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Isoform 3 of Estrogen-related receptor gamma AlphaSync

Canonical isoform description: Orphan receptor that acts as a transcription activator in the absence of bound ligand. Binds specifically to an estrogen response element and activates reporter genes controlled by estrogen response elements (By similarity). Induces the expression of PERM1 in the skeletal muscle.

AlphaFold DB , UniProt , Accession P62508-3 (canonical: P62508), Species HUMAN (Homo sapiens, Human), Gene ESRRG, Length 442 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	31.1	Very low	39.5	Very low	245 Å²	245	164.9 Å²	164.9	100%	1.207	86%	0.862	S	S	*	*				0	174.2	0	-62	-176.9	83.1	0	0	108.2
2	S	39.7	Very low	39.2	Very low	125 Å²	125	161.8 Å²	161.8	87%	0.874	86%	0.862	S	S	*	*			trans	-64.7	168.9	-147.3	-59.6	0	0	0	0	119.1
3	N	37.5	Very low	38.7	Very low	172 Å²	172	157.1 Å²	157.1	92%	0.92	85%	0.85	S	S	*	*			trans	-62.9	178.2	-169.3	-75.3	-22.5	0	0	0	116.7
4	K	52.2	Low	38.9	Very low	188 Å²	188	154.1 Å²	154.1	82%	0.817	85%	0.847	S	S	*	*			trans	-115.2	149.2	-167	-146.5	175	-168.3	171.9	0	110.6
5	D	37.2	Very low	38.8	Very low	145 Å²	145	157.1 Å²	157.1	78%	0.775	85%	0.849	S	S	*	*			trans	-67	160.7	173.3	-40.5	-100.1	0	0	0	113.1
6	R	47.3	Very low	38.8	Very low	237 Å²	237	157.9 Å²	157.9	89%	0.894	85%	0.85	S	S	*	*				-170.4	132.3	125.6	-103.3	153.6	-172.9	-146.9	-5.2	114.5
7	H	35.9	Very low	38.7	Very low	159 Å²	159	157.9 Å²	157.9	74%	0.736	84%	0.84	S	S	*	*			trans	-65.1	161.3	157.7	-90.5	-118	0	0	0	111.8
8	I	43.1	Very low	38.6	Very low	171 Å²	171	156.5 Å²	156.5	88%	0.877	84%	0.839	S	S	*	*				-162.4	144.1	123.5	-100.5	153.9	0	0	0	109.4
9	D	32.4	Very low	38.8	Very low	133 Å²	133	156.4 Å²	156.4	71%	0.711	83%	0.832	S	S	*	*			trans	-91.2	157.9	-172.9	-40.6	-94.7	0	0	0	113.1
10	S	40.9	Very low	38.9	Very low	124 Å²	124	154.6 Å²	154.6	87%	0.867	83%	0.83	S	S	*	*			trans	-165.3	133.3	133.8	-171.7	0	0	0	0	111.8
11	S	36.9	Very low	38.8	Very low	115 Å²	115	153 Å²	153	80%	0.804	83%	0.831	S	S	*	*			trans	-88.6	146.3	176	55.6	0	0	0	0	112.9
12	C	35.9	Very low	39.3	Very low	128 Å²	128	146.8 Å²	146.8	87%	0.865	81%	0.811	S	S	*	*			trans	-148.6	131.2	150	-167.4	0	0	0	0	110.1
13	S	33	Very low	39.3	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	81%	0.808	S	S	*	*			trans	-128.1	130	-178.4	58	0	0	0	0	110.2
14	S	41.9	Very low	39.1	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	81%	0.806	S	S	*	*			trans	-145.5	119.2	173.1	-75.3	0	0	0	0	110.4
15	F	36.7	Very low	38.8	Very low	200 Å²	200	140.2 Å²	140.2	88%	0.877	81%	0.806	S	S	*	*			trans	-83.6	136.3	176.5	-76.7	-107.7	0	0	0	110.4
16	I	38.7	Very low	38.8	Very low	170 Å²	170	141.2 Å²	141.2	87%	0.872	81%	0.811	S	S	*	*			trans	-123.2	106.9	155.8	-60.9	-174.9	0	0	0	109.5
17	K	36.8	Very low	38.5	Very low	158 Å²	158	136 Å²	136	69%	0.687	81%	0.805	S	S	*	*			trans	-28.7	126.8	171	-172.8	-172.8	-179.5	-138.4	0	115.9	E19	K17-E19 IonicContact NZ-OE1 3.53Å; K17-E19 PolarHBondContact NZ-OE1 2.85Å
18	T	38.1	Very low	38.6	Very low	132 Å²	132	134.9 Å²	134.9	81%	0.81	81%	0.805	S	S	*	*			trans	-74.7	147.7	159.5	44.6	0	0	0	0	111.2
19	E	41.1	Very low	38.4	Very low	154 Å²	154	131.5 Å²	131.5	72%	0.72	80%	0.796	S	S	*	*			trans	-111.8	149.6	165	-62.8	-149.2	135.5	0	0	110.9	K17	K17-E19 IonicContact NZ-OE1 3.53Å; K17-E19 PolarHBondContact NZ-OE1 2.85Å
20	P	42.4	Very low	38.7	Very low	120 Å²	120	130.7 Å²	130.7	78%	0.779	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-94.4	158.4	-164.4	36.5	-36	0	0	0	114.4
21	S	36.7	Very low	38.7	Very low	121 Å²	121	131 Å²	131	85%	0.846	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-61.2	136.7	173.3	-46.7	0	0	0	0	112.7
22	S	40.2	Very low	39	Very low	115 Å²	115	132 Å²	132	80%	0.804	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-79.8	144.4	169.3	-67.8	0	0	0	0	111.2
23	P	41.2	Very low	39.4	Very low	124 Å²	124	133.7 Å²	133.7	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-87	159.7	-169.7	35	-37	0	0	0	114
24	A	32.5	Very low	40.2	Very low	107 Å²	107	133.8 Å²	133.8	88%	0.884	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-77.6	143.8	165.8	0	0	0	0	0	111.4
25	S	45.9	Very low	40.4	Very low	116 Å²	116	134.2 Å²	134.2	81%	0.811	78%	0.775	S	S	*	*			trans	-130.7	115.2	174.9	57.8	0	0	0	0	111.2
26	L	37.1	Very low	40.4	Very low	167 Å²	167	128.5 Å²	128.5	87%	0.874	77%	0.773	S	S	*	*			trans	-73.9	142.4	166.6	-68	142.5	0	0	0	110
27	T	40.8	Very low	40.8	Very low	127 Å²	127	124.3 Å²	124.3	78%	0.779	77%	0.772	S	S	*	*				177.9	130.3	125.8	42.2	0	0	0	0	112.6
28	D	37.5	Very low	40.8	Very low	136 Å²	136	122.2 Å²	122.2	73%	0.727	78%	0.777	S	S	*	*			trans	53.8	102.4	140.5	-73.3	-75.4	0	0	0	124.8
29	S	39	Very low	41.6	Very low	99 Å²	99	121.9 Å²	121.9	69%	0.692	78%	0.78	S	S	*	*				82.3	149	102.4	-62.6	0	0	0	0	123
30	V	40.4	Very low	41.6	Very low	117 Å²	117	122.4 Å²	122.4	71%	0.709	79%	0.788	S	S	*	*			trans	86.1	96.5	163.2	-165.1	0	0	0	0	119
31	N	40.8	Very low	41.8	Very low	129 Å²	129	121.3 Å²	121.3	69%	0.69	79%	0.789	S	S	*	*			trans	56	141.9	143.8	-53.8	-16.9	0	0	0	119.6
32	H	42.3	Very low	42	Very low	138 Å²	138	121.6 Å²	121.6	64%	0.639	79%	0.79	S	S	*	*				-172.5	135.5	62.4	-94.7	-84.8	0	0	0	113.2
33	H	43.5	Very low	42	Very low	162 Å²	162	120 Å²	120	75%	0.75	79%	0.792	S	S	*	*			trans	61.3	157.9	152.8	-48.6	-43.9	0	0	0	118.8
34	S	50.7	Low	42	Very low	102 Å²	102	119.1 Å²	119.1	71%	0.713	79%	0.789	S	S	*	*			cis	176.3	172	-21.9	-85.6	0	0	0	0	106.7
35	P	46.5	Very low	42.3	Very low	124 Å²	124	123.7 Å²	123.7	81%	0.805	79%	0.785	S	S	*	*			cis	-122.8	175	-35.3	38.7	-24.2	0	0	0	112.2
36	G	36.3	Very low	41.9	Very low	81 Å²	81	123 Å²	123	84%	0.835	78%	0.78	S	S	*	*			trans	-92.6	168	167.2	0	0	0	0	0	113.3
37	G	47.3	Very low	42	Very low	82 Å²	82	120 Å²	120	85%	0.845	77%	0.773	S	S	*	*			trans	-159.8	118.6	174.3	0	0	0	0	0	112.8
38	S	37.5	Very low	41.9	Very low	114 Å²	114	119.6 Å²	119.6	80%	0.797	77%	0.77	S	S	*	*			trans	-151.4	145.1	177.1	50.5	0	0	0	0	109.5
39	S	54.1	Low	42.2	Very low	124 Å²	124	121 Å²	121	87%	0.867	77%	0.774	S	S	*	*			trans	-151.2	121.4	179.7	-62.3	0	0	0	0	111
40	D	40.5	Very low	42.2	Very low	166 Å²	166	124 Å²	124	89%	0.888	78%	0.783	S	S	*	*			trans	-91.5	150.6	175.7	-60.6	-69.5	0	0	0	112.1
41	A	47.3	Very low	42.1	Very low	97 Å²	97	121.2 Å²	121.2	80%	0.802	78%	0.778	S	S	*	*			trans	-164.3	83.4	156.3	0	0	0	0	0	113.2
42	S	41.7	Very low	42.2	Very low	126 Å²	126	123.2 Å²	123.2	88%	0.881	78%	0.783	S	S	*	*			trans	-2.4	139.4	151.7	57	0	0	0	0	121.5
43	G	39.2	Very low	42.2	Very low	81 Å²	81	123.3 Å²	123.3	84%	0.835	78%	0.784	S	S	*	*			trans	176.3	95.3	159.4	0	0	0	0	0	118.1
44	S	40.5	Very low	42.1	Very low	107 Å²	107	122.5 Å²	122.5	75%	0.748	79%	0.785	S	S	*	*			trans	-54.1	165.9	168.4	56.5	0	0	0	0	115.8
45	Y	39.8	Very low	41.5	Very low	203 Å²	203	120.7 Å²	120.7	80%	0.796	78%	0.783	S	S	*	*			cis	-164.3	159.2	26.8	39.9	-95.9	0	0	0	114.6
46	S	38.3	Very low	41.3	Very low	100 Å²	100	122.6 Å²	122.6	70%	0.699	79%	0.785	S	S	*	*			trans	49	120.9	142.2	-58.1	0	0	0	0	125
47	S	37.4	Very low	41.6	Very low	105 Å²	105	125.9 Å²	125.9	73%	0.734	78%	0.783	S	S	*	*				64.5	145.2	112.2	-54	0	0	0	0	122.1
48	T	40.5	Very low	41.3	Very low	118 Å²	118	127.2 Å²	127.2	72%	0.724	78%	0.78	S	S	*	*			cis	-168.3	148.4	2.6	14.1	0	0	0	0	113.5
49	M	42.8	Very low	42.3	Very low	165 Å²	165	127.5 Å²	127.5	81%	0.813	78%	0.779	S	S	*	*			trans	70.3	153.9	144.3	-67.3	-60.9	170.6	0	0	124.8
50	N	39.5	Very low	42	Very low	162 Å²	162	126.6 Å²	126.6	87%	0.866	77%	0.77	S	S	*	*			trans	68.1	144.2	170.8	-67.3	2.1	0	0	0	118.8
51	G	37.4	Very low	42.1	Very low	60 Å²	60	125.5 Å²	125.5	62%	0.619	76%	0.764	S	S	*	*			cis	158.3	151.5	-10.3	0	0	0	0	0	114.2
52	H	43.3	Very low	42	Very low	170 Å²	170	131.1 Å²	131.1	79%	0.787	77%	0.766	S	S	*	*			trans	65.5	157.9	173.1	-69	-83.4	0	0	0	118.4
53	Q	42	Very low	42.2	Very low	140 Å²	140	130.1 Å²	130.1	65%	0.654	76%	0.756	S	S	*	*			cis	-171.1	153.2	-41.3	-132.1	179.7	21.2	0	0	110.1
54	N	41.8	Very low	42.4	Very low	146 Å²	146	132.3 Å²	132.3	78%	0.781	76%	0.758	S	S	*	*			trans	65.1	147.9	162.3	-47.4	-30.7	0	0	0	117.5
55	G	38.6	Very low	42.5	Very low	64 Å²	64	131.6 Å²	131.6	66%	0.66	76%	0.759	S	S	*	*			cis	161.6	152.4	-11.2	0	0	0	0	0	112.6
56	L	41.9	Very low	42.9	Very low	164 Å²	164	127.1 Å²	127.1	86%	0.859	76%	0.755	S	S	*	*			trans	61.7	144.6	163.7	-47.4	178.4	0	0	0	116.2
57	D	41.5	Very low	43.1	Very low	149 Å²	149	129.1 Å²	129.1	80%	0.797	76%	0.757	S	S	*	*			cis	-155.3	-173.2	27.8	-121.9	-42.1	0	0	0	113.2
58	S	42.5	Very low	43.3	Very low	111 Å²	111	132.1 Å²	132.1	78%	0.776	76%	0.763	S	S	*	*			trans	-111.5	164	-171.5	-83.4	0	0	0	0	117.2
59	P	57.3	Low	43.1	Very low	119 Å²	119	130.4 Å²	130.4	77%	0.773	77%	0.77	S	S	*	*			trans	-84.7	-161.5	178.9	40.9	-41.2	0	0	0	111.7
60	P	49.2	Very low	42.8	Very low	106 Å²	106	126.1 Å²	126.1	69%	0.688	77%	0.768	S	S	*	*			cis	-140.6	-160.8	4.3	42.5	-20.9	0	0	0	115.8
61	L	41.5	Very low	42.9	Very low	142 Å²	142	124.5 Å²	124.5	74%	0.743	77%	0.769	S	S	*	*				160.6	120.1	123.8	-81	172.7	0	0	0	116.4
62	Y	44.9	Very low	43	Very low	216 Å²	216	125 Å²	125	85%	0.847	77%	0.774	S	S	*	*			trans	70.4	157.4	140.5	-84.6	-110.9	0	0	0	124.7
63	P	47.6	Very low	43.1	Very low	104 Å²	104	122.9 Å²	122.9	68%	0.675	78%	0.776	S	S	*	*			trans	-128.7	-179.3	-161.2	44.9	-29.9	0	0	0	116.4
64	S	43.1	Very low	43	Very low	127 Å²	127	121.3 Å²	121.3	89%	0.888	78%	0.775	S	S	*	*			trans	-162	161.9	152.1	-84	0	0	0	0	112.7
65	A	41.5	Very low	43	Very low	93 Å²	93	125.1 Å²	125.1	77%	0.769	78%	0.779	S	S	*	*			trans	-135	-163.3	178	0	0	0	0	0	108.4
66	P	47.9	Very low	43.1	Very low	109 Å²	109	130.2 Å²	130.2	71%	0.708	78%	0.783	S	S	*	*			cis	-136.3	-147.3	-9	28	-0.6	0	0	0	112.4
67	I	43.2	Very low	43.1	Very low	142 Å²	142	128.3 Å²	128.3	73%	0.728	77%	0.773	S	S	*	*			trans	104.5	115.9	146.5	-77.4	164.9	0	0	0	121.6
68	L	40.6	Very low	43.2	Very low	167 Å²	167	131.2 Å²	131.2	87%	0.874	77%	0.774	S	S	*	*			trans	50.6	129.5	149.9	-88.2	65.5	0	0	0	124.4
69	G	37.3	Very low	43.4	Very low	83 Å²	83	132.1 Å²	132.1	86%	0.856	77%	0.77	S	S	*	*				133.1	132.3	116	0	0	0	0	0	118.6
70	G	37.3	Very low	42.6	Very low	75 Å²	75	134 Å²	134	77%	0.773	77%	0.774	S	S	*	*			trans	132.9	95.6	155.2	0	0	0	0	0	119.4
71	S	41.7	Very low	42.3	Very low	127 Å²	127	134 Å²	134	89%	0.888	78%	0.775	S	S	*	*			trans	25.1	133.8	141.1	-50.1	0	0	0	0	123.6
72	G	38.3	Very low	42.2	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	77%	0.774	S	S	*	*			trans	-84.4	-139.9	160.4	0	0	0	0	0	112.8
73	P	45.3	Very low	41.9	Very low	126 Å²	126	126.4 Å²	126.4	82%	0.818	77%	0.765	S	S	*	*			cis	-137.3	-152.1	1	33.3	-8.9	0	0	0	114
74	V	41.1	Very low	41.6	Very low	107 Å²	107	126.5 Å²	126.5	65%	0.648	76%	0.764	S	S	*	*			trans	120.2	108.3	147.3	177.5	0	0	0	0	120.2
75	R	40.8	Very low	41.6	Very low	226 Å²	226	127.6 Å²	127.6	85%	0.853	76%	0.759	S	S	*	*			trans	74.1	158.6	145.4	-76.7	172.5	-171.5	159.8	-0.2	120.1
76	K	41.2	Very low	41.7	Very low	170 Å²	170	128.1 Å²	128.1	74%	0.739	75%	0.752	S	S	*	*			cis	-159	158.9	12.4	-138.5	-178.3	167.5	-166.9	0	114
77	L	42.1	Very low	41.3	Very low	125 Å²	125	131.4 Å²	131.4	65%	0.654	76%	0.758	S	S	*	*			trans	62.5	149.9	163.2	-93.9	73.2	0	0	0	116.7
78	Y	43.4	Very low	41.4	Very low	210 Å²	210	131.8 Å²	131.8	82%	0.824	76%	0.761	S	S	*	*			cis	-161.1	174.1	-10.9	64.2	-72	0	0	0	111.8
79	D	45.7	Very low	41.2	Very low	130 Å²	130	128.4 Å²	128.4	70%	0.695	75%	0.749	S	S	*	*				-165.7	155.3	-54.1	-81.6	-40.4	0	0	0	108.7
80	D	41.4	Very low	41	Very low	159 Å²	159	133.3 Å²	133.3	85%	0.85	75%	0.75	S	S	*	*			trans	67.6	152.2	165.7	-106.1	-12.6	0	0	0	121.4
81	C	41.8	Very low	41	Very low	105 Å²	105	137.2 Å²	137.2	71%	0.709	76%	0.759	S	S	*	*			cis	-149.1	150.9	5.3	-174.6	0	0	0	0	114
82	S	40.3	Very low	40.6	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	76%	0.759	S	S	*	*			trans	-23.8	162.3	162.9	-80.5	0	0	0	0	120.9
83	S	38.6	Very low	40.2	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	75%	0.751	S	S	*	*			cis	-173.7	-156.7	-10.9	53.6	0	0	0	0	108.6
84	T	41	Very low	39.7	Very low	106 Å²	106	144 Å²	144	65%	0.65	75%	0.752	S	S	*	*			cis	-168.8	159.9	6.5	-3.8	0	0	0	0	109.9
85	I	43.6	Very low	39.3	Very low	151 Å²	151	147.3 Å²	147.3	77%	0.774	75%	0.754	S	S	*	*			trans	62.6	133.6	145.7	-69.7	165.8	0	0	0	119.1
86	V	42.4	Very low	38.9	Very low	104 Å²	104	144.3 Å²	144.3	63%	0.63	75%	0.752	S	S	*	*			cis	-166	151.1	-8.2	122.2	0	0	0	0	110.1
87	E	40.3	Very low	39	Very low	178 Å²	178	143.1 Å²	143.1	83%	0.832	75%	0.753	S	S	*	*			trans	55	152.8	164.8	-72.7	152.6	-171.8	0	0	118.9
88	D	45.1	Very low	38.7	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	75%	0.754	S	S	*	*			cis	-140.2	162.8	15.3	-171.1	56.5	0	0	0	109.8
89	P	36.5	Very low	38.7	Very low	96 Å²	96	139.1 Å²	139.1	62%	0.623	76%	0.755	S	S	*	*			trans	-102.2	133.5	-160.4	36.5	-31.6	0	0	0	116.5
90	Q	34	Very low	39	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	76%	0.758	S	S	*	*			trans	-172.6	71.5	154.3	-114.6	166.3	90	0	0	116.4
91	T	36.2	Very low	39.5	Very low	156 Å²	156	137.9 Å²	137.9	96%	0.957	75%	0.752	S	S	*	*			trans	-161.9	118.6	152.7	8.1	0	0	0	0	111.9
92	K	34.3	Very low	40.6	Very low	203 Å²	203	138.8 Å²	138.8	88%	0.883	74%	0.744	S	S	*	*			trans	-120.7	110.8	177.6	-164.1	174.4	-173.5	176.6	0	110.6
93	C	28.2	Very low	42.6	Very low	84 Å²	84	141.6 Å²	141.6	57%	0.568	74%	0.738	S	S	*	*			trans	34	104.6	165.4	-55.5	0	0	0	0	119	Y95	C93-Y95 HydrophobicContact CB-CE1 4.3Å
94	E	34.7	Very low	45.3	Very low	180 Å²	180	141.8 Å²	141.8	84%	0.841	73%	0.732	S	S	*	*			trans	-140.9	35.7	145.6	-143.5	174.1	-133.5	0	0	113.2
95	Y	33.2	Very low	48	Very low	177 Å²	177	136.8 Å²	136.8	69%	0.694	70%	0.701	S	S	*	*			trans	-78.8	151.7	154.1	56.8	-85.2	0	0	0	108.9	C93	C93-Y95 HydrophobicContact CB-CE1 4.3Å
96	M	32.7	Very low	50.5	Low	163 Å²	163	134.4 Å²	134.4	80%	0.803	69%	0.689	S	S	*	*			trans	95.1	43.2	-172.4	-54.9	-62.8	-179.1	0	0	118.5
97	L	42.8	Very low	53.2	Low	145 Å²	145	129.5 Å²	129.5	76%	0.759	66%	0.659	S	S	*	*			trans	-132.3	57.3	162.4	-72.9	178.6	0	0	0	112.6
98	N	36.3	Very low	55.9	Low	127 Å²	127	121.2 Å²	121.2	68%	0.679	62%	0.621	S	S	*	*			trans	-134.8	15.6	-166.8	-133.4	13.1	0	0	0	116.8	K102	N98-K102 WeakPolarHBondContact OD1-CE 3.28Å; N98-K102 PolarHBondContact OD1-NZ 3.18Å
