274-F280 WeakPolarHBondContact O-CG 3.33Å; A274-L292 HydrophobicContact CB-CD2 3.83Å; A274-L366 HydrophobicContact CB-CD1 4.38Å; A274-L366 HydrophobicContact CB-CD2 4.23Å
275	K	97.8	Very high	96.1	Very high	99 Å²	99	52 Å²	52	43%	0.43	26%	0.256	S	S	.	.	H	α-helix	trans	-58.5	-26.3	174.9	-73.6	176	-175.2	166.7	0	114.2	V271 E272 W273 S281	V271-K275 WeakPolarHBondContact O-CG 3.33Å; V271-K275 PolarHBondContact O-N 3.45Å; E272-K275 IonicContact OE1-NZ 2.89Å; E272-K275 PolarHBondContact OE1-NZ 3.04Å; W273-K275 VanDerWaalsContact C-N 3.34Å; W273-K275 PolarHBondContact O-N 3.28Å; K275-S281 WeakPolarHBondContact CA-OG 3.21Å; K275-S281 PolarHBondContact O-OG 3.47Å; K275-S281 VanDerWaalsContact O-OG 3.06Å
276	R	98.1	Very high	96.4	Very high	111 Å²	111	51.9 Å²	51.9	42%	0.419	26%	0.261	S	S	.	.	H	α-helix	trans	-87.4	-15.1	179	-69.2	167.3	173.6	70.4	0.1	112.7	A232 E272 W273 A274	A232-R276 HydrophobicContact CB-CB 3.61Å; E272-R276 WeakPolarHBondContact O-CG 3.49Å; E272-R276 PolarHBondContact O-NH1 3.27Å; E272-R276 IonicContact OE2-CZ 2.7Å; E272-R276 IonicContact OE2-NH1 2.81Å; E272-R276 PolarHBondContact OE2-NH1 3.2Å; E272-R276 IonicContact OE2-NH2 3.62Å; W273-R276 WeakPolarHBondContact O-CB 3.47Å; W273-R276 PolarHBondContact O-N 3.2Å; A274-R276 PolarHBondContact O-N 3.05Å; A274-R276 VanDerWaalsContact O-N 3.15Å
277	I	98.4	Very high	96.6	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.015	26%	0.258	C	S	.	.	S	Bend	trans	-68.9	131.8	173.6	-61.2	-58.2	0	0	0	108.9	I229 A232 W273 A274 H279 F280 A363 L366 F367	I229-I277 HydrophobicContact CG1-CD1 4.46Å; I229-I277 HydrophobicContact CG2-CD1 4.43Å; A232-I277 HydrophobicContact CB-CD1 3.85Å; W273-I277 HydrophobicContact CD2-CD1 4.43Å; W273-I277 HydrophobicContact CD2-CG1 4.23Å; W273-I277 HydrophobicContact CE3-CG1 4.42Å; W273-I277 HydrophobicContact CH2-CD1 4.31Å; W273-I277 HydrophobicContact CH2-CG1 4.06Å; W273-I277 HydrophobicContact CZ2-CD1 3.66Å; W273-I277 HydrophobicContact CZ2-CG1 3.88Å; W273-I277 HydrophobicContact CZ3-CG1 4.34Å; W273-I277 PolarHBondContact O-N 2.88Å; A274-I277 WeakPolarHBondContact O-CB 3.45Å; A274-I277 PolarHBondContact O-N 3.37Å; I277-H279 PolarHBondContact O-N 3.12Å; I277-F280 HydrophobicContact CB-CB 4.29Å; I277-F280 PolarHBondContact O-N 3.5Å; I277-A363 HydrophobicContact CG2-CB 4.42Å; I277-L366 HydrophobicContact CB-CD2 4.33Å; I277-L366 HydrophobicContact CG1-CD2 4.22Å; I277-L366 HydrophobicContact CG2-CD2 4.31Å; I277-F367 HydrophobicContact CG2-CE2 3.72Å; I277-F367 HydrophobicContact CG2-CZ 3.81Å
278	P	97.7	Very high	96.9	Very high	13 Å²	13	52 Å²	52	8%	0.084	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	139.6	179.7	-25.8	33.6	0	0	0	112.4	M224 P225 K228 F280	M224-P278 HydrophobicContact CE-CB 4.34Å; M224-P278 HydrophobicContact SD-CB 3.76Å; M224-P278 HydrophobicContact SD-CG 3.9Å; P225-P278 HydrophobicContact CG-CG 4.31Å; K228-P278 HydrophobicContact CB-CG 3.85Å; K228-P278 HydrophobicContact CD-CG 4.14Å; P278-F280 PolarHBondContact O-N 3.2Å
279	H	97.6	Very high	97.2	Very high	35 Å²	35	49.9 Å²	49.9	16%	0.162	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-9.3	-179.4	-49.5	-68.1	0	0	0	117.5	D223 I277 S281 E282 L283 L383	D223-H279 PolarHBondContact O-NE2 3.24Å; D223-H279 IonicContact OD1-CE1 2.85Å; D223-H279 PolarHBondContact OD1-CE1 3.29Å; D223-H279 IonicContact OD1-NE2 3.9Å; D223-H279 PolarHBondContact OD1-NE2 3.09Å; D223-H279 IonicContact OD2-NE2 2.94Å; I277-H279 PolarHBondContact O-N 3.12Å; H279-S281 VanDerWaalsContact C-N 3.34Å; H279-S281 PolarHBondContact O-N 2.85Å; H279-E282 IonicContact CE1-OE2 3.62Å; H279-E282 IonicContact CG-OE2 3.55Å; H279-E282 IonicContact ND1-OE1 3.89Å; H279-E282 IonicContact ND1-OE2 2.82Å; H279-E282 PolarHBondContact ND1-OE2 3.25Å; H279-E282 WeakPolarHBondContact O-CB 3.48Å; H279-E282 PolarHBondContact O-N 3.36Å; H279-E282 VanDerWaalsContact O-N 3.11Å; H279-L283 PolarHBondContact O-N 2.86Å; H279-L383 HydrophobicContact CB-CD1 4.11Å; H279-L383 HydrophobicContact CB-CD2 3.61Å
280	F	98.4	Very high	97.3	Very high	1 Å²	1	49.6 Å²	49.6	0%	0.004	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-61.6	-43.8	-179.4	179.9	-97.1	0	0	0	112.1	A274 I277 P278 E282 L283 Q288 L291 L292 L366 F367	A274-F280 VanDerWaalsContact C-CD1 3.44Å; A274-F280 HydrophobicContact CB-CD1 3.84Å; A274-F280 HydrophobicContact CB-CE1 3.62Å; A274-F280 HydrophobicContact CB-CE2 4.47Å; A274-F280 HydrophobicContact CB-CG 4.35Å; A274-F280 HydrophobicContact CB-CZ 3.96Å; A274-F280 VanDerWaalsContact O-CB 3.29Å; A274-F280 WeakPolarHBondContact O-CB 3.49Å; A274-F280 WeakPolarHBondContact O-CD1 3.27Å; A274-F280 WeakPolarHBondContact O-CG 3.33Å; I277-F280 HydrophobicContact CB-CB 4.29Å; I277-F280 PolarHBondContact O-N 3.5Å; P278-F280 PolarHBondContact O-N 3.2Å; F280-E282 PolarHBondContact O-N 3.44Å; F280-L283 HydrophobicContact CD2-CD1 4.42Å; F280-L283 WeakPolarHBondContact O-CB 3.29Å; F280-L283 PolarHBondContact O-N 3.42Å; F280-Q288 HydrophobicContact CD1-CG 4.36Å; F280-Q288 HydrophobicContact CE1-CB 3.93Å; F280-Q288 HydrophobicContact CE1-CG 3.87Å; F280-Q288 HydrophobicContact CE2-CB 4.28Å; F280-Q288 HydrophobicContact CE2-CG 4.28Å; F280-Q288 HydrophobicContact CZ-CB 3.59Å; F280-Q288 HydrophobicContact CZ-CG 3.84Å; F280-Q288 WeakPolarHBondContact O-CG 3.45Å; F280-Q288 PolarHBondContact O-NE2 3.33Å; F280-L291 HydrophobicContact CE2-CB 4.34Å; F280-L291 HydrophobicContact CE2-CD1 4.19Å; F280-L292 HydrophobicContact CE1-CD1 4.37Å; F280-L292 HydrophobicContact CZ-CD1 3.95Å; F280-L292 HydrophobicContact CZ-CG 3.95Å; F280-L366 HydrophobicContact CD2-CD1 4.23Å; F280-L366 HydrophobicContact CD2-CD2 3.69Å; F280-L366 HydrophobicContact CD2-CG 4.07Å; F280-L366 HydrophobicContact CE2-CD1 3.77Å; F280-L366 HydrophobicContact CE2-CD2 4.1Å; F280-L366 HydrophobicContact CE2-CG 4.09Å; F280-L366 HydrophobicContact CG-CD2 4.23Å; F280-L366 HydrophobicContact CZ-CD1 4.4Å; F280-F367 HydrophobicContact CB-CE1 4.29Å; F280-F367 HydrophobicContact CB-CZ 4.2Å; F280-F367 HydrophobicContact CD2-CE1 4.04Å
281	S	97.6	Very high	97.4	Very high	66 Å²	66	49.5 Å²	49.5	46%	0.462	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-71.2	-11.4	179	-61	0	0	0	0	113.7	K275 H279 Q288	K275-S281 WeakPolarHBondContact CA-OG 3.21Å; K275-S281 PolarHBondContact O-OG 3.47Å; K275-S281 VanDerWaalsContact O-OG 3.06Å; H279-S281 VanDerWaalsContact C-N 3.34Å; H279-S281 PolarHBondContact O-N 2.85Å; S281-Q288 PolarHBondContact O-NE2 3.05Å
282	E	96.8	Very high	97.5	Very high	144 Å²	144	48.3 Å²	48.3	67%	0.673	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-86.7	-20.6	177.8	-64.3	163.6	-156.8	0	0	111.9	H279 F280	H279-E282 IonicContact CE1-OE2 3.62Å; H279-E282 IonicContact CG-OE2 3.55Å; H279-E282 IonicContact ND1-OE1 3.89Å; H279-E282 IonicContact ND1-OE2 2.82Å; H279-E282 PolarHBondContact ND1-OE2 3.25Å; H279-E282 WeakPolarHBondContact O-CB 3.48Å; H279-E282 PolarHBondContact O-N 3.36Å; H279-E282 VanDerWaalsContact O-N 3.11Å; F280-E282 PolarHBondContact O-N 3.44Å
283	L	97.6	Very high	97.4	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	24%	0.241	C	C	.	.	S	Bend	trans	-65.5	156.2	174.7	-65.7	175.2	0	0	0	111.6	H279 F280 L285 Q288 L291 F367 E379 L383	H279-L283 PolarHBondContact O-N 2.86Å; F280-L283 HydrophobicContact CD2-CD1 4.42Å; F280-L283 WeakPolarHBondContact O-CB 3.29Å; F280-L283 PolarHBondContact O-N 3.42Å; L283-L285 PolarHBondContact O-N 2.98Å; L283-Q288 HydrophobicContact CB-CG 4.08Å; L283-Q288 PolarHBondContact O-NE2 3.12Å; L283-L291 HydrophobicContact CD1-CD1 3.75Å; L283-F367 HydrophobicContact CD1-CD1 4.38Å; L283-F367 HydrophobicContact CD1-CE1 4.05Å; L283-E379 HydrophobicContact CD2-CG 4.04Å; L283-L383 HydrophobicContact CD1-CD1 4.08Å; L283-L383 HydrophobicContact CD2-CD1 3.92Å; L283-L383 HydrophobicContact CG-CD1 4.17Å
284	P	97.7	Very high	97.2	Very high	55 Å²	55	49.8 Å²	49.8	36%	0.357	26%	0.258	S	S	.	.			trans	-52.6	140	171	-25	34.2	0	0	0	111.9	D286 D287 Q288	P284-D286 PolarHBondContact O-N 3.31Å; P284-D287 HydrophobicContact CB-CB 4.23Å; P284-D287 WeakPolarHBondContact O-CB 3.23Å; P284-D287 PolarHBondContact O-N 2.87Å; P284-Q288 WeakPolarHBondContact O-CG 3.37Å; P284-Q288 PolarHBondContact O-N 2.95Å
285	L	96.8	Very high	97.2	Very high	131 Å²	131	49.9 Å²	49.9	69%	0.686	26%	0.259	S	S	*	.	H	α-helix	trans	-56.9	-37.7	-178.7	-75.5	174.8	0	0	0	112.6	L283 Q288 V289	L283-L285 PolarHBondContact O-N 2.98Å; L285-Q288 WeakPolarHBondContact O-CB 3.12Å; L285-Q288 PolarHBondContact O-N 3.32Å; L285-V289 WeakPolarHBondContact O-CG2 3.49Å; L285-V289 PolarHBondContact O-N 3.27Å
286	D	95.7	Very high	97.1	Very high	119 Å²	119	45.8 Å²	45.8	64%	0.636	24%	0.241	S	C	*	.	H	α-helix	trans	-62.6	-43.7	176.2	-65.5	-36.5	0	0	0	111.3	P284 V289 I290	P284-D286 PolarHBondContact O-N 3.31Å; D286-V289 PolarHBondContact O-N 3.27Å; D286-I290 WeakPolarHBondContact O-CD1 3.33Å; D286-I290 VanDerWaalsContact O-CG1 3.24Å; D286-I290 WeakPolarHBondContact O-CG1 3.47Å; D286-I290 PolarHBondContact O-N 3.22Å
287	D	97.5	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-41.2	176.8	-73.4	22.2	0	0	0	110.6	P284 V289 I290 L291 L374 S375	P284-D287 HydrophobicContact CB-CB 4.23Å; P284-D287 WeakPolarHBondContact O-CB 3.23Å; P284-D287 PolarHBondContact O-N 2.87Å; D287-V289 VanDerWaalsContact C-N 3.33Å; D287-V289 PolarHBondContact O-N 3.42Å; D287-I290 PolarHBondContact O-N 2.74Å; D287-L291 WeakPolarHBondContact O-CB 3.31Å; D287-L291 WeakPolarHBondContact O-CG 3.45Å; D287-L291 PolarHBondContact O-N 3.12Å; D287-L374 HydrophobicContact CB-CD2 3.8Å; D287-S375 WeakPolarHBondContact OD1-CB 3.31Å; D287-S375 PolarHBondContact OD1-N 3.41Å; D287-S375 PolarHBondContact OD1-OG 3.05Å; D287-S375 PolarHBondContact OD2-N 3.01Å; D287-S375 VanDerWaalsContact OD2-N 3.12Å
288	Q	98.2	Very high	97.1	Very high	23 Å²	23	41.2 Å²	41.2	11%	0.107	23%	0.225	C	C	.	.	H	α-helix	trans	-56.9	-45.4	174.3	-67	179.9	38	0	0	111.9	F280 S281 L283 P284 L285 L292	F280-Q288 HydrophobicContact CD1-CG 4.36Å; F280-Q288 HydrophobicContact CE1-CB 3.93Å; F280-Q288 HydrophobicContact CE1-CG 3.87Å; F280-Q288 HydrophobicContact CE2-CB 4.28Å; F280-Q288 HydrophobicContact CE2-CG 4.28Å; F280-Q288 HydrophobicContact CZ-CB 3.59Å; F280-Q288 HydrophobicContact CZ-CG 3.84Å; F280-Q288 WeakPolarHBondContact O-CG 3.45Å; F280-Q288 PolarHBondContact O-NE2 3.33Å; S281-Q288 PolarHBondContact O-NE2 3.05Å; L283-Q288 HydrophobicContact CB-CG 4.08Å; L283-Q288 PolarHBondContact O-NE2 3.12Å; P284-Q288 WeakPolarHBondContact O-CG 3.37Å; P284-Q288 PolarHBondContact O-N 2.95Å; L285-Q288 WeakPolarHBondContact O-CB 3.12Å; L285-Q288 PolarHBondContact O-N 3.32Å; Q288-L292 WeakPolarHBondContact O-CG 3.44Å; Q288-L292 PolarHBondContact O-N 2.99Å; Q288-L292 VanDerWaalsContact O-N 3.1Å
289	V	96.3	Very high	97.1	Very high	75 Å²	75	40.6 Å²	40.6	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-65.2	-43.5	177.6	172.2	0	0	0	0	111.1	L285 D286 D287 L291 L292 R293	L285-V289 WeakPolarHBondContact O-CG2 3.49Å; L285-V289 PolarHBondContact O-N 3.27Å; D286-V289 PolarHBondContact O-N 3.27Å; D287-V289 VanDerWaalsContact C-N 3.33Å; D287-V289 PolarHBondContact O-N 3.42Å; V289-L291 PolarHBondContact O-N 3.02Å; V289-L292 PolarHBondContact O-N 2.77Å; V289-R293 HydrophobicContact CG1-CG 4.29Å; V289-R293 VanDerWaalsContact O-CB 3.31Å; V289-R293 WeakPolarHBondContact O-CB 3.37Å; V289-R293 VanDerWaalsContact O-CG 3.3Å; V289-R293 WeakPolarHBondContact O-CG 3.29Å; V289-R293 PolarHBondContact O-N 3.07Å
290	I	96.5	Very high	97.1	Very high	38 Å²	38	39.6 Å²	39.6	20%	0.195	22%	0.217	C	C	.	.	H	α-helix	trans	-60.3	-46.2	178.2	-72.5	165.5	0	0	0	111	D286 D287 R293 A294 A371 G373 L374	D286-I290 WeakPolarHBondContact O-CD1 3.33Å; D286-I290 VanDerWaalsContact O-CG1 3.24Å; D286-I290 WeakPolarHBondContact O-CG1 3.47Å; D286-I290 PolarHBondContact O-N 3.22Å; D287-I290 PolarHBondContact O-N 2.74Å; I290-R293 PolarHBondContact O-N 2.96Å; I290-A294 VanDerWaalsContact O-CB 3.29Å; I290-A294 WeakPolarHBondContact O-CB 3.49Å; I290-A294 PolarHBondContact O-N 3.15Å; I290-A371 HydrophobicContact CG2-CB 3.68Å; I290-G373 VanDerWaalsContact CD1-C 3.46Å; I290-G373 VanDerWaalsContact CD1-O 3.27Å; I290-G373 WeakPolarHBondContact CD1-O 3.41Å; I290-L374 HydrophobicContact CB-CD2 4.24Å; I290-L374 HydrophobicContact CG2-CD2 3.84Å; I290-L374 HydrophobicContact CG2-CG 4.13Å
291	L	98.2	Very high	97.1	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-45	-179.7	-67.7	172.5	0	0	0	111.7	F280 L283 D287 V289 A294 G295 L366 N368 A371 L374 V380	F280-L291 HydrophobicContact CE2-CB 4.34Å; F280-L291 HydrophobicContact CE2-CD1 4.19Å; L283-L291 HydrophobicContact CD1-CD1 3.75Å; D287-L291 WeakPolarHBondContact O-CB 3.31Å; D287-L291 WeakPolarHBondContact O-CG 3.45Å; D287-L291 PolarHBondContact O-N 3.12Å; V289-L291 PolarHBondContact O-N 3.02Å; L291-A294 PolarHBondContact O-N 2.88Å; L291-G295 PolarHBondContact O-N 2.78Å; L291-L366 WeakPolarHBondContact CD2-O 3.35Å; L291-N368 HydrophobicContact CD2-CB 4.4Å; L291-N368 WeakPolarHBondContact CD2-O 3.46Å; L291-A371 HydrophobicContact CD2-CB 4.28Å; L291-L374 HydrophobicContact CD2-CD1 4.28Å; L291-L374 HydrophobicContact CD2-CD2 3.99Å; L291-L374 HydrophobicContact CG-CD2 4.03Å; L291-V380 HydrophobicContact CD1-CG1 4.38Å; L291-V380 HydrophobicContact CD1-CG2 4.26Å; L291-V380 HydrophobicContact CD2-CG1 3.9Å
292	L	97.4	Very high	97.1	Very high	20 Å²	20	37 Å²	37	11%	0.105	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-44.5	175.5	-74.9	168.6	0	0	0	111.7	L270 V271 A274 F280 Q288 V289 A294 G295 W296 L366	L270-L292 HydrophobicContact CD2-CD2 4.46Å; L270-L292 HydrophobicContact CG-CD2 4.26Å; V271-L292 HydrophobicContact CG2-CD1 4.26Å; A274-L292 HydrophobicContact CB-CD2 3.83Å; F280-L292 HydrophobicContact CE1-CD1 4.37Å; F280-L292 HydrophobicContact CZ-CD1 3.95Å; F280-L292 HydrophobicContact CZ-CG 3.95Å; Q288-L292 WeakPolarHBondContact O-CG 3.44Å; Q288-L292 PolarHBondContact O-N 2.99Å; Q288-L292 VanDerWaalsContact O-N 3.1Å; V289-L292 PolarHBondContact O-N 2.77Å; L292-A294 VanDerWaalsContact C-N 3.3Å; L292-A294 PolarHBondContact O-N 3.14Å; L292-G295 PolarHBondContact O-N 2.89Å; L292-W296 VanDerWaalsContact O-CB 3.31Å; L292-W296 WeakPolarHBondContact O-CB 3.14Å; L292-W296 PolarHBondContact O-N 2.91Å; L292-L366 HydrophobicContact CD2-CD1 4.08Å
293	R	94.1	Very high	97.2	Very high	61 Å²	61	31 Å²	31	23%	0.23	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-35.4	175.9	-77.2	178.9	171	-84.2	-2.7	113	V289 I290 W296 E444 M445	V289-R293 HydrophobicContact CG1-CG 4.29Å; V289-R293 VanDerWaalsContact O-CB 3.31Å; V289-R293 WeakPolarHBondContact O-CB 3.37Å; V289-R293 VanDerWaalsContact O-CG 3.3Å; V289-R293 WeakPolarHBondContact O-CG 3.29Å; V289-R293 PolarHBondContact O-N 3.07Å; I290-R293 PolarHBondContact O-N 2.96Å; R293-W296 VanDerWaalsContact O-CD1 3.3Å; R293-E444 PolarHBondContact NH1-O 3.27Å; R293-E444 PolarHBondContact NH2-O 3.02Å; R293-E444 IonicContact NH2-OE1 2.69Å; R293-E444 PolarHBondContact NH2-OE1 2.9Å; R293-M445 HydrophobicContact CB-CE 4.41Å; R293-M445 HydrophobicContact CG-CE 4Å; R293-M445 HydrophobicContact CG-SD 3.96Å
294	A	95.4	Very high	97.1	Very high	42 Å²	42	32.3 Å²	32.3	35%	0.347	18%	0.177	S	C	.	.	H	α-helix	trans	-75	-29.8	179.3	0	0	0	0	0	113.3	I290 L291 L292 A371	I290-A294 VanDerWaalsContact O-CB 3.29Å; I290-A294 WeakPolarHBondContact O-CB 3.49Å; I290-A294 PolarHBondContact O-N 3.15Å; L291-A294 PolarHBondContact O-N 2.88Å; L292-A294 VanDerWaalsContact C-N 3.3Å; L292-A294 PolarHBondContact O-N 3.14Å; A294-A371 HydrophobicContact CB-CB 3.96Å