99	S	43.3	Very low	58.3	Low	123 Å²	123	116.5 Å²	116.5	86%	0.86	61%	0.607	S	S	*	*			trans	-118.3	9	-175.4	53.3	0	0	0	0	115.6
100	M	51.5	Low	61.2	Low	154 Å²	154	112.8 Å²	112.8	76%	0.759	58%	0.583	S	S	*	*	S	Bend	trans	-102.6	134.6	176	-167.3	65	61.7	0	0	110.5	K102	M100-K102 PolarHBondContact O-N 3.46Å
101	P	53.2	Low	64.1	Low	110 Å²	110	108.5 Å²	108.5	71%	0.714	56%	0.564	S	S	*	*			trans	-55.1	114.8	177	-28.4	36.2	0	0	0	112.2	R103	P101-R103 PolarHBondContact O-N 3.42Å
102	K	63.9	Low	67	Low	123 Å²	123	102 Å²	102	54%	0.535	53%	0.526	S	S	.	.			trans	-73.7	88	-171.3	-68.4	178.2	-177.6	171.4	0	110.9	N98 M100 L104	N98-K102 WeakPolarHBondContact OD1-CE 3.28Å; N98-K102 PolarHBondContact OD1-NZ 3.18Å; M100-K102 PolarHBondContact O-N 3.46Å; K102-L104 PolarHBondContact O-N 2.95Å
103	R	83.4	Confident	69.8	Low	163 Å²	163	95.3 Å²	95.3	62%	0.615	51%	0.505	S	S	*	.			trans	-53.2	133.4	177.4	-63	-172.2	-173.4	-106.3	-2.5	110.6	P101 A112 Y115	P101-R103 PolarHBondContact O-N 3.42Å; R103-A112 HydrophobicContact CB-CB 4.42Å; R103-A112 VanDerWaalsContact O-CB 3.25Å; R103-A112 WeakPolarHBondContact O-CB 3.19Å; R103-A112 PolarHBondContact O-N 3.16Å; R103-Y115 PolarHBondContact NH1-OH 3.37Å
104	L	95.1	Very high	72.9	Confident	99 Å²	99	92.8 Å²	92.8	52%	0.518	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-93	151.9	179.5	-60	-179.3	0	0	0	111.4	K102 L106	K102-L104 PolarHBondContact O-N 2.95Å; L104-L106 PolarHBondContact O-N 3.49Å
105	C	97.8	Very high	75.7	Confident	1 Å²	1	90.5 Å²	90.5	1%	0.007	48%	0.479	C	S	.	.			trans	-75.5	108.7	176.8	174.3	0	0	0	0	110.1	V107 C108 G109 D110 A120 C122	C105-V107 PolarHBondContact O-N 3.25Å; C105-C108 PolarHBondContact O-N 3.16Å; C105-G109 PolarHBondContact O-N 3.37Å; C105-D110 WeakPolarHBondContact CB-O 3.4Å; C105-D110 PolarHBondContact N-O 3.39Å; C105-A120 WeakPolarHBondContact CA-O 3.45Å; C105-C122 HydrophobicContact CB-CB 3.95Å; C105-C122 PolarHBondContact SG-N 2.99Å
106	L	96.4	Very high	78.6	Confident	101 Å²	101	83.4 Å²	83.4	53%	0.529	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-26.1	-174.7	-54.6	-170.6	0	0	0	113.4	L104 V119 A120 K164 V168	L104-L106 PolarHBondContact O-N 3.49Å; L106-V119 HydrophobicContact CB-CG1 4.22Å; L106-V119 HydrophobicContact CD1-CG1 3.85Å; L106-V119 HydrophobicContact CG-CG1 4.17Å; L106-A120 PolarHBondContact N-O 2.9Å; L106-K164 WeakPolarHBondContact O-CE 3.33Å; L106-V168 HydrophobicContact CB-CB 4.13Å; L106-V168 HydrophobicContact CB-CG1 4.06Å; L106-V168 HydrophobicContact CB-CG2 4.35Å
107	V	97.9	Very high	81.6	Confident	0 Å²	0	77 Å²	77	0%	0	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-38.9	175.2	-175.2	0	0	0	0	112.6	C105 C125 I149 R161 K164 V168 M170	C105-V107 PolarHBondContact O-N 3.25Å; V107-C125 HydrophobicContact CB-CB 4.39Å; V107-C125 HydrophobicContact CG2-CB 4.45Å; V107-I149 HydrophobicContact CG1-CG2 4.22Å; V107-I149 VanDerWaalsContact O-CG2 3.3Å; V107-I149 WeakPolarHBondContact O-CG2 3.26Å; V107-R161 HydrophobicContact CG1-CG 4.37Å; V107-K164 VanDerWaalsContact O-CD 3.26Å; V107-K164 WeakPolarHBondContact O-CD 3.38Å; V107-K164 WeakPolarHBondContact O-CE 3.24Å; V107-K164 PolarHBondContact O-NZ 2.93Å; V107-V168 HydrophobicContact CG2-CG2 3.68Å; V107-M170 HydrophobicContact CG2-CE 4.41Å; V107-M170 HydrophobicContact CG2-SD 4.29Å
108	C	97.7	Very high	83.9	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.034	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	3.8	-165.6	71.1	0	0	0	0	117.7	C105 D110 C125 I149 T150 K151 R154	C105-C108 PolarHBondContact O-N 3.16Å; C108-D110 PolarHBondContact O-N 3.08Å; C108-C125 VanDerWaalsContact SG-SG 3.64Å; C108-I149 HydrophobicContact CB-CG2 4.05Å; C108-T150 CarbonylContact O-C 3.35Å; C108-T150 VanDerWaalsContact O-C 3.3Å; C108-T150 WeakPolarHBondContact O-CA 3.3Å; C108-K151 PolarHBondContact O-N 3.21Å; C108-R154 HydrophobicContact CB-CB 4.37Å; C108-R154 PolarHBondContact SG-NH1 2.72Å; C108-R154 VanDerWaalsContact SG-NH1 3.36Å
109	G	95.8	Very high	86.6	Confident	49 Å²	49	65.8 Å²	65.8	51%	0.505	37%	0.366	S	S	.	.	S	Bend	trans	71	3.1	179.2	0	0	0	0	0	115.9	C105	C105-G109 PolarHBondContact O-N 3.37Å
110	D	96.7	Very high	89.1	Confident	19 Å²	19	60.4 Å²	60.4	10%	0.102	33%	0.329	C	S	.	.	S	Bend	trans	-72.2	162	168.9	-160.1	2.7	0	0	0	111.1	C105 C108 A112 C122 K151 R154	C105-D110 WeakPolarHBondContact CB-O 3.4Å; C105-D110 PolarHBondContact N-O 3.39Å; C108-D110 PolarHBondContact O-N 3.08Å; D110-A112 PolarHBondContact O-N 3.42Å; D110-C122 HydrophobicContact CB-CB 4.1Å; D110-K151 HydrophobicContact CB-CB 4.17Å; D110-K151 HydrophobicContact CB-CD 4.01Å; D110-K151 HydrophobicContact CB-CG 4Å; D110-K151 VanDerWaalsContact OD1-CD 3.28Å; D110-K151 WeakPolarHBondContact OD1-CD 3.07Å; D110-K151 WeakPolarHBondContact OD1-CE 3.41Å; D110-K151 IonicContact OD1-NZ 3.95Å; D110-K151 PolarHBondContact OD1-NZ 3.06Å; D110-R154 VanDerWaalsContact CB-NH1 3.35Å; D110-R154 IonicContact OD2-CZ 3.16Å; D110-R154 IonicContact OD2-NH1 2.72Å; D110-R154 PolarHBondContact OD2-NH1 3.43Å; D110-R154 IonicContact OD2-NH2 2.76Å; D110-R154 PolarHBondContact OD2-NH2 2.76Å
111	I	95.4	Very high	91.2	Very high	96 Å²	96	53 Å²	53	49%	0.492	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-62.8	129.9	179.7	-57.5	175.7	0	0	0	109.4	C122	I111-C122 WeakPolarHBondContact O-CB 3.17Å
112	A	96.2	Very high	93.4	Very high	19 Å²	19	48 Å²	48	16%	0.157	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-78.8	135.8	176.6	0	0	0	0	0	111	R103 D110 G114 S121	R103-A112 HydrophobicContact CB-CB 4.42Å; R103-A112 VanDerWaalsContact O-CB 3.25Å; R103-A112 WeakPolarHBondContact O-CB 3.19Å; R103-A112 PolarHBondContact O-N 3.16Å; D110-A112 PolarHBondContact O-N 3.42Å; A112-G114 VanDerWaalsContact C-N 3.3Å; A112-S121 WeakPolarHBondContact CA-O 3.33Å
113	S	94.1	Very high	95	Very high	63 Å²	63	46.5 Å²	46.5	44%	0.441	26%	0.255	S	S	.	.			trans	-89.2	1.2	173.7	51.6	0	0	0	0	112.8	H116 S121 E123	S113-H116 PolarHBondContact OG-NE2 3.35Å; S113-S121 PolarHBondContact N-O 3.18Å; S113-S121 PolarHBondContact OG-O 3.45Å; S113-E123 WeakPolarHBondContact CB-OE1 3.25Å; S113-E123 WeakPolarHBondContact OG-CG 3.45Å; S113-E123 PolarHBondContact OG-N 3.35Å; S113-E123 PolarHBondContact OG-OE1 3.45Å
114	G	91.9	Very high	95.6	Very high	32 Å²	32	40.7 Å²	40.7	33%	0.33	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	143.7	-164.1	-178.8	0	0	0	0	0	111.9	A112 A120 S121	A112-G114 VanDerWaalsContact C-N 3.3Å; G114-A120 WeakPolarHBondContact O-CA 3.36Å; G114-S121 PolarHBondContact O-N 3.49Å
115	Y	94.1	Very high	95.8	Very high	132 Å²	132	36 Å²	36	52%	0.518	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.7	169.4	-67.4	-88.9	0	0	0	109.8	R103 V119 A120	R103-Y115 PolarHBondContact NH1-OH 3.37Å; Y115-V119 WeakPolarHBondContact CA-O 3.44Å; Y115-A120 HydrophobicContact CD1-CB 4.21Å; Y115-A120 HydrophobicContact CE1-CB 3.94Å
116	H	94.9	Very high	95.8	Very high	27 Å²	27	38.6 Å²	38.6	13%	0.125	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.1	174.4	-48.1	-77.6	0	0	0	108.1	S113 G118 V119 S121 E123 K126	S113-H116 PolarHBondContact OG-NE2 3.35Å; H116-G118 VanDerWaalsContact C-N 3.25Å; H116-G118 PolarHBondContact O-N 2.92Å; H116-V119 PolarHBondContact N-O 3.07Å; H116-V119 PolarHBondContact O-N 3.04Å; H116-S121 PolarHBondContact CD2-O 2.62Å; H116-S121 VanDerWaalsContact CD2-O 3.28Å; H116-S121 PolarHBondContact CD2-OG 3.11Å; H116-S121 PolarHBondContact NE2-O 3.18Å; H116-E123 IonicContact CE1-OE1 3.88Å; H116-E123 PolarHBondContact CE1-OE1 3.27Å; H116-E123 IonicContact NE2-OE1 3.57Å; H116-E123 PolarHBondContact NE2-OE1 2.85Å; H116-K126 HydrophobicContact CB-CB 3.95Å; H116-K126 HydrophobicContact CB-CD 4.38Å; H116-K126 HydrophobicContact CB-CG 3.85Å; H116-K126 PolarHBondContact CE1-NZ 3.44Å; H116-K126 WeakPolarHBondContact ND1-CD 3.37Å; H116-K126 WeakPolarHBondContact ND1-CE 3.41Å
117	Y	94.9	Very high	95.8	Very high	30 Å²	30	35.9 Å²	35.9	12%	0.118	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	42.4	-177.4	-46.2	-64.9	0	0	0	112.5	V119 K126 F129 K130 M170 L171 G174 V175	Y117-V119 VanDerWaalsContact C-N 3.34Å; Y117-V119 PolarHBondContact O-N 2.77Å; Y117-K126 HydrophobicContact CE2-CB 4.43Å; Y117-K126 HydrophobicContact CE2-CG 3.98Å; Y117-F129 HydrophobicContact CD1-CD1 4.32Å; Y117-F129 HydrophobicContact CD1-CE1 4.41Å; Y117-F129 HydrophobicContact CD2-CB 4.4Å; Y117-F129 AromaticContact CD2-CD1 3.56Å; Y117-F129 HydrophobicContact CD2-CD1 3.56Å; Y117-F129 HydrophobicContact CD2-CE1 4.28Å; Y117-F129 HydrophobicContact CD2-CG 4.32Å; Y117-F129 HydrophobicContact CE2-CD1 4.1Å; Y117-F129 AromaticContact CG-CD1 3.7Å; Y117-F129 HydrophobicContact CG-CD1 3.7Å; Y117-F129 AromaticContact CG-CE1 3.94Å; Y117-F129 HydrophobicContact CG-CE1 3.94Å; Y117-K130 HydrophobicContact CE2-CB 4.45Å; Y117-K130 WeakPolarHBondContact OH-CB 3.3Å; Y117-M170 WeakPolarHBondContact O-CA 3.23Å; Y117-L171 PolarHBondContact O-N 3.45Å; Y117-G174 WeakPolarHBondContact CD1-O 3.13Å; Y117-G174 VanDerWaalsContact CE1-O 3.25Å; Y117-G174 WeakPolarHBondContact CE1-O 3.04Å; Y117-V175 HydrophobicContact CD1-CG2 3.71Å; Y117-V175 HydrophobicContact CE1-CB 4.38Å; Y117-V175 HydrophobicContact CE1-CG2 3.49Å; Y117-V175 VanDerWaalsContact CE1-CG2 3.49Å; Y117-V175 HydrophobicContact CG-CG2 4.41Å
118	G	90.8	Very high	95.8	Very high	26 Å²	26	36.3 Å²	36.3	27%	0.268	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	-22.5	-176.7	0	0	0	0	0	115.9	H116	H116-G118 VanDerWaalsContact C-N 3.25Å; H116-G118 PolarHBondContact O-N 2.92Å
119	V	93	Very high	95.8	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.055	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.2	-163.3	-168.8	0	0	0	0	113.9	L106 Y115 H116 Y117 S121 V168 G169 M170	L106-V119 HydrophobicContact CB-CG1 4.22Å; L106-V119 HydrophobicContact CD1-CG1 3.85Å; L106-V119 HydrophobicContact CG-CG1 4.17Å; Y115-V119 WeakPolarHBondContact CA-O 3.44Å; H116-V119 PolarHBondContact N-O 3.07Å; H116-V119 PolarHBondContact O-N 3.04Å; Y117-V119 VanDerWaalsContact C-N 3.34Å; Y117-V119 PolarHBondContact O-N 2.77Å; V119-S121 PolarHBondContact O-N 3.3Å; V119-S121 VanDerWaalsContact O-N 3.08Å; V119-S121 PolarHBondContact O-OG 3.12Å; V119-V168 HydrophobicContact CG1-CB 4.34Å; V119-V168 HydrophobicContact CG1-CG2 3.88Å; V119-V168 HydrophobicContact CG2-CG2 4.49Å; V119-V168 WeakPolarHBondContact CG2-O 3.31Å; V119-G169 VanDerWaalsContact CG2-O 3.24Å; V119-G169 WeakPolarHBondContact CG2-O 3.14Å; V119-M170 HydrophobicContact CB-CE 4.32Å; V119-M170 HydrophobicContact CB-CG 4.01Å; V119-M170 HydrophobicContact CG2-CB 4.38Å; V119-M170 HydrophobicContact CG2-CG 3.7Å
120	A	95.7	Very high	95.8	Very high	10 Å²	10	38 Å²	38	8%	0.083	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	110.4	171.2	0	0	0	0	0	110.6	C105 L106 G114 Y115	C105-A120 WeakPolarHBondContact CA-O 3.45Å; L106-A120 PolarHBondContact N-O 2.9Å; G114-A120 WeakPolarHBondContact O-CA 3.36Å; Y115-A120 HydrophobicContact CD1-CB 4.21Å; Y115-A120 HydrophobicContact CE1-CB 3.94Å
121	S	97	Very high	95.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	157.1	-169.8	53.2	0	0	0	0	114.4	A112 S113 G114 H116 V119 M170	A112-S121 WeakPolarHBondContact CA-O 3.33Å; S113-S121 PolarHBondContact N-O 3.18Å; S113-S121 PolarHBondContact OG-O 3.45Å; G114-S121 PolarHBondContact O-N 3.49Å; H116-S121 PolarHBondContact CD2-O 2.62Å; H116-S121 VanDerWaalsContact CD2-O 3.28Å; H116-S121 PolarHBondContact CD2-OG 3.11Å; H116-S121 PolarHBondContact NE2-O 3.18Å; V119-S121 PolarHBondContact O-N 3.3Å; V119-S121 VanDerWaalsContact O-N 3.08Å; V119-S121 PolarHBondContact O-OG 3.12Å; S121-M170 VanDerWaalsContact CB-CE 3.47Å; S121-M170 WeakPolarHBondContact OG-CE 3.39Å
122	C	98.1	Very high	95.8	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.027	22%	0.217	C	C	.	.			trans	-83.4	154.2	176.3	69.7	0	0	0	0	111.6	C105 D110 I111 A124 C125 K126 R154	C105-C122 HydrophobicContact CB-CB 3.95Å; C105-C122 PolarHBondContact SG-N 2.99Å; D110-C122 HydrophobicContact CB-CB 4.1Å; I111-C122 WeakPolarHBondContact O-CB 3.17Å; C122-A124 PolarHBondContact O-N 3.02Å; C122-A124 VanDerWaalsContact O-N 3.1Å; C122-C125 PolarHBondContact O-N 3.11Å; C122-C125 VanDerWaalsContact SG-SG 3.67Å; C122-K126 PolarHBondContact O-N 2.95Å; C122-K126 VanDerWaalsContact O-N 3.09Å; C122-R154 PolarHBondContact SG-NH1 3.38Å
123	E	97.4	Very high	95.7	Very high	91 Å²	91	40.8 Å²	40.8	43%	0.425	22%	0.216	S	C	.	.	H	α-helix	trans	-49.5	-39	177.3	-69.1	-58	117	0	0	113.3	S113 H116 C125 K126 A127	S113-E123 WeakPolarHBondContact CB-OE1 3.25Å; S113-E123 WeakPolarHBondContact OG-CG 3.45Å; S113-E123 PolarHBondContact OG-N 3.35Å; S113-E123 PolarHBondContact OG-OE1 3.45Å; H116-E123 IonicContact CE1-OE1 3.88Å; H116-E123 PolarHBondContact CE1-OE1 3.27Å; H116-E123 IonicContact NE2-OE1 3.57Å; H116-E123 PolarHBondContact NE2-OE1 2.85Å; E123-C125 VanDerWaalsContact C-N 3.3Å; E123-C125 PolarHBondContact O-N 2.86Å; E123-K126 PolarHBondContact O-N 2.93Å; E123-K126 WeakPolarHBondContact OE1-CD 3.39Å; E123-K126 IonicContact OE1-NZ 3.78Å; E123-K126 PolarHBondContact OE1-NZ 3.41Å; E123-K126 VanDerWaalsContact OE2-CD 3.25Å; E123-K126 WeakPolarHBondContact OE2-CD 3.33Å; E123-K126 WeakPolarHBondContact OE2-CE 3.35Å; E123-K126 IonicContact OE2-NZ 3.48Å; E123-K126 PolarHBondContact OE2-NZ 3.32Å; E123-A127 VanDerWaalsContact O-CB 3.27Å; E123-A127 WeakPolarHBondContact O-CB 3.47Å; E123-A127 PolarHBondContact O-N 2.84Å
124	A	97.6	Very high	95.6	Very high	41 Å²	41	39.8 Å²	39.8	34%	0.339	20%	0.204	S	C	.	.	H	α-helix	trans	-65.7	-28.6	-179.8	0	0	0	0	0	113.7	C122 F128 R161	C122-A124 PolarHBondContact O-N 3.02Å; C122-A124 VanDerWaalsContact O-N 3.1Å; A124-F128 WeakPolarHBondContact O-CB 3.38Å; A124-F128 PolarHBondContact O-N 3.19Å; A124-R161 PolarHBondContact O-NH2 3.29Å
125	C	98.4	Very high	95.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-86.5	-40.9	176	-70.9	0	0	0	0	111.7	V107 C108 C122 E123 A127 F128 F129 R161	V107-C125 HydrophobicContact CB-CB 4.39Å; V107-C125 HydrophobicContact CG2-CB 4.45Å; C108-C125 VanDerWaalsContact SG-SG 3.64Å; C122-C125 PolarHBondContact O-N 3.11Å; C122-C125 VanDerWaalsContact SG-SG 3.67Å; E123-C125 VanDerWaalsContact C-N 3.3Å; E123-C125 PolarHBondContact O-N 2.86Å; C125-A127 PolarHBondContact O-N 3.39Å; C125-F128 WeakPolarHBondContact O-CB 3.22Å; C125-F128 PolarHBondContact O-N 3.04Å; C125-F128 VanDerWaalsContact O-N 3.13Å; C125-F129 WeakPolarHBondContact O-CB 3.43Å; C125-F129 PolarHBondContact O-N 3.16Å; C125-R161 PolarHBondContact SG-NH2 2.81Å
126	K	97.3	Very high	95.4	Very high	56 Å²	56	40.4 Å²	40.4	24%	0.243	22%	0.22	C	C	.	.	H	α-helix	trans	-50.2	-53.6	167.5	169.4	-158.3	-166.4	-179.9	0	111.9	H116 Y117 C122 E123 F128 F129 K130	H116-K126 HydrophobicContact CB-CB 3.95Å; H116-K126 HydrophobicContact CB-CD 4.38Å; H116-K126 HydrophobicContact CB-CG 3.85Å; H116-K126 PolarHBondContact CE1-NZ 3.44Å; H116-K126 WeakPolarHBondContact ND1-CD 3.37Å; H116-K126 WeakPolarHBondContact ND1-CE 3.41Å; Y117-K126 HydrophobicContact CE2-CB 4.43Å; Y117-K126 HydrophobicContact CE2-CG 3.98Å; C122-K126 PolarHBondContact O-N 2.95Å; C122-K126 VanDerWaalsContact O-N 3.09Å; E123-K126 PolarHBondContact O-N 2.93Å; E123-K126 WeakPolarHBondContact OE1-CD 3.39Å; E123-K126 IonicContact OE1-NZ 3.78Å; E123-K126 PolarHBondContact OE1-NZ 3.41Å; E123-K126 VanDerWaalsContact OE2-CD 3.25Å; E123-K126 WeakPolarHBondContact OE2-CD 3.33Å; E123-K126 WeakPolarHBondContact OE2-CE 3.35Å; E123-K126 IonicContact OE2-NZ 3.48Å; E123-K126 PolarHBondContact OE2-NZ 3.32Å; K126-F128 VanDerWaalsContact C-N 3.26Å; K126-F128 PolarHBondContact O-N 2.97Å; K126-F129 PolarHBondContact O-N 2.84Å; K126-K130 WeakPolarHBondContact O-CB 3.24Å; K126-K130 PolarHBondContact O-N 3.19Å
127	A	96.8	Very high	95.4	Very high	45 Å²	45	42.4 Å²	42.4	37%	0.372	23%	0.23	S	C	.	.	H	α-helix	trans	-73.3	-14.1	-179.9	0	0	0	0	0	114.1	E123 C125 R131	E123-A127 VanDerWaalsContact O-CB 3.27Å; E123-A127 WeakPolarHBondContact O-CB 3.47Å; E123-A127 PolarHBondContact O-N 2.84Å; C125-A127 PolarHBondContact O-N 3.39Å; A127-R131 WeakPolarHBondContact O-CG 3.22Å; A127-R131 PolarHBondContact O-NE 2.91Å
128	F	98.3	Very high	95.4	Very high	9 Å²	9	49.3 Å²	49.3	4%	0.039	26%	0.264	C	S	.	.	H	α-helix	trans	-81.7	-54.1	169.8	170.1	-106.1	0	0	0	110.5	A124 C125 K126 K130 R131 T132 Y139 Q158 R161 F162	A124-F128 WeakPolarHBondContact O-CB 3.38Å; A124-F128 PolarHBondContact O-N 3.19Å; C125-F128 WeakPolarHBondContact O-CB 3.22Å; C125-F128 PolarHBondContact O-N 3.04Å; C125-F128 VanDerWaalsContact O-N 3.13Å; K126-F128 VanDerWaalsContact C-N 3.26Å; K126-F128 PolarHBondContact O-N 2.97Å; F128-K130 PolarHBondContact O-N 2.89Å; F128-R131 PolarHBondContact O-N 3.36Å; F128-R131 VanDerWaalsContact O-N 3.12Å; F128-T132 PolarHBondContact O-N 2.85Å; F128-T132 PolarHBondContact O-OG1 3.34Å; F128-Y139 AromaticContact CE2-CE2 3.74Å; F128-Y139 HydrophobicContact CE2-CE2 3.74Å; F128-Y139 AromaticContact CE2-CZ 3.96Å; F128-Y139 HydrophobicContact CZ-CD2 4.29Å; F128-Y139 AromaticContact CZ-CE2 3.6Å; F128-Y139 HydrophobicContact CZ-CE2 3.6Å; F128-Q158 HydrophobicContact CE2-CB 4.26Å; F128-Q158 HydrophobicContact CZ-CB 4.34Å; F128-Q158 WeakPolarHBondContact CZ-O 3.42Å; F128-R161 HydrophobicContact CD1-CG 3.91Å; F128-R161 HydrophobicContact CE1-CB 3.92Å; F128-R161 HydrophobicContact CE1-CG 3.58Å; F128-R161 HydrophobicContact CZ-CB 4.15Å; F128-R161 HydrophobicContact CZ-CG 4.2Å; F128-F162 HydrophobicContact CE1-CB 3.85Å; F128-F162 HydrophobicContact CE1-CD2 4.49Å; F128-F162 HydrophobicContact CZ-CB 3.96Å
129	F	97.6	Very high	95.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55.7	-48	178.3	-170.4	-98.5	0	0	0	111.8	Y117 C125 K126 R131 T132 I133 F162 C165 L166 M170 L171 K172 V175	Y117-F129 HydrophobicContact CD1-CD1 4.32Å; Y117-F129 HydrophobicContact CD1-CE1 4.41Å; Y117-F129 HydrophobicContact CD2-CB 4.4Å; Y117-F129 AromaticContact CD2-CD1 3.56Å; Y117-F129 HydrophobicContact CD2-CD1 3.56Å; Y117-F129 HydrophobicContact CD2-CE1 4.28Å; Y117-F129 HydrophobicContact CD2-CG 4.32Å; Y117-F129 HydrophobicContact CE2-CD1 4.1Å; Y117-F129 AromaticContact CG-CD1 3.7Å; Y117-F129 HydrophobicContact CG-CD1 3.7Å; Y117-F129 AromaticContact CG-CE1 3.94Å; Y117-F129 HydrophobicContact CG-CE1 3.94Å; C125-F129 WeakPolarHBondContact O-CB 3.43Å; C125-F129 PolarHBondContact O-N 3.16Å; K126-F129 PolarHBondContact O-N 2.84Å; F129-R131 VanDerWaalsContact C-N 3.33Å; F129-R131 PolarHBondContact O-N 3.3Å; F129-T132 PolarHBondContact O-N 2.69Å; F129-I133 HydrophobicContact CD1-CG1 4.32Å; F129-I133 HydrophobicContact CE1-CG1 3.99Å; F129-I133 HydrophobicContact CZ-CD1 4.31Å; F129-I133 HydrophobicContact CZ-CG1 4.1Å; F129-I133 PolarHBondContact O-N 3.43Å; F129-F162 HydrophobicContact CD2-CD2 4.02Å; F129-F162 AromaticContact CD2-CE2 3.72Å; F129-F162 HydrophobicContact CD2-CE2 3.72Å; F129-F162 HydrophobicContact CE2-CD2 4.31Å; F129-F162 AromaticContact CE2-CE2 3.68Å; F129-F162 HydrophobicContact CE2-CE2 3.68Å; F129-C165 HydrophobicContact CD2-CB 3.68Å; F129-C165 HydrophobicContact CE2-CB 4.16Å; F129-L166 HydrophobicContact CE2-CD2 3.83Å; F129-L166 HydrophobicContact CE2-CG 4.46Å; F129-L166 HydrophobicContact CZ-CD2 4.21Å; F129-M170 HydrophobicContact CB-SD 4.07Å; F129-M170 HydrophobicContact CD1-CB 4.42Å; F129-M170 HydrophobicContact CD2-CB 3.92Å; F129-M170 HydrophobicContact CD2-SD 3.98Å; F129-M170 HydrophobicContact CE1-CB 4.1Å; F129-M170 HydrophobicContact CE2-CB 3.56Å; F129-M170 HydrophobicContact CG-CB 4.33Å; F129-M170 HydrophobicContact CG-SD 3.95Å; F129-M170 HydrophobicContact CZ-CB 3.66Å; F129-M170 VanDerWaalsContact CZ-O 3.24Å; F129-M170 WeakPolarHBondContact CZ-O 3.4Å; F129-L171 WeakPolarHBondContact CE1-O 3.37Å; F129-K172 HydrophobicContact CZ-CG 4.3Å; F129-V175 HydrophobicContact CD1-CG2 3.8Å; F129-V175 HydrophobicContact CE1-CG2 3.75Å
130	K	95.2	Very high	95.7	Very high	89 Å²	89	56 Å²	56	39%	0.387	30%	0.298	S	S	.	.	H	α-helix	trans	-53.3	-46.7	175.7	-173.7	179	171.3	179.3	0	112.7	Y117 K126 F128 Q134 V175	Y117-K130 HydrophobicContact CE2-CB 4.45Å; Y117-K130 WeakPolarHBondContact OH-CB 3.3Å; K126-K130 WeakPolarHBondContact O-CB 3.24Å; K126-K130 PolarHBondContact O-N 3.19Å; F128-K130 PolarHBondContact O-N 2.89Å; K130-Q134 VanDerWaalsContact CE-CD 3.43Å; K130-Q134 HydrophobicContact CG-CG 4.28Å; K130-Q134 VanDerWaalsContact O-CB 3.3Å; K130-Q134 WeakPolarHBondContact O-CB 3.45Å; K130-Q134 WeakPolarHBondContact O-CG 3.48Å; K130-Q134 PolarHBondContact O-N 3.33Å; K130-V175 HydrophobicContact CG-CG1 4.19Å
131	R	95.7	Very high	95.8	Very high	162 Å²	162	56.5 Å²	56.5	61%	0.611	30%	0.301	S	S	*	.	H	α-helix	trans	-71.6	-33.9	-178.3	-75.8	-175.3	-65.9	154.8	2.7	112.6	A127 F128 F129 G135	A127-R131 WeakPolarHBondContact O-CG 3.22Å; A127-R131 PolarHBondContact O-NE 2.91Å; F128-R131 PolarHBondContact O-N 3.36Å; F128-R131 VanDerWaalsContact O-N 3.12Å; F129-R131 VanDerWaalsContact C-N 3.33Å; F129-R131 PolarHBondContact O-N 3.3Å; R131-G135 PolarHBondContact O-N 3.2Å
132	T	96.5	Very high	95.6	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-63.5	-48.4	176.4	-46.1	0	0	0	0	110.1	F128 F129 N136 I137 Y139 F162	F128-T132 PolarHBondContact O-N 2.85Å; F128-T132 PolarHBondContact O-OG1 3.34Å; F129-T132 PolarHBondContact O-N 2.69Å; T132-N136 PolarHBondContact O-N 3.01Å; T132-N136 VanDerWaalsContact O-N 3.16Å; T132-I137 HydrophobicContact CG2-CB 4.28Å; T132-I137 VanDerWaalsContact CG2-O 3.28Å; T132-I137 WeakPolarHBondContact CG2-O 3.27Å; T132-I137 PolarHBondContact O-N 3.46Å; T132-Y139 HydrophobicContact CG2-CD2 4.13Å; T132-Y139 HydrophobicContact CG2-CE2 3.51Å; T132-F162 HydrophobicContact CG2-CD1 4Å; T132-F162 HydrophobicContact CG2-CD2 3.6Å; T132-F162 HydrophobicContact CG2-CE1 3.96Å; T132-F162 HydrophobicContact CG2-CE2 3.57Å; T132-F162 HydrophobicContact CG2-CG 3.82Å; T132-F162 HydrophobicContact CG2-CZ 3.76Å
133	I	94.3	Very high	95.3	Very high	27 Å²	27	64.7 Å²	64.7	14%	0.138	36%	0.359	C	S	.	.	H	α-helix	trans	-71	-48.4	178.7	-54.1	-62.6	0	0	0	112.1	F129 G135 N136 F162 K172 V175 L177	F129-I133 HydrophobicContact CD1-CG1 4.32Å; F129-I133 HydrophobicContact CE1-CG1 3.99Å; F129-I133 HydrophobicContact CZ-CD1 4.31Å; F129-I133 HydrophobicContact CZ-CG1 4.1Å; F129-I133 PolarHBondContact O-N 3.43Å; I133-G135 PolarHBondContact O-N 3.43Å; I133-G135 VanDerWaalsContact O-N 3.16Å; I133-N136 PolarHBondContact O-N 2.98Å; I133-N136 VanDerWaalsContact O-N 3.08Å; I133-F162 HydrophobicContact CD1-CE2 3.92Å; I133-F162 HydrophobicContact CD1-CZ 3.67Å; I133-F162 HydrophobicContact CG1-CE2 4.47Å; I133-K172 HydrophobicContact CD1-CB 4.21Å; I133-K172 HydrophobicContact CD1-CD 4.33Å; I133-K172 HydrophobicContact CD1-CG 3.91Å; I133-V175 HydrophobicContact CB-CB 3.97Å; I133-V175 HydrophobicContact CB-CG1 3.96Å; I133-V175 HydrophobicContact CB-CG2 4.02Å; I133-V175 HydrophobicContact CG1-CB 4.47Å; I133-V175 HydrophobicContact CG1-CG2 4.05Å; I133-V175 HydrophobicContact CG2-CB 3.78Å; I133-V175 HydrophobicContact CG2-CG1 3.98Å; I133-V175 HydrophobicContact CG2-CG2 4.29Å; I133-L177 HydrophobicContact CG2-CD2 4.05Å
134	Q	91.5	Very high	95.1	Very high	42 Å²	42	65 Å²	65	20%	0.196	37%	0.367	C	S	.	.	H	α-helix	trans	-69.7	-9	-179.9	-69.8	-165.7	-38.9	0	0	115.2	K130 V175 R176 R179	K130-Q134 VanDerWaalsContact CE-CD 3.43Å; K130-Q134 HydrophobicContact CG-CG 4.28Å; K130-Q134 VanDerWaalsContact O-CB 3.3Å; K130-Q134 WeakPolarHBondContact O-CB 3.45Å; K130-Q134 WeakPolarHBondContact O-CG 3.48Å; K130-Q134 PolarHBondContact O-N 3.33Å; Q134-V175 HydrophobicContact CG-CG1 3.47Å; Q134-V175 VanDerWaalsContact CG-CG1 3.47Å; Q134-R176 PolarHBondContact NE2-O 3.17Å; Q134-R179 PolarHBondContact O-NH2 2.92Å
135	G	92.2	Very high	94.8	Very high	43 Å²	43	67 Å²	67	44%	0.443	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	0.5	172.2	0	0	0	0	0	113.8	R131 I133 I137	R131-G135 PolarHBondContact O-N 3.2Å; I133-G135 PolarHBondContact O-N 3.43Å; I133-G135 VanDerWaalsContact O-N 3.16Å; G135-I137 PolarHBondContact O-N 3.13Å
136	N	91.3	Very high	94.6	Very high	135 Å²	135	74.3 Å²	74.3	72%	0.722	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.2	46.9	-168.7	-162.4	60.3	0	0	0	112.9	T132 I133 E138	T132-N136 PolarHBondContact O-N 3.01Å; T132-N136 VanDerWaalsContact O-N 3.16Å; I133-N136 PolarHBondContact O-N 2.98Å; I133-N136 VanDerWaalsContact O-N 3.08Å; N136-E138 PolarHBondContact O-N 2.86Å
137	I	94.8	Very high	94.5	Very high	69 Å²	69	73.7 Å²	73.7	35%	0.354	41%	0.408	S	S	.	.			trans	-86.8	116.4	-168.5	-46.4	179.1	0	0	0	110.1	T132 G135 Y139	T132-I137 HydrophobicContact CG2-CB 4.28Å; T132-I137 VanDerWaalsContact CG2-O 3.28Å; T132-I137 WeakPolarHBondContact CG2-O 3.27Å; T132-I137 PolarHBondContact O-N 3.46Å; G135-I137 PolarHBondContact O-N 3.13Å; I137-Y139 HydrophobicContact CB-CE1 4.37Å; I137-Y139 HydrophobicContact CG2-CD1 3.98Å; I137-Y139 HydrophobicContact CG2-CE1 3.42Å; I137-Y139 VanDerWaalsContact CG2-CE1 3.42Å
138	E	93.9	Very high	94.4	Very high	175 Å²	175	76.7 Å²	76.7	82%	0.818	41%	0.414	S	S	*	.			trans	-85.3	145.9	168.8	-60.4	-169	169.4	0	0	111	N136	N136-E138 PolarHBondContact O-N 2.86Å
139	Y	96.2	Very high	94.3	Very high	59 Å²	59	76.6 Å²	76.6	23%	0.231	41%	0.414	C	S	.	.			trans	-132.3	126.8	-178.1	-64.3	-51.1	0	0	0	110.6	F128 T132 I137 Q158 A159 F162	F128-Y139 AromaticContact CE2-CE2 3.74Å; F128-Y139 HydrophobicContact CE2-CE2 3.74Å; F128-Y139 AromaticContact CE2-CZ 3.96Å; F128-Y139 HydrophobicContact CZ-CD2 4.29Å; F128-Y139 AromaticContact CZ-CE2 3.6Å; F128-Y139 HydrophobicContact CZ-CE2 3.6Å; T132-Y139 HydrophobicContact CG2-CD2 4.13Å; T132-Y139 HydrophobicContact CG2-CE2 3.51Å; I137-Y139 HydrophobicContact CB-CE1 4.37Å; I137-Y139 HydrophobicContact CG2-CD1 3.98Å; I137-Y139 HydrophobicContact CG2-CE1 3.42Å; I137-Y139 VanDerWaalsContact CG2-CE1 3.42Å; Y139-Q158 HydrophobicContact CD1-CB 3.86Å; Y139-Q158 HydrophobicContact CD2-CB 4.01Å; Y139-Q158 HydrophobicContact CE1-CB 3.93Å; Y139-Q158 HydrophobicContact CE2-CB 4.08Å; Y139-Q158 HydrophobicContact CG-CB 3.9Å; Y139-Q158 PolarHBondContact OH-OE1 3.46Å; Y139-A159 WeakPolarHBondContact O-CB 3.4Å; Y139-F162 HydrophobicContact CD2-CB 4Å; Y139-F162 HydrophobicContact CD2-CG 4.48Å; Y139-F162 HydrophobicContact CE2-CB 4.32Å
140	S	94.7	Very high	94.3	Very high	116 Å²	116	78.3 Å²	78.3	81%	0.811	43%	0.425	S	S	*	.			trans	-92.1	147	166.7	-63.2	0	0	0	0	110.9
141	C	96.9	Very high	94.3	Very high	21 Å²	21	79.5 Å²	79.5	14%	0.142	43%	0.43	C	S	.	.			trans	-85.1	135.2	170.4	-172.7	0	0	0	0	110	A143 N145 C157 A159	C141-A143 PolarHBondContact O-N 3.35Å; C141-A143 PolarHBondContact SG-N 3.41Å; C141-A143 VanDerWaalsContact SG-N 3.39Å; C141-A143 PolarHBondContact SG-O 2.86Å; C141-N145 HydrophobicContact CB-CB 4.35Å; C141-N145 WeakPolarHBondContact CB-OD1 3.37Å; C141-N145 PolarHBondContact SG-N 3.33Å; C141-C157 VanDerWaalsContact SG-SG 3.6Å; C141-A159 HydrophobicContact CB-CB 4.06Å
142	P	93.9	Very high	94.4	Very high	119 Å²	119	82.8 Å²	82.8	77%	0.773	44%	0.443	S	S	*	.	S	Bend	trans	-79.2	17.9	171.5	35.2	-37.3	0	0	0	113.1
143	A	91.8	Very high	94.3	Very high	57 Å²	57	89.3 Å²	89.3	47%	0.471	47%	0.467	S	S	.	.	S	Bend	trans	-156.6	-162.2	-174.9	0	0	0	0	0	109.2	C141 N145	C141-A143 PolarHBondContact O-N 3.35Å; C141-A143 PolarHBondContact SG-N 3.41Å; C141-A143 VanDerWaalsContact SG-N 3.39Å; C141-A143 PolarHBondContact SG-O 2.86Å; A143-N145 PolarHBondContact O-N 3.45Å
144	T	92.6	Very high	94.4	Very high	97 Å²	97	90 Å²	90	60%	0.595	47%	0.467	S	S	*	.	S	Bend	trans	-69.8	9.5	-170.7	60.8	0	0	0	0	116.8	E146	T144-E146 WeakPolarHBondContact CB-OE2 3.41Å; T144-E146 PolarHBondContact O-N 3.09Å; T144-E146 PolarHBondContact OG1-OE2 2.86Å
145	N	91.6	Very high	94.7	Very high	83 Å²	83	96.6 Å²	96.6	44%	0.444	50%	0.496	S	S	.	.	S	Bend	trans	67	5	-167.2	-60.3	-75.9	0	0	0	116.1	C141 A143 C160 M163	C141-N145 HydrophobicContact CB-CB 4.35Å; C141-N145 WeakPolarHBondContact CB-OD1 3.37Å; C141-N145 PolarHBondContact SG-N 3.33Å; A143-N145 PolarHBondContact O-N 3.45Å; N145-C160 VanDerWaalsContact CA-SG 3.59Å; N145-C160 PolarHBondContact O-SG 2.8Å; N145-M163 HydrophobicContact CB-CE 4.2Å; N145-M163 WeakPolarHBondContact O-CE 3.33Å
146	E	93.3	Very high	94.8	Very high	154 Å²	154	99 Å²	99	72%	0.72	51%	0.506	S	S	*	.			trans	-100.1	11.1	-174.4	-62	163.5	129.5	0	0	114.3	T144 E148	T144-E146 WeakPolarHBondContact CB-OE2 3.41Å; T144-E146 PolarHBondContact O-N 3.09Å; T144-E146 PolarHBondContact OG1-OE2 2.86Å; E146-E148 PolarHBondContact O-N 2.9Å