295	G	96.9	Very high	97.2	Very high	3 Å²	3	29.7 Å²	29.7	3%	0.031	16%	0.16	C	C	.	.	H	α-helix	trans	-116.2	-7.7	-169	0	0	0	0	0	116.8	L291 L292 N297 E298 L299	L291-G295 PolarHBondContact O-N 2.78Å; L292-G295 PolarHBondContact O-N 2.89Å; G295-N297 VanDerWaalsContact C-N 3.3Å; G295-N297 PolarHBondContact O-N 2.94Å; G295-N297 VanDerWaalsContact O-N 3.15Å; G295-E298 PolarHBondContact O-N 3.07Å; G295-E298 VanDerWaalsContact O-N 3.15Å; G295-L299 VanDerWaalsContact O-CG 3.23Å; G295-L299 WeakPolarHBondContact O-CG 3.37Å; G295-L299 PolarHBondContact O-N 3.3Å
296	W	97	Very high	97.2	Very high	12 Å²	12	24.5 Å²	24.5	5%	0.045	13%	0.132	C	C	.	.	H	α-helix	trans	-53.3	-42.5	-168.4	70	-85.6	0	0	0	114.3	L267 L270 L292 R293 L299 L300 L424 L427 L442 M445 L446	L267-W296 HydrophobicContact CD2-CB 3.86Å; L267-W296 HydrophobicContact CD2-CD2 4.02Å; L267-W296 HydrophobicContact CD2-CE3 3.66Å; L267-W296 HydrophobicContact CD2-CG 4.14Å; L270-W296 HydrophobicContact CD2-CB 3.85Å; L292-W296 VanDerWaalsContact O-CB 3.31Å; L292-W296 WeakPolarHBondContact O-CB 3.14Å; L292-W296 PolarHBondContact O-N 2.91Å; R293-W296 VanDerWaalsContact O-CD1 3.3Å; W296-L299 PolarHBondContact O-N 3.47Å; W296-L300 HydrophobicContact CE3-CD1 3.87Å; W296-L300 HydrophobicContact CZ3-CD1 4.18Å; W296-L300 WeakPolarHBondContact O-CB 3.35Å; W296-L300 VanDerWaalsContact O-CG 3.29Å; W296-L300 WeakPolarHBondContact O-CG 3.45Å; W296-L300 PolarHBondContact O-N 3.24Å; W296-L424 HydrophobicContact CH2-CD2 4.43Å; W296-L424 HydrophobicContact CZ2-CD2 3.7Å; W296-L427 HydrophobicContact CH2-CD1 3.72Å; W296-L427 HydrophobicContact CZ2-CD1 4.38Å; W296-L442 HydrophobicContact CE3-CD1 4.39Å; W296-L442 HydrophobicContact CH2-CD1 3.34Å; W296-L442 HydrophobicContact CZ2-CD1 4.11Å; W296-L442 HydrophobicContact CZ3-CD1 3.51Å; W296-M445 HydrophobicContact CB-CE 3.61Å; W296-M445 HydrophobicContact CD2-CB 4.47Å; W296-M445 HydrophobicContact CD2-CE 4.4Å; W296-M445 HydrophobicContact CG-CE 3.49Å; W296-M445 VanDerWaalsContact CG-CE 3.49Å; W296-M445 HydrophobicContact CZ2-CB 4.49Å; W296-L446 HydrophobicContact CZ2-CD2 4.1Å
297	N	96.6	Very high	97.2	Very high	8 Å²	8	21 Å²	21	4%	0.043	11%	0.11	C	C	.	.	H	α-helix	trans	-65.8	-46.6	-177.7	61.6	-40.4	0	0	0	110.9	G295 L300 I301 G420 L424	G295-N297 VanDerWaalsContact C-N 3.3Å; G295-N297 PolarHBondContact O-N 2.94Å; G295-N297 VanDerWaalsContact O-N 3.15Å; N297-L300 PolarHBondContact O-N 3.21Å; N297-I301 WeakPolarHBondContact O-CB 3.38Å; N297-I301 WeakPolarHBondContact O-CD1 3.4Å; N297-I301 WeakPolarHBondContact O-CG1 3.44Å; N297-I301 PolarHBondContact O-N 3.08Å; N297-G420 VanDerWaalsContact ND2-C 3.3Å; N297-G420 PolarHBondContact ND2-O 3.26Å; N297-L424 HydrophobicContact CB-CD2 4.23Å; N297-L424 HydrophobicContact CB-CG 4.41Å; N297-L424 WeakPolarHBondContact ND2-CD1 3.32Å; N297-L424 WeakPolarHBondContact ND2-CG 3.45Å
298	E	98.4	Very high	97.2	Very high	11 Å²	11	21 Å²	21	5%	0.051	11%	0.11	C	C	.	.	H	α-helix	trans	-64.5	-40.9	177	-71.4	178.2	-140.3	0	0	111.5	G295 I301 A302 V365 L416 R417	G295-E298 PolarHBondContact O-N 3.07Å; G295-E298 VanDerWaalsContact O-N 3.15Å; E298-I301 PolarHBondContact O-N 3.4Å; E298-A302 WeakPolarHBondContact O-CB 3.27Å; E298-A302 PolarHBondContact O-N 2.93Å; E298-V365 HydrophobicContact CB-CG1 3.73Å; E298-L416 HydrophobicContact CB-CD2 4.27Å; E298-L416 HydrophobicContact CB-CG 4.16Å; E298-L416 HydrophobicContact CG-CG 4.31Å; E298-R417 WeakPolarHBondContact OE1-CD 3.3Å; E298-R417 IonicContact OE1-CZ 2.98Å; E298-R417 IonicContact OE1-NE 3.52Å; E298-R417 PolarHBondContact OE1-NE 2.76Å; E298-R417 IonicContact OE1-NH2 3.32Å; E298-R417 IonicContact OE2-NE 3.79Å
299	L	98.5	Very high	97.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.5	-45.3	178	-67.4	167	0	0	0	111.7	L270 W273 G295 W296 S303 R362 V365 L366	L270-L299 HydrophobicContact CD1-CB 3.74Å; L270-L299 HydrophobicContact CD1-CD1 4Å; L270-L299 HydrophobicContact CD1-CG 4.4Å; L270-L299 HydrophobicContact CD2-CB 4.15Å; L270-L299 HydrophobicContact CD2-CD1 4.12Å; L270-L299 HydrophobicContact CG-CD1 4.48Å; W273-L299 HydrophobicContact CH2-CD2 3.87Å; W273-L299 HydrophobicContact CZ3-CD1 4.24Å; W273-L299 HydrophobicContact CZ3-CD2 3.92Å; G295-L299 VanDerWaalsContact O-CG 3.23Å; G295-L299 WeakPolarHBondContact O-CG 3.37Å; G295-L299 PolarHBondContact O-N 3.3Å; W296-L299 PolarHBondContact O-N 3.47Å; L299-S303 WeakPolarHBondContact O-CB 3.39Å; L299-S303 PolarHBondContact O-N 2.84Å; L299-S303 VanDerWaalsContact O-N 3.12Å; L299-R362 HydrophobicContact CD2-CB 3.81Å; L299-R362 HydrophobicContact CD2-CG 4.26Å; L299-R362 WeakPolarHBondContact CD2-O 3.19Å; L299-V365 HydrophobicContact CD2-CB 4.01Å; L299-V365 HydrophobicContact CD2-CG1 3.93Å; L299-V365 HydrophobicContact CG-CG1 3.97Å; L299-L366 HydrophobicContact CD1-CD1 4.2Å; L299-L366 HydrophobicContact CD2-CB 4.44Å
300	L	97.7	Very high	97	Very high	14 Å²	14	23.6 Å²	23.6	7%	0.073	13%	0.128	C	C	.	.	H	α-helix	trans	-67	-43	176.2	-69	-173.5	0	0	0	111.8	A263 Q266 L267 L270 W296 N297 S303 F304	A263-L300 HydrophobicContact CB-CD1 4.07Å; Q266-L300 HydrophobicContact CB-CD2 3.61Å; L267-L300 HydrophobicContact CD2-CD1 4.05Å; L267-L300 HydrophobicContact CG-CD1 4.23Å; L270-L300 HydrophobicContact CB-CD2 4.44Å; L270-L300 HydrophobicContact CD2-CD2 4.48Å; W296-L300 HydrophobicContact CE3-CD1 3.87Å; W296-L300 HydrophobicContact CZ3-CD1 4.18Å; W296-L300 WeakPolarHBondContact O-CB 3.35Å; W296-L300 VanDerWaalsContact O-CG 3.29Å; W296-L300 WeakPolarHBondContact O-CG 3.45Å; W296-L300 PolarHBondContact O-N 3.24Å; N297-L300 PolarHBondContact O-N 3.21Å; L300-S303 PolarHBondContact O-N 3.49Å; L300-F304 WeakPolarHBondContact O-CD1 3.38Å; L300-F304 PolarHBondContact O-N 2.86Å
301	I	98.3	Very high	96.8	Very high	9 Å²	9	23.1 Å²	23.1	5%	0.046	13%	0.127	C	C	.	.	H	α-helix	trans	-60.8	-46.2	178.4	-70	163.5	0	0	0	111.2	N297 E298 S303 F304 S305 L344 L416 I419 C423	N297-I301 WeakPolarHBondContact O-CB 3.38Å; N297-I301 WeakPolarHBondContact O-CD1 3.4Å; N297-I301 WeakPolarHBondContact O-CG1 3.44Å; N297-I301 PolarHBondContact O-N 3.08Å; E298-I301 PolarHBondContact O-N 3.4Å; I301-S303 VanDerWaalsContact C-N 3.34Å; I301-S303 PolarHBondContact O-N 2.85Å; I301-F304 VanDerWaalsContact CA-CE1 3.4Å; I301-F304 HydrophobicContact CB-CE1 4.08Å; I301-F304 HydrophobicContact CB-CZ 4.22Å; I301-F304 HydrophobicContact CG1-CE1 3.73Å; I301-F304 HydrophobicContact CG1-CZ 3.92Å; I301-F304 HydrophobicContact CG2-CZ 4.24Å; I301-S305 WeakPolarHBondContact O-CB 3.48Å; I301-S305 PolarHBondContact O-N 3.35Å; I301-S305 PolarHBondContact O-OG 2.97Å; I301-L344 HydrophobicContact CG2-CD1 3.51Å; I301-L416 HydrophobicContact CB-CD1 4.01Å; I301-L416 HydrophobicContact CG2-CD1 3.62Å; I301-I419 HydrophobicContact CD1-CG2 4.41Å; I301-I419 HydrophobicContact CG2-CG2 4.28Å; I301-C423 HydrophobicContact CD1-CB 4.1Å
302	A	98.4	Very high	96.5	Very high	4 Å²	4	31.2 Å²	31.2	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-45.9	175.8	0	0	0	0	0	111.5	E298 S305 H306 L358 R362 L416	E298-A302 WeakPolarHBondContact O-CB 3.27Å; E298-A302 PolarHBondContact O-N 2.93Å; A302-S305 PolarHBondContact O-N 3.42Å; A302-H306 PolarHBondContact O-N 3.21Å; A302-H306 VanDerWaalsContact O-N 3.07Å; A302-L358 HydrophobicContact CB-CD1 4.28Å; A302-R362 HydrophobicContact CB-CG 4.04Å; A302-L416 HydrophobicContact CB-CD1 4.3Å; A302-L416 HydrophobicContact CB-CD2 4Å
303	S	97.6	Very high	96.3	Very high	16 Å²	16	33.6 Å²	33.6	11%	0.112	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-53.4	-178.9	179.8	0	0	0	0	112.9	L299 L300 I301 S305 H306 R307	L299-S303 WeakPolarHBondContact O-CB 3.39Å; L299-S303 PolarHBondContact O-N 2.84Å; L299-S303 VanDerWaalsContact O-N 3.12Å; L300-S303 PolarHBondContact O-N 3.49Å; I301-S303 VanDerWaalsContact C-N 3.34Å; I301-S303 PolarHBondContact O-N 2.85Å; S303-S305 VanDerWaalsContact C-N 3.31Å; S303-S305 PolarHBondContact O-N 2.8Å; S303-H306 PolarHBondContact O-N 2.91Å; S303-R307 PolarHBondContact O-N 3.46Å
304	F	96.6	Very high	96.3	Very high	35 Å²	35	30.8 Å²	30.8	15%	0.154	17%	0.165	C	C	.	.	H	α-helix	trans	-71.7	-27.5	-178.9	76.6	-115	0	0	0	112.5	L300 I301 R307 S308 I315 V340	L300-F304 WeakPolarHBondContact O-CD1 3.38Å; L300-F304 PolarHBondContact O-N 2.86Å; I301-F304 VanDerWaalsContact CA-CE1 3.4Å; I301-F304 HydrophobicContact CB-CE1 4.08Å; I301-F304 HydrophobicContact CB-CZ 4.22Å; I301-F304 HydrophobicContact CG1-CE1 3.73Å; I301-F304 HydrophobicContact CG1-CZ 3.92Å; I301-F304 HydrophobicContact CG2-CZ 4.24Å; F304-R307 PolarHBondContact O-N 2.87Å; F304-S308 WeakPolarHBondContact O-CB 3.39Å; F304-S308 PolarHBondContact O-N 3.23Å; F304-S308 VanDerWaalsContact O-N 3.08Å; F304-S308 PolarHBondContact O-OG 3.44Å; F304-I315 HydrophobicContact CD2-CB 4.5Å; F304-I315 HydrophobicContact CD2-CD1 4.18Å; F304-I315 HydrophobicContact CD2-CG2 4.45Å; F304-I315 HydrophobicContact CE2-CD1 3.99Å; F304-I315 HydrophobicContact CE2-CG2 4.42Å; F304-V340 HydrophobicContact CE2-CG1 3.92Å
305	S	98.3	Very high	96.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.8	-44.7	174.7	-63.6	0	0	0	0	110.8	I301 A302 S303 S308	I301-S305 WeakPolarHBondContact O-CB 3.48Å; I301-S305 PolarHBondContact O-N 3.35Å; I301-S305 PolarHBondContact O-OG 2.97Å; A302-S305 PolarHBondContact O-N 3.42Å; S303-S305 VanDerWaalsContact C-N 3.31Å; S303-S305 PolarHBondContact O-N 2.8Å; S305-S308 PolarHBondContact O-N 2.95Å
306	H	98	Very high	96.3	Very high	23 Å²	23	29.9 Å²	29.9	11%	0.106	15%	0.153	C	C	.	.	H	α-helix	trans	-66.8	-43.1	176.2	-175.1	-90.1	0	0	0	112.1	A302 S303 S308 V309 M348 M353 L358	A302-H306 PolarHBondContact O-N 3.21Å; A302-H306 VanDerWaalsContact O-N 3.07Å; S303-H306 PolarHBondContact O-N 2.91Å; H306-S308 PolarHBondContact O-N 3.26Å; H306-V309 VanDerWaalsContact O-CG1 3.24Å; H306-V309 WeakPolarHBondContact O-CG1 3.31Å; H306-V309 WeakPolarHBondContact O-CG2 3.15Å; H306-V309 PolarHBondContact O-N 2.96Å; H306-V309 VanDerWaalsContact O-N 3.13Å; H306-M348 HydrophobicContact CB-SD 3.93Å; H306-M353 PolarHBondContact NE2-O 3.33Å; H306-L358 HydrophobicContact CB-CD1 3.9Å; H306-L358 HydrophobicContact CB-CD2 3.57Å; H306-L358 HydrophobicContact CB-CG 4.29Å
307	R	95.8	Very high	96.1	Very high	46 Å²	46	29.6 Å²	29.6	17%	0.174	15%	0.152	C	C	.	.	H	α-helix	trans	-57.3	-25.8	173.7	-178.6	168	56	-106.8	3.4	113.2	S303 F304 L316	S303-R307 PolarHBondContact O-N 3.46Å; F304-R307 PolarHBondContact O-N 2.87Å; R307-L316 HydrophobicContact CG-CD2 4.28Å; R307-L316 PolarHBondContact NE-O 2.84Å; R307-L316 PolarHBondContact NH2-O 3.37Å
308	S	97.3	Very high	95.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	2.9	-176.7	-55.2	0	0	0	0	114.3	F304 S305 H306 T310 V311 I315 L316 V345	F304-S308 WeakPolarHBondContact O-CB 3.39Å; F304-S308 PolarHBondContact O-N 3.23Å; F304-S308 VanDerWaalsContact O-N 3.08Å; F304-S308 PolarHBondContact O-OG 3.44Å; S305-S308 PolarHBondContact O-N 2.95Å; H306-S308 PolarHBondContact O-N 3.26Å; S308-T310 PolarHBondContact O-N 2.91Å; S308-T310 VanDerWaalsContact O-N 3.15Å; S308-V311 WeakPolarHBondContact O-CB 3.2Å; S308-V311 PolarHBondContact O-N 3.16Å; S308-I315 VanDerWaalsContact OG-CA 3.28Å; S308-I315 WeakPolarHBondContact OG-CA 3.45Å; S308-I315 WeakPolarHBondContact OG-CB 3.28Å; S308-L316 PolarHBondContact OG-N 3.25Å; S308-V345 WeakPolarHBondContact O-CG1 3.31Å
309	V	96.6	Very high	95.3	Very high	30 Å²	30	31.3 Å²	31.3	18%	0.182	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.5	-175.8	-66.6	0	0	0	0	114.2	H306 V345 M348 K349	H306-V309 VanDerWaalsContact O-CG1 3.24Å; H306-V309 WeakPolarHBondContact O-CG1 3.31Å; H306-V309 WeakPolarHBondContact O-CG2 3.15Å; H306-V309 PolarHBondContact O-N 2.96Å; H306-V309 VanDerWaalsContact O-N 3.13Å; V309-V345 HydrophobicContact CG1-CG1 4.47Å; V309-M348 HydrophobicContact CG1-CB 3.78Å; V309-K349 HydrophobicContact CB-CB 4.21Å; V309-K349 HydrophobicContact CG1-CB 4.4Å; V309-K349 WeakPolarHBondContact O-CD 3.24Å
310	T	93.1	Very high	94.8	Very high	123 Å²	123	32.5 Å²	32.5	76%	0.755	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-13.6	176.7	56	0	0	0	0	113.1	S308	S308-T310 PolarHBondContact O-N 2.91Å; S308-T310 VanDerWaalsContact O-N 3.15Å
311	V	93.1	Very high	94.5	Very high	28 Å²	28	35 Å²	35	17%	0.17	19%	0.19	C	C	.	.	S	Bend	trans	-83.2	133.5	-178.2	-175.2	0	0	0	0	109.6	S308 L316	S308-V311 WeakPolarHBondContact O-CB 3.2Å; S308-V311 PolarHBondContact O-N 3.16Å; V311-L316 HydrophobicContact CG2-CB 3.98Å
312	K	90.9	Very high	94.2	Very high	170 Å²	170	40.7 Å²	40.7	74%	0.739	22%	0.217	S	C	*	.	S	Bend	trans	-89.8	130.8	176.8	-170.8	-179.5	176.6	-173.6	0	110.1	G314	K312-G314 PolarHBondContact O-N 3.36Å; K312-G314 VanDerWaalsContact O-N 3.11Å
313	D	93.2	Very high	94	Very high	70 Å²	70	40.8 Å²	40.8	37%	0.374	22%	0.216	S	C	.	.	S	Bend	trans	52.1	33.3	173.7	-63.5	-50.7	0	0	0	114.4	H324 R325	D313-H324 PolarHBondContact O-CD2 3Å; D313-R325 VanDerWaalsContact O-CB 3.29Å; D313-R325 WeakPolarHBondContact O-CB 3.43Å; D313-R325 PolarHBondContact O-N 2.82Å
314	G	95.2	Very high	93.9	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.3	-179.9	-177.7	0	0	0	0	0	113.6	K312 V323	K312-G314 PolarHBondContact O-N 3.36Å; K312-G314 VanDerWaalsContact O-N 3.11Å; G314-V323 CarbonylContact C-O 3.51Å; G314-V323 WeakPolarHBondContact CA-O 3.33Å
315	I	96.3	Very high	93.9	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	150.4	176.3	64.9	174.6	0	0	0	111.2	F304 S308 L317 H322 V323 F337 L341	F304-I315 HydrophobicContact CD2-CB 4.5Å; F304-I315 HydrophobicContact CD2-CD1 4.18Å; F304-I315 HydrophobicContact CD2-CG2 4.45Å; F304-I315 HydrophobicContact CE2-CD1 3.99Å; F304-I315 HydrophobicContact CE2-CG2 4.42Å; S308-I315 VanDerWaalsContact OG-CA 3.28Å; S308-I315 WeakPolarHBondContact OG-CA 3.45Å; S308-I315 WeakPolarHBondContact OG-CB 3.28Å; I315-L317 HydrophobicContact CD1-CD2 3.91Å; I315-L317 HydrophobicContact CG1-CD2 4.27Å; I315-H322 WeakPolarHBondContact O-CA 3.42Å; I315-V323 HydrophobicContact CD1-CB 4.46Å; I315-V323 HydrophobicContact CG1-CB 3.87Å; I315-V323 PolarHBondContact N-O 2.7Å; I315-V323 PolarHBondContact O-N 3.06Å; I315-F337 HydrophobicContact CB-CZ 4.42Å; I315-F337 HydrophobicContact CD1-CE2 3.64Å; I315-F337 HydrophobicContact CD1-CZ 4.26Å; I315-F337 HydrophobicContact CG1-CE2 3.74Å; I315-F337 HydrophobicContact CG1-CZ 3.86Å; I315-F337 HydrophobicContact CG2-CE2 4.3Å; I315-F337 HydrophobicContact CG2-CZ 4.03Å; I315-L341 HydrophobicContact CG2-CD2 3.9Å
316	L	94.4	Very high	93.8	Very high	23 Å²	23	49.8 Å²	49.8	12%	0.12	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	112.4	173.8	178.1	58.8	0	0	0	110.5	T240 R307 S308 V311	T240-L316 HydrophobicContact CG2-CD2 4.24Å; R307-L316 HydrophobicContact CG-CD2 4.28Å; R307-L316 PolarHBondContact NE-O 2.84Å; R307-L316 PolarHBondContact NH2-O 3.37Å; S308-L316 PolarHBondContact OG-N 3.25Å; V311-L316 HydrophobicContact CG2-CB 3.98Å
317	L	93.4	Very high	93.6	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	27%	0.269	C	S	.	.			trans	-72.4	154.6	176.2	-57.1	-174.4	0	0	0	110.9	N258 I259 A262 I315 T319 G320 L321 V323	N258-L317 HydrophobicContact CB-CD1 3.95Å; N258-L317 WeakPolarHBondContact O-CD1 3.32Å; I259-L317 HydrophobicContact CG1-CD1 4.34Å; I259-L317 HydrophobicContact CG1-CD2 4.02Å; A262-L317 HydrophobicContact CB-CB 3.9Å; A262-L317 HydrophobicContact CB-CD1 4.14Å; A262-L317 HydrophobicContact CB-CD2 4.33Å; A262-L317 HydrophobicContact CB-CG 4.35Å; I315-L317 HydrophobicContact CD1-CD2 3.91Å; I315-L317 HydrophobicContact CG1-CD2 4.27Å; L317-T319 WeakPolarHBondContact CB-OG1 3.31Å; L317-T319 PolarHBondContact O-N 3.36Å; L317-T319 VanDerWaalsContact O-N 3.12Å; L317-G320 PolarHBondContact O-N 3.33Å; L317-L321 WeakPolarHBondContact CB-O 3.35Å; L317-L321 HydrophobicContact CD1-CB 4.22Å; L317-L321 PolarHBondContact N-O 3.39Å; L317-V323 HydrophobicContact CD1-CG2 3.73Å; L317-V323 HydrophobicContact CD2-CG2 4.34Å; L317-V323 HydrophobicContact CG-CG2 4Å