147	C	95.8	Very high	95.1	Very high	42 Å²	42	92.9 Å²	92.9	28%	0.284	47%	0.473	S	S	.	.			trans	-58.1	122.1	-171.3	-54.2	0	0	0	0	113.4	I149 C157 C160	C147-I149 WeakPolarHBondContact O-CD1 3.47Å; C147-I149 WeakPolarHBondContact O-CG1 3.17Å; C147-I149 PolarHBondContact O-N 3.37Å; C147-C157 HydrophobicContact CB-CB 3.77Å; C147-C160 HydrophobicContact CB-CB 3.88Å
148	E	94.8	Very high	95.3	Very high	108 Å²	108	94.5 Å²	94.5	51%	0.505	48%	0.479	S	S	.	.			trans	-65.2	122.4	-177.8	-175.1	-121.2	-157.2	0	0	112.8	E146 T150 R153	E146-E148 PolarHBondContact O-N 2.9Å; E148-T150 HydrophobicContact CG-CG2 4.26Å; E148-T150 WeakPolarHBondContact OE1-CG2 3.48Å; E148-T150 VanDerWaalsContact OE2-CG2 3.32Å; E148-T150 WeakPolarHBondContact OE2-CG2 3.22Å; E148-R153 IonicContact OE1-NH2 3.11Å; E148-R153 PolarHBondContact OE1-NH2 2.74Å; E148-R153 IonicContact OE2-CZ 3.69Å; E148-R153 IonicContact OE2-NE 2.69Å; E148-R153 PolarHBondContact OE2-NE 3.23Å; E148-R153 IonicContact OE2-NH2 2.58Å; E148-R153 PolarHBondContact OE2-NH2 2.94Å
149	I	96.7	Very high	95.5	Very high	7 Å²	7	86.6 Å²	86.6	4%	0.036	44%	0.444	C	S	.	.			trans	-101.2	103.5	-174.1	-52.8	-57.5	0	0	0	111.1	V107 C108 C147 R154 C160 R161 K164	V107-I149 HydrophobicContact CG1-CG2 4.22Å; V107-I149 VanDerWaalsContact O-CG2 3.3Å; V107-I149 WeakPolarHBondContact O-CG2 3.26Å; C108-I149 HydrophobicContact CB-CG2 4.05Å; C147-I149 WeakPolarHBondContact O-CD1 3.47Å; C147-I149 WeakPolarHBondContact O-CG1 3.17Å; C147-I149 PolarHBondContact O-N 3.37Å; I149-R154 HydrophobicContact CG2-CB 4.06Å; I149-C160 HydrophobicContact CD1-CB 3.98Å; I149-C160 HydrophobicContact CG1-CB 4.43Å; I149-R161 HydrophobicContact CD1-CB 3.97Å; I149-R161 HydrophobicContact CG1-CB 4.43Å; I149-R161 HydrophobicContact CG2-CB 4.48Å; I149-R161 HydrophobicContact CG2-CG 4.14Å; I149-K164 HydrophobicContact CB-CD 3.86Å; I149-K164 HydrophobicContact CG1-CB 4.45Å; I149-K164 HydrophobicContact CG1-CD 4.14Å; I149-K164 HydrophobicContact CG2-CD 4.46Å; I149-K164 PolarHBondContact O-NZ 3.41Å
150	T	96.3	Very high	95.5	Very high	36 Å²	36	84 Å²	84	22%	0.221	44%	0.435	C	S	.	.			trans	-122.2	168	176.2	59.2	0	0	0	0	112.2	C108 E148 R152 R153 R154	C108-T150 CarbonylContact O-C 3.35Å; C108-T150 VanDerWaalsContact O-C 3.3Å; C108-T150 WeakPolarHBondContact O-CA 3.3Å; E148-T150 HydrophobicContact CG-CG2 4.26Å; E148-T150 WeakPolarHBondContact OE1-CG2 3.48Å; E148-T150 VanDerWaalsContact OE2-CG2 3.32Å; E148-T150 WeakPolarHBondContact OE2-CG2 3.22Å; T150-R152 PolarHBondContact O-N 3.32Å; T150-R152 VanDerWaalsContact O-N 3.09Å; T150-R153 PolarHBondContact O-N 3.49Å; T150-R153 VanDerWaalsContact O-N 3.14Å; T150-R153 PolarHBondContact OG1-N 3.06Å; T150-R153 VanDerWaalsContact OG1-N 3.15Å; T150-R154 VanDerWaalsContact O-CB 3.22Å; T150-R154 WeakPolarHBondContact O-CB 3.34Å; T150-R154 WeakPolarHBondContact O-CG 3.34Å; T150-R154 PolarHBondContact O-N 2.91Å
151	K	96.3	Very high	95.7	Very high	114 Å²	114	79.4 Å²	79.4	50%	0.496	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-37.2	175.3	-178.7	174.4	-178	155.5	0	112.8	C108 D110 R154	C108-K151 PolarHBondContact O-N 3.21Å; D110-K151 HydrophobicContact CB-CB 4.17Å; D110-K151 HydrophobicContact CB-CD 4.01Å; D110-K151 HydrophobicContact CB-CG 4Å; D110-K151 VanDerWaalsContact OD1-CD 3.28Å; D110-K151 WeakPolarHBondContact OD1-CD 3.07Å; D110-K151 WeakPolarHBondContact OD1-CE 3.41Å; D110-K151 IonicContact OD1-NZ 3.95Å; D110-K151 PolarHBondContact OD1-NZ 3.06Å; K151-R154 PolarHBondContact O-NE 3.36Å
152	R	96.6	Very high	95.8	Very high	232 Å²	232	80.1 Å²	80.1	88%	0.875	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-51.6	175.4	-67.3	-169.3	-81.5	-171.1	-3.3	112.3	T150	T150-R152 PolarHBondContact O-N 3.32Å; T150-R152 VanDerWaalsContact O-N 3.09Å
153	R	95.7	Very high	95.9	Very high	140 Å²	140	79.2 Å²	79.2	53%	0.528	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.1	-172	-70	-173	-87.4	-109.4	5.1	116.2	E148 T150 K155 S156	E148-R153 IonicContact OE1-NH2 3.11Å; E148-R153 PolarHBondContact OE1-NH2 2.74Å; E148-R153 IonicContact OE2-CZ 3.69Å; E148-R153 IonicContact OE2-NE 2.69Å; E148-R153 PolarHBondContact OE2-NE 3.23Å; E148-R153 IonicContact OE2-NH2 2.58Å; E148-R153 PolarHBondContact OE2-NH2 2.94Å; T150-R153 PolarHBondContact O-N 3.49Å; T150-R153 VanDerWaalsContact O-N 3.14Å; T150-R153 PolarHBondContact OG1-N 3.06Å; T150-R153 VanDerWaalsContact OG1-N 3.15Å; R153-K155 PolarHBondContact O-N 3.04Å; R153-S156 WeakPolarHBondContact O-CB 3.45Å; R153-S156 PolarHBondContact O-N 3Å; R153-S156 PolarHBondContact O-OG 2.79Å
154	R	96.1	Very high	96.2	Very high	40 Å²	40	79.9 Å²	79.9	15%	0.151	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	5.3	-179.8	69.1	179.7	178.1	-166.3	-4.7	117.2	C108 D110 C122 I149 T150 K151 R161	C108-R154 HydrophobicContact CB-CB 4.37Å; C108-R154 PolarHBondContact SG-NH1 2.72Å; C108-R154 VanDerWaalsContact SG-NH1 3.36Å; D110-R154 VanDerWaalsContact CB-NH1 3.35Å; D110-R154 IonicContact OD2-CZ 3.16Å; D110-R154 IonicContact OD2-NH1 2.72Å; D110-R154 PolarHBondContact OD2-NH1 3.43Å; D110-R154 IonicContact OD2-NH2 2.76Å; D110-R154 PolarHBondContact OD2-NH2 2.76Å; C122-R154 PolarHBondContact SG-NH1 3.38Å; I149-R154 HydrophobicContact CG2-CB 4.06Å; T150-R154 VanDerWaalsContact O-CB 3.22Å; T150-R154 WeakPolarHBondContact O-CB 3.34Å; T150-R154 WeakPolarHBondContact O-CG 3.34Å; T150-R154 PolarHBondContact O-N 2.91Å; K151-R154 PolarHBondContact O-NE 3.36Å; R154-R161 VanDerWaalsContact O-CD 3.22Å; R154-R161 WeakPolarHBondContact O-CD 3.01Å; R154-R161 PolarHBondContact O-NH1 3.27Å
155	K	96.2	Very high	96.4	Very high	182 Å²	182	75.2 Å²	75.2	79%	0.791	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-20.3	168.3	-70.8	-173.1	178.6	-178.2	0	112.8	R153	R153-K155 PolarHBondContact O-N 3.04Å
156	S	96.1	Very high	96.7	Very high	93 Å²	93	74.1 Å²	74.1	65%	0.65	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-32.2	-168.8	-52.9	0	0	0	0	114.2	R153	R153-S156 WeakPolarHBondContact O-CB 3.45Å; R153-S156 PolarHBondContact O-N 3Å; R153-S156 PolarHBondContact O-OG 2.79Å
157	C	97.4	Very high	96.8	Very high	6 Å²	6	75.7 Å²	75.7	4%	0.041	35%	0.349	C	S	.	.			trans	-136	121.8	173.6	-176.4	0	0	0	0	110.2	C141 C147 C160 R161	C141-C157 VanDerWaalsContact SG-SG 3.6Å; C147-C157 HydrophobicContact CB-CB 3.77Å; C157-C160 HydrophobicContact CB-CB 4.25Å; C157-C160 PolarHBondContact SG-N 3.14Å; C157-C160 PolarHBondContact SG-SG 2.58Å; C157-R161 WeakPolarHBondContact O-CB 3.15Å
158	Q	97.9	Very high	96.8	Very high	104 Å²	104	75.7 Å²	75.7	49%	0.486	35%	0.347	S	S	.	.	H	α-helix	trans	-82.1	-38	179.4	-59	-173.5	21.3	0	0	111.3	F128 Y139 R161 F162	F128-Q158 HydrophobicContact CE2-CB 4.26Å; F128-Q158 HydrophobicContact CZ-CB 4.34Å; F128-Q158 WeakPolarHBondContact CZ-O 3.42Å; Y139-Q158 HydrophobicContact CD1-CB 3.86Å; Y139-Q158 HydrophobicContact CD2-CB 4.01Å; Y139-Q158 HydrophobicContact CE1-CB 3.93Å; Y139-Q158 HydrophobicContact CE2-CB 4.08Å; Y139-Q158 HydrophobicContact CG-CB 3.9Å; Y139-Q158 PolarHBondContact OH-OE1 3.46Å; Q158-R161 PolarHBondContact O-N 3.34Å; Q158-F162 PolarHBondContact O-N 3.15Å
159	A	97.7	Very high	96.8	Very high	9 Å²	9	72.4 Å²	72.4	7%	0.074	34%	0.342	C	S	.	.	H	α-helix	trans	-58	-60.3	177.1	0	0	0	0	0	112.6	Y139 C141 R161 F162 M163	Y139-A159 WeakPolarHBondContact O-CB 3.4Å; C141-A159 HydrophobicContact CB-CB 4.06Å; A159-R161 PolarHBondContact O-N 3.15Å; A159-R161 VanDerWaalsContact O-N 3.16Å; A159-F162 PolarHBondContact O-N 3.11Å; A159-M163 WeakPolarHBondContact O-CB 3.4Å; A159-M163 PolarHBondContact O-N 2.92Å
160	C	97.7	Very high	96.8	Very high	5 Å²	5	72.3 Å²	72.3	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-58.8	-31.7	179	-57.5	0	0	0	0	112.5	N145 C147 I149 C157 K164	N145-C160 VanDerWaalsContact CA-SG 3.59Å; N145-C160 PolarHBondContact O-SG 2.8Å; C147-C160 HydrophobicContact CB-CB 3.88Å; I149-C160 HydrophobicContact CD1-CB 3.98Å; I149-C160 HydrophobicContact CG1-CB 4.43Å; C157-C160 HydrophobicContact CB-CB 4.25Å; C157-C160 PolarHBondContact SG-N 3.14Å; C157-C160 PolarHBondContact SG-SG 2.58Å; C160-K164 VanDerWaalsContact O-CB 3.25Å; C160-K164 WeakPolarHBondContact O-CB 3.32Å; C160-K164 PolarHBondContact O-N 3.09Å
161	R	98.4	Very high	96.5	Very high	19 Å²	19	73.3 Å²	73.3	7%	0.072	35%	0.346	C	S	.	.	H	α-helix	trans	-69	-43.3	174.9	-172.5	179.2	-176.8	-168.5	-9.5	112.5	V107 A124 C125 F128 I149 R154 C157 Q158 A159 K164 C165	V107-R161 HydrophobicContact CG1-CG 4.37Å; A124-R161 PolarHBondContact O-NH2 3.29Å; C125-R161 PolarHBondContact SG-NH2 2.81Å; F128-R161 HydrophobicContact CD1-CG 3.91Å; F128-R161 HydrophobicContact CE1-CB 3.92Å; F128-R161 HydrophobicContact CE1-CG 3.58Å; F128-R161 HydrophobicContact CZ-CB 4.15Å; F128-R161 HydrophobicContact CZ-CG 4.2Å; I149-R161 HydrophobicContact CD1-CB 3.97Å; I149-R161 HydrophobicContact CG1-CB 4.43Å; I149-R161 HydrophobicContact CG2-CB 4.48Å; I149-R161 HydrophobicContact CG2-CG 4.14Å; R154-R161 VanDerWaalsContact O-CD 3.22Å; R154-R161 WeakPolarHBondContact O-CD 3.01Å; R154-R161 PolarHBondContact O-NH1 3.27Å; C157-R161 WeakPolarHBondContact O-CB 3.15Å; Q158-R161 PolarHBondContact O-N 3.34Å; A159-R161 PolarHBondContact O-N 3.15Å; A159-R161 VanDerWaalsContact O-N 3.16Å; R161-K164 PolarHBondContact O-N 2.71Å; R161-C165 PolarHBondContact O-N 3.48Å; R161-C165 PolarHBondContact O-SG 2.83Å; R161-C165 VanDerWaalsContact O-SG 3.41Å
162	F	98.1	Very high	96.3	Very high	36 Å²	36	73.3 Å²	73.3	16%	0.158	35%	0.345	C	S	.	.	H	α-helix	trans	-71.4	-41.7	178.2	-177.3	-119.4	0	0	0	111.5	F128 F129 T132 I133 Y139 Q158 A159 K164 C165 L166	F128-F162 HydrophobicContact CE1-CB 3.85Å; F128-F162 HydrophobicContact CE1-CD2 4.49Å; F128-F162 HydrophobicContact CZ-CB 3.96Å; F129-F162 HydrophobicContact CD2-CD2 4.02Å; F129-F162 AromaticContact CD2-CE2 3.72Å; F129-F162 HydrophobicContact CD2-CE2 3.72Å; F129-F162 HydrophobicContact CE2-CD2 4.31Å; F129-F162 AromaticContact CE2-CE2 3.68Å; F129-F162 HydrophobicContact CE2-CE2 3.68Å; T132-F162 HydrophobicContact CG2-CD1 4Å; T132-F162 HydrophobicContact CG2-CD2 3.6Å; T132-F162 HydrophobicContact CG2-CE1 3.96Å; T132-F162 HydrophobicContact CG2-CE2 3.57Å; T132-F162 HydrophobicContact CG2-CG 3.82Å; T132-F162 HydrophobicContact CG2-CZ 3.76Å; I133-F162 HydrophobicContact CD1-CE2 3.92Å; I133-F162 HydrophobicContact CD1-CZ 3.67Å; I133-F162 HydrophobicContact CG1-CE2 4.47Å; Y139-F162 HydrophobicContact CD2-CB 4Å; Y139-F162 HydrophobicContact CD2-CG 4.48Å; Y139-F162 HydrophobicContact CE2-CB 4.32Å; Q158-F162 PolarHBondContact O-N 3.15Å; A159-F162 PolarHBondContact O-N 3.11Å; F162-K164 VanDerWaalsContact C-N 3.3Å; F162-K164 PolarHBondContact O-N 2.9Å; F162-C165 VanDerWaalsContact O-CB 3.31Å; F162-C165 WeakPolarHBondContact O-CB 3.25Å; F162-C165 PolarHBondContact O-N 2.98Å; F162-C165 VanDerWaalsContact O-N 3.11Å; F162-L166 HydrophobicContact CD1-CD1 4.29Å; F162-L166 HydrophobicContact CE1-CD1 3.85Å; F162-L166 HydrophobicContact CZ-CD1 4.03Å; F162-L166 HydrophobicContact CZ-CD2 4.5Å; F162-L166 HydrophobicContact CZ-CG 4.37Å; F162-L166 PolarHBondContact O-N 3.23Å
163	M	96.8	Very high	95.8	Very high	100 Å²	100	68.9 Å²	68.9	49%	0.493	34%	0.335	S	S	.	.	H	α-helix	trans	-57	-43.3	170.7	-173.2	168.9	68.1	0	0	111.4	N145 A159 L166 K167	N145-M163 HydrophobicContact CB-CE 4.2Å; N145-M163 WeakPolarHBondContact O-CE 3.33Å; A159-M163 WeakPolarHBondContact O-CB 3.4Å; A159-M163 PolarHBondContact O-N 2.92Å; M163-L166 PolarHBondContact O-N 3.05Å; M163-K167 WeakPolarHBondContact O-CB 3.45Å; M163-K167 PolarHBondContact O-N 2.74Å
164	K	97.5	Very high	95.2	Very high	70 Å²	70	62.7 Å²	62.7	30%	0.304	31%	0.314	S	S	.	.	H	α-helix	trans	-68.3	-34.6	174.7	-167.5	176	177.3	-170.4	0	113.1	L106 V107 I149 C160 R161 F162 L166 K167 V168	L106-K164 WeakPolarHBondContact O-CE 3.33Å; V107-K164 VanDerWaalsContact O-CD 3.26Å; V107-K164 WeakPolarHBondContact O-CD 3.38Å; V107-K164 WeakPolarHBondContact O-CE 3.24Å; V107-K164 PolarHBondContact O-NZ 2.93Å; I149-K164 HydrophobicContact CB-CD 3.86Å; I149-K164 HydrophobicContact CG1-CB 4.45Å; I149-K164 HydrophobicContact CG1-CD 4.14Å; I149-K164 HydrophobicContact CG2-CD 4.46Å; I149-K164 PolarHBondContact O-NZ 3.41Å; C160-K164 VanDerWaalsContact O-CB 3.25Å; C160-K164 WeakPolarHBondContact O-CB 3.32Å; C160-K164 PolarHBondContact O-N 3.09Å; R161-K164 PolarHBondContact O-N 2.71Å; F162-K164 VanDerWaalsContact C-N 3.3Å; F162-K164 PolarHBondContact O-N 2.9Å; K164-L166 VanDerWaalsContact C-N 3.34Å; K164-K167 PolarHBondContact O-N 3.28Å; K164-V168 HydrophobicContact CG-CG1 4.42Å; K164-V168 WeakPolarHBondContact O-CG2 3.32Å; K164-V168 PolarHBondContact O-N 3.3Å
165	C	98	Very high	94.8	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.5	-48.2	170.5	-78.6	0	0	0	0	111.4	F129 R161 F162 V168 M170	F129-C165 HydrophobicContact CD2-CB 3.68Å; F129-C165 HydrophobicContact CE2-CB 4.16Å; R161-C165 PolarHBondContact O-N 3.48Å; R161-C165 PolarHBondContact O-SG 2.83Å; R161-C165 VanDerWaalsContact O-SG 3.41Å; F162-C165 VanDerWaalsContact O-CB 3.31Å; F162-C165 WeakPolarHBondContact O-CB 3.25Å; F162-C165 PolarHBondContact O-N 2.98Å; F162-C165 VanDerWaalsContact O-N 3.11Å; C165-V168 WeakPolarHBondContact O-CG2 3.14Å; C165-V168 PolarHBondContact O-N 3.06Å; C165-M170 HydrophobicContact CB-CB 4.34Å; C165-M170 HydrophobicContact CB-CG 4.3Å; C165-M170 HydrophobicContact CB-SD 3.69Å; C165-M170 VanDerWaalsContact O-CB 3.22Å; C165-M170 WeakPolarHBondContact O-CB 3.47Å; C165-M170 WeakPolarHBondContact O-CG 3.25Å; C165-M170 PolarHBondContact O-N 3.36Å; C165-M170 VanDerWaalsContact SG-SD 3.61Å
166	L	96.9	Very high	93.9	Very high	59 Å²	59	57.3 Å²	57.3	31%	0.309	29%	0.29	S	S	.	.	H	α-helix	trans	-65.3	-44.9	176.6	-64.2	172.9	0	0	0	111.5	F129 F162 M163 K164 V168 G169 K172	F129-L166 HydrophobicContact CE2-CD2 3.83Å; F129-L166 HydrophobicContact CE2-CG 4.46Å; F129-L166 HydrophobicContact CZ-CD2 4.21Å; F162-L166 HydrophobicContact CD1-CD1 4.29Å; F162-L166 HydrophobicContact CE1-CD1 3.85Å; F162-L166 HydrophobicContact CZ-CD1 4.03Å; F162-L166 HydrophobicContact CZ-CD2 4.5Å; F162-L166 HydrophobicContact CZ-CG 4.37Å; F162-L166 PolarHBondContact O-N 3.23Å; M163-L166 PolarHBondContact O-N 3.05Å; K164-L166 VanDerWaalsContact C-N 3.34Å; L166-V168 PolarHBondContact O-N 3.48Å; L166-G169 PolarHBondContact O-N 2.65Å; L166-K172 HydrophobicContact CD2-CD 4.34Å; L166-K172 HydrophobicContact CD2-CG 3.83Å