318	A	90.2	Very high	93.5	Very high	7 Å²	7	48.4 Å²	48.4	6%	0.058	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-12	176.7	0	0	0	0	0	113.4	P238 Q266 G320	P238-A318 HydrophobicContact CB-CB 4.14Å; P238-A318 HydrophobicContact CG-CB 4.1Å; Q266-A318 HydrophobicContact CG-CB 3.39Å; A318-G320 VanDerWaalsContact C-N 3.27Å
319	T	89.1	Confident	93.4	Very high	48 Å²	48	52.7 Å²	52.7	29%	0.294	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-8.6	170.4	53.4	0	0	0	0	113	A262 L317 L321	A262-T319 HydrophobicContact CB-CG2 4.06Å; L317-T319 WeakPolarHBondContact CB-OG1 3.31Å; L317-T319 PolarHBondContact O-N 3.36Å; L317-T319 VanDerWaalsContact O-N 3.12Å; T319-L321 VanDerWaalsContact C-N 3.32Å
320	G	88	Confident	93.3	Very high	26 Å²	26	56.6 Å²	56.6	27%	0.268	31%	0.31	S	S	.	.	S	Bend	trans	89.1	-7.9	-173.5	0	0	0	0	0	114	L317 A318 H322	L317-G320 PolarHBondContact O-N 3.33Å; A318-G320 VanDerWaalsContact C-N 3.27Å; G320-H322 PolarHBondContact O-ND1 2.92Å
321	L	90.3	Very high	93.1	Very high	65 Å²	65	52.3 Å²	52.3	34%	0.34	29%	0.287	S	S	.	.			trans	-73	139	177.5	-65	177.8	0	0	0	111.4	N258 L317 T319	N258-L321 HydrophobicContact CB-CD1 4.2Å; L317-L321 WeakPolarHBondContact CB-O 3.35Å; L317-L321 HydrophobicContact CD1-CB 4.22Å; L317-L321 PolarHBondContact N-O 3.39Å; T319-L321 VanDerWaalsContact C-N 3.32Å
322	H	92.6	Very high	93.1	Very high	130 Å²	130	53.9 Å²	53.9	60%	0.602	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.7	174.3	-71.4	72.6	0	0	0	109.8	I315 G320	I315-H322 WeakPolarHBondContact O-CA 3.42Å; G320-H322 PolarHBondContact O-ND1 2.92Å
323	V	94.8	Very high	93.2	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.03	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	110.6	171.9	-178.8	0	0	0	0	107.9	P255 I259 G314 I315 L317 F337	P255-V323 HydrophobicContact CB-CG1 3.78Å; I259-V323 HydrophobicContact CG1-CG2 4.32Å; G314-V323 CarbonylContact C-O 3.51Å; G314-V323 WeakPolarHBondContact CA-O 3.33Å; I315-V323 HydrophobicContact CD1-CB 4.46Å; I315-V323 HydrophobicContact CG1-CB 3.87Å; I315-V323 PolarHBondContact N-O 2.7Å; I315-V323 PolarHBondContact O-N 3.06Å; L317-V323 HydrophobicContact CD1-CG2 3.73Å; L317-V323 HydrophobicContact CD2-CG2 4.34Å; L317-V323 HydrophobicContact CG-CG2 4Å; V323-F337 HydrophobicContact CB-CE2 4.31Å; V323-F337 HydrophobicContact CB-CZ 4.43Å; V323-F337 HydrophobicContact CG1-CE2 3.75Å; V323-F337 HydrophobicContact CG1-CZ 4.04Å; V323-F337 WeakPolarHBondContact O-CZ 3.23Å
324	H	95.6	Very high	93.3	Very high	90 Å²	90	43.2 Å²	43.2	42%	0.417	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	149	178.4	-173.3	-101.4	0	0	0	111.2	D313 S326 S327 A328	D313-H324 PolarHBondContact O-CD2 3Å; H324-S326 VanDerWaalsContact C-N 3.29Å; H324-S326 PolarHBondContact ND1-N 3.44Å; H324-S326 PolarHBondContact ND1-OG 3.08Å; H324-S326 PolarHBondContact O-N 3.36Å; H324-S327 WeakPolarHBondContact O-CB 3.37Å; H324-S327 PolarHBondContact O-N 3.03Å; H324-A328 PolarHBondContact O-N 3.46Å
325	R	96	Very high	93.4	Very high	82 Å²	82	47 Å²	47	31%	0.309	29%	0.287	S	S	.	.	H	α-helix	trans	-49.2	-46.6	179.6	-175.8	177.9	-172.1	145.1	1.8	112.8	D313 S327 A328 H329 F337 D338 L341	D313-R325 VanDerWaalsContact O-CB 3.29Å; D313-R325 WeakPolarHBondContact O-CB 3.43Å; D313-R325 PolarHBondContact O-N 2.82Å; R325-S327 VanDerWaalsContact C-N 3.3Å; R325-S327 PolarHBondContact O-N 3.28Å; R325-A328 PolarHBondContact O-N 2.77Å; R325-H329 PolarHBondContact O-CD2 2.69Å; R325-H329 VanDerWaalsContact O-CD2 3.27Å; R325-H329 PolarHBondContact O-N 2.98Å; R325-H329 VanDerWaalsContact O-N 3.11Å; R325-F337 HydrophobicContact CB-CE1 4.23Å; R325-D338 WeakPolarHBondContact CG-OD1 3.41Å; R325-D338 VanDerWaalsContact CZ-CG 3.43Å; R325-D338 IonicContact CZ-OD1 3.01Å; R325-D338 IonicContact CZ-OD2 3.58Å; R325-D338 IonicContact NE-OD1 2.62Å; R325-D338 PolarHBondContact NE-OD1 2.69Å; R325-D338 IonicContact NE-OD2 2.58Å; R325-D338 IonicContact NH2-OD1 3.22Å; R325-D338 PolarHBondContact NH2-OD1 2.88Å; R325-D338 VanDerWaalsContact NH2-OD1 3.12Å; R325-D338 IonicContact NH2-OD2 2.69Å; R325-D338 PolarHBondContact NH2-OD2 3.48Å; R325-L341 HydrophobicContact CB-CD1 4.32Å; R325-L341 HydrophobicContact CG-CD1 4.42Å
326	S	95.1	Very high	93.4	Very high	69 Å²	69	47.5 Å²	47.5	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-59.4	-38.7	179.8	59.1	0	0	0	0	113.1	H324 H329 S330	H324-S326 VanDerWaalsContact C-N 3.29Å; H324-S326 PolarHBondContact ND1-N 3.44Å; H324-S326 PolarHBondContact ND1-OG 3.08Å; H324-S326 PolarHBondContact O-N 3.36Å; S326-H329 PolarHBondContact O-N 2.89Å; S326-S330 PolarHBondContact O-N 3.37Å; S326-S330 PolarHBondContact O-OG 2.97Å
327	S	93.9	Very high	93.5	Very high	39 Å²	39	47 Å²	47	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-41.9	178.3	176.9	0	0	0	0	111.4	P255 H324 R325 H329 S330 A331	P255-S327 WeakPolarHBondContact CG-OG 3.41Å; H324-S327 WeakPolarHBondContact O-CB 3.37Å; H324-S327 PolarHBondContact O-N 3.03Å; R325-S327 VanDerWaalsContact C-N 3.3Å; R325-S327 PolarHBondContact O-N 3.28Å; S327-H329 VanDerWaalsContact C-N 3.33Å; S327-H329 PolarHBondContact O-N 3.36Å; S327-S330 PolarHBondContact O-N 2.66Å; S327-A331 PolarHBondContact O-N 3.42Å
328	A	94.5	Very high	93.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-39	175.9	0	0	0	0	0	112.5	H324 R325 A331 G332 V333 G334 F337	H324-A328 PolarHBondContact O-N 3.46Å; R325-A328 PolarHBondContact O-N 2.77Å; A328-A331 PolarHBondContact O-N 3.33Å; A328-G332 PolarHBondContact O-N 2.78Å; A328-V333 HydrophobicContact CB-CG2 4.18Å; A328-V333 CarbonylContact O-C 3.53Å; A328-V333 WeakPolarHBondContact O-CG2 3.28Å; A328-V333 PolarHBondContact O-N 2.92Å; A328-G334 PolarHBondContact O-N 2.69Å; A328-F337 HydrophobicContact CB-CB 3.73Å; A328-F337 HydrophobicContact CB-CD1 3.85Å; A328-F337 HydrophobicContact CB-CD2 3.61Å; A328-F337 HydrophobicContact CB-CE1 4.34Å; A328-F337 HydrophobicContact CB-CE2 4.13Å; A328-F337 HydrophobicContact CB-CG 3.45Å; A328-F337 VanDerWaalsContact CB-CG 3.45Å; A328-F337 HydrophobicContact CB-CZ 4.47Å
329	H	95.1	Very high	94.1	Very high	90 Å²	90	51.1 Å²	51.1	42%	0.417	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-44.9	173.9	-84.2	-94.1	0	0	0	111.9	R325 S326 S327 A331 G332 D338	R325-H329 PolarHBondContact O-CD2 2.69Å; R325-H329 VanDerWaalsContact O-CD2 3.27Å; R325-H329 PolarHBondContact O-N 2.98Å; R325-H329 VanDerWaalsContact O-N 3.11Å; S326-H329 PolarHBondContact O-N 2.89Å; S327-H329 VanDerWaalsContact C-N 3.33Å; S327-H329 PolarHBondContact O-N 3.36Å; H329-A331 PolarHBondContact O-N 3.44Å; H329-G332 PolarHBondContact O-N 3.35Å; H329-D338 IonicContact CD2-OD1 2.7Å; H329-D338 IonicContact CE1-OD2 3.45Å; H329-D338 PolarHBondContact CE1-OD2 3.1Å; H329-D338 VanDerWaalsContact CE1-OD2 3.32Å; H329-D338 VanDerWaalsContact NE2-CG 3.25Å; H329-D338 IonicContact NE2-OD1 3.3Å; H329-D338 PolarHBondContact NE2-OD1 3.27Å; H329-D338 IonicContact NE2-OD2 3.78Å; H329-D338 PolarHBondContact NE2-OD2 3.5Å
330	S	93.6	Very high	94.6	Very high	111 Å²	111	49.2 Å²	49.2	78%	0.776	29%	0.291	S	S	*	.	H	α-helix	trans	-61.6	-29.9	175.4	-62.3	0	0	0	0	113.2	S326 S327 G332	S326-S330 PolarHBondContact O-N 3.37Å; S326-S330 PolarHBondContact O-OG 2.97Å; S327-S330 PolarHBondContact O-N 2.66Å; S330-G332 VanDerWaalsContact C-N 3.31Å
331	A	90.4	Very high	95	Very high	34 Å²	34	48.8 Å²	48.8	28%	0.281	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	4.8	175.7	0	0	0	0	0	114.1	P255 V256 S327 A328 H329 V333	P255-A331 HydrophobicContact CG-CB 3.43Å; P255-A331 VanDerWaalsContact CG-CB 3.43Å; V256-A331 HydrophobicContact CG2-CB 4.21Å; S327-A331 PolarHBondContact O-N 3.42Å; A328-A331 PolarHBondContact O-N 3.33Å; H329-A331 PolarHBondContact O-N 3.44Å; A331-V333 VanDerWaalsContact C-N 3.25Å; A331-V333 HydrophobicContact CB-CG2 4.33Å; A331-V333 PolarHBondContact O-N 3Å
332	G	91.5	Very high	95.4	Very high	61 Å²	61	49.4 Å²	49.4	63%	0.629	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	3.1	177.3	0	0	0	0	0	115.5	A328 H329 S330	A328-G332 PolarHBondContact O-N 2.78Å; H329-G332 PolarHBondContact O-N 3.35Å; S330-G332 VanDerWaalsContact C-N 3.31Å
333	V	93.8	Very high	95.7	Very high	13 Å²	13	46 Å²	46	8%	0.079	27%	0.273	C	S	.	.			trans	-103.9	12.2	177.7	-62.9	0	0	0	0	113	V256 A328 A331 S335 I336 F337 F430	V256-V333 HydrophobicContact CG2-CG1 4.04Å; V256-V333 HydrophobicContact CG2-CG2 4.02Å; A328-V333 HydrophobicContact CB-CG2 4.18Å; A328-V333 CarbonylContact O-C 3.53Å; A328-V333 WeakPolarHBondContact O-CG2 3.28Å; A328-V333 PolarHBondContact O-N 2.92Å; A331-V333 VanDerWaalsContact C-N 3.25Å; A331-V333 HydrophobicContact CB-CG2 4.33Å; A331-V333 PolarHBondContact O-N 3Å; V333-S335 VanDerWaalsContact C-N 3.3Å; V333-S335 PolarHBondContact O-N 3.28Å; V333-I336 HydrophobicContact CB-CG2 4.21Å; V333-I336 WeakPolarHBondContact O-CG2 3.47Å; V333-I336 PolarHBondContact O-N 3.12Å; V333-F337 WeakPolarHBondContact O-CB 3.36Å; V333-F337 PolarHBondContact O-N 3.5Å; V333-F337 VanDerWaalsContact O-N 3.12Å; V333-F430 HydrophobicContact CG1-CE2 4.2Å; V333-F430 HydrophobicContact CG1-CZ 3.9Å
334	G	95.2	Very high	95.8	Very high	3 Å²	3	45.9 Å²	45.9	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-58.6	-34.4	-175.7	0	0	0	0	0	114.7	A328 F337 D338	A328-G334 PolarHBondContact O-N 2.69Å; G334-F337 PolarHBondContact O-N 3.29Å; G334-D338 WeakPolarHBondContact O-CB 3.4Å; G334-D338 PolarHBondContact O-N 2.82Å
335	S	96.8	Very high	96	Very high	80 Å²	80	42 Å²	42	56%	0.559	26%	0.255	S	S	*	.	H	α-helix	trans	-65.6	-47.1	-178.3	59.8	0	0	0	0	112.9	V333 R339	V333-S335 VanDerWaalsContact C-N 3.3Å; V333-S335 PolarHBondContact O-N 3.28Å; S335-R339 WeakPolarHBondContact O-CG 3.3Å; S335-R339 PolarHBondContact O-N 3.48Å
336	I	96.4	Very high	96.1	Very high	14 Å²	14	40.2 Å²	40.2	7%	0.072	26%	0.255	C	S	.	.	H	α-helix	trans	-71.5	-35.2	176.7	-173.9	57.2	0	0	0	111.2	V333 R339 V340 I419 K422	V333-I336 HydrophobicContact CB-CG2 4.21Å; V333-I336 WeakPolarHBondContact O-CG2 3.47Å; V333-I336 PolarHBondContact O-N 3.12Å; I336-R339 WeakPolarHBondContact O-CB 3.11Å; I336-R339 PolarHBondContact O-N 3.12Å; I336-V340 WeakPolarHBondContact O-CG2 3.23Å; I336-V340 PolarHBondContact O-N 3.35Å; I336-I419 HydrophobicContact CD1-CB 4.37Å; I336-I419 HydrophobicContact CD1-CG1 4.36Å; I336-I419 HydrophobicContact CD1-CG2 3.94Å; I336-K422 HydrophobicContact CD1-CB 3.85Å; I336-K422 HydrophobicContact CD1-CG 3.84Å; I336-K422 HydrophobicContact CG1-CG 4.35Å
337	F	97.4	Very high	96.2	Very high	12 Å²	12	41.1 Å²	41.1	5%	0.053	25%	0.25	C	S	.	.	H	α-helix	trans	-61.9	-43.7	175.3	-165.4	-88.6	0	0	0	111.9	I315 V323 R325 A328 V333 G334 R339 V340 L341	I315-F337 HydrophobicContact CB-CZ 4.42Å; I315-F337 HydrophobicContact CD1-CE2 3.64Å; I315-F337 HydrophobicContact CD1-CZ 4.26Å; I315-F337 HydrophobicContact CG1-CE2 3.74Å; I315-F337 HydrophobicContact CG1-CZ 3.86Å; I315-F337 HydrophobicContact CG2-CE2 4.3Å; I315-F337 HydrophobicContact CG2-CZ 4.03Å; V323-F337 HydrophobicContact CB-CE2 4.31Å; V323-F337 HydrophobicContact CB-CZ 4.43Å; V323-F337 HydrophobicContact CG1-CE2 3.75Å; V323-F337 HydrophobicContact CG1-CZ 4.04Å; V323-F337 WeakPolarHBondContact O-CZ 3.23Å; R325-F337 HydrophobicContact CB-CE1 4.23Å; A328-F337 HydrophobicContact CB-CB 3.73Å; A328-F337 HydrophobicContact CB-CD1 3.85Å; A328-F337 HydrophobicContact CB-CD2 3.61Å; A328-F337 HydrophobicContact CB-CE1 4.34Å; A328-F337 HydrophobicContact CB-CE2 4.13Å; A328-F337 HydrophobicContact CB-CG 3.45Å; A328-F337 VanDerWaalsContact CB-CG 3.45Å; A328-F337 HydrophobicContact CB-CZ 4.47Å; V333-F337 WeakPolarHBondContact O-CB 3.36Å; V333-F337 PolarHBondContact O-N 3.5Å; V333-F337 VanDerWaalsContact O-N 3.12Å; G334-F337 PolarHBondContact O-N 3.29Å; F337-R339 VanDerWaalsContact C-N 3.31Å; F337-R339 PolarHBondContact O-N 3.39Å; F337-V340 WeakPolarHBondContact O-CB 3.48Å; F337-V340 PolarHBondContact O-N 3.4Å; F337-L341 HydrophobicContact CD1-CD1 3.92Å; F337-L341 HydrophobicContact CD1-CG 4.09Å; F337-L341 HydrophobicContact CE1-CD1 3.65Å; F337-L341 HydrophobicContact CE1-CD2 4.25Å; F337-L341 HydrophobicContact CE1-CG 3.92Å; F337-L341 PolarHBondContact O-N 3.24Å
338	D	97.9	Very high	96.4	Very high	30 Å²	30	39.7 Å²	39.7	16%	0.16	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-40	176.3	-73.7	-4.7	0	0	0	111.8	R325 H329 G334 L341 T342	R325-D338 WeakPolarHBondContact CG-OD1 3.41Å; R325-D338 VanDerWaalsContact CZ-CG 3.43Å; R325-D338 IonicContact CZ-OD1 3.01Å; R325-D338 IonicContact CZ-OD2 3.58Å; R325-D338 IonicContact NE-OD1 2.62Å; R325-D338 PolarHBondContact NE-OD1 2.69Å; R325-D338 IonicContact NE-OD2 2.58Å; R325-D338 IonicContact NH2-OD1 3.22Å; R325-D338 PolarHBondContact NH2-OD1 2.88Å; R325-D338 VanDerWaalsContact NH2-OD1 3.12Å; R325-D338 IonicContact NH2-OD2 2.69Å; R325-D338 PolarHBondContact NH2-OD2 3.48Å; H329-D338 IonicContact CD2-OD1 2.7Å; H329-D338 IonicContact CE1-OD2 3.45Å; H329-D338 PolarHBondContact CE1-OD2 3.1Å; H329-D338 VanDerWaalsContact CE1-OD2 3.32Å; H329-D338 VanDerWaalsContact NE2-CG 3.25Å; H329-D338 IonicContact NE2-OD1 3.3Å; H329-D338 PolarHBondContact NE2-OD1 3.27Å; H329-D338 IonicContact NE2-OD2 3.78Å; H329-D338 PolarHBondContact NE2-OD2 3.5Å; G334-D338 WeakPolarHBondContact O-CB 3.4Å; G334-D338 PolarHBondContact O-N 2.82Å; D338-L341 PolarHBondContact O-N 3.18Å; D338-T342 WeakPolarHBondContact O-CB 3.46Å; D338-T342 PolarHBondContact O-N 3.18Å; D338-T342 PolarHBondContact O-OG1 3.18Å
339	R	98.1	Very high	96.6	Very high	71 Å²	71	45.2 Å²	45.2	27%	0.268	26%	0.263	S	S	.	.	H	α-helix	trans	-62	-44	174.7	-70	-176.2	66.2	-157.4	-2.6	112.2	S335 I336 F337 L341 T342 E343 S418 I419	S335-R339 WeakPolarHBondContact O-CG 3.3Å; S335-R339 PolarHBondContact O-N 3.48Å; I336-R339 WeakPolarHBondContact O-CB 3.11Å; I336-R339 PolarHBondContact O-N 3.12Å; F337-R339 VanDerWaalsContact C-N 3.31Å; F337-R339 PolarHBondContact O-N 3.39Å; R339-L341 VanDerWaalsContact C-N 3.35Å; R339-L341 PolarHBondContact O-N 2.88Å; R339-T342 PolarHBondContact O-N 3.44Å; R339-E343 WeakPolarHBondContact CB-OE1 3.41Å; R339-E343 WeakPolarHBondContact CG-OE1 3.45Å; R339-E343 IonicContact CZ-OE1 3.61Å; R339-E343 IonicContact NE-OE1 2.95Å; R339-E343 PolarHBondContact NE-OE1 3.07Å; R339-E343 IonicContact NH2-OE1 3.71Å; R339-E343 IonicContact NH2-OE2 3.09Å; R339-E343 VanDerWaalsContact O-CB 3.23Å; R339-E343 WeakPolarHBondContact O-CB 3.46Å; R339-E343 WeakPolarHBondContact O-CG 3.37Å; R339-E343 PolarHBondContact O-N 3.26Å; R339-S418 PolarHBondContact NH2-OG 3.24Å; R339-I419 HydrophobicContact CB-CD1 4.22Å; R339-I419 HydrophobicContact CB-CG1 4.24Å
340	V	98.4	Very high	96.7	Very high	8 Å²	8	45.8 Å²	45.8	5%	0.048	27%	0.269	C	S	.	.	I	π-helix	trans	-57.1	-49.2	174.1	170.1	0	0	0	0	110.7	F304 I336 F337 L344 V345 I419	F304-V340 HydrophobicContact CE2-CG1 3.92Å; I336-V340 WeakPolarHBondContact O-CG2 3.23Å; I336-V340 PolarHBondContact O-N 3.35Å; F337-V340 WeakPolarHBondContact O-CB 3.48Å; F337-V340 PolarHBondContact O-N 3.4Å; V340-L344 VanDerWaalsContact O-CB 3.31Å; V340-L344 WeakPolarHBondContact O-CB 3.41Å; V340-L344 PolarHBondContact O-N 2.82Å; V340-L344 VanDerWaalsContact O-N 3.14Å; V340-V345 HydrophobicContact CG1-CG2 4.33Å; V340-V345 PolarHBondContact O-N 3.41Å; V340-I419 HydrophobicContact CG2-CG2 3.6Å
341	L	98.1	Very high	96.9	Very high	16 Å²	16	42 Å²	42	8%	0.084	24%	0.239	C	C	.	.	I	π-helix	trans	-62.1	-46.8	179.8	-68.6	-174.1	0	0	0	112.3	I315 R325 F337 D338 R339 V345 S346	I315-L341 HydrophobicContact CG2-CD2 3.9Å; R325-L341 HydrophobicContact CB-CD1 4.32Å; R325-L341 HydrophobicContact CG-CD1 4.42Å; F337-L341 HydrophobicContact CD1-CD1 3.92Å; F337-L341 HydrophobicContact CD1-CG 4.09Å; F337-L341 HydrophobicContact CE1-CD1 3.65Å; F337-L341 HydrophobicContact CE1-CD2 4.25Å; F337-L341 HydrophobicContact CE1-CG 3.92Å; F337-L341 PolarHBondContact O-N 3.24Å; D338-L341 PolarHBondContact O-N 3.18Å; R339-L341 VanDerWaalsContact C-N 3.35Å; R339-L341 PolarHBondContact O-N 2.88Å; L341-V345 HydrophobicContact CD2-CB 4.47Å; L341-V345 HydrophobicContact CD2-CG2 4.13Å; L341-S346 WeakPolarHBondContact O-CB 3.4Å; L341-S346 PolarHBondContact O-N 3.47Å
342	T	97.8	Very high	97.3	Very high	78 Å²	78	48 Å²	48	48%	0.479	26%	0.262	S	S	.	.	I	π-helix	trans	-81.1	-40.5	-172.5	-60.2	0	0	0	0	113.4	D338 R339	D338-T342 WeakPolarHBondContact O-CB 3.46Å; D338-T342 PolarHBondContact O-N 3.18Å; D338-T342 PolarHBondContact O-OG1 3.18Å; R339-T342 PolarHBondContact O-N 3.44Å
343	E	98.3	Very high	97.6	Very high	59 Å²	59	45.6 Å²	45.6	28%	0.276	23%	0.234	S	C	.	.	I	π-helix	trans	-91.3	-25.1	-172.6	-56.9	-179.3	-123.9	0	0	112.9	R339 K347 R412 A415 I419	R339-E343 WeakPolarHBondContact CB-OE1 3.41Å; R339-E343 WeakPolarHBondContact CG-OE1 3.45Å; R339-E343 IonicContact CZ-OE1 3.61Å; R339-E343 IonicContact NE-OE1 2.95Å; R339-E343 PolarHBondContact NE-OE1 3.07Å; R339-E343 IonicContact NH2-OE1 3.71Å; R339-E343 IonicContact NH2-OE2 3.09Å; R339-E343 VanDerWaalsContact O-CB 3.23Å; R339-E343 WeakPolarHBondContact O-CB 3.46Å; R339-E343 WeakPolarHBondContact O-CG 3.37Å; R339-E343 PolarHBondContact O-N 3.26Å; E343-K347 WeakPolarHBondContact O-CG 3.41Å; E343-R412 PolarHBondContact O-NH1 2.93Å; E343-A415 HydrophobicContact CB-CB 4.22Å; E343-I419 HydrophobicContact CB-CD1 4.16Å
344	L	98.4	Very high	97.8	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	24%	0.237	C	C	.	.	I	π-helix	trans	-110.7	-69.7	179.4	-52.6	178.3	0	0	0	111.8	I301 V340 S346 K347 M348 A415 L416 I419	I301-L344 HydrophobicContact CG2-CD1 3.51Å; V340-L344 VanDerWaalsContact O-CB 3.31Å; V340-L344 WeakPolarHBondContact O-CB 3.41Å; V340-L344 PolarHBondContact O-N 2.82Å; V340-L344 VanDerWaalsContact O-N 3.14Å; L344-S346 PolarHBondContact O-N 3.3Å; L344-K347 PolarHBondContact O-N 3.44Å; L344-K347 VanDerWaalsContact O-N 3.08Å; L344-M348 WeakPolarHBondContact O-CB 3.34Å; L344-M348 VanDerWaalsContact O-CG 3.29Å; L344-M348 WeakPolarHBondContact O-CG 3.2Å; L344-M348 PolarHBondContact O-N 2.74Å; L344-A415 HydrophobicContact CD2-CB 4.44Å; L344-L416 HydrophobicContact CD1-CD1 3.98Å; L344-L416 HydrophobicContact CD2-CB 4.24Å; L344-I419 HydrophobicContact CD1-CD1 3.86Å; L344-I419 HydrophobicContact CD2-CD1 4.36Å; L344-I419 HydrophobicContact CG-CD1 3.81Å
345	V	98.4	Very high	97.9	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.055	25%	0.249	C	C	.	.	I	π-helix	trans	-58.5	-51.4	-170.6	-176.8	0	0	0	0	111.4	S308 V309 V340 L341 K347 M348 K349	S308-V345 WeakPolarHBondContact O-CG1 3.31Å; V309-V345 HydrophobicContact CG1-CG1 4.47Å; V340-V345 HydrophobicContact CG1-CG2 4.33Å; V340-V345 PolarHBondContact O-N 3.41Å; L341-V345 HydrophobicContact CD2-CB 4.47Å; L341-V345 HydrophobicContact CD2-CG2 4.13Å; V345-K347 VanDerWaalsContact C-N 3.29Å; V345-K347 PolarHBondContact O-N 3.08Å; V345-M348 PolarHBondContact O-N 3.08Å; V345-K349 WeakPolarHBondContact O-CB 3.37Å; V345-K349 PolarHBondContact O-N 2.9Å
346	S	98.2	Very high	98	Very high	45 Å²	45	45.8 Å²	45.8	32%	0.315	23%	0.225	S	C	.	.	H	α-helix	trans	-59.6	-40.8	177.9	-171.5	0	0	0	0	111.4	L341 L344 K349 D350	L341-S346 WeakPolarHBondContact O-CB 3.4Å; L341-S346 PolarHBondContact O-N 3.47Å; L344-S346 PolarHBondContact O-N 3.3Å; S346-K349 PolarHBondContact O-N 3.35Å; S346-D350 WeakPolarHBondContact O-CB 3.2Å; S346-D350 PolarHBondContact O-N 3.49Å
347	K	98.3	Very high	98.1	Very high	88 Å²	88	45.1 Å²	45.1	38%	0.383	22%	0.221	S	C	.	.	H	α-helix	trans	-73.3	-38	-176.5	-63.1	-65.3	170.7	-153.5	0	112.7	E343 L344 V345 K349 D350 M351	E343-K347 WeakPolarHBondContact O-CG 3.41Å; L344-K347 PolarHBondContact O-N 3.44Å; L344-K347 VanDerWaalsContact O-N 3.08Å; V345-K347 VanDerWaalsContact C-N 3.29Å; V345-K347 PolarHBondContact O-N 3.08Å; K347-K349 VanDerWaalsContact C-N 3.33Å; K347-D350 IonicContact NZ-OD2 3.12Å; K347-M351 WeakPolarHBondContact O-CG 2.96Å; K347-M351 PolarHBondContact O-N 3.11Å
348	M	98.5	Very high	98.2	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-41.2	171.6	-68.7	174	175.2	0	0	111.1	H306 V309 L344 V345 Q352 M353 L358	H306-M348 HydrophobicContact CB-SD 3.93Å; V309-M348 HydrophobicContact CG1-CB 3.78Å; L344-M348 WeakPolarHBondContact O-CB 3.34Å; L344-M348 VanDerWaalsContact O-CG 3.29Å; L344-M348 WeakPolarHBondContact O-CG 3.2Å; L344-M348 PolarHBondContact O-N 2.74Å; V345-M348 PolarHBondContact O-N 3.08Å; M348-Q352 PolarHBondContact O-N 3.24Å; M348-Q352 VanDerWaalsContact O-N 3.16Å; M348-M353 HydrophobicContact CB-CB 4.27Å; M348-M353 HydrophobicContact CB-SD 4.47Å; M348-M353 HydrophobicContact CE-CE 4.44Å; M348-M353 HydrophobicContact CE-SD 4.25Å; M348-M353 HydrophobicContact CG-CE 3.79Å; M348-M353 HydrophobicContact CG-SD 3.82Å; M348-M353 PolarHBondContact O-N 3.24Å; M348-M353 HydrophobicContact SD-SD 4.33Å; M348-L358 HydrophobicContact CE-CD1 4.48Å
349	K	98.2	Very high	98.2	Very high	117 Å²	117	43.3 Å²	43.3	51%	0.509	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-51.3	175.6	-175.2	-176.4	-172.8	165	0	112.4	V309 V345 S346 K347 M351 Q352	V309-K349 HydrophobicContact CB-CB 4.21Å; V309-K349 HydrophobicContact CG1-CB 4.4Å; V309-K349 WeakPolarHBondContact O-CD 3.24Å; V345-K349 WeakPolarHBondContact O-CB 3.37Å; V345-K349 PolarHBondContact O-N 2.9Å; S346-K349 PolarHBondContact O-N 3.35Å; K347-K349 VanDerWaalsContact C-N 3.33Å; K349-M351 PolarHBondContact O-N 3Å; K349-Q352 PolarHBondContact O-N 3.39Å
350	D	97.4	Very high	98.3	Very high	102 Å²	102	40 Å²	40	55%	0.545	20%	0.2	S	C	.	.	H	α-helix	trans	-58.1	-38.6	-177.3	-67.1	-16.5	0	0	0	111.5	S346 K347	S346-D350 WeakPolarHBondContact O-CB 3.2Å; S346-D350 PolarHBondContact O-N 3.49Å; K347-D350 IonicContact NZ-OD2 3.12Å
351	M	97	Very high	98.3	Very high	31 Å²	31	40.1 Å²	40.1	15%	0.153	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.2	179.7	77.4	-170.4	-63.7	0	0	114.4	K347 K349 M353 R405 K408 L409	K347-M351 WeakPolarHBondContact O-CG 2.96Å; K347-M351 PolarHBondContact O-N 3.11Å; K349-M351 PolarHBondContact O-N 3Å; M351-M353 VanDerWaalsContact C-N 3.34Å; M351-M353 HydrophobicContact CG-CB 4.05Å; M351-M353 PolarHBondContact O-N 3.29Å; M351-M353 HydrophobicContact SD-CE 3.91Å; M351-R405 PolarHBondContact O-NH1 3.07Å; M351-R405 PolarHBondContact O-NH2 2.9Å; M351-K408 HydrophobicContact CE-CB 4.19Å; M351-L409 HydrophobicContact CE-CD2 3.34Å; M351-L409 HydrophobicContact CE-CG 3.67Å; M351-L409 HydrophobicContact SD-CD2 4.09Å
352	Q	98.1	Very high	98.3	Very high	160 Å²	160	39.6 Å²	39.6	75%	0.748	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	57.6	-173.4	-59.7	178.4	-4.9	0	0	110.9	M348 K349 D354 R405	M348-Q352 PolarHBondContact O-N 3.24Å; M348-Q352 VanDerWaalsContact O-N 3.16Å; K349-Q352 PolarHBondContact O-N 3.39Å; Q352-D354 PolarHBondContact O-N 3.16Å; Q352-R405 PolarHBondContact O-NH2 3.01Å; Q352-R405 VanDerWaalsContact O-NH2 3.08Å
353	M	98.6	Very high	98.4	Very high	12 Å²	12	35.9 Å²	35.9	6%	0.059	17%	0.174	C	C	.	.			trans	-63.1	126.6	178.1	-177.7	-175.6	-72.6	0	0	109.5	H306 M348 M351 E357 L358 L361 L409 R412	H306-M353 PolarHBondContact NE2-O 3.33Å; M348-M353 HydrophobicContact CB-CB 4.27Å; M348-M353 HydrophobicContact CB-SD 4.47Å; M348-M353 HydrophobicContact CE-CE 4.44Å; M348-M353 HydrophobicContact CE-SD 4.25Å; M348-M353 HydrophobicContact CG-CE 3.79Å; M348-M353 HydrophobicContact CG-SD 3.82Å; M348-M353 PolarHBondContact O-N 3.24Å; M348-M353 HydrophobicContact SD-SD 4.33Å; M351-M353 VanDerWaalsContact C-N 3.34Å; M351-M353 HydrophobicContact CG-CB 4.05Å; M351-M353 PolarHBondContact O-N 3.29Å; M351-M353 HydrophobicContact SD-CE 3.91Å; M353-E357 WeakPolarHBondContact CA-OE2 3.31Å; M353-E357 HydrophobicContact CG-CB 3.98Å; M353-L358 HydrophobicContact SD-CB 4.28Å; M353-L358 HydrophobicContact SD-CD1 4.38Å; M353-L361 HydrophobicContact CE-CD1 3.63Å; M353-L361 HydrophobicContact SD-CD1 4.25Å; M353-L409 HydrophobicContact CE-CD2 3.61Å; M353-L409 HydrophobicContact CG-CD2 4.2Å; M353-R412 HydrophobicContact CE-CG 4.12Å
354	D	98.2	Very high	98.4	Very high	24 Å²	24	33.3 Å²	33.3	13%	0.128	16%	0.162	C	C	.	.			trans	-88.3	173.9	175.9	71.9	43.6	0	0	0	112.2	Q352 T356 E357 L358 Y394 K398 Y399	Q352-D354 PolarHBondContact O-N 3.16Å; D354-T356 WeakPolarHBondContact OD1-CA 3.45Å; D354-T356 VanDerWaalsContact OD1-CB 3.31Å; D354-T356 WeakPolarHBondContact OD1-CB 3.34Å; D354-T356 PolarHBondContact OD1-N 3.12Å; D354-E357 PolarHBondContact N-OE2 2.58Å; D354-E357 WeakPolarHBondContact OD1-CG 3.49Å; D354-E357 PolarHBondContact OD1-N 3.17Å; D354-L358 PolarHBondContact O-N 3.12Å; D354-Y394 PolarHBondContact OD2-OH 3.18Å; D354-K398 IonicContact OD2-NZ 3.71Å; D354-K398 PolarHBondContact OD2-NZ 2.82Å; D354-Y399 PolarHBondContact OD2-OH 3.48Å
355	K	98.1	Very high	98.4	Very high	68 Å²	68	33.8 Å²	33.8	30%	0.296	17%	0.166	S	C	.	.	H	α-helix	trans	-71.2	-29.1	-177.7	-64.9	-175.5	-170.6	175.9	0	113.2	L230 L234 E237 G359	L230-K355 HydrophobicContact CD1-CB 3.75Å; L234-K355 HydrophobicContact CD2-CD 3.71Å; E237-K355 WeakPolarHBondContact OE1-CD 3.45Å; E237-K355 WeakPolarHBondContact OE1-CE 3.34Å; E237-K355 IonicContact OE1-NZ 2.69Å; E237-K355 PolarHBondContact OE1-NZ 2.89Å; E237-K355 IonicContact OE2-NZ 3.76Å; E237-K355 PolarHBondContact OE2-NZ 2.99Å; K355-G359 PolarHBondContact O-N 3.3Å
356	T	98.6	Very high	98.4	Very high	7 Å²	7	33.4 Å²	33.4	4%	0.043	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-46.1	176.2	-52.3	0	0	0	0	109.7	V226 D354 G359 C360 Y394	V226-T356 HydrophobicContact CB-CG2 3.76Å; V226-T356 HydrophobicContact CG2-CG2 4.35Å; D354-T356 WeakPolarHBondContact OD1-CA 3.45Å; D354-T356 VanDerWaalsContact OD1-CB 3.31Å; D354-T356 WeakPolarHBondContact OD1-CB 3.34Å; D354-T356 PolarHBondContact OD1-N 3.12Å; T356-G359 PolarHBondContact O-N 3.14Å; T356-C360 PolarHBondContact O-N 2.93Å; T356-C360 PolarHBondContact O-SG 2.92Å; T356-C360 VanDerWaalsContact O-SG 3.33Å; T356-Y394 VanDerWaalsContact CB-CZ 3.49Å; T356-Y394 VanDerWaalsContact CB-OH 3.24Å; T356-Y394 WeakPolarHBondContact CB-OH 3.46Å; T356-Y394 HydrophobicContact CG2-CD1 4.35Å; T356-Y394 HydrophobicContact CG2-CD2 4.03Å; T356-Y394 HydrophobicContact CG2-CE1 4.04Å; T356-Y394 HydrophobicContact CG2-CE2 3.64Å; T356-Y394 HydrophobicContact CG2-CG 4.33Å; T356-Y394 PolarHBondContact OG1-OH 3.28Å; T356-Y394 VanDerWaalsContact OG1-OH 3.04Å
357	E	98.8	Very high	98.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-43.5	176.9	-66.3	170.6	151.4	0	0	112	M353 D354 C360 L361 L391 Y394 Y399 R405 L409	M353-E357 WeakPolarHBondContact CA-OE2 3.31Å; M353-E357 HydrophobicContact CG-CB 3.98Å; D354-E357 PolarHBondContact N-OE2 2.58Å; D354-E357 WeakPolarHBondContact OD1-CG 3.49Å; D354-E357 PolarHBondContact OD1-N 3.17Å; E357-C360 PolarHBondContact O-N 3.46Å; E357-L361 WeakPolarHBondContact O-CG 3.32Å; E357-L361 PolarHBondContact O-N 3.48Å; E357-L391 HydrophobicContact CG-CD1 4.25Å; E357-Y394 HydrophobicContact CG-CD1 4.23Å; E357-Y394 HydrophobicContact CG-CE1 3.88Å; E357-Y399 WeakPolarHBondContact OE1-CE2 3.26Å; E357-R405 IonicContact OE1-CZ 2.67Å; E357-R405 IonicContact OE1-NE 3.77Å; E357-R405 PolarHBondContact OE1-NE 2.83Å; E357-R405 IonicContact OE1-NH2 3.6Å; E357-R405 PolarHBondContact OE1-NH2 3.36Å; E357-R405 IonicContact OE2-CZ 3.78Å; E357-R405 IonicContact OE2-NE 3.65Å; E357-R405 IonicContact OE2-NH2 3.52Å; E357-R405 PolarHBondContact OE2-NH2 3.01Å; E357-L409 HydrophobicContact CB-CD1 4.13Å; E357-L409 HydrophobicContact CB-CD2 4.02Å; E357-L409 HydrophobicContact CG-CD1 3.86Å; E357-L409 HydrophobicContact CG-CD2 4.42Å
358	L	98.7	Very high	98.4	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.026	13%	0.133	C	C	.	.	H	α-helix	trans	-57.1	-49.9	173	176.3	68.4	0	0	0	111	A302 H306 M348 M353 D354 C360 L361 R362	A302-L358 HydrophobicContact CB-CD1 4.28Å; H306-L358 HydrophobicContact CB-CD1 3.9Å; H306-L358 HydrophobicContact CB-CD2 3.57Å; H306-L358 HydrophobicContact CB-CG 4.29Å; M348-L358 HydrophobicContact CE-CD1 4.48Å; M353-L358 HydrophobicContact SD-CB 4.28Å; M353-L358 HydrophobicContact SD-CD1 4.38Å; D354-L358 PolarHBondContact O-N 3.12Å; L358-C360 VanDerWaalsContact C-N 3.33Å; L358-C360 PolarHBondContact O-N 3.44Å; L358-L361 PolarHBondContact O-N 3.36Å; L358-R362 HydrophobicContact CD1-CG 4.32Å; L358-R362 HydrophobicContact CG-CG 4.46Å; L358-R362 WeakPolarHBondContact O-CB 3.31Å; L358-R362 WeakPolarHBondContact O-CG 3.43Å; L358-R362 PolarHBondContact O-N 2.85Å
359	G	98.7	Very high	98.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.1	-42.1	-179.9	0	0	0	0	0	112.2	E233 K355 T356 R362 A363	E233-G359 WeakPolarHBondContact OE1-CA 3.28Å; K355-G359 PolarHBondContact O-N 3.3Å; T356-G359 PolarHBondContact O-N 3.14Å; G359-R362 PolarHBondContact O-N 3.49Å; G359-A363 WeakPolarHBondContact O-CB 3.29Å; G359-A363 PolarHBondContact O-N 3.44Å
360	C	98.8	Very high	98.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.8	-43.1	175.1	-69.3	0	0	0	0	112.2	T356 E357 L358 R362 A363 I364 V387 L391	T356-C360 PolarHBondContact O-N 2.93Å; T356-C360 PolarHBondContact O-SG 2.92Å; T356-C360 VanDerWaalsContact O-SG 3.33Å; E357-C360 PolarHBondContact O-N 3.46Å; L358-C360 VanDerWaalsContact C-N 3.33Å; L358-C360 PolarHBondContact O-N 3.44Å; C360-R362 VanDerWaalsContact C-N 3.32Å; C360-R362 PolarHBondContact O-N 3.31Å; C360-A363 PolarHBondContact O-N 3Å; C360-I364 WeakPolarHBondContact O-CG1 3.37Å; C360-I364 PolarHBondContact O-N 3.15Å; C360-V387 HydrophobicContact CB-CG1 4.1Å; C360-V387 WeakPolarHBondContact O-CG1 3.44Å; C360-L391 HydrophobicContact CB-CB 4.03Å; C360-L391 HydrophobicContact CB-CD1 3.77Å; C360-L391 HydrophobicContact CB-CD2 3.96Å; C360-L391 HydrophobicContact CB-CG 4.12Å
361	L	98.9	Very high	98.2	Very high	11 Å²	11	24.5 Å²	24.5	6%	0.058	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-40.5	175	-71	-178.5	0	0	0	111.7	M353 E357 L358 I364 V365 L391 L409 L410 R412 L413	M353-L361 HydrophobicContact CE-CD1 3.63Å; M353-L361 HydrophobicContact SD-CD1 4.25Å; E357-L361 WeakPolarHBondContact O-CG 3.32Å; E357-L361 PolarHBondContact O-N 3.48Å; L358-L361 PolarHBondContact O-N 3.36Å; L361-I364 HydrophobicContact CD2-CD1 4.23Å; L361-I364 PolarHBondContact O-N 3.01Å; L361-V365 WeakPolarHBondContact O-CG2 3.47Å; L361-V365 PolarHBondContact O-N 2.62Å; L361-V365 VanDerWaalsContact O-N 3.11Å; L361-L391 HydrophobicContact CD2-CD2 4.26Å; L361-L409 HydrophobicContact CD1-CB 4.32Å; L361-L409 HydrophobicContact CD1-CD2 4.22Å; L361-L409 HydrophobicContact CD2-CB 4.23Å; L361-L410 HydrophobicContact CD2-CD2 4.25Å; L361-R412 HydrophobicContact CD1-CB 4.48Å; L361-L413 HydrophobicContact CB-CD2 4.41Å; L361-L413 HydrophobicContact CD2-CD1 4.39Å; L361-L413 HydrophobicContact CD2-CD2 4.18Å; L361-L413 HydrophobicContact CD2-CG 4.24Å
362	R	98.8	Very high	98	Very high	6 Å²	6	32.4 Å²	32.4	2%	0.023	16%	0.158	C	C	.	.	H	α-helix	trans	-64.9	-39.8	173.6	-72.3	176.6	62.6	-172.5	-1.5	111.6	E233 W273 L299 A302 L358 G359 C360 I364 V365 L366	E233-R362 VanDerWaalsContact OE1-CD 3.32Å; E233-R362 WeakPolarHBondContact OE1-CD 3.46Å; E233-R362 IonicContact OE1-CZ 2.84Å; E233-R362 VanDerWaalsContact OE1-CZ 3.3Å; E233-R362 IonicContact OE1-NE 2.76Å; E233-R362 PolarHBondContact OE1-NE 2.94Å; E233-R362 IonicContact OE1-NH1 2.68Å; E233-R362 PolarHBondContact OE1-NH1 3.42Å; E233-R362 IonicContact OE2-CZ 3.76Å; E233-R362 IonicContact OE2-NH1 2.66Å; E233-R362 PolarHBondContact OE2-NH1 3.45Å; W273-R362 HydrophobicContact CH2-CB 3.68Å; W273-R362 HydrophobicContact CZ2-CB 3.5Å; L299-R362 HydrophobicContact CD2-CB 3.81Å; L299-R362 HydrophobicContact CD2-CG 4.26Å; L299-R362 WeakPolarHBondContact CD2-O 3.19Å; A302-R362 HydrophobicContact CB-CG 4.04Å; L358-R362 HydrophobicContact CD1-CG 4.32Å; L358-R362 HydrophobicContact CG-CG 4.46Å; L358-R362 WeakPolarHBondContact O-CB 3.31Å; L358-R362 WeakPolarHBondContact O-CG 3.43Å; L358-R362 PolarHBondContact O-N 2.85Å; G359-R362 PolarHBondContact O-N 3.49Å; C360-R362 VanDerWaalsContact C-N 3.32Å; C360-R362 PolarHBondContact O-N 3.31Å; R362-I364 PolarHBondContact O-N 3.46Å; R362-V365 WeakPolarHBondContact O-CB 3.38Å; R362-V365 PolarHBondContact O-N 2.89Å; R362-L366 WeakPolarHBondContact O-CB 3.38Å; R362-L366 PolarHBondContact O-N 3.14Å