167	K	95.8	Very high	92.8	Very high	188 Å²	188	58.8 Å²	58.8	82%	0.817	29%	0.289	S	S	*	.	H	α-helix	trans	-61.5	-24.9	179.4	-173.6	168.1	-178.7	170.6	0	114.2	M163 K164	M163-K167 WeakPolarHBondContact O-CB 3.45Å; M163-K167 PolarHBondContact O-N 2.74Å; K164-K167 PolarHBondContact O-N 3.28Å
168	V	95.6	Very high	91.2	Very high	41 Å²	41	64 Å²	64	25%	0.248	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	10.6	172.4	-55.9	0	0	0	0	113.8	L106 V107 V119 K164 C165 L166 M170	L106-V168 HydrophobicContact CB-CB 4.13Å; L106-V168 HydrophobicContact CB-CG1 4.06Å; L106-V168 HydrophobicContact CB-CG2 4.35Å; V107-V168 HydrophobicContact CG2-CG2 3.68Å; V119-V168 HydrophobicContact CG1-CB 4.34Å; V119-V168 HydrophobicContact CG1-CG2 3.88Å; V119-V168 HydrophobicContact CG2-CG2 4.49Å; V119-V168 WeakPolarHBondContact CG2-O 3.31Å; K164-V168 HydrophobicContact CG-CG1 4.42Å; K164-V168 WeakPolarHBondContact O-CG2 3.32Å; K164-V168 PolarHBondContact O-N 3.3Å; C165-V168 WeakPolarHBondContact O-CG2 3.14Å; C165-V168 PolarHBondContact O-N 3.06Å; L166-V168 PolarHBondContact O-N 3.48Å; V168-M170 HydrophobicContact CG2-CG 4.49Å
169	G	94.5	Very high	89.7	Confident	39 Å²	39	69 Å²	69	40%	0.402	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	25.7	174.6	0	0	0	0	0	115.9	V119 L166 L171	V119-G169 VanDerWaalsContact CG2-O 3.24Å; V119-G169 WeakPolarHBondContact CG2-O 3.14Å; L166-G169 PolarHBondContact O-N 2.65Å; G169-L171 PolarHBondContact O-N 3.41Å
170	M	96.3	Very high	87.9	Confident	5 Å²	5	73.7 Å²	73.7	3%	0.025	36%	0.359	C	S	.	.			trans	-71.5	114.3	175.7	-72.9	-168.8	146.3	0	0	112	V107 Y117 V119 S121 F129 C165 V168 K172	V107-M170 HydrophobicContact CG2-CE 4.41Å; V107-M170 HydrophobicContact CG2-SD 4.29Å; Y117-M170 WeakPolarHBondContact O-CA 3.23Å; V119-M170 HydrophobicContact CB-CE 4.32Å; V119-M170 HydrophobicContact CB-CG 4.01Å; V119-M170 HydrophobicContact CG2-CB 4.38Å; V119-M170 HydrophobicContact CG2-CG 3.7Å; S121-M170 VanDerWaalsContact CB-CE 3.47Å; S121-M170 WeakPolarHBondContact OG-CE 3.39Å; F129-M170 HydrophobicContact CB-SD 4.07Å; F129-M170 HydrophobicContact CD1-CB 4.42Å; F129-M170 HydrophobicContact CD2-CB 3.92Å; F129-M170 HydrophobicContact CD2-SD 3.98Å; F129-M170 HydrophobicContact CE1-CB 4.1Å; F129-M170 HydrophobicContact CE2-CB 3.56Å; F129-M170 HydrophobicContact CG-CB 4.33Å; F129-M170 HydrophobicContact CG-SD 3.95Å; F129-M170 HydrophobicContact CZ-CB 3.66Å; F129-M170 VanDerWaalsContact CZ-O 3.24Å; F129-M170 WeakPolarHBondContact CZ-O 3.4Å; C165-M170 HydrophobicContact CB-CB 4.34Å; C165-M170 HydrophobicContact CB-CG 4.3Å; C165-M170 HydrophobicContact CB-SD 3.69Å; C165-M170 VanDerWaalsContact O-CB 3.22Å; C165-M170 WeakPolarHBondContact O-CB 3.47Å; C165-M170 WeakPolarHBondContact O-CG 3.25Å; C165-M170 PolarHBondContact O-N 3.36Å; C165-M170 VanDerWaalsContact SG-SD 3.61Å; V168-M170 HydrophobicContact CG2-CG 4.49Å; M170-K172 PolarHBondContact O-N 2.59Å
171	L	90.9	Very high	86.3	Confident	58 Å²	58	85.9 Å²	85.9	30%	0.304	40%	0.404	S	S	.	.			trans	-70.2	116	-175.6	-59.8	-172	0	0	0	112.1	Y117 F129 G169 E173 G174 Y187	Y117-L171 PolarHBondContact O-N 3.45Å; F129-L171 WeakPolarHBondContact CE1-O 3.37Å; G169-L171 PolarHBondContact O-N 3.41Å; L171-E173 WeakPolarHBondContact CB-OE1 3.39Å; L171-E173 WeakPolarHBondContact CD2-OE1 3.22Å; L171-G174 PolarHBondContact O-N 3.38Å; L171-Y187 HydrophobicContact CD1-CD1 4.03Å
172	K	92.2	Very high	84.4	Confident	113 Å²	113	87.4 Å²	87.4	49%	0.491	43%	0.426	S	S	.	.	S	Bend	trans	-66.1	-46.4	-178.9	-65.9	-175.2	-179.1	177.1	0	111.2	F129 I133 L166 M170 G174 V175	F129-K172 HydrophobicContact CZ-CG 4.3Å; I133-K172 HydrophobicContact CD1-CB 4.21Å; I133-K172 HydrophobicContact CD1-CD 4.33Å; I133-K172 HydrophobicContact CD1-CG 3.91Å; L166-K172 HydrophobicContact CD2-CD 4.34Å; L166-K172 HydrophobicContact CD2-CG 3.83Å; M170-K172 PolarHBondContact O-N 2.59Å; K172-G174 PolarHBondContact O-N 3.43Å; K172-G174 VanDerWaalsContact O-N 3.17Å; K172-V175 WeakPolarHBondContact O-CB 3.49Å; K172-V175 PolarHBondContact O-N 3.49Å
173	E	86.7	Confident	82.4	Confident	140 Å²	140	88.4 Å²	88.4	65%	0.654	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-17.3	173.8	73.4	-72.8	178.6	0	0	113.1	L171 V175	L171-E173 WeakPolarHBondContact CB-OE1 3.39Å; L171-E173 WeakPolarHBondContact CD2-OE1 3.22Å; E173-V175 PolarHBondContact O-N 3.41Å
174	G	83.6	Confident	80.5	Confident	9 Å²	9	95.6 Å²	95.6	9%	0.093	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-9.2	168.6	0	0	0	0	0	114.6	Y117 L171 K172 Y187	Y117-G174 WeakPolarHBondContact CD1-O 3.13Å; Y117-G174 VanDerWaalsContact CE1-O 3.25Å; Y117-G174 WeakPolarHBondContact CE1-O 3.04Å; L171-G174 PolarHBondContact O-N 3.38Å; K172-G174 PolarHBondContact O-N 3.43Å; K172-G174 VanDerWaalsContact O-N 3.17Å; G174-Y187 VanDerWaalsContact C-OH 3.32Å; G174-Y187 WeakPolarHBondContact CA-OH 3.09Å; G174-Y187 PolarHBondContact O-OH 3.1Å
175	V	86	Confident	78.7	Confident	6 Å²	6	97.2 Å²	97.2	4%	0.036	48%	0.477	C	S	.	.	S	Bend	trans	-99.9	106.3	174.7	-176.6	0	0	0	0	109.4	Y117 F129 K130 I133 Q134 K172 E173 L177	Y117-V175 HydrophobicContact CD1-CG2 3.71Å; Y117-V175 HydrophobicContact CE1-CB 4.38Å; Y117-V175 HydrophobicContact CE1-CG2 3.49Å; Y117-V175 VanDerWaalsContact CE1-CG2 3.49Å; Y117-V175 HydrophobicContact CG-CG2 4.41Å; F129-V175 HydrophobicContact CD1-CG2 3.8Å; F129-V175 HydrophobicContact CE1-CG2 3.75Å; K130-V175 HydrophobicContact CG-CG1 4.19Å; I133-V175 HydrophobicContact CB-CB 3.97Å; I133-V175 HydrophobicContact CB-CG1 3.96Å; I133-V175 HydrophobicContact CB-CG2 4.02Å; I133-V175 HydrophobicContact CG1-CB 4.47Å; I133-V175 HydrophobicContact CG1-CG2 4.05Å; I133-V175 HydrophobicContact CG2-CB 3.78Å; I133-V175 HydrophobicContact CG2-CG1 3.98Å; I133-V175 HydrophobicContact CG2-CG2 4.29Å; Q134-V175 HydrophobicContact CG-CG1 3.47Å; Q134-V175 VanDerWaalsContact CG-CG1 3.47Å; K172-V175 WeakPolarHBondContact O-CB 3.49Å; K172-V175 PolarHBondContact O-N 3.49Å; E173-V175 PolarHBondContact O-N 3.41Å; V175-L177 PolarHBondContact O-N 2.94Å
176	R	79	Confident	76.7	Confident	103 Å²	103	106.9 Å²	106.9	39%	0.389	52%	0.519	S	S	.	.			trans	-52.9	123.1	166.8	-72.4	-172.8	173.6	88.1	4.7	109.6	Q134 G182 G183	Q134-R176 PolarHBondContact NE2-O 3.17Å; R176-G182 PolarHBondContact NH1-O 3.17Å; R176-G183 PolarHBondContact NH1-O 2.92Å
177	L	71.2	Confident	74.7	Confident	124 Å²	124	108.3 Å²	108.3	65%	0.649	52%	0.521	S	S	*	.	S	Bend	trans	-71.1	-42.2	176.1	-61	178.3	0	0	0	110.4	I133 V175 R179	I133-L177 HydrophobicContact CG2-CD2 4.05Å; V175-L177 PolarHBondContact O-N 2.94Å; L177-R179 PolarHBondContact O-N 3.36Å
178	D	65.4	Low	72.3	Confident	116 Å²	116	108.4 Å²	108.4	62%	0.62	52%	0.521	S	S	*	.	S	Bend	trans	-57.3	128.7	172	-59	-56.3	0	0	0	111.4	V180	D178-V180 HydrophobicContact CB-CG1 4.47Å; D178-V180 HydrophobicContact CB-CG2 3.91Å; D178-V180 PolarHBondContact O-N 3.06Å; D178-V180 VanDerWaalsContact O-N 3.11Å
179	R	64.7	Low	70	Confident	208 Å²	208	116.2 Å²	116.2	79%	0.785	55%	0.546	S	S	*	.			trans	-77.8	9.9	-178.2	-63.1	-177.7	177.4	-179.9	-0.1	113.4	Q134 L177	Q134-R179 PolarHBondContact O-NH2 2.92Å; L177-R179 PolarHBondContact O-N 3.36Å
180	V	61.6	Low	67.7	Low	108 Å²	108	124.2 Å²	124.2	66%	0.655	56%	0.564	S	S	*	*			trans	-66.5	146.4	-179.5	-61.2	0	0	0	0	112.6	D178 G182	D178-V180 HydrophobicContact CB-CG1 4.47Å; D178-V180 HydrophobicContact CB-CG2 3.91Å; D178-V180 PolarHBondContact O-N 3.06Å; D178-V180 VanDerWaalsContact O-N 3.11Å; V180-G182 PolarHBondContact O-N 3.21Å
181	R	64.1	Low	65.1	Low	261 Å²	261	131.2 Å²	131.2	99%	0.985	60%	0.6	S	S	*	*			trans	-98	82.8	-170.1	-173.9	-178.9	176.3	128	-3.5	111.7
182	G	58.3	Low	62.8	Low	52 Å²	52	134.1 Å²	134.1	54%	0.536	62%	0.616	S	S	.	*			trans	-169.2	160.7	175.4	0	0	0	0	0	116.6	R176 V180	R176-G182 PolarHBondContact NH1-O 3.17Å; V180-G182 PolarHBondContact O-N 3.21Å
183	G	55.4	Low	60.4	Low	56 Å²	56	133.2 Å²	133.2	58%	0.577	63%	0.63	S	S	*	*			trans	81.6	111.6	165	0	0	0	0	0	117	R176 Q185	R176-G183 PolarHBondContact NH1-O 2.92Å; G183-Q185 PolarHBondContact O-N 3.38Å; G183-Q185 VanDerWaalsContact O-N 3.15Å
184	R	57.2	Low	58.3	Low	251 Å²	251	135.7 Å²	135.7	95%	0.947	64%	0.641	S	S	*	*			trans	-77.8	95.1	170.3	-152.7	-177	-162.3	-166.6	6.6	109.2	K186	R184-K186 PolarHBondContact O-N 2.95Å; R184-K186 VanDerWaalsContact O-N 3.15Å
185	Q	59.6	Low	56.1	Low	105 Å²	105	142.3 Å²	142.3	49%	0.491	67%	0.674	S	S	.	*			trans	-64.3	112.7	-178.1	-157.6	74.5	-11.5	0	0	110.5	G183 Y187	G183-Q185 PolarHBondContact O-N 3.38Å; G183-Q185 VanDerWaalsContact O-N 3.15Å; Q185-Y187 HydrophobicContact CB-CE2 4.21Å; Q185-Y187 HydrophobicContact CG-CE1 3.99Å; Q185-Y187 HydrophobicContact CG-CE2 4.36Å
186	K	55.4	Low	53.8	Low	202 Å²	202	147.1 Å²	147.1	88%	0.878	71%	0.708	S	S	*	*			trans	-86	108.9	171.9	-75.5	-173.2	177.6	-178.4	0	109.2	R184 K188	R184-K186 PolarHBondContact O-N 2.95Å; R184-K186 VanDerWaalsContact O-N 3.15Å; K186-K188 PolarHBondContact O-N 3Å
187	Y	55.1	Low	51.8	Low	90 Å²	90	147.1 Å²	147.1	35%	0.353	72%	0.722	S	S	.	*			trans	-75.6	90.6	168.9	-57.4	-77.3	0	0	0	109.5	L171 G174 Q185 R189	L171-Y187 HydrophobicContact CD1-CD1 4.03Å; G174-Y187 VanDerWaalsContact C-OH 3.32Å; G174-Y187 WeakPolarHBondContact CA-OH 3.09Å; G174-Y187 PolarHBondContact O-OH 3.1Å; Q185-Y187 HydrophobicContact CB-CE2 4.21Å; Q185-Y187 HydrophobicContact CG-CE1 3.99Å; Q185-Y187 HydrophobicContact CG-CE2 4.36Å; Y187-R189 PolarHBondContact O-N 3.23Å
188	K	44.8	Very low	50.1	Low	190 Å²	190	150.8 Å²	150.8	83%	0.826	73%	0.728	S	S	*	*			trans	-71.7	118.4	154.9	-174.2	178.4	178.8	-178.1	0	105.7	K186 R190	K186-K188 PolarHBondContact O-N 3Å; K188-R190 PolarHBondContact O-N 3.3Å; K188-R190 VanDerWaalsContact O-N 3.16Å
189	R	48.5	Very low	49.1	Very low	204 Å²	204	153 Å²	153	77%	0.77	74%	0.739	S	S	*	*			trans	-60.7	118.2	168	-65.6	-178.1	-173.8	167.5	0.3	107.1	Y187	Y187-R189 PolarHBondContact O-N 3.23Å
190	R	45	Very low	47.6	Very low	208 Å²	208	150.2 Å²	150.2	79%	0.785	74%	0.74	S	S	*	*			trans	-83.2	103.5	149	-82.2	-174.1	176.7	-95.7	9.5	105.6	K188	K188-R190 PolarHBondContact O-N 3.3Å; K188-R190 VanDerWaalsContact O-N 3.16Å
191	I	43	Very low	46.6	Very low	152 Å²	152	150.1 Å²	150.1	78%	0.779	74%	0.741	S	S	*	*			trans	-72.9	114.2	134.1	-61.7	166.2	0	0	0	102.3
192	D	42.5	Very low	45.6	Very low	119 Å²	119	146.3 Å²	146.3	64%	0.636	74%	0.735	S	S	*	*			trans	168.1	134.9	164.1	-90.6	-23.7	0	0	0	111.6
193	A	42.4	Very low	45	Very low	94 Å²	94	152.5 Å²	152.5	78%	0.777	76%	0.755	S	S	*	*			trans	57	94.8	153.8	0	0	0	0	0	119.3	N195	A193-N195 PolarHBondContact O-N 3.26Å
194	E	41.5	Very low	44.3	Very low	191 Å²	191	155.9 Å²	155.9	89%	0.893	76%	0.764	S	S	*	*			trans	-65.5	107.5	137.5	-68.6	-161.8	120.5	0	0	109.3
195	N	38.4	Very low	43.8	Very low	149 Å²	149	152.6 Å²	152.6	80%	0.797	76%	0.759	S	S	*	*			trans	-177.5	99.1	149.9	-105	-44.1	0	0	0	112.1	A193	A193-N195 PolarHBondContact O-N 3.26Å
196	S	37.5	Very low	42.9	Very low	106 Å²	106	153 Å²	153	74%	0.741	77%	0.771	S	S	*	*			trans	-166.5	81.4	149.3	-168.8	0	0	0	0	111.7	Y198	S196-Y198 PolarHBondContact O-N 3.4Å
197	P	36	Very low	41.9	Very low	104 Å²	104	148.3 Å²	148.3	68%	0.675	77%	0.77	S	S	*	*			trans	-92.4	74.6	177.1	36.1	-32.8	0	0	0	111.6
198	Y	36.1	Very low	41.3	Very low	200 Å²	200	153.5 Å²	153.5	78%	0.784	79%	0.794	S	S	*	*			trans	-135.4	136	172.4	-72.3	-78.7	0	0	0	111.8	S196	S196-Y198 PolarHBondContact O-N 3.4Å
199	L	43.2	Very low	40.9	Very low	164 Å²	164	152.9 Å²	152.9	86%	0.859	79%	0.792	S	S	*	*	S	Bend	trans	67.4	128.4	-172.9	-45.3	172.4	0	0	0	114.5
200	N	34.7	Very low	40.3	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	79%	0.79	S	S	*	*			cis	-159.7	163.8	-28.2	-129.4	4	0	0	0	107
201	P	39.3	Very low	40.2	Very low	106 Å²	106	146.8 Å²	146.8	69%	0.688	80%	0.795	S	S	*	*			trans	-96.6	-174.9	-160.1	37.7	-37.7	0	0	0	115.8
202	Q	44.6	Very low	39.8	Very low	181 Å²	181	146.5 Å²	146.5	85%	0.846	80%	0.795	S	S	*	*			trans	87.2	96.5	169.6	-54.2	-176	2.1	0	0	117.9
203	L	45.8	Very low	39.5	Very low	183 Å²	183	152 Å²	152	96%	0.958	81%	0.806	S	S	*	*				-160.3	152.5	112.3	-104.3	159.7	0	0	0	110.1
204	V	40.2	Very low	39.2	Very low	126 Å²	126	151.4 Å²	151.4	76%	0.764	80%	0.797	S	S	*	*			trans	-103.6	149.2	-163.9	-176	0	0	0	0	111.6
205	Q	47.1	Very low	39.4	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	78%	0.781	S	S	*	*			trans	122.4	142.7	154.7	-68.3	178.7	47.6	0	0	114.7
206	P	40	Very low	39.9	Very low	113 Å²	113	142.6 Å²	142.6	73%	0.734	76%	0.758	S	S	*	*				-112.8	156.8	-50.1	35	-25.1	0	0	0	110	K208	P206-K208 PolarHBondContact O-N 2.99Å
207	A	34.8	Very low	40.5	Very low	104 Å²	104	141.1 Å²	141.1	86%	0.86	75%	0.753	S	S	*	*			trans	-64.6	97.7	-175.9	0	0	0	0	0	112	K209	A207-K209 PolarHBondContact O-N 2.9Å
208	K	41.3	Very low	41.7	Very low	199 Å²	199	140.7 Å²	140.7	87%	0.865	75%	0.745	S	S	*	*			trans	-58.7	133.3	149.9	-70.4	-178	-179.8	177	0	106.1	P206	P206-K208 PolarHBondContact O-N 2.99Å
209	K	36.1	Very low	43.8	Very low	178 Å²	178	132 Å²	132	77%	0.774	71%	0.712	S	S	*	*			trans	-42.7	143.5	-172.2	-61.7	-179.3	177.1	-174.9	0	111	A207	A207-K209 PolarHBondContact O-N 2.9Å
210	P	36.8	Very low	46.1	Very low	113 Å²	113	130.7 Å²	130.7	73%	0.734	70%	0.699	S	S	*	*			trans	-45.2	154.4	155.5	-23.8	34.2	0	0	0	109.8	L212	P210-L212 PolarHBondContact O-N 2.81Å
211	L	42.3	Very low	48.9	Very low	171 Å²	171	125.5 Å²	125.5	90%	0.895	67%	0.671	S	S	*	*	S	Bend	trans	-45.1	134.4	167.5	-74.7	151.8	0	0	0	108.1	W213	L211-W213 PolarHBondContact O-N 3.33Å
212	L	34.6	Very low	51.6	Low	146 Å²	146	120.7 Å²	120.7	76%	0.764	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-51.9	145.1	-174.8	-84.8	71.1	0	0	0	108.5	P210 S214	P210-L212 PolarHBondContact O-N 2.81Å; L212-S214 PolarHBondContact O-N 3.18Å
213	W	37.9	Very low	53.9	Low	233 Å²	233	114.5 Å²	114.5	88%	0.883	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-50.6	116.1	158.8	-64	-1.7	0	0	0	106.8	L211 D215	L211-W213 PolarHBondContact O-N 3.33Å; W213-D215 PolarHBondContact O-N 2.69Å