363	A	98.8	Very high	97.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-37	175.4	0	0	0	0	0	112.3	I277 G359 C360 V365 L366 F367 V387	I277-A363 HydrophobicContact CG2-CB 4.42Å; G359-A363 WeakPolarHBondContact O-CB 3.29Å; G359-A363 PolarHBondContact O-N 3.44Å; C360-A363 PolarHBondContact O-N 3Å; A363-V365 VanDerWaalsContact C-N 3.33Å; A363-V365 PolarHBondContact O-N 3.16Å; A363-L366 WeakPolarHBondContact O-CB 3.46Å; A363-L366 PolarHBondContact O-N 3.29Å; A363-F367 VanDerWaalsContact O-CD2 3.27Å; A363-F367 WeakPolarHBondContact O-CD2 3.43Å; A363-F367 PolarHBondContact O-N 3.25Å; A363-V387 HydrophobicContact CB-CG1 4.04Å; A363-V387 HydrophobicContact CB-CG2 4.04Å
364	I	98.9	Very high	97.6	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-61.1	-42.2	172.1	-69.6	156.9	0	0	0	111.1	C360 L361 R362 R384 V387 Y388 L391 L410 L413	C360-I364 WeakPolarHBondContact O-CG1 3.37Å; C360-I364 PolarHBondContact O-N 3.15Å; L361-I364 HydrophobicContact CD2-CD1 4.23Å; L361-I364 PolarHBondContact O-N 3.01Å; R362-I364 PolarHBondContact O-N 3.46Å; I364-R384 HydrophobicContact CG2-CG 4.38Å; I364-R384 PolarHBondContact O-NE 3.49Å; I364-R384 VanDerWaalsContact O-NE 3.08Å; I364-R384 PolarHBondContact O-NH2 3.35Å; I364-V387 HydrophobicContact CD1-CG1 4.2Å; I364-V387 HydrophobicContact CG1-CB 4.19Å; I364-V387 HydrophobicContact CG1-CG1 3.7Å; I364-Y388 HydrophobicContact CB-CE1 4.39Å; I364-Y388 HydrophobicContact CD1-CD1 3.63Å; I364-Y388 HydrophobicContact CD1-CE1 3.56Å; I364-Y388 HydrophobicContact CG1-CD1 3.93Å; I364-Y388 HydrophobicContact CG1-CE1 3.7Å; I364-Y388 HydrophobicContact CG2-CE1 3.73Å; I364-L391 HydrophobicContact CD1-CD2 4.17Å; I364-L410 HydrophobicContact CD1-CD2 3.81Å; I364-L413 HydrophobicContact CG2-CD1 3.71Å
365	V	98.8	Very high	97.5	Very high	13 Å²	13	31.2 Å²	31.2	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-42.9	174.9	172.9	0	0	0	0	111.1	E298 L299 L361 R362 A363 L413 L416	E298-V365 HydrophobicContact CB-CG1 3.73Å; L299-V365 HydrophobicContact CD2-CB 4.01Å; L299-V365 HydrophobicContact CD2-CG1 3.93Å; L299-V365 HydrophobicContact CG-CG1 3.97Å; L361-V365 WeakPolarHBondContact O-CG2 3.47Å; L361-V365 PolarHBondContact O-N 2.62Å; L361-V365 VanDerWaalsContact O-N 3.11Å; R362-V365 WeakPolarHBondContact O-CB 3.38Å; R362-V365 PolarHBondContact O-N 2.89Å; A363-V365 VanDerWaalsContact C-N 3.33Å; A363-V365 PolarHBondContact O-N 3.16Å; V365-L413 HydrophobicContact CG2-CD2 3.75Å; V365-L416 HydrophobicContact CG2-CD2 4.06Å
366	L	98.8	Very high	97.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.6	-51.6	179.8	178.1	66.2	0	0	0	111.7	W273 A274 I277 F280 L291 L292 L299 R362 A363 N368	W273-L366 HydrophobicContact CH2-CB 4.15Å; W273-L366 HydrophobicContact CH2-CD2 4.04Å; W273-L366 HydrophobicContact CZ3-CB 4.19Å; W273-L366 HydrophobicContact CZ3-CD1 4.31Å; W273-L366 HydrophobicContact CZ3-CD2 3.77Å; W273-L366 HydrophobicContact CZ3-CG 4.31Å; A274-L366 HydrophobicContact CB-CD1 4.38Å; A274-L366 HydrophobicContact CB-CD2 4.23Å; I277-L366 HydrophobicContact CB-CD2 4.33Å; I277-L366 HydrophobicContact CG1-CD2 4.22Å; I277-L366 HydrophobicContact CG2-CD2 4.31Å; F280-L366 HydrophobicContact CD2-CD1 4.23Å; F280-L366 HydrophobicContact CD2-CD2 3.69Å; F280-L366 HydrophobicContact CD2-CG 4.07Å; F280-L366 HydrophobicContact CE2-CD1 3.77Å; F280-L366 HydrophobicContact CE2-CD2 4.1Å; F280-L366 HydrophobicContact CE2-CG 4.09Å; F280-L366 HydrophobicContact CG-CD2 4.23Å; F280-L366 HydrophobicContact CZ-CD1 4.4Å; L291-L366 WeakPolarHBondContact CD2-O 3.35Å; L292-L366 HydrophobicContact CD2-CD1 4.08Å; L299-L366 HydrophobicContact CD1-CD1 4.2Å; L299-L366 HydrophobicContact CD2-CB 4.44Å; R362-L366 WeakPolarHBondContact O-CB 3.38Å; R362-L366 PolarHBondContact O-N 3.14Å; A363-L366 WeakPolarHBondContact O-CB 3.46Å; A363-L366 PolarHBondContact O-N 3.29Å; L366-N368 VanDerWaalsContact C-N 3.27Å; L366-N368 PolarHBondContact O-N 3.01Å
367	F	98.8	Very high	97.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-80.5	73.7	-179.4	-65.2	-58.3	0	0	0	110.8	M224 I277 F280 L283 A363 P369 V380 L383 R384 V387	M224-F367 HydrophobicContact CE-CE2 4.03Å; M224-F367 HydrophobicContact CE-CZ 4.48Å; I277-F367 HydrophobicContact CG2-CE2 3.72Å; I277-F367 HydrophobicContact CG2-CZ 3.81Å; F280-F367 HydrophobicContact CB-CE1 4.29Å; F280-F367 HydrophobicContact CB-CZ 4.2Å; F280-F367 HydrophobicContact CD2-CE1 4.04Å; L283-F367 HydrophobicContact CD1-CD1 4.38Å; L283-F367 HydrophobicContact CD1-CE1 4.05Å; A363-F367 VanDerWaalsContact O-CD2 3.27Å; A363-F367 WeakPolarHBondContact O-CD2 3.43Å; A363-F367 PolarHBondContact O-N 3.25Å; F367-P369 VanDerWaalsContact O-CD 3.3Å; F367-P369 WeakPolarHBondContact O-CD 3.48Å; F367-V380 VanDerWaalsContact C-CG1 3.45Å; F367-V380 HydrophobicContact CB-CG1 4Å; F367-L383 HydrophobicContact CD1-CB 4.02Å; F367-L383 HydrophobicContact CD1-CD1 3.98Å; F367-L383 HydrophobicContact CD2-CB 4.23Å; F367-L383 HydrophobicContact CE1-CB 4.21Å; F367-L383 HydrophobicContact CE1-CD1 3.62Å; F367-L383 HydrophobicContact CE2-CB 4.39Å; F367-L383 HydrophobicContact CG-CB 4.04Å; F367-L383 HydrophobicContact CZ-CB 4.38Å; F367-L383 HydrophobicContact CZ-CD1 4.15Å; F367-R384 HydrophobicContact CB-CB 3.99Å; F367-R384 PolarHBondContact O-NE 2.91Å; F367-R384 PolarHBondContact O-NH2 3.05Å; F367-R384 VanDerWaalsContact O-NH2 3.08Å; F367-V387 HydrophobicContact CD2-CG2 4.12Å; F367-V387 HydrophobicContact CE2-CG2 4.27Å
368	N	98.3	Very high	97.2	Very high	13 Å²	13	37.5 Å²	37.5	7%	0.07	22%	0.224	C	C	.	.			trans	-96.7	100.6	179.9	-174.3	29.6	0	0	0	113.5	L291 L366 D370 A371 L374 R384	L291-N368 HydrophobicContact CD2-CB 4.4Å; L291-N368 WeakPolarHBondContact CD2-O 3.46Å; L366-N368 VanDerWaalsContact C-N 3.27Å; L366-N368 PolarHBondContact O-N 3.01Å; N368-D370 PolarHBondContact O-N 3.47Å; N368-D370 PolarHBondContact OD1-N 2.86Å; N368-A371 VanDerWaalsContact O-CB 3.28Å; N368-A371 WeakPolarHBondContact O-CB 3.27Å; N368-A371 PolarHBondContact O-N 2.96Å; N368-A371 VanDerWaalsContact O-N 3.12Å; N368-L374 WeakPolarHBondContact O-CD1 3.46Å; N368-R384 VanDerWaalsContact CA-NH2 3.27Å; N368-R384 PolarHBondContact OD1-NH2 3.35Å
369	P	97.8	Very high	97.1	Very high	18 Å²	18	41.2 Å²	41.2	12%	0.117	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.8	179.4	31.5	-35.8	0	0	0	112.9	F367 A371 P377 V380 E381 R384	F367-P369 VanDerWaalsContact O-CD 3.3Å; F367-P369 WeakPolarHBondContact O-CD 3.48Å; P369-A371 PolarHBondContact O-N 3.09Å; P369-P377 WeakPolarHBondContact CB-O 3.47Å; P369-V380 HydrophobicContact CB-CB 4.44Å; P369-V380 HydrophobicContact CB-CG1 4.42Å; P369-E381 HydrophobicContact CB-CB 3.89Å; P369-E381 HydrophobicContact CG-CB 4.09Å; P369-E381 HydrophobicContact CG-CG 4.44Å; P369-R384 VanDerWaalsContact CD-CZ 3.47Å; P369-R384 VanDerWaalsContact CD-NH1 3.31Å
370	D	96.6	Very high	97.1	Very high	132 Å²	132	41.2 Å²	41.2	71%	0.706	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.8	176.4	-58.1	-47.9	0	0	0	113	N368 K372	N368-D370 PolarHBondContact O-N 3.47Å; N368-D370 PolarHBondContact OD1-N 2.86Å; D370-K372 PolarHBondContact O-N 2.88Å
371	A	95.1	Very high	97	Very high	10 Å²	10	45.6 Å²	45.6	8%	0.083	26%	0.262	C	S	.	.	S	Bend	trans	-66	127.8	177.6	0	0	0	0	0	110.2	I290 L291 A294 N368 P369 G373 L374	I290-A371 HydrophobicContact CG2-CB 3.68Å; L291-A371 HydrophobicContact CD2-CB 4.28Å; A294-A371 HydrophobicContact CB-CB 3.96Å; N368-A371 VanDerWaalsContact O-CB 3.28Å; N368-A371 WeakPolarHBondContact O-CB 3.27Å; N368-A371 PolarHBondContact O-N 2.96Å; N368-A371 VanDerWaalsContact O-N 3.12Å; P369-A371 PolarHBondContact O-N 3.09Å; A371-G373 PolarHBondContact O-N 3.41Å; A371-L374 HydrophobicContact CB-CD1 3.99Å; A371-L374 HydrophobicContact CB-CG 4.14Å; A371-L374 WeakPolarHBondContact O-CG 3.34Å
372	K	92.8	Very high	97	Very high	198 Å²	198	46.9 Å²	46.9	86%	0.861	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	132.3	-175.5	-65.4	-178.2	-178.9	177.3	0	110.5	D370	D370-K372 PolarHBondContact O-N 2.88Å
373	G	93.2	Very high	96.9	Very high	65 Å²	65	47.1 Å²	47.1	67%	0.67	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.7	0.5	175.5	0	0	0	0	0	114.8	I290 A371	I290-G373 VanDerWaalsContact CD1-C 3.46Å; I290-G373 VanDerWaalsContact CD1-O 3.27Å; I290-G373 WeakPolarHBondContact CD1-O 3.41Å; A371-G373 PolarHBondContact O-N 3.41Å
374	L	94.8	Very high	96.9	Very high	20 Å²	20	48.9 Å²	48.9	11%	0.105	28%	0.283	C	S	.	.			trans	-59.1	139.4	175.2	-69.6	173.6	0	0	0	111.5	D287 I290 L291 N368 A371 P377 V380	D287-L374 HydrophobicContact CB-CD2 3.8Å; I290-L374 HydrophobicContact CB-CD2 4.24Å; I290-L374 HydrophobicContact CG2-CD2 3.84Å; I290-L374 HydrophobicContact CG2-CG 4.13Å; L291-L374 HydrophobicContact CD2-CD1 4.28Å; L291-L374 HydrophobicContact CD2-CD2 3.99Å; L291-L374 HydrophobicContact CG-CD2 4.03Å; N368-L374 WeakPolarHBondContact O-CD1 3.46Å; A371-L374 HydrophobicContact CB-CD1 3.99Å; A371-L374 HydrophobicContact CB-CG 4.14Å; A371-L374 WeakPolarHBondContact O-CG 3.34Å; L374-P377 HydrophobicContact CB-CG 4.09Å; L374-V380 HydrophobicContact CD1-CB 4.43Å; L374-V380 HydrophobicContact CD1-CG2 4.09Å; L374-V380 HydrophobicContact CD2-CG2 4.35Å
375	S	96.5	Very high	96.8	Very high	85 Å²	85	54.2 Å²	54.2	59%	0.594	31%	0.308	S	S	*	.	S	Bend	trans	-69.8	-42.3	177.7	-54.5	0	0	0	0	111.2	D287	D287-S375 WeakPolarHBondContact OD1-CB 3.31Å; D287-S375 PolarHBondContact OD1-N 3.41Å; D287-S375 PolarHBondContact OD1-OG 3.05Å; D287-S375 PolarHBondContact OD2-N 3.01Å; D287-S375 VanDerWaalsContact OD2-N 3.12Å
376	N	94.4	Very high	96.8	Very high	71 Å²	71	57 Å²	57	38%	0.38	32%	0.319	S	S	.	.			trans	-139.5	84.3	179.2	-171.7	6.1	0	0	0	111.9	S378 E379	N376-S378 PolarHBondContact O-N 2.94Å; N376-E379 HydrophobicContact CB-CB 4.22Å; N376-E379 WeakPolarHBondContact ND2-CB 3.29Å; N376-E379 PolarHBondContact ND2-OE2 3.31Å; N376-E379 PolarHBondContact O-N 2.97Å
377	P	96.6	Very high	96.8	Very high	58 Å²	58	57 Å²	57	38%	0.377	32%	0.319	S	S	.	.	H	α-helix	trans	-56	-33.2	179.5	-25.9	33.7	0	0	0	114.2	P369 L374 E379 V380 E381	P369-P377 WeakPolarHBondContact CB-O 3.47Å; L374-P377 HydrophobicContact CB-CG 4.09Å; P377-E379 VanDerWaalsContact C-N 3.33Å; P377-E379 PolarHBondContact O-N 2.88Å; P377-V380 PolarHBondContact O-N 3.32Å; P377-E381 PolarHBondContact O-N 3.5Å
378	S	96.5	Very high	96.7	Very high	78 Å²	78	60.6 Å²	60.6	55%	0.545	33%	0.333	S	S	.	.	H	α-helix	trans	-67.6	-31.2	-178.5	-60.1	0	0	0	0	113.1	N376 A382	N376-S378 PolarHBondContact O-N 2.94Å; S378-A382 WeakPolarHBondContact O-CB 3.5Å; S378-A382 PolarHBondContact O-N 2.94Å
379	E	96.8	Very high	96.7	Very high	83 Å²	83	62 Å²	62	39%	0.388	35%	0.347	S	S	.	.	H	α-helix	trans	-69.6	-41.7	174.6	179.2	174.3	-174.9	0	0	111.3	L283 N376 P377 E381 A382 L383	L283-E379 HydrophobicContact CD2-CG 4.04Å; N376-E379 HydrophobicContact CB-CB 4.22Å; N376-E379 WeakPolarHBondContact ND2-CB 3.29Å; N376-E379 PolarHBondContact ND2-OE2 3.31Å; N376-E379 PolarHBondContact O-N 2.97Å; P377-E379 VanDerWaalsContact C-N 3.33Å; P377-E379 PolarHBondContact O-N 2.88Å; E379-E381 VanDerWaalsContact C-N 3.33Å; E379-E381 PolarHBondContact O-N 3.42Å; E379-A382 PolarHBondContact O-N 2.95Å; E379-L383 WeakPolarHBondContact O-CG 3.18Å; E379-L383 PolarHBondContact O-N 2.97Å
380	V	98.4	Very high	96.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-63.5	-40.8	174.1	179.5	0	0	0	0	111.1	L291 F367 P369 L374 P377 L383 R384	L291-V380 HydrophobicContact CD1-CG1 4.38Å; L291-V380 HydrophobicContact CD1-CG2 4.26Å; L291-V380 HydrophobicContact CD2-CG1 3.9Å; F367-V380 VanDerWaalsContact C-CG1 3.45Å; F367-V380 HydrophobicContact CB-CG1 4Å; P369-V380 HydrophobicContact CB-CB 4.44Å; P369-V380 HydrophobicContact CB-CG1 4.42Å; L374-V380 HydrophobicContact CD1-CB 4.43Å; L374-V380 HydrophobicContact CD1-CG2 4.09Å; L374-V380 HydrophobicContact CD2-CG2 4.35Å; P377-V380 PolarHBondContact O-N 3.32Å; V380-L383 PolarHBondContact O-N 3.43Å; V380-R384 PolarHBondContact O-N 3.07Å
381	E	98.3	Very high	96.8	Very high	93 Å²	93	55.1 Å²	55.1	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-46.3	174.3	-174.1	168.1	-141	0	0	111.4	P369 P377 E379 L383 R384 E385	P369-E381 HydrophobicContact CB-CB 3.89Å; P369-E381 HydrophobicContact CG-CB 4.09Å; P369-E381 HydrophobicContact CG-CG 4.44Å; P377-E381 PolarHBondContact O-N 3.5Å; E379-E381 VanDerWaalsContact C-N 3.33Å; E379-E381 PolarHBondContact O-N 3.42Å; E381-L383 VanDerWaalsContact C-N 3.33Å; E381-L383 PolarHBondContact O-N 2.91Å; E381-R384 WeakPolarHBondContact O-CB 3.41Å; E381-R384 PolarHBondContact O-N 3.4Å; E381-R384 VanDerWaalsContact O-N 3.12Å; E381-E385 WeakPolarHBondContact O-CG 3.33Å; E381-E385 PolarHBondContact O-N 3.22Å
382	A	97.2	Very high	96.9	Very high	38 Å²	38	58.2 Å²	58.2	31%	0.314	32%	0.322	S	S	.	.	H	α-helix	trans	-60.5	-40.5	176.7	0	0	0	0	0	112.4	S378 E379 E385 K386	S378-A382 WeakPolarHBondContact O-CB 3.5Å; S378-A382 PolarHBondContact O-N 2.94Å; E379-A382 PolarHBondContact O-N 2.95Å; A382-E385 PolarHBondContact O-N 2.97Å; A382-K386 WeakPolarHBondContact O-CG 3.43Å; A382-K386 PolarHBondContact O-N 3.45Å
383	L	98.1	Very high	97.1	Very high	10 Å²	10	50 Å²	50	5%	0.052	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-41.6	174.2	-68.8	178.1	0	0	0	111.9	M224 H279 L283 F367 E379 V380 E381 K386 V387	M224-L383 HydrophobicContact CE-CD2 4.25Å; H279-L383 HydrophobicContact CB-CD1 4.11Å; H279-L383 HydrophobicContact CB-CD2 3.61Å; L283-L383 HydrophobicContact CD1-CD1 4.08Å; L283-L383 HydrophobicContact CD2-CD1 3.92Å; L283-L383 HydrophobicContact CG-CD1 4.17Å; F367-L383 HydrophobicContact CD1-CB 4.02Å; F367-L383 HydrophobicContact CD1-CD1 3.98Å; F367-L383 HydrophobicContact CD2-CB 4.23Å; F367-L383 HydrophobicContact CE1-CB 4.21Å; F367-L383 HydrophobicContact CE1-CD1 3.62Å; F367-L383 HydrophobicContact CE2-CB 4.39Å; F367-L383 HydrophobicContact CG-CB 4.04Å; F367-L383 HydrophobicContact CZ-CB 4.38Å; F367-L383 HydrophobicContact CZ-CD1 4.15Å; E379-L383 WeakPolarHBondContact O-CG 3.18Å; E379-L383 PolarHBondContact O-N 2.97Å; V380-L383 PolarHBondContact O-N 3.43Å; E381-L383 VanDerWaalsContact C-N 3.33Å; E381-L383 PolarHBondContact O-N 2.91Å; L383-K386 HydrophobicContact CD2-CD 4.27Å; L383-K386 WeakPolarHBondContact O-CB 3.23Å; L383-K386 PolarHBondContact O-N 2.9Å; L383-V387 WeakPolarHBondContact O-CG2 3.42Å; L383-V387 PolarHBondContact O-N 2.95Å; L383-V387 VanDerWaalsContact O-N 3.12Å
384	R	98.5	Very high	97.3	Very high	38 Å²	38	48.5 Å²	48.5	14%	0.143	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-42	174.2	176.7	-176.1	-86.1	-179.4	-3.3	111.7	I364 F367 N368 P369 V380 E381 K386 V387 Y388	I364-R384 HydrophobicContact CG2-CG 4.38Å; I364-R384 PolarHBondContact O-NE 3.49Å; I364-R384 VanDerWaalsContact O-NE 3.08Å; I364-R384 PolarHBondContact O-NH2 3.35Å; F367-R384 HydrophobicContact CB-CB 3.99Å; F367-R384 PolarHBondContact O-NE 2.91Å; F367-R384 PolarHBondContact O-NH2 3.05Å; F367-R384 VanDerWaalsContact O-NH2 3.08Å; N368-R384 VanDerWaalsContact CA-NH2 3.27Å; N368-R384 PolarHBondContact OD1-NH2 3.35Å; P369-R384 VanDerWaalsContact CD-CZ 3.47Å; P369-R384 VanDerWaalsContact CD-NH1 3.31Å; V380-R384 PolarHBondContact O-N 3.07Å; E381-R384 WeakPolarHBondContact O-CB 3.41Å; E381-R384 PolarHBondContact O-N 3.4Å; E381-R384 VanDerWaalsContact O-N 3.12Å; R384-K386 VanDerWaalsContact C-N 3.33Å; R384-K386 PolarHBondContact O-N 3.16Å; R384-V387 PolarHBondContact O-N 3Å; R384-V387 VanDerWaalsContact O-N 3.16Å; R384-Y388 HydrophobicContact CG-CD2 4.32Å; R384-Y388 HydrophobicContact CG-CE2 3.72Å; R384-Y388 PolarHBondContact O-N 3.41Å