214	S	36.2	Very low	56.3	Low	83 Å²	83	110.3 Å²	110.3	58%	0.58	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-54	119.4	149.9	-58.9	0	0	0	0	104.7	L212	L212-S214 PolarHBondContact O-N 3.18Å
215	D	44.7	Very low	59	Low	104 Å²	104	104.3 Å²	104.3	56%	0.556	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-56.2	132.1	168.5	-167.7	-45	0	0	0	106.4	W213 A217 D218	W213-D215 PolarHBondContact O-N 2.69Å; D215-A217 PolarHBondContact O-N 3.24Å; D215-A217 WeakPolarHBondContact OD1-CB 3.46Å; D215-A217 PolarHBondContact OD1-N 2.93Å; D215-D218 HydrophobicContact CB-CB 4.45Å; D215-D218 WeakPolarHBondContact O-CB 3.28Å; D215-D218 PolarHBondContact O-N 3.44Å
216	P	49.3	Very low	61.3	Low	50 Å²	50	97.6 Å²	97.6	33%	0.325	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-54.9	-22.3	177.3	-27.4	35.8	0	0	0	113.1	D218	P216-D218 VanDerWaalsContact C-N 3.29Å; P216-D218 PolarHBondContact O-N 2.81Å
217	A	49.4	Very low	63.8	Low	75 Å²	75	98.4 Å²	98.4	62%	0.62	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-71.1	-13.3	171.5	0	0	0	0	0	115.2	D215 N219	D215-A217 PolarHBondContact O-N 3.24Å; D215-A217 WeakPolarHBondContact OD1-CB 3.46Å; D215-A217 PolarHBondContact OD1-N 2.93Å; A217-N219 VanDerWaalsContact C-N 3.33Å
218	D	61.2	Low	66.7	Low	95 Å²	95	94.2 Å²	94.2	51%	0.508	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-87.3	-2.7	-175.3	-138.7	11.8	0	0	0	113.2	D215 P216 K220	D215-D218 HydrophobicContact CB-CB 4.45Å; D215-D218 WeakPolarHBondContact O-CB 3.28Å; D215-D218 PolarHBondContact O-N 3.44Å; P216-D218 VanDerWaalsContact C-N 3.29Å; P216-D218 PolarHBondContact O-N 2.81Å; D218-K220 VanDerWaalsContact C-N 3.31Å; D218-K220 VanDerWaalsContact CG-NZ 3.27Å; D218-K220 PolarHBondContact O-N 3.15Å; D218-K220 PolarHBondContact O-NZ 2.56Å; D218-K220 WeakPolarHBondContact OD1-CE 3.42Å; D218-K220 IonicContact OD1-NZ 2.72Å; D218-K220 PolarHBondContact OD1-NZ 3.16Å; D218-K220 IonicContact OD2-NZ 2.9Å
219	N	80.5	Confident	69.3	Low	19 Å²	19	86.7 Å²	86.7	10%	0.102	46%	0.461	C	S	.	.			trans	-73.2	82.2	172.3	-167.6	-29.4	0	0	0	111.1	A217 I221 V222 S223 A382 Y386	A217-N219 VanDerWaalsContact C-N 3.33Å; N219-I221 VanDerWaalsContact C-N 3.26Å; N219-I221 PolarHBondContact O-N 3.06Å; N219-I221 PolarHBondContact OD1-N 2.82Å; N219-V222 WeakPolarHBondContact ND2-CG2 3.04Å; N219-V222 WeakPolarHBondContact OD1-CG2 3.25Å; N219-V222 PolarHBondContact OD1-N 2.7Å; N219-V222 VanDerWaalsContact OD1-N 3.13Å; N219-S223 WeakPolarHBondContact O-CB 3.02Å; N219-S223 PolarHBondContact O-N 3.08Å; N219-S223 PolarHBondContact O-OG 2.88Å; N219-A382 PolarHBondContact ND2-O 2.85Å; N219-Y386 PolarHBondContact ND2-N 2.79Å
220	K	90.8	Very high	72	Confident	135 Å²	135	80.3 Å²	80.3	59%	0.587	44%	0.438	S	S	*	.	H	α-helix	trans	-65.5	-25.1	-176.5	-70.2	162.6	-167.1	92.3	0	113.5	D218 H224	D218-K220 VanDerWaalsContact C-N 3.31Å; D218-K220 VanDerWaalsContact CG-NZ 3.27Å; D218-K220 PolarHBondContact O-N 3.15Å; D218-K220 PolarHBondContact O-NZ 2.56Å; D218-K220 WeakPolarHBondContact OD1-CE 3.42Å; D218-K220 IonicContact OD1-NZ 2.72Å; D218-K220 PolarHBondContact OD1-NZ 3.16Å; D218-K220 IonicContact OD2-NZ 2.9Å; K220-H224 VanDerWaalsContact O-CB 3.24Å; K220-H224 WeakPolarHBondContact O-CB 3.43Å; K220-H224 PolarHBondContact O-N 3.44Å
221	I	94.6	Very high	74.5	Confident	40 Å²	40	83.7 Å²	83.7	21%	0.205	44%	0.444	C	S	.	.	H	α-helix	trans	-73	-53.8	178.6	-57.1	-61.2	0	0	0	109.8	N219 S223 H224 L225 P271 V378 L379 A382	N219-I221 VanDerWaalsContact C-N 3.26Å; N219-I221 PolarHBondContact O-N 3.06Å; N219-I221 PolarHBondContact OD1-N 2.82Å; I221-S223 VanDerWaalsContact C-N 3.29Å; I221-S223 PolarHBondContact O-N 2.87Å; I221-H224 PolarHBondContact O-N 2.88Å; I221-H224 VanDerWaalsContact O-N 3.09Å; I221-L225 HydrophobicContact CG2-CD1 4.28Å; I221-L225 WeakPolarHBondContact O-CG 3.45Å; I221-L225 PolarHBondContact O-N 3.11Å; I221-P271 HydrophobicContact CD1-CB 3.82Å; I221-P271 HydrophobicContact CD1-CG 3.96Å; I221-V378 HydrophobicContact CD1-CG1 3.92Å; I221-V378 HydrophobicContact CG1-CG1 4.14Å; I221-L379 HydrophobicContact CG2-CD2 4.14Å; I221-A382 HydrophobicContact CB-CB 3.57Å; I221-A382 HydrophobicContact CG1-CB 4.13Å; I221-A382 HydrophobicContact CG2-CB 3.55Å
222	V	95.3	Very high	76.8	Confident	4 Å²	4	82 Å²	82	2%	0.024	43%	0.429	C	S	.	.	H	α-helix	trans	-58.1	-43.9	175.7	177.5	0	0	0	0	110.7	N219 H224 L225 L226 E348 A382 Y386	N219-V222 WeakPolarHBondContact ND2-CG2 3.04Å; N219-V222 WeakPolarHBondContact OD1-CG2 3.25Å; N219-V222 PolarHBondContact OD1-N 2.7Å; N219-V222 VanDerWaalsContact OD1-N 3.13Å; V222-H224 VanDerWaalsContact C-N 3.32Å; V222-H224 PolarHBondContact O-N 2.82Å; V222-L225 PolarHBondContact O-N 3.39Å; V222-L226 WeakPolarHBondContact O-CG 3.34Å; V222-L226 PolarHBondContact O-N 2.95Å; V222-E348 HydrophobicContact CG1-CB 3.71Å; V222-E348 HydrophobicContact CG1-CG 3.82Å; V222-A382 HydrophobicContact CG2-CB 4.47Å; V222-Y386 HydrophobicContact CG1-CD2 4.21Å
223	S	93.9	Very high	79.6	Confident	51 Å²	51	76.7 Å²	76.7	36%	0.357	40%	0.401	S	S	.	.	H	α-helix	trans	-58.8	-39.8	175.9	-57.3	0	0	0	0	113	N219 I221 V227	N219-S223 WeakPolarHBondContact O-CB 3.02Å; N219-S223 PolarHBondContact O-N 3.08Å; N219-S223 PolarHBondContact O-OG 2.88Å; I221-S223 VanDerWaalsContact C-N 3.29Å; I221-S223 PolarHBondContact O-N 2.87Å; S223-V227 WeakPolarHBondContact O-CG2 3.28Å; S223-V227 PolarHBondContact O-N 2.96Å
224	H	94.6	Very high	82.4	Confident	96 Å²	96	71.4 Å²	71.4	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-72.2	-36.6	177	-164	-75.4	0	0	0	112	K220 I221 V222 V227 A228 H269 P271	K220-H224 VanDerWaalsContact O-CB 3.24Å; K220-H224 WeakPolarHBondContact O-CB 3.43Å; K220-H224 PolarHBondContact O-N 3.44Å; I221-H224 PolarHBondContact O-N 2.88Å; I221-H224 VanDerWaalsContact O-N 3.09Å; V222-H224 VanDerWaalsContact C-N 3.32Å; V222-H224 PolarHBondContact O-N 2.82Å; H224-V227 PolarHBondContact O-N 2.81Å; H224-A228 VanDerWaalsContact O-CB 3.23Å; H224-A228 WeakPolarHBondContact O-CB 3.45Å; H224-A228 PolarHBondContact O-N 3.47Å; H224-H269 PolarHBondContact CE1-O 3.43Å; H224-H269 PolarHBondContact ND1-O 3.4Å; H224-P271 HydrophobicContact CB-CG 4.23Å
225	L	96.9	Very high	85.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-66.1	-39.1	175	-67.3	176.7	0	0	0	112	I221 V222 V227 A228 E229 I270 V351 A355 L379	I221-L225 HydrophobicContact CG2-CD1 4.28Å; I221-L225 WeakPolarHBondContact O-CG 3.45Å; I221-L225 PolarHBondContact O-N 3.11Å; V222-L225 PolarHBondContact O-N 3.39Å; L225-V227 VanDerWaalsContact C-N 3.33Å; L225-V227 PolarHBondContact O-N 2.69Å; L225-A228 PolarHBondContact O-N 2.77Å; L225-E229 PolarHBondContact O-N 2.83Å; L225-I270 HydrophobicContact CD2-CB 4.41Å; L225-I270 HydrophobicContact CD2-CG1 3.95Å; L225-I270 HydrophobicContact CD2-CG2 4.29Å; L225-V351 HydrophobicContact CB-CB 4.1Å; L225-V351 HydrophobicContact CB-CG2 3.72Å; L225-A355 HydrophobicContact CD1-CB 3.85Å; L225-A355 HydrophobicContact CD2-CB 3.94Å; L225-L379 HydrophobicContact CD1-CD2 4.19Å
226	L	95.5	Very high	87.7	Confident	40 Å²	40	69.1 Å²	69.1	21%	0.209	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-38.2	174.1	-76.7	176.7	0	0	0	113.4	V222 K347 E348 V351	V222-L226 WeakPolarHBondContact O-CG 3.34Å; V222-L226 PolarHBondContact O-N 2.95Å; L226-K347 HydrophobicContact CD2-CB 4.33Å; L226-K347 HydrophobicContact CD2-CD 3.81Å; L226-K347 HydrophobicContact CD2-CG 3.91Å; L226-E348 HydrophobicContact CD1-CG 3.97Å; L226-E348 WeakPolarHBondContact CD1-OE1 3.21Å; L226-E348 HydrophobicContact CD2-CG 4.18Å; L226-E348 HydrophobicContact CG-CG 4.36Å; L226-V351 HydrophobicContact CD2-CG2 4.06Å; L226-V351 HydrophobicContact CG-CG2 4.31Å
227	V	94.3	Very high	89.8	Confident	130 Å²	130	68.6 Å²	68.6	79%	0.788	36%	0.358	S	S	*	.	H	α-helix	trans	-81.7	-30.3	-179.8	172.4	0	0	0	0	111.8	S223 H224 L225 E229	S223-V227 WeakPolarHBondContact O-CG2 3.28Å; S223-V227 PolarHBondContact O-N 2.96Å; H224-V227 PolarHBondContact O-N 2.81Å; L225-V227 VanDerWaalsContact C-N 3.33Å; L225-V227 PolarHBondContact O-N 2.69Å; V227-E229 VanDerWaalsContact C-N 3.28Å
228	A	94.9	Very high	91.8	Very high	17 Å²	17	68.6 Å²	68.6	14%	0.14	35%	0.347	C	S	.	.	H	α-helix	trans	-74.7	-17.2	172.4	0	0	0	0	0	113.3	H224 L225 H269	H224-A228 VanDerWaalsContact O-CB 3.23Å; H224-A228 WeakPolarHBondContact O-CB 3.45Å; H224-A228 PolarHBondContact O-N 3.47Å; L225-A228 PolarHBondContact O-N 2.77Å; A228-H269 HydrophobicContact CB-CB 3.64Å
229	E	95.1	Very high	93.2	Very high	40 Å²	40	69.9 Å²	69.9	19%	0.187	36%	0.361	C	S	.	.	S	Bend	trans	-62.5	125	-173	-172.7	58.4	-168.5	0	0	111.8	L225 V227 W266 F350 V351 K354	L225-E229 PolarHBondContact O-N 2.83Å; V227-E229 VanDerWaalsContact C-N 3.28Å; E229-W266 PolarHBondContact OE2-NE1 2.8Å; E229-F350 WeakPolarHBondContact OE1-CE1 3.46Å; E229-V351 HydrophobicContact CB-CG1 4.02Å; E229-V351 HydrophobicContact CG-CG1 3.79Å; E229-K354 IonicContact OE1-NZ 3.67Å; E229-K354 PolarHBondContact OE1-NZ 3.24Å; E229-K354 WeakPolarHBondContact OE2-CE 3.49Å; E229-K354 IonicContact OE2-NZ 2.82Å; E229-K354 PolarHBondContact OE2-NZ 2.73Å
230	P	92.4	Very high	93.8	Very high	44 Å²	44	74.5 Å²	74.5	29%	0.286	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.6	156.4	-171.3	-25.4	36.3	0	0	0	115.1	V262 W266	P230-V262 HydrophobicContact CB-CG1 3.35Å; P230-V262 HydrophobicContact CG-CG1 3.52Å; P230-W266 HydrophobicContact CG-CB 3.94Å; P230-W266 HydrophobicContact CG-CG 4.22Å
231	E	89.3	Confident	93.8	Very high	184 Å²	184	70.9 Å²	70.9	86%	0.86	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-64.8	156.7	166.6	-62.7	-171.7	169.8	0	0	111.5
232	K	91.5	Very high	93.7	Very high	135 Å²	135	74 Å²	74	59%	0.587	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-67.1	136.8	-178.3	-62.3	-167.2	177.1	-165.4	0	111.5	D312	K232-D312 WeakPolarHBondContact CD-OD1 3.49Å; K232-D312 VanDerWaalsContact CD-OD2 3.24Å; K232-D312 WeakPolarHBondContact CD-OD2 3.33Å; K232-D312 IonicContact NZ-OD1 2.73Å; K232-D312 PolarHBondContact NZ-OD1 3.09Å; K232-D312 IonicContact NZ-OD2 3.24Å; K232-D312 PolarHBondContact NZ-OD2 3.44Å
233	I	93.5	Very high	93.6	Very high	35 Å²	35	79.9 Å²	79.9	18%	0.179	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-100.5	131.7	169.9	-50.5	-173.8	0	0	0	108.7	L255 R258 E259 V262	I233-L255 HydrophobicContact CB-CD1 4.28Å; I233-L255 HydrophobicContact CG2-CD1 3.93Å; I233-R258 HydrophobicContact CD1-CB 4.33Å; I233-R258 HydrophobicContact CG2-CB 4.28Å; I233-E259 HydrophobicContact CD1-CB 4.44Å; I233-E259 HydrophobicContact CD1-CG 3.89Å; I233-V262 HydrophobicContact CD1-CB 4.14Å; I233-V262 HydrophobicContact CD1-CG2 3.76Å
234	Y	96.2	Very high	93.6	Very high	123 Å²	123	79.2 Å²	79.2	48%	0.482	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-87.3	140	171.8	-64.6	-81.4	0	0	0	110.4	R258 D312 D313	Y234-R258 PolarHBondContact O-NH1 3.41Å; Y234-D312 HydrophobicContact CD1-CB 4.14Å; Y234-D312 HydrophobicContact CE1-CB 3.75Å; Y234-D313 VanDerWaalsContact CA-OD1 3.26Å; Y234-D313 WeakPolarHBondContact CA-OD1 3.15Å; Y234-D313 WeakPolarHBondContact CB-OD1 3.25Å; Y234-D313 HydrophobicContact CD1-CB 4.02Å
235	A	97	Very high	93.6	Very high	2 Å²	2	77.8 Å²	77.8	2%	0.017	42%	0.424	C	S	.	.			trans	-65.9	-39.2	178.3	0	0	0	0	0	111.8	T251 L255 R258 A311 D313 Y314	A235-T251 HydrophobicContact CB-CG2 3.95Å; A235-L255 HydrophobicContact CB-CD2 4.23Å; A235-R258 PolarHBondContact O-NH1 3.35Å; A235-R258 PolarHBondContact O-NH2 3.03Å; A235-A311 HydrophobicContact CB-CB 3.88Å; A235-D313 PolarHBondContact N-OD1 2.95Å; A235-D313 PolarHBondContact N-OD2 3.19Å; A235-Y314 VanDerWaalsContact CB-CB 3.44Å; A235-Y314 HydrophobicContact CB-CD1 4.43Å; A235-Y314 HydrophobicContact CB-CG 3.99Å
236	M	94.6	Very high	93.5	Very high	136 Å²	136	81.3 Å²	81.3	67%	0.67	44%	0.442	S	S	*	.			trans	54.6	57	-175.7	-56.8	-175.3	-68.9	0	0	113.3	D313	M236-D313 WeakPolarHBondContact CA-OD2 3.45Å; M236-D313 PolarHBondContact N-OD2 3.29Å
237	P	93.9	Very high	93.5	Very high	40 Å²	40	80.9 Å²	80.9	26%	0.26	44%	0.439	S	S	.	.			trans	-61.1	138	176.5	27.9	-35.7	0	0	0	111.4	P239 T251 Y314	P237-P239 VanDerWaalsContact O-CD 3.32Å; P237-P239 WeakPolarHBondContact O-CD 3.4Å; P237-T251 HydrophobicContact CB-CG2 4Å; P237-Y314 HydrophobicContact CB-CD2 4.3Å; P237-Y314 HydrophobicContact CB-CE2 4.45Å; P237-Y314 HydrophobicContact CG-CD2 4.09Å
238	D	91.6	Very high	93.6	Very high	75 Å²	75	75.2 Å²	75.2	40%	0.401	41%	0.405	S	S	.	.			trans	-66.4	118	178.7	-170.5	-29	0	0	0	110.8	T240 V241 K247	D238-T240 VanDerWaalsContact C-N 3.25Å; D238-T240 PolarHBondContact O-N 3.17Å; D238-T240 WeakPolarHBondContact OD1-CA 3.15Å; D238-T240 VanDerWaalsContact OD1-CB 3.3Å; D238-T240 WeakPolarHBondContact OD1-CB 3.29Å; D238-T240 PolarHBondContact OD1-N 2.95Å; D238-T240 PolarHBondContact OD1-OG1 3.4Å; D238-T240 PolarHBondContact OD2-OG1 2.88Å; D238-V241 HydrophobicContact CB-CB 4.47Å; D238-V241 HydrophobicContact CB-CG2 4Å; D238-K247 WeakPolarHBondContact O-CE 3.39Å; D238-K247 PolarHBondContact O-NZ 3.41Å; D238-K247 VanDerWaalsContact O-NZ 3.1Å
239	P	91.6	Very high	93.7	Very high	122 Å²	122	75 Å²	75	79%	0.792	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-9.5	-179.5	33.2	-36.7	0	0	0	113.5	P237	P237-P239 VanDerWaalsContact O-CD 3.32Å; P237-P239 WeakPolarHBondContact O-CD 3.4Å
240	T	93	Very high	93.7	Very high	115 Å²	115	74.5 Å²	74.5	71%	0.706	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-21.3	179.6	73.5	0	0	0	0	113	D238	D238-T240 VanDerWaalsContact C-N 3.25Å; D238-T240 PolarHBondContact O-N 3.17Å; D238-T240 WeakPolarHBondContact OD1-CA 3.15Å; D238-T240 VanDerWaalsContact OD1-CB 3.3Å; D238-T240 WeakPolarHBondContact OD1-CB 3.29Å; D238-T240 PolarHBondContact OD1-N 2.95Å; D238-T240 PolarHBondContact OD1-OG1 3.4Å; D238-T240 PolarHBondContact OD2-OG1 2.88Å
241	V	91.1	Very high	94	Very high	59 Å²	59	73 Å²	73	36%	0.358	39%	0.391	S	S	.	.	S	Bend	trans	-86.5	129.2	178.8	-177.8	0	0	0	0	110	D238 K247	D238-V241 HydrophobicContact CB-CB 4.47Å; D238-V241 HydrophobicContact CB-CG2 4Å; V241-K247 HydrophobicContact CB-CD 4.13Å; V241-K247 HydrophobicContact CB-CG 4.38Å; V241-K247 HydrophobicContact CG1-CB 4.12Å; V241-K247 HydrophobicContact CG1-CD 4.05Å; V241-K247 HydrophobicContact CG1-CG 4.06Å; V241-K247 WeakPolarHBondContact O-CD 3.33Å; V241-K247 WeakPolarHBondContact O-CE 3.25Å; V241-K247 PolarHBondContact O-NZ 3.35Å