385	E	97.5	Very high	97.5	Very high	116 Å²	116	47.8 Å²	47.8	54%	0.542	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-39.7	176.2	-72.4	-175.9	165.2	0	0	112.3	E381 A382 V387 Y388 A389	E381-E385 WeakPolarHBondContact O-CG 3.33Å; E381-E385 PolarHBondContact O-N 3.22Å; A382-E385 PolarHBondContact O-N 2.97Å; E385-V387 VanDerWaalsContact C-N 3.32Å; E385-V387 PolarHBondContact O-N 3.28Å; E385-Y388 WeakPolarHBondContact O-CB 3.23Å; E385-Y388 PolarHBondContact O-N 3.42Å; E385-Y388 VanDerWaalsContact O-N 3.15Å; E385-A389 PolarHBondContact O-N 3.04Å
386	K	97.5	Very high	97.5	Very high	71 Å²	71	49.9 Å²	49.9	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-60.2	-41.8	172.5	-67.2	169.4	-172.7	-179.5	0	111.6	D223 M224 A382 L383 R384 Y388 A389 S390	D223-K386 WeakPolarHBondContact OD2-CD 3.25Å; D223-K386 WeakPolarHBondContact OD2-CE 3.48Å; D223-K386 IonicContact OD2-NZ 2.74Å; D223-K386 PolarHBondContact OD2-NZ 2.83Å; M224-K386 HydrophobicContact CB-CB 3.78Å; M224-K386 HydrophobicContact CG-CB 4.35Å; A382-K386 WeakPolarHBondContact O-CG 3.43Å; A382-K386 PolarHBondContact O-N 3.45Å; L383-K386 HydrophobicContact CD2-CD 4.27Å; L383-K386 WeakPolarHBondContact O-CB 3.23Å; L383-K386 PolarHBondContact O-N 2.9Å; R384-K386 VanDerWaalsContact C-N 3.33Å; R384-K386 PolarHBondContact O-N 3.16Å; K386-Y388 VanDerWaalsContact C-N 3.34Å; K386-Y388 PolarHBondContact O-N 3.03Å; K386-A389 PolarHBondContact O-N 2.97Å; K386-S390 WeakPolarHBondContact O-CB 3.38Å; K386-S390 PolarHBondContact O-N 3.16Å; K386-S390 PolarHBondContact O-OG 3.32Å
387	V	98.4	Very high	97.6	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-38.8	174.5	-176.6	0	0	0	0	111.6	M224 C360 A363 I364 F367 L383 R384 E385 S390 L391	M224-V387 HydrophobicContact CE-CG2 3.95Å; M224-V387 HydrophobicContact CG-CB 4.45Å; M224-V387 HydrophobicContact CG-CG2 3.72Å; M224-V387 HydrophobicContact SD-CG2 3.87Å; C360-V387 HydrophobicContact CB-CG1 4.1Å; C360-V387 WeakPolarHBondContact O-CG1 3.44Å; A363-V387 HydrophobicContact CB-CG1 4.04Å; A363-V387 HydrophobicContact CB-CG2 4.04Å; I364-V387 HydrophobicContact CD1-CG1 4.2Å; I364-V387 HydrophobicContact CG1-CB 4.19Å; I364-V387 HydrophobicContact CG1-CG1 3.7Å; F367-V387 HydrophobicContact CD2-CG2 4.12Å; F367-V387 HydrophobicContact CE2-CG2 4.27Å; L383-V387 WeakPolarHBondContact O-CG2 3.42Å; L383-V387 PolarHBondContact O-N 2.95Å; L383-V387 VanDerWaalsContact O-N 3.12Å; R384-V387 PolarHBondContact O-N 3Å; R384-V387 VanDerWaalsContact O-N 3.16Å; E385-V387 VanDerWaalsContact C-N 3.32Å; E385-V387 PolarHBondContact O-N 3.28Å; V387-S390 PolarHBondContact O-N 2.84Å; V387-L391 VanDerWaalsContact O-CB 3.31Å; V387-L391 WeakPolarHBondContact O-CB 3.36Å; V387-L391 PolarHBondContact O-N 3.29Å
388	Y	98.4	Very high	97.6	Very high	75 Å²	75	55.1 Å²	55.1	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-59.9	-48.1	173.9	-69	-40.5	0	0	0	111.8	I364 R384 E385 K386 L391 E392 F406 L410	I364-Y388 HydrophobicContact CB-CE1 4.39Å; I364-Y388 HydrophobicContact CD1-CD1 3.63Å; I364-Y388 HydrophobicContact CD1-CE1 3.56Å; I364-Y388 HydrophobicContact CG1-CD1 3.93Å; I364-Y388 HydrophobicContact CG1-CE1 3.7Å; I364-Y388 HydrophobicContact CG2-CE1 3.73Å; R384-Y388 HydrophobicContact CG-CD2 4.32Å; R384-Y388 HydrophobicContact CG-CE2 3.72Å; R384-Y388 PolarHBondContact O-N 3.41Å; E385-Y388 WeakPolarHBondContact O-CB 3.23Å; E385-Y388 PolarHBondContact O-N 3.42Å; E385-Y388 VanDerWaalsContact O-N 3.15Å; K386-Y388 VanDerWaalsContact C-N 3.34Å; K386-Y388 PolarHBondContact O-N 3.03Å; Y388-L391 PolarHBondContact O-N 3.38Å; Y388-E392 WeakPolarHBondContact O-CB 3.35Å; Y388-E392 PolarHBondContact O-N 2.67Å; Y388-F406 HydrophobicContact CD1-CZ 4.49Å; Y388-F406 WeakPolarHBondContact O-CE2 3.37Å; Y388-L410 HydrophobicContact CD1-CD2 4.02Å; Y388-L410 HydrophobicContact CE1-CD1 4.5Å; Y388-L410 HydrophobicContact CE1-CD2 3.77Å
389	A	97.4	Very high	97.6	Very high	44 Å²	44	53.6 Å²	53.6	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-60.5	-47.3	178.5	0	0	0	0	0	111.6	E385 K386 L391 E392 S393	E385-A389 PolarHBondContact O-N 3.04Å; K386-A389 PolarHBondContact O-N 2.97Å; A389-L391 PolarHBondContact O-N 3.2Å; A389-E392 PolarHBondContact O-N 3.11Å; A389-S393 VanDerWaalsContact O-CB 3.29Å; A389-S393 WeakPolarHBondContact O-CB 3.4Å; A389-S393 PolarHBondContact O-N 2.96Å
390	S	97.6	Very high	97.6	Very high	4 Å²	4	54 Å²	54	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-43.4	178.6	-65.8	0	0	0	0	112.7	M224 K386 V387 S393 Y394	M224-S390 VanDerWaalsContact O-CB 3.31Å; M224-S390 WeakPolarHBondContact O-CB 3.49Å; M224-S390 PolarHBondContact O-OG 3.43Å; K386-S390 WeakPolarHBondContact O-CB 3.38Å; K386-S390 PolarHBondContact O-N 3.16Å; K386-S390 PolarHBondContact O-OG 3.32Å; V387-S390 PolarHBondContact O-N 2.84Å; S390-S393 PolarHBondContact O-N 3.25Å; S390-Y394 WeakPolarHBondContact O-CB 3.46Å; S390-Y394 PolarHBondContact O-N 3.43Å
391	L	98.3	Very high	97.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-39.4	177.3	-179.5	59.6	0	0	0	112.1	E357 C360 L361 I364 V387 Y388 A389 Y394 T395 F406 L409	E357-L391 HydrophobicContact CG-CD1 4.25Å; C360-L391 HydrophobicContact CB-CB 4.03Å; C360-L391 HydrophobicContact CB-CD1 3.77Å; C360-L391 HydrophobicContact CB-CD2 3.96Å; C360-L391 HydrophobicContact CB-CG 4.12Å; L361-L391 HydrophobicContact CD2-CD2 4.26Å; I364-L391 HydrophobicContact CD1-CD2 4.17Å; V387-L391 VanDerWaalsContact O-CB 3.31Å; V387-L391 WeakPolarHBondContact O-CB 3.36Å; V387-L391 PolarHBondContact O-N 3.29Å; Y388-L391 PolarHBondContact O-N 3.38Å; A389-L391 PolarHBondContact O-N 3.2Å; L391-Y394 PolarHBondContact O-N 3Å; L391-T395 HydrophobicContact CD1-CG2 4.09Å; L391-T395 HydrophobicContact CG-CG2 4.5Å; L391-T395 VanDerWaalsContact O-CG2 3.31Å; L391-T395 WeakPolarHBondContact O-CG2 3.41Å; L391-T395 PolarHBondContact O-N 3.16Å; L391-T395 PolarHBondContact O-OG1 2.91Å; L391-F406 HydrophobicContact CB-CD2 4.41Å; L391-F406 HydrophobicContact CB-CE2 4.13Å; L391-F406 HydrophobicContact CD2-CD2 4.24Å; L391-F406 HydrophobicContact CD2-CE2 4.15Å; L391-F406 HydrophobicContact CG-CD2 3.98Å; L391-F406 HydrophobicContact CG-CE2 4.08Å; L391-L409 HydrophobicContact CD1-CD1 4.12Å; L391-L409 HydrophobicContact CD2-CD1 4.47Å
392	E	97.8	Very high	97.5	Very high	76 Å²	76	61 Å²	61	36%	0.355	30%	0.304	S	S	.	.	H	α-helix	trans	-62.9	-46	175.6	-168.6	-173.6	-175.3	0	0	110.8	Y388 A389 T395 K396 F406	Y388-E392 WeakPolarHBondContact O-CB 3.35Å; Y388-E392 PolarHBondContact O-N 2.67Å; A389-E392 PolarHBondContact O-N 3.11Å; E392-T395 PolarHBondContact O-N 3.37Å; E392-T395 PolarHBondContact O-OG1 3.04Å; E392-K396 HydrophobicContact CG-CD 4.3Å; E392-K396 WeakPolarHBondContact O-CB 3.44Å; E392-K396 WeakPolarHBondContact O-CG 3.37Å; E392-K396 PolarHBondContact O-N 3.18Å; E392-K396 VanDerWaalsContact OE1-CE 3.23Å; E392-K396 WeakPolarHBondContact OE1-CE 3.29Å; E392-K396 IonicContact OE1-NZ 2.83Å; E392-K396 PolarHBondContact OE1-NZ 3.43Å; E392-K396 IonicContact OE2-NZ 2.97Å; E392-F406 HydrophobicContact CB-CD1 4.38Å; E392-F406 HydrophobicContact CB-CD2 3.87Å; E392-F406 HydrophobicContact CB-CE1 4.32Å; E392-F406 HydrophobicContact CB-CE2 3.81Å; E392-F406 HydrophobicContact CB-CG 4.15Å; E392-F406 HydrophobicContact CB-CZ 4.04Å; E392-F406 HydrophobicContact CG-CD1 4.12Å; E392-F406 HydrophobicContact CG-CD2 4.34Å; E392-F406 HydrophobicContact CG-CE1 4.35Å; E392-F406 HydrophobicContact CG-CG 4.11Å
393	S	96.8	Very high	97.4	Very high	26 Å²	26	65.2 Å²	65.2	18%	0.182	33%	0.328	C	S	.	.	H	α-helix	trans	-57.7	-49.7	174.9	-171.6	0	0	0	0	111.4	N221 A389 S390 T395 K396 Q397	N221-S393 PolarHBondContact ND2-OG 2.88Å; N221-S393 WeakPolarHBondContact OD1-CB 3.26Å; N221-S393 PolarHBondContact OD1-OG 3.03Å; A389-S393 VanDerWaalsContact O-CB 3.29Å; A389-S393 WeakPolarHBondContact O-CB 3.4Å; A389-S393 PolarHBondContact O-N 2.96Å; S390-S393 PolarHBondContact O-N 3.25Å; S393-T395 PolarHBondContact O-N 3.34Å; S393-K396 PolarHBondContact O-N 2.91Å; S393-Q397 VanDerWaalsContact O-CG 3.29Å; S393-Q397 WeakPolarHBondContact O-CG 3.3Å; S393-Q397 PolarHBondContact O-N 3.27Å; S393-Q397 PolarHBondContact OG-NE2 3.34Å
394	Y	97.8	Very high	97.3	Very high	32 Å²	32	66.4 Å²	66.4	13%	0.125	34%	0.343	C	S	.	.	H	α-helix	trans	-57.7	-48.9	177.8	179.6	-99.2	0	0	0	112.6	V226 D354 T356 E357 S390 L391 K396 Q397 K398 Y399	V226-Y394 HydrophobicContact CB-CD2 4.46Å; V226-Y394 HydrophobicContact CG2-CD2 3.88Å; V226-Y394 HydrophobicContact CG2-CE2 4.45Å; D354-Y394 PolarHBondContact OD2-OH 3.18Å; T356-Y394 VanDerWaalsContact CB-CZ 3.49Å; T356-Y394 VanDerWaalsContact CB-OH 3.24Å; T356-Y394 WeakPolarHBondContact CB-OH 3.46Å; T356-Y394 HydrophobicContact CG2-CD1 4.35Å; T356-Y394 HydrophobicContact CG2-CD2 4.03Å; T356-Y394 HydrophobicContact CG2-CE1 4.04Å; T356-Y394 HydrophobicContact CG2-CE2 3.64Å; T356-Y394 HydrophobicContact CG2-CG 4.33Å; T356-Y394 PolarHBondContact OG1-OH 3.28Å; T356-Y394 VanDerWaalsContact OG1-OH 3.04Å; E357-Y394 HydrophobicContact CG-CD1 4.23Å; E357-Y394 HydrophobicContact CG-CE1 3.88Å; S390-Y394 WeakPolarHBondContact O-CB 3.46Å; S390-Y394 PolarHBondContact O-N 3.43Å; L391-Y394 PolarHBondContact O-N 3Å; Y394-K396 PolarHBondContact O-N 2.97Å; Y394-Q397 PolarHBondContact O-N 3.31Å; Y394-K398 HydrophobicContact CE1-CB 4.45Å; Y394-K398 HydrophobicContact CE1-CD 3.73Å; Y394-K398 HydrophobicContact CE2-CD 3.99Å; Y394-K398 WeakPolarHBondContact O-CB 3.26Å; Y394-K398 PolarHBondContact O-N 3.09Å; Y394-K398 WeakPolarHBondContact OH-CD 3.14Å; Y394-K398 PolarHBondContact OH-NZ 3.42Å; Y394-Y399 HydrophobicContact CE1-CE2 4.26Å
395	T	97.9	Very high	97.3	Very high	6 Å²	6	64.8 Å²	64.8	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-66.3	-37.7	-178.2	53.5	0	0	0	0	112.4	L391 E392 S393 Q397 Y399 R405 L409	L391-T395 HydrophobicContact CD1-CG2 4.09Å; L391-T395 HydrophobicContact CG-CG2 4.5Å; L391-T395 VanDerWaalsContact O-CG2 3.31Å; L391-T395 WeakPolarHBondContact O-CG2 3.41Å; L391-T395 PolarHBondContact O-N 3.16Å; L391-T395 PolarHBondContact O-OG1 2.91Å; E392-T395 PolarHBondContact O-N 3.37Å; E392-T395 PolarHBondContact O-OG1 3.04Å; S393-T395 PolarHBondContact O-N 3.34Å; T395-Q397 VanDerWaalsContact C-N 3.35Å; T395-Y399 CarbonylContact O-C 3.54Å; T395-Y399 WeakPolarHBondContact O-CA 3.37Å; T395-Y399 WeakPolarHBondContact O-CB 3.31Å; T395-Y399 PolarHBondContact O-N 2.92Å; T395-R405 HydrophobicContact CG2-CG 4.3Å; T395-L409 HydrophobicContact CG2-CD1 3.65Å
396	K	96.8	Very high	97.3	Very high	128 Å²	128	61.2 Å²	61.2	56%	0.557	32%	0.32	S	S	*	.	H	α-helix	trans	-63	-39.6	173.7	-74.8	173	-177.7	166.3	0	112.3	E392 S393 Y394	E392-K396 HydrophobicContact CG-CD 4.3Å; E392-K396 WeakPolarHBondContact O-CB 3.44Å; E392-K396 WeakPolarHBondContact O-CG 3.37Å; E392-K396 PolarHBondContact O-N 3.18Å; E392-K396 VanDerWaalsContact OE1-CE 3.23Å; E392-K396 WeakPolarHBondContact OE1-CE 3.29Å; E392-K396 IonicContact OE1-NZ 2.83Å; E392-K396 PolarHBondContact OE1-NZ 3.43Å; E392-K396 IonicContact OE2-NZ 2.97Å; S393-K396 PolarHBondContact O-N 2.91Å; Y394-K396 PolarHBondContact O-N 2.97Å
397	Q	96.3	Very high	97.4	Very high	138 Å²	138	60.3 Å²	60.3	65%	0.645	33%	0.325	S	S	*	.	H	α-helix	trans	-76.7	-47.4	-178.2	-69.3	176.6	41.5	0	0	112.6	S393 Y394 T395	S393-Q397 VanDerWaalsContact O-CG 3.29Å; S393-Q397 WeakPolarHBondContact O-CG 3.3Å; S393-Q397 PolarHBondContact O-N 3.27Å; S393-Q397 PolarHBondContact OG-NE2 3.34Å; Y394-Q397 PolarHBondContact O-N 3.31Å; T395-Q397 VanDerWaalsContact C-N 3.35Å
398	K	97.5	Very high	97.3	Very high	102 Å²	102	66.3 Å²	66.3	44%	0.443	35%	0.351	S	S	.	.	H	α-helix	trans	-83.1	-29.5	-174.4	-171.6	173.1	-178.5	-172.1	0	113.6	D354 Y394 P400	D354-K398 IonicContact OD2-NZ 3.71Å; D354-K398 PolarHBondContact OD2-NZ 2.82Å; Y394-K398 HydrophobicContact CE1-CB 4.45Å; Y394-K398 HydrophobicContact CE1-CD 3.73Å; Y394-K398 HydrophobicContact CE2-CD 3.99Å; Y394-K398 WeakPolarHBondContact O-CB 3.26Å; Y394-K398 PolarHBondContact O-N 3.09Å; Y394-K398 WeakPolarHBondContact OH-CD 3.14Å; Y394-K398 PolarHBondContact OH-NZ 3.42Å; K398-P400 WeakPolarHBondContact O-CD 3.37Å
399	Y	97.1	Very high	97.4	Very high	46 Å²	46	62.8 Å²	62.8	18%	0.18	34%	0.337	C	S	.	.			trans	-127.9	59	-176	-57.2	-82.3	0	0	0	112	D354 E357 Y394 T395 D401 Q402 R405	D354-Y399 PolarHBondContact OD2-OH 3.48Å; E357-Y399 WeakPolarHBondContact OE1-CE2 3.26Å; Y394-Y399 HydrophobicContact CE1-CE2 4.26Å; T395-Y399 CarbonylContact O-C 3.54Å; T395-Y399 WeakPolarHBondContact O-CA 3.37Å; T395-Y399 WeakPolarHBondContact O-CB 3.31Å; T395-Y399 PolarHBondContact O-N 2.92Å; Y399-D401 PolarHBondContact O-N 2.93Å; Y399-D401 VanDerWaalsContact O-N 3.16Å; Y399-Q402 PolarHBondContact O-N 3.46Å; Y399-R405 VanDerWaalsContact CB-CD 3.48Å; Y399-R405 VanDerWaalsContact CE2-NE 3.3Å
400	P	96.9	Very high	97.4	Very high	90 Å²	90	62.8 Å²	62.8	58%	0.584	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-29.4	-176.5	25.4	-34.9	0	0	0	113	K398 Q402	K398-P400 WeakPolarHBondContact O-CD 3.37Å; P400-Q402 PolarHBondContact O-N 3.25Å
401	D	97.3	Very high	97.5	Very high	155 Å²	155	67.7 Å²	67.7	83%	0.829	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-6.2	178.5	-58.7	-44.3	0	0	0	113.8	Y399 P403	Y399-D401 PolarHBondContact O-N 2.93Å; Y399-D401 VanDerWaalsContact O-N 3.16Å; D401-P403 VanDerWaalsContact C-CD 3.49Å; D401-P403 WeakPolarHBondContact O-CD 3.41Å
402	Q	96.8	Very high	97.5	Very high	86 Å²	86	70.3 Å²	70.3	40%	0.402	37%	0.366	S	S	.	.			trans	-122.6	69.9	-177	-59.2	-178.7	38	0	0	111.3	Y399 P400 G404 R405	Y399-Q402 PolarHBondContact O-N 3.46Å; P400-Q402 PolarHBondContact O-N 3.25Å; Q402-G404 PolarHBondContact O-N 3.42Å; Q402-R405 HydrophobicContact CB-CB 3.94Å; Q402-R405 WeakPolarHBondContact O-CB 3.39Å; Q402-R405 PolarHBondContact O-N 2.92Å
403	P	94	Very high	97.5	Very high	127 Å²	127	68.1 Å²	68.1	83%	0.825	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.7	-175.2	23.6	-34.6	0	0	0	113.7	D401	D401-P403 VanDerWaalsContact C-CD 3.49Å; D401-P403 WeakPolarHBondContact O-CD 3.41Å
404	G	96.5	Very high	97.6	Very high	35 Å²	35	70.8 Å²	70.8	36%	0.361	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	5.2	175.7	0	0	0	0	0	115.2	Q402 A407 K408	Q402-G404 PolarHBondContact O-N 3.42Å; G404-A407 PolarHBondContact O-N 3.39Å; G404-K408 WeakPolarHBondContact O-CB 3.28Å; G404-K408 VanDerWaalsContact O-CG 3.31Å; G404-K408 WeakPolarHBondContact O-CG 3.49Å; G404-K408 PolarHBondContact O-N 3.47Å
405	R	98.3	Very high	97.6	Very high	4 Å²	4	69.9 Å²	69.9	2%	0.015	37%	0.373	C	S	.	.	H	α-helix	trans	-64.8	-46.8	-172.6	-171.7	169.9	-178.2	86.7	2.3	112.6	M351 Q352 E357 T395 Y399 Q402 A407 K408 L409	M351-R405 PolarHBondContact O-NH1 3.07Å; M351-R405 PolarHBondContact O-NH2 2.9Å; Q352-R405 PolarHBondContact O-NH2 3.01Å; Q352-R405 VanDerWaalsContact O-NH2 3.08Å; E357-R405 IonicContact OE1-CZ 2.67Å; E357-R405 IonicContact OE1-NE 3.77Å; E357-R405 PolarHBondContact OE1-NE 2.83Å; E357-R405 IonicContact OE1-NH2 3.6Å; E357-R405 PolarHBondContact OE1-NH2 3.36Å; E357-R405 IonicContact OE2-CZ 3.78Å; E357-R405 IonicContact OE2-NE 3.65Å; E357-R405 IonicContact OE2-NH2 3.52Å; E357-R405 PolarHBondContact OE2-NH2 3.01Å; T395-R405 HydrophobicContact CG2-CG 4.3Å; Y399-R405 VanDerWaalsContact CB-CD 3.48Å; Y399-R405 VanDerWaalsContact CE2-NE 3.3Å; Q402-R405 HydrophobicContact CB-CB 3.94Å; Q402-R405 WeakPolarHBondContact O-CB 3.39Å; Q402-R405 PolarHBondContact O-N 2.92Å; R405-A407 PolarHBondContact O-N 2.72Å; R405-K408 PolarHBondContact O-N 3.17Å; R405-K408 VanDerWaalsContact O-N 3.16Å; R405-L409 HydrophobicContact CG-CD1 4.27Å; R405-L409 WeakPolarHBondContact O-CG 3.41Å; R405-L409 PolarHBondContact O-N 3.08Å