242	P	92.1	Very high	94.3	Very high	105 Å²	105	64.6 Å²	64.6	68%	0.682	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-62.1	145.6	174	-23.9	34.7	0	0	0	113.3	S244	P242-S244 PolarHBondContact O-N 3.37Å; P242-S244 PolarHBondContact O-OG 3.01Å; P242-S244 VanDerWaalsContact O-OG 3.08Å
243	D	91.7	Very high	94.6	Very high	128 Å²	128	58.1 Å²	58.1	68%	0.684	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-64.6	128.7	-179.2	-60.8	-38.9	0	0	0	111.7	K247	D243-K247 WeakPolarHBondContact OD1-CD 3.48Å; D243-K247 WeakPolarHBondContact OD1-CE 3.38Å; D243-K247 IonicContact OD1-NZ 2.58Å; D243-K247 PolarHBondContact OD1-NZ 2.91Å
244	S	94.2	Very high	94.8	Very high	38 Å²	38	58.6 Å²	58.6	27%	0.266	33%	0.327	S	S	.	.			trans	-162.9	162.6	-167.9	48.4	0	0	0	0	109.9	P242 I246 K247 A248	P242-S244 PolarHBondContact O-N 3.37Å; P242-S244 PolarHBondContact O-OG 3.01Å; P242-S244 VanDerWaalsContact O-OG 3.08Å; S244-I246 PolarHBondContact O-N 3.36Å; S244-K247 PolarHBondContact O-N 3.06Å; S244-K247 VanDerWaalsContact OG-CB 3.29Å; S244-K247 WeakPolarHBondContact OG-CB 3.33Å; S244-K247 PolarHBondContact OG-N 3.45Å; S244-A248 PolarHBondContact O-N 3.18Å
245	D	94.5	Very high	94.9	Very high	66 Å²	66	52.9 Å²	52.9	35%	0.353	31%	0.305	S	S	.	.	H	α-helix	trans	-55.1	-49.4	172.3	61.9	-31.6	0	0	0	111.6	K247 A248 L249	D245-K247 PolarHBondContact O-N 2.79Å; D245-A248 PolarHBondContact O-N 2.8Å; D245-L249 WeakPolarHBondContact O-CB 3.48Å; D245-L249 VanDerWaalsContact O-CG 3.25Å; D245-L249 WeakPolarHBondContact O-CG 3.47Å; D245-L249 PolarHBondContact O-N 3.37Å
246	I	95.1	Very high	94.9	Very high	73 Å²	73	53.3 Å²	53.3	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-61.8	-42.9	-179.6	-61.4	174.3	0	0	0	111.5	S244 T250	S244-I246 PolarHBondContact O-N 3.36Å; I246-T250 VanDerWaalsContact O-CB 3.3Å; I246-T250 WeakPolarHBondContact O-CB 3.49Å; I246-T250 PolarHBondContact O-N 3.18Å; I246-T250 PolarHBondContact O-OG1 2.98Å
247	K	95.5	Very high	95	Very high	32 Å²	32	47.9 Å²	47.9	14%	0.139	28%	0.282	C	S	.	.	H	α-helix	trans	-61.7	-47.3	176.9	-177.4	-169.2	178	179.2	0	111.5	D238 V241 D243 S244 D245 T251	D238-K247 WeakPolarHBondContact O-CE 3.39Å; D238-K247 PolarHBondContact O-NZ 3.41Å; D238-K247 VanDerWaalsContact O-NZ 3.1Å; V241-K247 HydrophobicContact CB-CD 4.13Å; V241-K247 HydrophobicContact CB-CG 4.38Å; V241-K247 HydrophobicContact CG1-CB 4.12Å; V241-K247 HydrophobicContact CG1-CD 4.05Å; V241-K247 HydrophobicContact CG1-CG 4.06Å; V241-K247 WeakPolarHBondContact O-CD 3.33Å; V241-K247 WeakPolarHBondContact O-CE 3.25Å; V241-K247 PolarHBondContact O-NZ 3.35Å; D243-K247 WeakPolarHBondContact OD1-CD 3.48Å; D243-K247 WeakPolarHBondContact OD1-CE 3.38Å; D243-K247 IonicContact OD1-NZ 2.58Å; D243-K247 PolarHBondContact OD1-NZ 2.91Å; S244-K247 PolarHBondContact O-N 3.06Å; S244-K247 VanDerWaalsContact OG-CB 3.29Å; S244-K247 WeakPolarHBondContact OG-CB 3.33Å; S244-K247 PolarHBondContact OG-N 3.45Å; D245-K247 PolarHBondContact O-N 2.79Å; K247-T251 WeakPolarHBondContact O-CB 3.41Å; K247-T251 PolarHBondContact O-N 2.77Å; K247-T251 PolarHBondContact O-OG1 3.35Å
248	A	96.6	Very high	95.1	Very high	11 Å²	11	49.4 Å²	49.4	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-46.5	-180	0	0	0	0	0	111.7	S244 D245 T251 L252 Y314 A324	S244-A248 PolarHBondContact O-N 3.18Å; D245-A248 PolarHBondContact O-N 2.8Å; A248-T251 PolarHBondContact O-N 3.05Å; A248-L252 VanDerWaalsContact O-CG 3.32Å; A248-L252 WeakPolarHBondContact O-CG 3.41Å; A248-L252 PolarHBondContact O-N 3.13Å; A248-Y314 WeakPolarHBondContact CA-OH 3.44Å; A248-Y314 WeakPolarHBondContact CB-OH 3.37Å; A248-A324 HydrophobicContact CB-CB 3.78Å
249	L	96.6	Very high	95.4	Very high	13 Å²	13	47 Å²	47	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-38.1	179.9	-65.5	178.3	0	0	0	112.4	D245 L252 C253 L326 I422 V428	D245-L249 WeakPolarHBondContact O-CB 3.48Å; D245-L249 VanDerWaalsContact O-CG 3.25Å; D245-L249 WeakPolarHBondContact O-CG 3.47Å; D245-L249 PolarHBondContact O-N 3.37Å; L249-L252 PolarHBondContact O-N 3.33Å; L249-C253 PolarHBondContact O-N 3.32Å; L249-C253 PolarHBondContact O-SG 2.9Å; L249-L326 HydrophobicContact CD2-CD1 3.83Å; L249-L326 HydrophobicContact CD2-CD2 3.91Å; L249-L326 HydrophobicContact CD2-CG 3.89Å; L249-I422 HydrophobicContact CD1-CD1 3.9Å; L249-I422 HydrophobicContact CD1-CG1 4.15Å; L249-I422 HydrophobicContact CD1-CG2 4.17Å; L249-I422 HydrophobicContact CD2-CD1 3.76Å; L249-I422 HydrophobicContact CG-CD1 4.4Å; L249-V428 HydrophobicContact CB-CG1 4.09Å; L249-V428 HydrophobicContact CB-CG2 3.75Å; L249-V428 HydrophobicContact CD1-CG2 4.08Å
250	T	96.4	Very high	95.7	Very high	28 Å²	28	41.2 Å²	41.2	17%	0.172	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-50.4	173.7	-57.7	0	0	0	0	110.5	I246 L252 C253 D254 P429	I246-T250 VanDerWaalsContact O-CB 3.3Å; I246-T250 WeakPolarHBondContact O-CB 3.49Å; I246-T250 PolarHBondContact O-N 3.18Å; I246-T250 PolarHBondContact O-OG1 2.98Å; T250-L252 PolarHBondContact O-N 3.43Å; T250-C253 PolarHBondContact O-N 3.07Å; T250-C253 VanDerWaalsContact O-N 3.08Å; T250-D254 WeakPolarHBondContact CG2-OD2 3.49Å; T250-D254 WeakPolarHBondContact O-CB 3.44Å; T250-D254 VanDerWaalsContact O-CG 3.29Å; T250-D254 PolarHBondContact O-N 3.45Å; T250-P429 HydrophobicContact CG2-CG 3.93Å
251	T	97.1	Very high	95.9	Very high	12 Å²	12	39.8 Å²	39.8	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-55	-41.5	178.8	-55.9	0	0	0	0	111.6	A235 P237 K247 A248 L255 Y314	A235-T251 HydrophobicContact CB-CG2 3.95Å; P237-T251 HydrophobicContact CB-CG2 4Å; K247-T251 WeakPolarHBondContact O-CB 3.41Å; K247-T251 PolarHBondContact O-N 2.77Å; K247-T251 PolarHBondContact O-OG1 3.35Å; A248-T251 PolarHBondContact O-N 3.05Å; T251-L255 VanDerWaalsContact O-CB 3.28Å; T251-L255 WeakPolarHBondContact O-CB 3.4Å; T251-L255 PolarHBondContact O-N 3.36Å; T251-Y314 HydrophobicContact CG2-CD1 4.18Å; T251-Y314 HydrophobicContact CG2-CD2 4.15Å; T251-Y314 HydrophobicContact CG2-CE1 4.12Å; T251-Y314 HydrophobicContact CG2-CE2 4.06Å; T251-Y314 HydrophobicContact CG2-CG 4.22Å
252	L	97.5	Very high	96.1	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-70.9	-39.5	177.5	-70.9	171.9	0	0	0	113.4	A248 L249 T250 A256 Y310 Y314 M316 L326 F419	A248-L252 VanDerWaalsContact O-CG 3.32Å; A248-L252 WeakPolarHBondContact O-CG 3.41Å; A248-L252 PolarHBondContact O-N 3.13Å; L249-L252 PolarHBondContact O-N 3.33Å; T250-L252 PolarHBondContact O-N 3.43Å; L252-A256 VanDerWaalsContact O-CB 3.27Å; L252-A256 WeakPolarHBondContact O-CB 3.23Å; L252-A256 PolarHBondContact O-N 2.99Å; L252-Y310 HydrophobicContact CD2-CD1 3.35Å; L252-Y310 HydrophobicContact CD2-CD2 4.01Å; L252-Y310 HydrophobicContact CD2-CE1 3.72Å; L252-Y310 HydrophobicContact CD2-CE2 4.33Å; L252-Y310 HydrophobicContact CD2-CG 3.5Å; L252-Y310 VanDerWaalsContact CD2-CG 3.5Å; L252-Y314 HydrophobicContact CD2-CD1 4.2Å; L252-Y314 HydrophobicContact CD2-CE1 3.82Å; L252-Y314 HydrophobicContact CG-CE1 4.03Å; L252-M316 HydrophobicContact CD1-SD 4.05Å; L252-L326 HydrophobicContact CD1-CD1 3.38Å; L252-F419 HydrophobicContact CB-CZ 4.41Å
253	C	97.2	Very high	96.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-43.2	176.3	-65.2	0	0	0	0	111.4	L249 T250 A256 D257 M430 F434	L249-C253 PolarHBondContact O-N 3.32Å; L249-C253 PolarHBondContact O-SG 2.9Å; T250-C253 PolarHBondContact O-N 3.07Å; T250-C253 VanDerWaalsContact O-N 3.08Å; C253-A256 PolarHBondContact O-N 3.46Å; C253-D257 PolarHBondContact O-N 3.34Å; C253-M430 HydrophobicContact CB-CG 4.32Å; C253-F434 HydrophobicContact CB-CD1 4.45Å; C253-F434 HydrophobicContact CB-CE1 4.22Å
254	D	96.8	Very high	96.5	Very high	44 Å²	44	31.2 Å²	31.2	24%	0.235	17%	0.17	C	C	.	.	H	α-helix	trans	-68.2	-36.1	179.4	-64.8	-11	0	0	0	111.4	T250 R258 H431	T250-D254 WeakPolarHBondContact CG2-OD2 3.49Å; T250-D254 WeakPolarHBondContact O-CB 3.44Å; T250-D254 VanDerWaalsContact O-CG 3.29Å; T250-D254 PolarHBondContact O-N 3.45Å; D254-R258 WeakPolarHBondContact O-CG 3.39Å; D254-R258 PolarHBondContact O-N 3.03Å; D254-R258 PolarHBondContact O-NE 3.04Å; D254-H431 IonicContact OD1-CD2 2.62Å; D254-H431 PolarHBondContact OD1-CD2 3.41Å; D254-H431 IonicContact OD1-NE2 3.9Å
255	L	97.8	Very high	96.6	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-46	170.8	176.8	61.5	0	0	0	111.4	I233 A235 T251 D257 R258 E259 A311	I233-L255 HydrophobicContact CB-CD1 4.28Å; I233-L255 HydrophobicContact CG2-CD1 3.93Å; A235-L255 HydrophobicContact CB-CD2 4.23Å; T251-L255 VanDerWaalsContact O-CB 3.28Å; T251-L255 WeakPolarHBondContact O-CB 3.4Å; T251-L255 PolarHBondContact O-N 3.36Å; L255-D257 PolarHBondContact O-N 3.32Å; L255-R258 PolarHBondContact O-N 2.66Å; L255-E259 HydrophobicContact CD1-CG 4.19Å; L255-E259 PolarHBondContact O-N 3.42Å; L255-A311 HydrophobicContact CD2-CB 4.13Å
256	A	97.7	Very high	96.7	Very high	11 Å²	11	27.9 Å²	27.9	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-64.4	-37.4	-178.4	0	0	0	0	0	113	L252 C253 L260 L293 F434	L252-A256 VanDerWaalsContact O-CB 3.27Å; L252-A256 WeakPolarHBondContact O-CB 3.23Å; L252-A256 PolarHBondContact O-N 2.99Å; C253-A256 PolarHBondContact O-N 3.46Å; A256-L260 VanDerWaalsContact O-CB 3.28Å; A256-L260 WeakPolarHBondContact O-CB 3.26Å; A256-L260 VanDerWaalsContact O-CG 3.27Å; A256-L260 WeakPolarHBondContact O-CG 3.34Å; A256-L260 PolarHBondContact O-N 3.21Å; A256-L293 HydrophobicContact CB-CD1 4.16Å; A256-F434 HydrophobicContact CB-CD2 3.79Å; A256-F434 HydrophobicContact CB-CE2 3.5Å; A256-F434 HydrophobicContact CB-CZ 4.29Å
257	D	97	Very high	96.8	Very high	22 Å²	22	24.4 Å²	24.4	12%	0.118	14%	0.138	C	C	.	.	H	α-helix	trans	-64.5	-40.1	174.4	-162.8	86.7	0	0	0	111.7	C253 L255 L260 V261 H431 L433 F434	C253-D257 PolarHBondContact O-N 3.34Å; L255-D257 PolarHBondContact O-N 3.32Å; D257-L260 WeakPolarHBondContact O-CB 3.47Å; D257-L260 PolarHBondContact O-N 3.04Å; D257-V261 WeakPolarHBondContact O-CG2 3.24Å; D257-V261 PolarHBondContact O-N 3.29Å; D257-V261 VanDerWaalsContact O-N 3.11Å; D257-H431 HydrophobicContact CB-CB 3.84Å; D257-H431 WeakPolarHBondContact OD1-CB 3.47Å; D257-H431 IonicContact OD2-CG 3.39Å; D257-L433 WeakPolarHBondContact OD1-CB 3.41Å; D257-L433 PolarHBondContact OD1-N 3.21Å; D257-F434 HydrophobicContact CB-CB 4.18Å; D257-F434 WeakPolarHBondContact OD1-CB 3.43Å; D257-F434 PolarHBondContact OD1-N 2.93Å
258	R	97	Very high	96.9	Very high	71 Å²	71	28.4 Å²	28.4	27%	0.268	16%	0.155	S	C	.	.	H	α-helix	trans	-68.2	-44	175.3	-72.1	175.5	-73.7	155.1	-5.9	112.7	I233 Y234 A235 D254 L255 L260 V261 V262	I233-R258 HydrophobicContact CD1-CB 4.33Å; I233-R258 HydrophobicContact CG2-CB 4.28Å; Y234-R258 PolarHBondContact O-NH1 3.41Å; A235-R258 PolarHBondContact O-NH1 3.35Å; A235-R258 PolarHBondContact O-NH2 3.03Å; D254-R258 WeakPolarHBondContact O-CG 3.39Å; D254-R258 PolarHBondContact O-N 3.03Å; D254-R258 PolarHBondContact O-NE 3.04Å; L255-R258 PolarHBondContact O-N 2.66Å; R258-L260 VanDerWaalsContact C-N 3.31Å; R258-L260 PolarHBondContact O-N 3.17Å; R258-V261 PolarHBondContact O-N 2.96Å; R258-V262 PolarHBondContact O-N 2.69Å
259	E	97.5	Very high	96.8	Very high	25 Å²	25	33.1 Å²	33.1	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-36.9	172.8	-75.4	-164.6	125.8	0	0	111.2	I233 L255 V262 I263 L293 R300	I233-E259 HydrophobicContact CD1-CB 4.44Å; I233-E259 HydrophobicContact CD1-CG 3.89Å; L255-E259 HydrophobicContact CD1-CG 4.19Å; L255-E259 PolarHBondContact O-N 3.42Å; E259-V262 PolarHBondContact O-N 2.99Å; E259-I263 WeakPolarHBondContact O-CB 3.5Å; E259-I263 WeakPolarHBondContact O-CD1 3.44Å; E259-I263 WeakPolarHBondContact O-CG1 3.47Å; E259-I263 PolarHBondContact O-N 3.31Å; E259-L293 HydrophobicContact CB-CD2 3.37Å; E259-L293 HydrophobicContact CG-CD2 4.28Å; E259-L293 WeakPolarHBondContact OE2-CD2 3.21Å; E259-R300 IonicContact OE1-CZ 3.85Å; E259-R300 VanDerWaalsContact OE1-CZ 3.27Å; E259-R300 IonicContact OE1-NH1 2.69Å; E259-R300 PolarHBondContact OE1-NH1 2.99Å; E259-R300 IonicContact OE1-NH2 2.83Å; E259-R300 PolarHBondContact OE1-NH2 3.17Å; E259-R300 IonicContact OE2-NH2 3.12Å; E259-R300 PolarHBondContact OE2-NH2 3.1Å
260	L	97.4	Very high	96.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-48.3	175	-87.4	172.2	0	0	0	113.1	A256 D257 R258 V262 I263 I264 W289 L433 F434 M437	A256-L260 VanDerWaalsContact O-CB 3.28Å; A256-L260 WeakPolarHBondContact O-CB 3.26Å; A256-L260 VanDerWaalsContact O-CG 3.27Å; A256-L260 WeakPolarHBondContact O-CG 3.34Å; A256-L260 PolarHBondContact O-N 3.21Å; D257-L260 WeakPolarHBondContact O-CB 3.47Å; D257-L260 PolarHBondContact O-N 3.04Å; R258-L260 VanDerWaalsContact C-N 3.31Å; R258-L260 PolarHBondContact O-N 3.17Å; L260-V262 PolarHBondContact O-N 3.26Å; L260-I263 PolarHBondContact O-N 2.85Å; L260-I264 VanDerWaalsContact O-CG1 3.29Å; L260-I264 WeakPolarHBondContact O-CG1 3.43Å; L260-I264 PolarHBondContact O-N 3.43Å; L260-W289 HydrophobicContact CD1-CE3 4.21Å; L260-W289 HydrophobicContact CD1-CZ3 4.28Å; L260-W289 HydrophobicContact CD2-CB 3.68Å; L260-W289 HydrophobicContact CD2-CD2 4.04Å; L260-W289 HydrophobicContact CD2-CE3 3.76Å; L260-W289 HydrophobicContact CD2-CG 4.07Å; L260-W289 HydrophobicContact CG-CE3 4.23Å; L260-L433 HydrophobicContact CB-CD2 3.95Å; L260-L433 HydrophobicContact CB-CG 4.4Å; L260-L433 HydrophobicContact CD1-CG 4.43Å; L260-F434 HydrophobicContact CD1-CB 4.24Å; L260-F434 HydrophobicContact CD1-CD2 3.86Å; L260-M437 HydrophobicContact CD1-CB 4.17Å; L260-M437 HydrophobicContact CD1-CG 4.09Å; L260-M437 HydrophobicContact CD2-CE 4.06Å; L260-M437 HydrophobicContact CD2-CG 4.22Å
261	V	96.8	Very high	96.7	Very high	86 Å²	86	33 Å²	33	52%	0.521	18%	0.175	S	C	.	.	H	α-helix	trans	-55.7	-42.7	176.2	172.5	0	0	0	0	110.8	D257 R258 G265 L433	D257-V261 WeakPolarHBondContact O-CG2 3.24Å; D257-V261 PolarHBondContact O-N 3.29Å; D257-V261 VanDerWaalsContact O-N 3.11Å; R258-V261 PolarHBondContact O-N 2.96Å; V261-G265 PolarHBondContact O-N 3.45Å; V261-L433 HydrophobicContact CG2-CD2 3.62Å