406	F	98.6	Very high	97.6	Very high	41 Å²	41	70.1 Å²	70.1	18%	0.18	37%	0.374	C	S	.	.	H	α-helix	trans	-52	-53.2	175.1	178.1	-113.6	0	0	0	112	Y388 L391 E392 K408 L409 L410	Y388-F406 HydrophobicContact CD1-CZ 4.49Å; Y388-F406 WeakPolarHBondContact O-CE2 3.37Å; L391-F406 HydrophobicContact CB-CD2 4.41Å; L391-F406 HydrophobicContact CB-CE2 4.13Å; L391-F406 HydrophobicContact CD2-CD2 4.24Å; L391-F406 HydrophobicContact CD2-CE2 4.15Å; L391-F406 HydrophobicContact CG-CD2 3.98Å; L391-F406 HydrophobicContact CG-CE2 4.08Å; E392-F406 HydrophobicContact CB-CD1 4.38Å; E392-F406 HydrophobicContact CB-CD2 3.87Å; E392-F406 HydrophobicContact CB-CE1 4.32Å; E392-F406 HydrophobicContact CB-CE2 3.81Å; E392-F406 HydrophobicContact CB-CG 4.15Å; E392-F406 HydrophobicContact CB-CZ 4.04Å; E392-F406 HydrophobicContact CG-CD1 4.12Å; E392-F406 HydrophobicContact CG-CD2 4.34Å; E392-F406 HydrophobicContact CG-CE1 4.35Å; E392-F406 HydrophobicContact CG-CG 4.11Å; F406-K408 PolarHBondContact O-N 3.32Å; F406-L409 WeakPolarHBondContact O-CB 3.39Å; F406-L409 PolarHBondContact O-N 3.05Å; F406-L410 HydrophobicContact CD1-CD1 4.26Å; F406-L410 HydrophobicContact CE1-CD1 3.63Å; F406-L410 HydrophobicContact CE1-CG 4.49Å; F406-L410 HydrophobicContact CE2-CD1 4.14Å; F406-L410 HydrophobicContact CE2-CD2 4.5Å; F406-L410 HydrophobicContact CE2-CG 4.32Å; F406-L410 HydrophobicContact CZ-CD1 3.57Å; F406-L410 HydrophobicContact CZ-CG 4.24Å; F406-L410 PolarHBondContact O-N 3.06Å
407	A	98.4	Very high	97.7	Very high	51 Å²	51	69.1 Å²	69.1	42%	0.421	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-41.8	178.8	0	0	0	0	0	112.3	G404 R405 L409 L410 L411	G404-A407 PolarHBondContact O-N 3.39Å; R405-A407 PolarHBondContact O-N 2.72Å; A407-L409 VanDerWaalsContact C-N 3.32Å; A407-L409 PolarHBondContact O-N 3.42Å; A407-L410 PolarHBondContact O-N 2.98Å; A407-L411 WeakPolarHBondContact O-CB 3.27Å; A407-L411 VanDerWaalsContact O-CG 3.27Å; A407-L411 WeakPolarHBondContact O-CG 3.47Å; A407-L411 PolarHBondContact O-N 2.91Å
408	K	98.1	Very high	97.8	Very high	127 Å²	127	65.1 Å²	65.1	55%	0.552	35%	0.354	S	S	*	.	H	α-helix	trans	-61.8	-37.7	177.2	-76.9	176.3	-179.4	179.9	0	112.7	M351 G404 R405 F406 L411 R412	M351-K408 HydrophobicContact CE-CB 4.19Å; G404-K408 WeakPolarHBondContact O-CB 3.28Å; G404-K408 VanDerWaalsContact O-CG 3.31Å; G404-K408 WeakPolarHBondContact O-CG 3.49Å; G404-K408 PolarHBondContact O-N 3.47Å; R405-K408 PolarHBondContact O-N 3.17Å; R405-K408 VanDerWaalsContact O-N 3.16Å; F406-K408 PolarHBondContact O-N 3.32Å; K408-L411 PolarHBondContact O-N 3.21Å; K408-R412 PolarHBondContact O-NE 3.01Å
409	L	98.8	Very high	97.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64	-50.4	174.5	-71.1	168	0	0	0	110.6	M351 M353 E357 L361 L391 T395 R405 F406 A407 L411 R412	M351-L409 HydrophobicContact CE-CD2 3.34Å; M351-L409 HydrophobicContact CE-CG 3.67Å; M351-L409 HydrophobicContact SD-CD2 4.09Å; M353-L409 HydrophobicContact CE-CD2 3.61Å; M353-L409 HydrophobicContact CG-CD2 4.2Å; E357-L409 HydrophobicContact CB-CD1 4.13Å; E357-L409 HydrophobicContact CB-CD2 4.02Å; E357-L409 HydrophobicContact CG-CD1 3.86Å; E357-L409 HydrophobicContact CG-CD2 4.42Å; L361-L409 HydrophobicContact CD1-CB 4.32Å; L361-L409 HydrophobicContact CD1-CD2 4.22Å; L361-L409 HydrophobicContact CD2-CB 4.23Å; L391-L409 HydrophobicContact CD1-CD1 4.12Å; L391-L409 HydrophobicContact CD2-CD1 4.47Å; T395-L409 HydrophobicContact CG2-CD1 3.65Å; R405-L409 HydrophobicContact CG-CD1 4.27Å; R405-L409 WeakPolarHBondContact O-CG 3.41Å; R405-L409 PolarHBondContact O-N 3.08Å; F406-L409 WeakPolarHBondContact O-CB 3.39Å; F406-L409 PolarHBondContact O-N 3.05Å; A407-L409 VanDerWaalsContact C-N 3.32Å; A407-L409 PolarHBondContact O-N 3.42Å; L409-L411 PolarHBondContact O-N 3.45Å; L409-R412 VanDerWaalsContact O-CB 3.23Å; L409-R412 WeakPolarHBondContact O-CB 3.37Å; L409-R412 WeakPolarHBondContact O-CG 3.42Å; L409-R412 PolarHBondContact O-N 3.36Å
410	L	98.7	Very high	97.8	Very high	44 Å²	44	58.1 Å²	58.1	23%	0.23	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-35.2	177.8	-66	-173.9	0	0	0	112.5	L361 I364 Y388 F406 A407 R412 L413 P414	L361-L410 HydrophobicContact CD2-CD2 4.25Å; I364-L410 HydrophobicContact CD1-CD2 3.81Å; Y388-L410 HydrophobicContact CD1-CD2 4.02Å; Y388-L410 HydrophobicContact CE1-CD1 4.5Å; Y388-L410 HydrophobicContact CE1-CD2 3.77Å; F406-L410 HydrophobicContact CD1-CD1 4.26Å; F406-L410 HydrophobicContact CE1-CD1 3.63Å; F406-L410 HydrophobicContact CE1-CG 4.49Å; F406-L410 HydrophobicContact CE2-CD1 4.14Å; F406-L410 HydrophobicContact CE2-CD2 4.5Å; F406-L410 HydrophobicContact CE2-CG 4.32Å; F406-L410 HydrophobicContact CZ-CD1 3.57Å; F406-L410 HydrophobicContact CZ-CG 4.24Å; F406-L410 PolarHBondContact O-N 3.06Å; A407-L410 PolarHBondContact O-N 2.98Å; L410-R412 PolarHBondContact O-N 3.39Å; L410-L413 HydrophobicContact CD2-CD1 4.1Å; L410-L413 WeakPolarHBondContact O-CB 3.2Å; L410-L413 WeakPolarHBondContact O-CG 3.3Å; L410-L413 PolarHBondContact O-N 3.37Å; L410-P414 WeakPolarHBondContact O-CD 3.07Å
411	L	98.5	Very high	97.7	Very high	107 Å²	107	58.1 Å²	58.1	56%	0.56	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-1.6	174.8	-72.2	172.2	0	0	0	114.1	A407 K408 L409	A407-L411 WeakPolarHBondContact O-CB 3.27Å; A407-L411 VanDerWaalsContact O-CG 3.27Å; A407-L411 WeakPolarHBondContact O-CG 3.47Å; A407-L411 PolarHBondContact O-N 2.91Å; K408-L411 PolarHBondContact O-N 3.21Å; L409-L411 PolarHBondContact O-N 3.45Å
412	R	98.4	Very high	97.5	Very high	55 Å²	55	54.4 Å²	54.4	21%	0.208	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-27.9	168	-57.2	-57.3	84.5	-147.1	-2.9	112.2	E343 M353 L361 K408 L409 L410 A415 L416	E343-R412 PolarHBondContact O-NH1 2.93Å; M353-R412 HydrophobicContact CE-CG 4.12Å; L361-R412 HydrophobicContact CD1-CB 4.48Å; K408-R412 PolarHBondContact O-NE 3.01Å; L409-R412 VanDerWaalsContact O-CB 3.23Å; L409-R412 WeakPolarHBondContact O-CB 3.37Å; L409-R412 WeakPolarHBondContact O-CG 3.42Å; L409-R412 PolarHBondContact O-N 3.36Å; L410-R412 PolarHBondContact O-N 3.39Å; R412-A415 PolarHBondContact O-N 3.43Å; R412-L416 PolarHBondContact O-N 2.68Å
413	L	98.5	Very high	97.4	Very high	30 Å²	30	51.8 Å²	51.8	16%	0.157	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-40.7	-176.2	-59.3	172.9	0	0	0	113.8	L361 I364 V365 L410 A415 L416 R417	L361-L413 HydrophobicContact CB-CD2 4.41Å; L361-L413 HydrophobicContact CD2-CD1 4.39Å; L361-L413 HydrophobicContact CD2-CD2 4.18Å; L361-L413 HydrophobicContact CD2-CG 4.24Å; I364-L413 HydrophobicContact CG2-CD1 3.71Å; V365-L413 HydrophobicContact CG2-CD2 3.75Å; L410-L413 HydrophobicContact CD2-CD1 4.1Å; L410-L413 WeakPolarHBondContact O-CB 3.2Å; L410-L413 WeakPolarHBondContact O-CG 3.3Å; L410-L413 PolarHBondContact O-N 3.37Å; L413-A415 PolarHBondContact O-N 3.3Å; L413-L416 HydrophobicContact CD2-CD2 4.49Å; L413-L416 WeakPolarHBondContact O-CB 3.44Å; L413-L416 PolarHBondContact O-N 3.1Å; L413-R417 PolarHBondContact O-N 3.29Å
414	P	98.4	Very high	97.2	Very high	82 Å²	82	47.4 Å²	47.4	53%	0.532	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-41.7	178.5	-25.1	35.6	0	0	0	113.5	L410 R417 S418	L410-P414 WeakPolarHBondContact O-CD 3.07Å; P414-R417 PolarHBondContact O-N 3.26Å; P414-S418 WeakPolarHBondContact O-CB 3.36Å; P414-S418 PolarHBondContact O-N 2.89Å
415	A	97.9	Very high	96.8	Very high	14 Å²	14	50.9 Å²	50.9	12%	0.116	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-42.7	176	0	0	0	0	0	110.7	E343 L344 R412 L413 R417 S418 I419	E343-A415 HydrophobicContact CB-CB 4.22Å; L344-A415 HydrophobicContact CD2-CB 4.44Å; R412-A415 PolarHBondContact O-N 3.43Å; L413-A415 PolarHBondContact O-N 3.3Å; A415-R417 PolarHBondContact O-N 2.89Å; A415-S418 PolarHBondContact O-N 3.11Å; A415-I419 WeakPolarHBondContact O-CB 3.41Å; A415-I419 VanDerWaalsContact O-CG1 3.31Å; A415-I419 WeakPolarHBondContact O-CG1 3.36Å; A415-I419 PolarHBondContact O-N 2.93Å
416	L	98.6	Very high	96.3	Very high	10 Å²	10	52.7 Å²	52.7	5%	0.052	27%	0.271	C	S	.	.	H	α-helix	trans	-57.8	-48.3	175.4	-179.4	62.8	0	0	0	111.8	E298 I301 A302 L344 V365 R412 L413 S418 I419 G420	E298-L416 HydrophobicContact CB-CD2 4.27Å; E298-L416 HydrophobicContact CB-CG 4.16Å; E298-L416 HydrophobicContact CG-CG 4.31Å; I301-L416 HydrophobicContact CB-CD1 4.01Å; I301-L416 HydrophobicContact CG2-CD1 3.62Å; A302-L416 HydrophobicContact CB-CD1 4.3Å; A302-L416 HydrophobicContact CB-CD2 4Å; L344-L416 HydrophobicContact CD1-CD1 3.98Å; L344-L416 HydrophobicContact CD2-CB 4.24Å; V365-L416 HydrophobicContact CG2-CD2 4.06Å; R412-L416 PolarHBondContact O-N 2.68Å; L413-L416 HydrophobicContact CD2-CD2 4.49Å; L413-L416 WeakPolarHBondContact O-CB 3.44Å; L413-L416 PolarHBondContact O-N 3.1Å; L416-S418 PolarHBondContact O-N 2.85Å; L416-I419 PolarHBondContact O-N 2.86Å; L416-G420 PolarHBondContact O-N 3.05Å
417	R	97.9	Very high	95.7	Very high	108 Å²	108	52 Å²	52	41%	0.408	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-46.3	176.3	173.5	60	70.9	106.6	0.3	111.8	E298 L413 P414 A415 I419 G420 L421	E298-R417 WeakPolarHBondContact OE1-CD 3.3Å; E298-R417 IonicContact OE1-CZ 2.98Å; E298-R417 IonicContact OE1-NE 3.52Å; E298-R417 PolarHBondContact OE1-NE 2.76Å; E298-R417 IonicContact OE1-NH2 3.32Å; E298-R417 IonicContact OE2-NE 3.79Å; L413-R417 PolarHBondContact O-N 3.29Å; P414-R417 PolarHBondContact O-N 3.26Å; A415-R417 PolarHBondContact O-N 2.89Å; R417-I419 VanDerWaalsContact C-N 3.33Å; R417-I419 PolarHBondContact O-N 3.02Å; R417-G420 PolarHBondContact O-N 3.26Å; R417-L421 HydrophobicContact CG-CD1 4.22Å; R417-L421 WeakPolarHBondContact O-CG 3.4Å; R417-L421 PolarHBondContact O-N 3.46Å
418	S	98.2	Very high	95	Very high	54 Å²	54	54.4 Å²	54.4	38%	0.378	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-42.4	178.8	179.8	0	0	0	0	112.3	R339 P414 A415 L416 K422	R339-S418 PolarHBondContact NH2-OG 3.24Å; P414-S418 WeakPolarHBondContact O-CB 3.36Å; P414-S418 PolarHBondContact O-N 2.89Å; A415-S418 PolarHBondContact O-N 3.11Å; L416-S418 PolarHBondContact O-N 2.85Å; S418-K422 PolarHBondContact O-N 3.24Å
419	I	98.1	Very high	94.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-45.9	176.3	-71	168.1	0	0	0	110.4	I301 I336 R339 V340 E343 L344 A415 L416 R417 L421 K422 C423	I301-I419 HydrophobicContact CD1-CG2 4.41Å; I301-I419 HydrophobicContact CG2-CG2 4.28Å; I336-I419 HydrophobicContact CD1-CB 4.37Å; I336-I419 HydrophobicContact CD1-CG1 4.36Å; I336-I419 HydrophobicContact CD1-CG2 3.94Å; R339-I419 HydrophobicContact CB-CD1 4.22Å; R339-I419 HydrophobicContact CB-CG1 4.24Å; V340-I419 HydrophobicContact CG2-CG2 3.6Å; E343-I419 HydrophobicContact CB-CD1 4.16Å; L344-I419 HydrophobicContact CD1-CD1 3.86Å; L344-I419 HydrophobicContact CD2-CD1 4.36Å; L344-I419 HydrophobicContact CG-CD1 3.81Å; A415-I419 WeakPolarHBondContact O-CB 3.41Å; A415-I419 VanDerWaalsContact O-CG1 3.31Å; A415-I419 WeakPolarHBondContact O-CG1 3.36Å; A415-I419 PolarHBondContact O-N 2.93Å; L416-I419 PolarHBondContact O-N 2.86Å; R417-I419 VanDerWaalsContact C-N 3.33Å; R417-I419 PolarHBondContact O-N 3.02Å; I419-L421 PolarHBondContact O-N 2.97Å; I419-K422 PolarHBondContact O-N 3.24Å; I419-K422 VanDerWaalsContact O-N 3.1Å; I419-C423 PolarHBondContact O-N 2.87Å; I419-C423 PolarHBondContact O-SG 3.1Å; I419-C423 VanDerWaalsContact O-SG 3.33Å
420	G	97.1	Very high	93.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-45.7	-179.5	0	0	0	0	0	112.8	N297 L416 R417 K422 C423 L424	N297-G420 VanDerWaalsContact ND2-C 3.3Å; N297-G420 PolarHBondContact ND2-O 3.26Å; L416-G420 PolarHBondContact O-N 3.05Å; R417-G420 PolarHBondContact O-N 3.26Å; G420-K422 VanDerWaalsContact C-N 3.35Å; G420-C423 PolarHBondContact O-N 2.97Å; G420-L424 PolarHBondContact O-N 2.89Å; G420-L424 VanDerWaalsContact O-N 3.09Å
421	L	94.3	Very high	92.4	Very high	90 Å²	90	56.9 Å²	56.9	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-61.7	-42.8	174.2	-69.8	174.2	0	0	0	111.6	R417 I419 C423 L424 E425	R417-L421 HydrophobicContact CG-CD1 4.22Å; R417-L421 WeakPolarHBondContact O-CG 3.4Å; R417-L421 PolarHBondContact O-N 3.46Å; I419-L421 PolarHBondContact O-N 2.97Å; L421-C423 PolarHBondContact O-N 3.4Å; L421-L424 PolarHBondContact O-N 2.94Å; L421-E425 PolarHBondContact O-N 3.1Å; L421-E425 VanDerWaalsContact O-N 3.12Å
422	K	94.4	Very high	91.4	Very high	78 Å²	78	59 Å²	59	34%	0.339	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-38.3	178.8	-170.7	61.4	-174.5	173.3	0	112.2	I336 S418 I419 G420 L424 E425 H426	I336-K422 HydrophobicContact CD1-CB 3.85Å; I336-K422 HydrophobicContact CD1-CG 3.84Å; I336-K422 HydrophobicContact CG1-CG 4.35Å; S418-K422 PolarHBondContact O-N 3.24Å; I419-K422 PolarHBondContact O-N 3.24Å; I419-K422 VanDerWaalsContact O-N 3.1Å; G420-K422 VanDerWaalsContact C-N 3.35Å; K422-L424 VanDerWaalsContact C-N 3.33Å; K422-L424 PolarHBondContact O-N 3.05Å; K422-E425 VanDerWaalsContact CD-OE2 3.28Å; K422-E425 WeakPolarHBondContact CD-OE2 3.43Å; K422-E425 IonicContact NZ-OE2 3.8Å; K422-E425 PolarHBondContact NZ-OE2 2.88Å; K422-E425 WeakPolarHBondContact O-CB 3.27Å; K422-E425 PolarHBondContact O-N 3.32Å; K422-H426 PolarHBondContact O-CD2 3.33Å; K422-H426 PolarHBondContact O-N 3.04Å
423	C	93.8	Very high	90.3	Very high	31 Å²	31	60.1 Å²	60.1	21%	0.209	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-40.2	174	-70.4	0	0	0	0	111.9	I301 I419 G420 L421 H426 L427	I301-C423 HydrophobicContact CD1-CB 4.1Å; I419-C423 PolarHBondContact O-N 2.87Å; I419-C423 PolarHBondContact O-SG 3.1Å; I419-C423 VanDerWaalsContact O-SG 3.33Å; G420-C423 PolarHBondContact O-N 2.97Å; L421-C423 PolarHBondContact O-N 3.4Å; C423-H426 PolarHBondContact O-N 3.4Å; C423-L427 WeakPolarHBondContact O-CG 3.27Å; C423-L427 PolarHBondContact O-N 3.25Å
424	L	90.1	Very high	88.8	Confident	35 Å²	35	61.4 Å²	61.4	18%	0.183	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-41.9	174.8	-72	173.9	0	0	0	111.9	W296 N297 G420 L421 K422 H426 L427 F428 L446	W296-L424 HydrophobicContact CH2-CD2 4.43Å; W296-L424 HydrophobicContact CZ2-CD2 3.7Å; N297-L424 HydrophobicContact CB-CD2 4.23Å; N297-L424 HydrophobicContact CB-CG 4.41Å; N297-L424 WeakPolarHBondContact ND2-CD1 3.32Å; N297-L424 WeakPolarHBondContact ND2-CG 3.45Å; G420-L424 PolarHBondContact O-N 2.89Å; G420-L424 VanDerWaalsContact O-N 3.09Å; L421-L424 PolarHBondContact O-N 2.94Å; K422-L424 VanDerWaalsContact C-N 3.33Å; K422-L424 PolarHBondContact O-N 3.05Å; L424-H426 VanDerWaalsContact C-N 3.29Å; L424-H426 PolarHBondContact O-N 3.27Å; L424-L427 PolarHBondContact O-N 2.91Å; L424-F428 HydrophobicContact CB-CD2 4.45Å; L424-F428 HydrophobicContact CB-CE2 4.35Å; L424-F428 WeakPolarHBondContact O-CD2 3.09Å; L424-F428 PolarHBondContact O-N 3.44Å; L424-L446 HydrophobicContact CD2-CD2 3.98Å
425	E	88.8	Confident	87.3	Confident	108 Å²	108	63.9 Å²	63.9	51%	0.505	33%	0.329	S	S	.	.	H	α-helix	trans	-56.1	-44.4	174.5	-68.7	175.8	-166	0	0	112	L421 K422 F428 F429	L421-E425 PolarHBondContact O-N 3.1Å; L421-E425 VanDerWaalsContact O-N 3.12Å; K422-E425 VanDerWaalsContact CD-OE2 3.28Å; K422-E425 WeakPolarHBondContact CD-OE2 3.43Å; K422-E425 IonicContact NZ-OE2 3.8Å; K422-E425 PolarHBondContact NZ-OE2 2.88Å; K422-E425 WeakPolarHBondContact O-CB 3.27Å; K422-E425 PolarHBondContact O-N 3.32Å; E425-F428 PolarHBondContact O-N 3.5Å; E425-F429 WeakPolarHBondContact O-CB 3.39Å; E425-F429 PolarHBondContact O-N 3.28Å
426	H	86.8	Confident	85.7	Confident	42 Å²	42	63.9 Å²	63.9	19%	0.194	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-43.9	176.1	-78	-76	0	0	0	112	K422 C423 L424 F428 F429 F430	K422-H426 PolarHBondContact O-CD2 3.33Å; K422-H426 PolarHBondContact O-N 3.04Å; C423-H426 PolarHBondContact O-N 3.4Å; L424-H426 VanDerWaalsContact C-N 3.29Å; L424-H426 PolarHBondContact O-N 3.27Å; H426-F428 PolarHBondContact O-N 2.83Å; H426-F429 WeakPolarHBondContact O-CB 3.4Å; H426-F429 PolarHBondContact O-N 3.26Å; H426-F430 HydrophobicContact CB-CD2 4.47Å; H426-F430 HydrophobicContact CB-CE2 4.13Å; H426-F430 WeakPolarHBondContact O-CD2 3.15Å; H426-F430 WeakPolarHBondContact O-CG 3.4Å; H426-F430 PolarHBondContact O-N 3.43Å
427	L	85.7	Confident	84.1	Confident	26 Å²	26	67.5 Å²	67.5	14%	0.136	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-40.2	177.6	-72.3	173.9	0	0	0	112.4	W296 C423 L424 F429 F430 K431 L446	W296-L427 HydrophobicContact CH2-CD1 3.72Å; W296-L427 HydrophobicContact CZ2-CD1 4.38Å; C423-L427 WeakPolarHBondContact O-CG 3.27Å; C423-L427 PolarHBondContact O-N 3.25Å; L424-L427 PolarHBondContact O-N 2.91Å; L427-F429 VanDerWaalsContact C-N 3.34Å; L427-F429 PolarHBondContact O-N 3.06Å; L427-F430 PolarHBondContact O-N 3.24Å; L427-K431 WeakPolarHBondContact O-CB 3.49Å; L427-K431 PolarHBondContact O-N 3.29Å; L427-L446 HydrophobicContact CB-CD1 4.33Å; L427-L446 HydrophobicContact CB-CD2 4.1Å; L427-L446 HydrophobicContact CD1-CD2 4.37Å
428	F	83.5	Confident	82.8	Confident	102 Å²	102	63.4 Å²	63.4	45%	0.447	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-40.5	173.7	-79.9	-61.4	0	0	0	112.2	L424 E425 H426 K431 L432 L446	L424-F428 HydrophobicContact CB-CD2 4.45Å; L424-F428 HydrophobicContact CB-CE2 4.35Å; L424-F428 WeakPolarHBondContact O-CD2 3.09Å; L424-F428 PolarHBondContact O-N 3.44Å; E425-F428 PolarHBondContact O-N 3.5Å; H426-F428 PolarHBondContact O-N 2.83Å; F428-K431 PolarHBondContact O-N 3.4Å; F428-L432 WeakPolarHBondContact O-CB 3.43Å; F428-L432 PolarHBondContact O-N 3.46Å; F428-L446 HydrophobicContact CE1-CB 4.42Å; F428-L446 WeakPolarHBondContact CE1-O 3.09Å; F428-L446 HydrophobicContact CZ-CD2 4.43Å
429	F	83.3	Confident	81.6	Confident	119 Å²	119	64.1 Å²	64.1	52%	0.522	34%	0.338	S	S	.	.	H	α-helix	trans	-63.2	-47.6	175.8	-179.7	-100.6	0	0	0	111.8	E425 H426 L427 K431 L432 I433	E425-F429 WeakPolarHBondContact O-CB 3.39Å; E425-F429 PolarHBondContact O-N 3.28Å; H426-F429 WeakPolarHBondContact O-CB 3.4Å; H426-F429 PolarHBondContact O-N 3.26Å; L427-F429 VanDerWaalsContact C-N 3.34Å; L427-F429 PolarHBondContact O-N 3.06Å; F429-K431 VanDerWaalsContact C-N 3.35Å; F429-K431 PolarHBondContact O-N 2.77Å; F429-L432 PolarHBondContact O-N 3.18Å; F429-I433 HydrophobicContact CD1-CD1 3.67Å; F429-I433 HydrophobicContact CD2-CD1 4Å; F429-I433 HydrophobicContact CE1-CD1 3.2Å; F429-I433 HydrophobicContact CE2-CD1 3.57Å; F429-I433 HydrophobicContact CG-CD1 4.06Å; F429-I433 HydrophobicContact CZ-CD1 3.17Å; F429-I433 HydrophobicContact CZ-CG1 4.48Å; F429-I433 WeakPolarHBondContact O-CG1 3.28Å; F429-I433 PolarHBondContact O-N 3.17Å; F429-I433 VanDerWaalsContact O-N 3.12Å
430	F	81.2	Confident	80.2	Confident	38 Å²	38	70.2 Å²	70.2	17%	0.167	38%	0.375	C	S	.	.	H	α-helix	trans	-63.5	-39.4	176.7	-66.4	-51.2	0	0	0	112.4	V256 V333 H426 L427 L432 I433 G434	V256-F430 HydrophobicContact CG1-CD2 4.07Å; V256-F430 HydrophobicContact CG1-CE2 3.78Å; V256-F430 HydrophobicContact CG1-CZ 4.19Å; V256-F430 HydrophobicContact CG2-CZ 4.45Å; V333-F430 HydrophobicContact CG1-CE2 4.2Å; V333-F430 HydrophobicContact CG1-CZ 3.9Å; H426-F430 HydrophobicContact CB-CD2 4.47Å; H426-F430 HydrophobicContact CB-CE2 4.13Å; H426-F430 WeakPolarHBondContact O-CD2 3.15Å; H426-F430 WeakPolarHBondContact O-CG 3.4Å; H426-F430 PolarHBondContact O-N 3.43Å; L427-F430 PolarHBondContact O-N 3.24Å; F430-L432 VanDerWaalsContact C-N 3.34Å; F430-L432 PolarHBondContact O-N 3.33Å; F430-I433 PolarHBondContact O-N 3.02Å; F430-G434 PolarHBondContact O-N 3.07Å
431	K	77.7	Confident	78.8	Confident	65 Å²	65	72.3 Å²	72.3	28%	0.283	38%	0.384	S	S	.	.	H	α-helix	trans	-58.9	-43.9	172.8	177.9	177	177.7	158.1	0	111.9	L427 F428 F429 I438 M443 E447	L427-K431 WeakPolarHBondContact O-CB 3.49Å; L427-K431 PolarHBondContact O-N 3.29Å; F428-K431 PolarHBondContact O-N 3.4Å; F429-K431 VanDerWaalsContact C-N 3.35Å; F429-K431 PolarHBondContact O-N 2.77Å; K431-I438 HydrophobicContact CB-CD1 3.94Å; K431-M443 HydrophobicContact CD-SD 3.42Å; K431-M443 WeakPolarHBondContact CD-SD 3.49Å; K431-M443 WeakPolarHBondContact CE-SD 3.34Å; K431-M443 HydrophobicContact CG-CE 4.43Å; K431-M443 HydrophobicContact CG-SD 3.85Å; K431-M443 PolarHBondContact NZ-SD 3.06Å; K431-E447 IonicContact NZ-OE1 3.81Å; K431-E447 PolarHBondContact NZ-OE1 2.86Å
432	L	75.9	Confident	77.8	Confident	153 Å²	153	68 Å²	68	80%	0.801	36%	0.362	S	S	*	.	H	α-helix	trans	-70.1	-34.1	-176.1	-172.6	64.8	0	0	0	112.6	F428 F429 F430	F428-L432 WeakPolarHBondContact O-CB 3.43Å; F428-L432 PolarHBondContact O-N 3.46Å; F429-L432 PolarHBondContact O-N 3.18Å; F430-L432 VanDerWaalsContact C-N 3.34Å; F430-L432 PolarHBondContact O-N 3.33Å
433	I	76.9	Confident	76.8	Confident	77 Å²	77	66.7 Å²	66.7	40%	0.395	36%	0.357	S	S	.	.	H	α-helix	trans	-81.3	-35.4	-179.1	-62.6	172.9	0	0	0	111.3	F429 F430 D435	F429-I433 HydrophobicContact CD1-CD1 3.67Å; F429-I433 HydrophobicContact CD2-CD1 4Å; F429-I433 HydrophobicContact CE1-CD1 3.2Å; F429-I433 HydrophobicContact CE2-CD1 3.57Å; F429-I433 HydrophobicContact CG-CD1 4.06Å; F429-I433 HydrophobicContact CZ-CD1 3.17Å; F429-I433 HydrophobicContact CZ-CG1 4.48Å; F429-I433 WeakPolarHBondContact O-CG1 3.28Å; F429-I433 PolarHBondContact O-N 3.17Å; F429-I433 VanDerWaalsContact O-N 3.12Å; F430-I433 PolarHBondContact O-N 3.02Å; I433-D435 HydrophobicContact CG2-CB 4.21Å; I433-D435 VanDerWaalsContact CG2-CG 3.43Å; I433-D435 WeakPolarHBondContact CG2-OD2 3.31Å
434	G	66.4	Low	76	Confident	57 Å²	57	69.8 Å²	69.8	59%	0.588	37%	0.368	S	S	*	.			trans	83.6	8.2	177.6	0	0	0	0	0	115	F430	F430-G434 PolarHBondContact O-N 3.07Å
435	D	66.7	Low	75.4	Confident	134 Å²	134	69.3 Å²	69.3	72%	0.717	37%	0.366	S	S	*	.			trans	-77	-21.3	-176.9	-71.9	-16.4	0	0	0	113.6	I433	I433-D435 HydrophobicContact CG2-CB 4.21Å; I433-D435 VanDerWaalsContact CG2-CG 3.43Å; I433-D435 WeakPolarHBondContact CG2-OD2 3.31Å
436	T	64.4	Low	74.6	Confident	14 Å²	14	64.7 Å²	64.7	9%	0.086	35%	0.345	C	S	.	.	S	Bend	trans	-114.6	124.9	-179.6	-47.9	0	0	0	0	109.9	V256 I438	V256-T436 HydrophobicContact CG1-CG2 4.26Å; T436-I438 PolarHBondContact O-N 3.15Å; T436-I438 VanDerWaalsContact O-N 3.13Å
437	P	65.6	Low	73.9	Confident	86 Å²	86	66.7 Å²	66.7	56%	0.558	35%	0.354	S	S	*	.			trans	-65.7	115.8	176	27.2	-32.2	0	0	0	109.5	T257	T257-P437 HydrophobicContact CG2-CG 4.2Å
438	I	70.8	Confident	72.5	Confident	22 Å²	22	69.4 Å²	69.4	11%	0.113	38%	0.38	C	S	.	.			trans	-105	119.7	173.7	-66.3	174.1	0	0	0	107	K431 T436 L442 M443 L446	K431-I438 HydrophobicContact CB-CD1 3.94Å; T436-I438 PolarHBondContact O-N 3.15Å; T436-I438 VanDerWaalsContact O-N 3.13Å; I438-L442 HydrophobicContact CG2-CB 3.98Å; I438-L442 HydrophobicContact CG2-CD2 3.96Å; I438-L442 HydrophobicContact CG2-CG 3.94Å; I438-M443 HydrophobicContact CB-CE 3.77Å; I438-M443 HydrophobicContact CG2-CB 4.42Å; I438-M443 HydrophobicContact CG2-CE 3.79Å; I438-M443 HydrophobicContact CG2-SD 4.28Å; I438-L446 HydrophobicContact CD1-CD1 4.46Å; I438-L446 HydrophobicContact CG2-CD1 4.34Å
439	D	71.7	Confident	71.1	Confident	70 Å²	70	69.3 Å²	69.3	37%	0.374	39%	0.39	S	S	.	.			trans	-63.1	155.9	-179.9	-72.9	-44.8	0	0	0	112.4	D264 F441 L442 M443	D264-D439 HydrophobicContact CB-CB 4.05Å; D264-D439 VanDerWaalsContact CG-CB 3.44Å; D264-D439 WeakPolarHBondContact OD1-CB 3.34Å; D439-F441 VanDerWaalsContact C-N 3.29Å; D439-F441 PolarHBondContact O-N 2.88Å; D439-L442 PolarHBondContact O-N 3.18Å; D439-M443 WeakPolarHBondContact O-CB 3.46Å; D439-M443 PolarHBondContact O-N 3.38Å
440	T	69.8	Low	69.1	Low	128 Å²	128	71.2 Å²	71.2	79%	0.785	40%	0.4	S	S	*	.	H	α-helix	trans	-58.3	-34.5	-170.9	55.1	0	0	0	0	114.3	M443 E444	T440-M443 WeakPolarHBondContact O-CB 3.05Å; T440-M443 PolarHBondContact O-N 2.86Å; T440-E444 PolarHBondContact O-N 2.59Å
441	F	67.9	Low	66.8	Low	43 Å²	43	77.8 Å²	77.8	19%	0.189	43%	0.431	C	S	.	.	H	α-helix	trans	-78	-42.9	-178	-167.1	-130.1	0	0	0	111.6	L267 F268 D439 M443 E444 M445	L267-F441 HydrophobicContact CB-CD1 3.6Å; L267-F441 HydrophobicContact CB-CE1 3.54Å; L267-F441 HydrophobicContact CD1-CD1 3.81Å; L267-F441 HydrophobicContact CD1-CE1 4.3Å; L267-F441 HydrophobicContact CG-CD1 4.35Å; L267-F441 HydrophobicContact CG-CE1 4.48Å; F268-F441 HydrophobicContact CD1-CE1 4.45Å; F268-F441 HydrophobicContact CD2-CD1 4.33Å; F268-F441 HydrophobicContact CE1-CD1 4.27Å; F268-F441 HydrophobicContact CE1-CE1 4.33Å; F268-F441 HydrophobicContact CE2-CB 4.43Å; F268-F441 AromaticContact CE2-CD1 3.89Å; F268-F441 HydrophobicContact CE2-CD1 3.89Å; F268-F441 HydrophobicContact CE2-CG 4.39Å; F268-F441 HydrophobicContact CZ-CB 4.25Å; F268-F441 AromaticContact CZ-CD1 3.86Å; F268-F441 HydrophobicContact CZ-CD1 3.86Å; F268-F441 HydrophobicContact CZ-CE1 4.37Å; F268-F441 HydrophobicContact CZ-CG 4.06Å; D439-F441 VanDerWaalsContact C-N 3.29Å; D439-F441 PolarHBondContact O-N 2.88Å; F441-M443 PolarHBondContact O-N 2.82Å; F441-E444 WeakPolarHBondContact O-CB 3.37Å; F441-E444 PolarHBondContact O-N 3.18Å; F441-E444 VanDerWaalsContact O-N 3.11Å; F441-M445 WeakPolarHBondContact O-CG 3.24Å; F441-M445 PolarHBondContact O-N 3.44Å
442	L	72.9	Confident	64.5	Low	1 Å²	1	82.7 Å²	82.7	1%	0.005	46%	0.458	C	S	.	.	H	α-helix	trans	-57.4	-37	168.7	-170.1	61.2	0	0	0	111.7	C260 D264 L267 W296 I438 D439 M445 L446	C260-L442 HydrophobicContact CB-CD2 4.16Å; D264-L442 PolarHBondContact OD1-N 3.14Å; L267-L442 HydrophobicContact CD1-CB 4.28Å; L267-L442 HydrophobicContact CD1-CD1 3.92Å; W296-L442 HydrophobicContact CE3-CD1 4.39Å; W296-L442 HydrophobicContact CH2-CD1 3.34Å; W296-L442 HydrophobicContact CZ2-CD1 4.11Å; W296-L442 HydrophobicContact CZ3-CD1 3.51Å; I438-L442 HydrophobicContact CG2-CB 3.98Å; I438-L442 HydrophobicContact CG2-CD2 3.96Å; I438-L442 HydrophobicContact CG2-CG 3.94Å; D439-L442 PolarHBondContact O-N 3.18Å; L442-M445 PolarHBondContact O-N 3.06Å; L442-L446 VanDerWaalsContact O-CG 3.3Å; L442-L446 WeakPolarHBondContact O-CG 3.36Å; L442-L446 PolarHBondContact O-N 3.16Å; L442-L446 VanDerWaalsContact O-N 3.16Å
443	M	72.3	Confident	62.4	Low	49 Å²	49	84.7 Å²	84.7	24%	0.241	48%	0.477	C	S	.	.	H	α-helix	trans	-62.6	-45.5	173.8	-162	67.8	74.7	0	0	112.1	K431 I438 D439 T440 F441 M445 L446 E447	K431-M443 HydrophobicContact CD-SD 3.42Å; K431-M443 WeakPolarHBondContact CD-SD 3.49Å; K431-M443 WeakPolarHBondContact CE-SD 3.34Å; K431-M443 HydrophobicContact CG-CE 4.43Å; K431-M443 HydrophobicContact CG-SD 3.85Å; K431-M443 PolarHBondContact NZ-SD 3.06Å; I438-M443 HydrophobicContact CB-CE 3.77Å; I438-M443 HydrophobicContact CG2-CB 4.42Å; I438-M443 HydrophobicContact CG2-CE 3.79Å; I438-M443 HydrophobicContact CG2-SD 4.28Å; D439-M443 WeakPolarHBondContact O-CB 3.46Å; D439-M443 PolarHBondContact O-N 3.38Å; T440-M443 WeakPolarHBondContact O-CB 3.05Å; T440-M443 PolarHBondContact O-N 2.86Å; F441-M443 PolarHBondContact O-N 2.82Å; M443-M445 VanDerWaalsContact C-N 3.26Å; M443-M445 PolarHBondContact O-N 3.49Å; M443-L446 PolarHBondContact O-N 3.12Å; M443-L446 VanDerWaalsContact O-N 3.08Å; M443-E447 WeakPolarHBondContact O-CG 3.38Å; M443-E447 PolarHBondContact O-N 2.91Å
444	E	77.2	Confident	61.6	Low	96 Å²	96	85.1 Å²	85.1	45%	0.449	48%	0.481	S	S	.	.	H	α-helix	trans	-59.5	-38.7	177.7	-156.3	-161	140	0	0	111.4	R293 T440 F441 L446 E447	R293-E444 PolarHBondContact NH1-O 3.27Å; R293-E444 PolarHBondContact NH2-O 3.02Å; R293-E444 IonicContact NH2-OE1 2.69Å; R293-E444 PolarHBondContact NH2-OE1 2.9Å; T440-E444 PolarHBondContact O-N 2.59Å; F441-E444 WeakPolarHBondContact O-CB 3.37Å; F441-E444 PolarHBondContact O-N 3.18Å; F441-E444 VanDerWaalsContact O-N 3.11Å; E444-L446 VanDerWaalsContact C-N 3.32Å; E444-L446 PolarHBondContact O-N 3.46Å; E444-E447 PolarHBondContact O-N 3.08Å
445	M	77.1	Confident	61.4	Low	26 Å²	26	86.5 Å²	86.5	13%	0.128	48%	0.476	C	S	.	.	H	α-helix	trans	-70.9	-24.8	177.3	-64.1	-61.5	-73.2	0	0	113.4	L267 R293 W296 F441 L442 M443	L267-M445 HydrophobicContact CD1-CG 4.02Å; L267-M445 HydrophobicContact CD2-CE 4.48Å; L267-M445 HydrophobicContact CD2-CG 4.39Å; R293-M445 HydrophobicContact CB-CE 4.41Å; R293-M445 HydrophobicContact CG-CE 4Å; R293-M445 HydrophobicContact CG-SD 3.96Å; W296-M445 HydrophobicContact CB-CE 3.61Å; W296-M445 HydrophobicContact CD2-CB 4.47Å; W296-M445 HydrophobicContact CD2-CE 4.4Å; W296-M445 HydrophobicContact CG-CE 3.49Å; W296-M445 VanDerWaalsContact CG-CE 3.49Å; W296-M445 HydrophobicContact CZ2-CB 4.49Å; F441-M445 WeakPolarHBondContact O-CG 3.24Å; F441-M445 PolarHBondContact O-N 3.44Å; L442-M445 PolarHBondContact O-N 3.06Å; M443-M445 VanDerWaalsContact C-N 3.26Å; M443-M445 PolarHBondContact O-N 3.49Å
446	L	72.4	Confident	61.1	Low	11 Å²	11	83.9 Å²	83.9	6%	0.058	46%	0.462	C	S	.	.	H	α-helix	trans	-85.7	-20.1	175.9	-69.7	170.1	0	0	0	112.9	W296 L424 L427 F428 I438 L442 M443 E444	W296-L446 HydrophobicContact CZ2-CD2 4.1Å; L424-L446 HydrophobicContact CD2-CD2 3.98Å; L427-L446 HydrophobicContact CB-CD1 4.33Å; L427-L446 HydrophobicContact CB-CD2 4.1Å; L427-L446 HydrophobicContact CD1-CD2 4.37Å; F428-L446 HydrophobicContact CE1-CB 4.42Å; F428-L446 WeakPolarHBondContact CE1-O 3.09Å; F428-L446 HydrophobicContact CZ-CD2 4.43Å; I438-L446 HydrophobicContact CD1-CD1 4.46Å; I438-L446 HydrophobicContact CG2-CD1 4.34Å; L442-L446 VanDerWaalsContact O-CG 3.3Å; L442-L446 WeakPolarHBondContact O-CG 3.36Å; L442-L446 PolarHBondContact O-N 3.16Å; L442-L446 VanDerWaalsContact O-N 3.16Å; M443-L446 PolarHBondContact O-N 3.12Å; M443-L446 VanDerWaalsContact O-N 3.08Å; E444-L446 VanDerWaalsContact C-N 3.32Å; E444-L446 PolarHBondContact O-N 3.46Å
447	E	72.9	Confident	60.9	Low	84 Å²	84	88 Å²	88	39%	0.393	49%	0.485	S	S	.	.	S	Bend	trans	-81.1	130.3	179.5	-73.4	177.5	-175	0	0	111.2	K431 M443 E444	K431-E447 IonicContact NZ-OE1 3.81Å; K431-E447 PolarHBondContact NZ-OE1 2.86Å; M443-E447 WeakPolarHBondContact O-CG 3.38Å; M443-E447 PolarHBondContact O-N 2.91Å; E444-E447 PolarHBondContact O-N 3.08Å
448	A	57	Low	60.6	Low	82 Å²	82	88.1 Å²	88.1	68%	0.678	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-60.7	134.2	169.5	0	0	0	0	0	108.1	H450	A448-H450 PolarHBondContact O-N 2.99Å
449	P	53.4	Low	59.9	Low	101 Å²	101	92.5 Å²	92.5	66%	0.656	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-54.5	130.7	177.7	20.3	-30	0	0	0	108.8	Q451	P449-Q451 PolarHBondContact O-N 3.18Å
450	H	41.1	Very low	59.1	Low	159 Å²	159	94.1 Å²	94.1	74%	0.736	51%	0.514	S	S	*	.			trans	-58.6	112.8	174.1	-71.4	58.6	0	0	0	106.4	A448 I452	A448-H450 PolarHBondContact O-N 2.99Å; H450-I452 PolarHBondContact O-N 3.42Å
451	Q	33.5	Very low	58.3	Low	175 Å²	175	91.5 Å²	91.5	82%	0.818	49%	0.493	S	S	*	.			trans	-63.5	96	166.7	-75.7	-179.9	4.7	0	0	106.1	P449 T453	P449-Q451 PolarHBondContact O-N 3.18Å; Q451-T453 VanDerWaalsContact C-N 3.3Å; Q451-T453 PolarHBondContact O-N 3.23Å; Q451-T453 PolarHBondContact O-OG1 3.17Å
452	I	28.7	Very low	57.5	Low	168 Å²	168	95.6 Å²	95.6	86%	0.862	52%	0.518	S	S	*	.			trans	-59.6	105.6	163.9	-56.6	177.6	0	0	0	104.2	H450	H450-I452 PolarHBondContact O-N 3.42Å
453	T	31.1	Very low	56.1	Low	195 Å²	195	104.2 Å²	104.2	100%	1.196	57%	0.565	S	S	*	*			trans	-82.7	0	-173.5	-9.7	0	0	0	0	110.7	Q451	Q451-T453 VanDerWaalsContact C-N 3.3Å; Q451-T453 PolarHBondContact O-N 3.23Å; Q451-T453 PolarHBondContact O-OG1 3.17Å

Retrieved 453 of 453 residues in 1081.1 ms (Link to these results)

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