262	V	96.2	Very high	96.6	Very high	54 Å²	54	34 Å²	34	33%	0.327	19%	0.188	S	C	.	.	H	α-helix	trans	-71.7	-37.3	-179.9	169.6	0	0	0	0	112.2	P230 I233 R258 E259 L260 G265 W266	P230-V262 HydrophobicContact CB-CG1 3.35Å; P230-V262 HydrophobicContact CG-CG1 3.52Å; I233-V262 HydrophobicContact CD1-CB 4.14Å; I233-V262 HydrophobicContact CD1-CG2 3.76Å; R258-V262 PolarHBondContact O-N 2.69Å; E259-V262 PolarHBondContact O-N 2.99Å; L260-V262 PolarHBondContact O-N 3.26Å; V262-G265 PolarHBondContact O-N 2.84Å; V262-W266 WeakPolarHBondContact O-CB 3.44Å; V262-W266 PolarHBondContact O-N 3.28Å
263	I	96.6	Very high	96.5	Very high	13 Å²	13	33.6 Å²	33.6	7%	0.067	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-41.1	173.9	-73.2	163.9	0	0	0	111.5	E259 L260 G265 W266 A267 L285 I292 L293	E259-I263 WeakPolarHBondContact O-CB 3.5Å; E259-I263 WeakPolarHBondContact O-CD1 3.44Å; E259-I263 WeakPolarHBondContact O-CG1 3.47Å; E259-I263 PolarHBondContact O-N 3.31Å; L260-I263 PolarHBondContact O-N 2.85Å; I263-G265 VanDerWaalsContact C-N 3.26Å; I263-G265 PolarHBondContact O-N 2.82Å; I263-W266 HydrophobicContact CG2-CE3 4.33Å; I263-W266 PolarHBondContact O-N 2.98Å; I263-A267 WeakPolarHBondContact O-CB 3.44Å; I263-A267 PolarHBondContact O-N 3.28Å; I263-L285 HydrophobicContact CG2-CD2 4.16Å; I263-I292 HydrophobicContact CB-CG2 4.49Å; I263-I292 HydrophobicContact CD1-CB 4.2Å; I263-I292 HydrophobicContact CD1-CG2 3.51Å; I263-I292 HydrophobicContact CG1-CG2 3.69Å; I263-I292 HydrophobicContact CG2-CD1 4.05Å; I263-I292 HydrophobicContact CG2-CG2 3.96Å; I263-L293 HydrophobicContact CD1-CD2 3.58Å; I263-L293 HydrophobicContact CD1-CG 4.02Å
264	I	95.9	Very high	96.5	Very high	44 Å²	44	36.7 Å²	36.7	23%	0.226	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-28.6	176.6	-65.8	164	0	0	0	111.5	L260 K268 L285 L433	L260-I264 VanDerWaalsContact O-CG1 3.29Å; L260-I264 WeakPolarHBondContact O-CG1 3.43Å; L260-I264 PolarHBondContact O-N 3.43Å; I264-K268 WeakPolarHBondContact O-CE 3.19Å; I264-L285 HydrophobicContact CG1-CD1 4.29Å; I264-L285 HydrophobicContact CG1-CD2 4.23Å; I264-L285 HydrophobicContact CG2-CD1 4.42Å; I264-L433 HydrophobicContact CD1-CD1 3.98Å; I264-L433 HydrophobicContact CD1-CD2 3.97Å
265	G	95	Very high	96.4	Very high	29 Å²	29	40.3 Å²	40.3	30%	0.299	23%	0.231	S	C	.	.	H	α-helix	trans	-68.5	-60.2	166.9	0	0	0	0	0	111.8	V261 V262 I263 A267 K268 H269	V261-G265 PolarHBondContact O-N 3.45Å; V262-G265 PolarHBondContact O-N 2.84Å; I263-G265 VanDerWaalsContact C-N 3.26Å; I263-G265 PolarHBondContact O-N 2.82Å; G265-A267 VanDerWaalsContact C-N 3.29Å; G265-A267 PolarHBondContact O-N 2.83Å; G265-K268 WeakPolarHBondContact O-CB 3.45Å; G265-K268 PolarHBondContact O-N 3.26Å; G265-K268 VanDerWaalsContact O-N 3.08Å; G265-H269 PolarHBondContact O-CD2 3.22Å
266	W	97.5	Very high	96.3	Very high	6 Å²	6	40.7 Å²	40.7	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-48.3	-44.6	-179.2	166.9	76.8	0	0	0	113.6	E229 P230 V262 I263 K268 H269 I270 I292 K354 A355 L358	E229-W266 PolarHBondContact OE2-NE1 2.8Å; P230-W266 HydrophobicContact CG-CB 3.94Å; P230-W266 HydrophobicContact CG-CG 4.22Å; V262-W266 WeakPolarHBondContact O-CB 3.44Å; V262-W266 PolarHBondContact O-N 3.28Å; I263-W266 HydrophobicContact CG2-CE3 4.33Å; I263-W266 PolarHBondContact O-N 2.98Å; W266-K268 PolarHBondContact O-N 3.39Å; W266-K268 VanDerWaalsContact O-N 3.1Å; W266-H269 WeakPolarHBondContact O-CA 3.43Å; W266-H269 WeakPolarHBondContact O-CB 3.36Å; W266-H269 PolarHBondContact O-N 2.92Å; W266-I270 HydrophobicContact CD2-CD1 4.36Å; W266-I270 HydrophobicContact CE3-CD1 4.19Å; W266-I270 HydrophobicContact CH2-CD1 3.6Å; W266-I270 HydrophobicContact CZ2-CD1 3.78Å; W266-I270 HydrophobicContact CZ2-CG1 4.22Å; W266-I270 HydrophobicContact CZ3-CD1 3.82Å; W266-I292 HydrophobicContact CZ3-CD1 4.07Å; W266-I292 HydrophobicContact CZ3-CG1 4.48Å; W266-I292 HydrophobicContact CZ3-CG2 4.21Å; W266-K354 HydrophobicContact CH2-CB 4.09Å; W266-K354 HydrophobicContact CH2-CD 4.28Å; W266-K354 HydrophobicContact CH2-CG 3.82Å; W266-K354 HydrophobicContact CZ2-CB 4.16Å; W266-K354 HydrophobicContact CZ2-CD 4.29Å; W266-K354 HydrophobicContact CZ2-CG 4.15Å; W266-K354 HydrophobicContact CZ3-CG 4.49Å; W266-A355 HydrophobicContact CZ2-CB 4.41Å; W266-L358 HydrophobicContact CZ3-CD2 4.16Å
267	A	97.6	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-54.2	-35.2	-178.8	0	0	0	0	0	113.2	I263 G265 H269 I270 F273 L285 L358	I263-A267 WeakPolarHBondContact O-CB 3.44Å; I263-A267 PolarHBondContact O-N 3.28Å; G265-A267 VanDerWaalsContact C-N 3.29Å; G265-A267 PolarHBondContact O-N 2.83Å; A267-H269 PolarHBondContact O-N 2.67Å; A267-I270 WeakPolarHBondContact O-CB 3.3Å; A267-I270 PolarHBondContact O-N 3.12Å; A267-I270 VanDerWaalsContact O-N 3.14Å; A267-F273 HydrophobicContact CB-CD1 4.16Å; A267-F273 HydrophobicContact CB-CE1 3.79Å; A267-F273 HydrophobicContact CB-CE2 4.37Å; A267-F273 HydrophobicContact CB-CZ 3.91Å; A267-F273 WeakPolarHBondContact O-CB 3.38Å; A267-F273 WeakPolarHBondContact O-CD1 3.27Å; A267-F273 VanDerWaalsContact O-CG 3.29Å; A267-F273 WeakPolarHBondContact O-CG 3.23Å; A267-L285 HydrophobicContact CB-CD2 3.9Å; A267-L285 HydrophobicContact CB-CG 4.49Å; A267-L358 HydrophobicContact CB-CD2 3.74Å
268	K	96	Very high	96.2	Very high	116 Å²	116	46.9 Å²	46.9	50%	0.504	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-69.4	-18.4	179.2	-60.6	170	-173.7	170.7	0	113.4	I264 G265 W266 S274	I264-K268 WeakPolarHBondContact O-CE 3.19Å; G265-K268 WeakPolarHBondContact O-CB 3.45Å; G265-K268 PolarHBondContact O-N 3.26Å; G265-K268 VanDerWaalsContact O-N 3.08Å; W266-K268 PolarHBondContact O-N 3.39Å; W266-K268 VanDerWaalsContact O-N 3.1Å; K268-S274 WeakPolarHBondContact CA-OG 3.3Å; K268-S274 PolarHBondContact O-OG 3.43Å; K268-S274 VanDerWaalsContact O-OG 3.09Å
269	H	95	Very high	96.1	Very high	109 Å²	109	45.3 Å²	45.3	51%	0.505	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-91	-2.4	175.7	-62	-86	0	0	0	113.1	H224 A228 G265 W266 A267 P271	H224-H269 PolarHBondContact CE1-O 3.43Å; H224-H269 PolarHBondContact ND1-O 3.4Å; A228-H269 HydrophobicContact CB-CB 3.64Å; G265-H269 PolarHBondContact O-CD2 3.22Å; W266-H269 WeakPolarHBondContact O-CA 3.43Å; W266-H269 WeakPolarHBondContact O-CB 3.36Å; W266-H269 PolarHBondContact O-N 2.92Å; A267-H269 PolarHBondContact O-N 2.67Å; H269-P271 WeakPolarHBondContact O-CD 3.46Å
270	I	96.7	Very high	96	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.015	26%	0.264	C	S	.	.	S	Bend	trans	-75.2	124.5	173.6	-62.1	168	0	0	0	108.8	L225 W266 A267 G272 F273 A355 L358 L375 L379	L225-I270 HydrophobicContact CD2-CB 4.41Å; L225-I270 HydrophobicContact CD2-CG1 3.95Å; L225-I270 HydrophobicContact CD2-CG2 4.29Å; W266-I270 HydrophobicContact CD2-CD1 4.36Å; W266-I270 HydrophobicContact CE3-CD1 4.19Å; W266-I270 HydrophobicContact CH2-CD1 3.6Å; W266-I270 HydrophobicContact CZ2-CD1 3.78Å; W266-I270 HydrophobicContact CZ2-CG1 4.22Å; W266-I270 HydrophobicContact CZ3-CD1 3.82Å; A267-I270 WeakPolarHBondContact O-CB 3.3Å; A267-I270 PolarHBondContact O-N 3.12Å; A267-I270 VanDerWaalsContact O-N 3.14Å; I270-G272 PolarHBondContact O-N 3.36Å; I270-G272 VanDerWaalsContact O-N 3.12Å; I270-F273 HydrophobicContact CB-CB 3.98Å; I270-F273 HydrophobicContact CG2-CB 4.35Å; I270-F273 PolarHBondContact O-N 2.89Å; I270-A355 HydrophobicContact CD1-CB 4.21Å; I270-A355 HydrophobicContact CG2-CB 4.36Å; I270-L358 HydrophobicContact CD1-CD2 3.43Å; I270-L358 VanDerWaalsContact CD1-CD2 3.43Å; I270-L375 HydrophobicContact CG2-CD1 4.21Å; I270-L379 HydrophobicContact CG2-CD1 4.49Å; I270-L379 HydrophobicContact CG2-CD2 4.31Å
271	P	94.5	Very high	96	Very high	35 Å²	35	45.4 Å²	45.4	23%	0.227	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	119.5	179.8	-28	36.4	0	0	0	112.2	I221 H224 H269 L375	I221-P271 HydrophobicContact CD1-CB 3.82Å; I221-P271 HydrophobicContact CD1-CG 3.96Å; H224-P271 HydrophobicContact CB-CG 4.23Å; H269-P271 WeakPolarHBondContact O-CD 3.46Å; P271-L375 WeakPolarHBondContact O-CD1 3.14Å
272	G	94.3	Very high	95.9	Very high	33 Å²	33	46 Å²	46	34%	0.34	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-26.4	-179	0	0	0	0	0	115.5	I270 S274 T275	I270-G272 PolarHBondContact O-N 3.36Å; I270-G272 VanDerWaalsContact O-N 3.12Å; G272-S274 PolarHBondContact O-N 3.14Å; G272-T275 WeakPolarHBondContact O-CB 3.35Å; G272-T275 PolarHBondContact O-N 3.18Å; G272-T275 PolarHBondContact O-OG1 3.48Å
273	F	97.1	Very high	95.8	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.2	-47.6	-176.8	-179.8	-89	0	0	0	112.5	A267 I270 T275 L276 Q281 L284 L285 L358 L375	A267-F273 HydrophobicContact CB-CD1 4.16Å; A267-F273 HydrophobicContact CB-CE1 3.79Å; A267-F273 HydrophobicContact CB-CE2 4.37Å; A267-F273 HydrophobicContact CB-CZ 3.91Å; A267-F273 WeakPolarHBondContact O-CB 3.38Å; A267-F273 WeakPolarHBondContact O-CD1 3.27Å; A267-F273 VanDerWaalsContact O-CG 3.29Å; A267-F273 WeakPolarHBondContact O-CG 3.23Å; I270-F273 HydrophobicContact CB-CB 3.98Å; I270-F273 HydrophobicContact CG2-CB 4.35Å; I270-F273 PolarHBondContact O-N 2.89Å; F273-T275 PolarHBondContact O-N 2.73Å; F273-L276 HydrophobicContact CD2-CD1 4.35Å; F273-L276 WeakPolarHBondContact O-CB 3.48Å; F273-L276 WeakPolarHBondContact O-CG 3.36Å; F273-L276 PolarHBondContact O-N 2.91Å; F273-L276 VanDerWaalsContact O-N 3.1Å; F273-Q281 HydrophobicContact CD1-CG 4.06Å; F273-Q281 HydrophobicContact CE1-CB 3.78Å; F273-Q281 HydrophobicContact CE1-CG 3.58Å; F273-Q281 HydrophobicContact CE2-CB 4.48Å; F273-Q281 HydrophobicContact CE2-CG 4.43Å; F273-Q281 HydrophobicContact CZ-CB 3.64Å; F273-Q281 HydrophobicContact CZ-CG 3.79Å; F273-L284 HydrophobicContact CD2-CD1 4.04Å; F273-L284 HydrophobicContact CE2-CB 4.05Å; F273-L284 HydrophobicContact CE2-CD1 3.81Å; F273-L285 HydrophobicContact CZ-CD1 4.1Å; F273-L285 HydrophobicContact CZ-CG 4.13Å; F273-L358 HydrophobicContact CD2-CD2 3.76Å; F273-L358 HydrophobicContact CD2-CG 4.44Å; F273-L358 HydrophobicContact CE2-CD1 4.38Å; F273-L358 HydrophobicContact CE2-CD2 3.63Å; F273-L358 HydrophobicContact CE2-CG 4.1Å; F273-L358 HydrophobicContact CZ-CD2 4.38Å; F273-L375 HydrophobicContact CB-CD2 4.32Å; F273-L375 HydrophobicContact CD2-CD2 4.22Å
274	S	96	Very high	95.8	Very high	65 Å²	65	43.5 Å²	43.5	46%	0.455	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-70.2	7.2	176.3	-65.6	0	0	0	0	115.3	K268 G272	K268-S274 WeakPolarHBondContact CA-OG 3.3Å; K268-S274 PolarHBondContact O-OG 3.43Å; K268-S274 VanDerWaalsContact O-OG 3.09Å; G272-S274 PolarHBondContact O-N 3.14Å
275	T	95.3	Very high	95.8	Very high	119 Å²	119	42.2 Å²	42.2	73%	0.73	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-99.5	-10.2	170	73.3	0	0	0	0	113.4	G272 F273	G272-T275 WeakPolarHBondContact O-CB 3.35Å; G272-T275 PolarHBondContact O-N 3.18Å; G272-T275 PolarHBondContact O-OG1 3.48Å; F273-T275 PolarHBondContact O-N 2.73Å
276	L	96.4	Very high	95.8	Very high	12 Å²	12	44 Å²	44	6%	0.063	25%	0.249	C	C	.	.	S	Bend	trans	-73.4	162.6	175	-57.9	177.4	0	0	0	111.6	F273 D280 Q281 L284 A371 V372 L375	F273-L276 HydrophobicContact CD2-CD1 4.35Å; F273-L276 WeakPolarHBondContact O-CB 3.48Å; F273-L276 WeakPolarHBondContact O-CG 3.36Å; F273-L276 PolarHBondContact O-N 2.91Å; F273-L276 VanDerWaalsContact O-N 3.1Å; L276-D280 HydrophobicContact CB-CB 4.05Å; L276-Q281 HydrophobicContact CB-CG 4.01Å; L276-Q281 PolarHBondContact O-NE2 3.33Å; L276-L284 HydrophobicContact CD1-CD1 3.47Å; L276-L284 VanDerWaalsContact CD1-CD1 3.47Å; L276-A371 HydrophobicContact CD2-CB 3.57Å; L276-V372 HydrophobicContact CD1-CG2 4.19Å; L276-V372 HydrophobicContact CD2-CG2 4.11Å; L276-L375 HydrophobicContact CD1-CD2 3.91Å
277	S	96.4	Very high	95.6	Very high	40 Å²	40	44.3 Å²	44.3	28%	0.28	25%	0.252	S	S	.	.			trans	-54.6	151.9	168.1	148.2	0	0	0	0	111.3	A279 D280 Q281 E367	S277-A279 VanDerWaalsContact C-N 3.25Å; S277-A279 PolarHBondContact O-N 3.09Å; S277-A279 PolarHBondContact OG-N 3.44Å; S277-D280 PolarHBondContact O-N 3.41Å; S277-D280 PolarHBondContact OG-N 2.89Å; S277-Q281 WeakPolarHBondContact O-CG 3.47Å; S277-Q281 PolarHBondContact O-N 3.02Å; S277-E367 VanDerWaalsContact CB-OE2 3.26Å; S277-E367 WeakPolarHBondContact CB-OE2 3.25Å; S277-E367 PolarHBondContact OG-OE2 3.39Å
278	L	95.7	Very high	95.5	Very high	123 Å²	123	44.3 Å²	44.3	64%	0.644	25%	0.252	S	S	*	.	H	α-helix	trans	-63.6	-33.8	174.2	-177.9	60.8	0	0	0	111.7	Q281 M282	L278-Q281 PolarHBondContact O-N 3.04Å; L278-M282 HydrophobicContact CD1-CG 4.46Å; L278-M282 HydrophobicContact CG-SD 4.27Å; L278-M282 WeakPolarHBondContact O-CB 3.35Å; L278-M282 VanDerWaalsContact O-CG 3.28Å; L278-M282 WeakPolarHBondContact O-CG 3.44Å; L278-M282 PolarHBondContact O-N 2.89Å
279	A	94.8	Very high	95.6	Very high	39 Å²	39	38.8 Å²	38.8	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-68.9	-37.6	175.2	0	0	0	0	0	111.6	S277 S283 E367	S277-A279 VanDerWaalsContact C-N 3.25Å; S277-A279 PolarHBondContact O-N 3.09Å; S277-A279 PolarHBondContact OG-N 3.44Å; A279-S283 VanDerWaalsContact O-CB 3.26Å; A279-S283 WeakPolarHBondContact O-CB 3.09Å; A279-S283 PolarHBondContact O-N 3.32Å; A279-S283 PolarHBondContact O-OG 3.15Å; A279-E367 HydrophobicContact CB-CG 4.45Å
280	D	96	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-48.1	172.2	-73.7	-23.7	0	0	0	111.3	L276 S277 M282 S283 L284 I366 E367 D368	L276-D280 HydrophobicContact CB-CB 4.05Å; S277-D280 PolarHBondContact O-N 3.41Å; S277-D280 PolarHBondContact OG-N 2.89Å; D280-M282 VanDerWaalsContact C-N 3.31Å; D280-M282 PolarHBondContact O-N 2.99Å; D280-S283 PolarHBondContact O-N 3.05Å; D280-S283 VanDerWaalsContact O-N 3.14Å; D280-L284 WeakPolarHBondContact O-CG 3.24Å; D280-L284 PolarHBondContact O-N 2.9Å; D280-I366 WeakPolarHBondContact OD1-CA 3.26Å; D280-E367 PolarHBondContact OD1-N 3.16Å; D280-D368 PolarHBondContact OD2-N 2.87Å; D280-D368 VanDerWaalsContact OD2-N 3.16Å
281	Q	96.3	Very high	95.7	Very high	27 Å²	27	33.9 Å²	33.9	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-56.7	-43.8	176.8	-71	178	49.1	0	0	111.8	F273 L276 S277 L278 L285	F273-Q281 HydrophobicContact CD1-CG 4.06Å; F273-Q281 HydrophobicContact CE1-CB 3.78Å; F273-Q281 HydrophobicContact CE1-CG 3.58Å; F273-Q281 HydrophobicContact CE2-CB 4.48Å; F273-Q281 HydrophobicContact CE2-CG 4.43Å; F273-Q281 HydrophobicContact CZ-CB 3.64Å; F273-Q281 HydrophobicContact CZ-CG 3.79Å; L276-Q281 HydrophobicContact CB-CG 4.01Å; L276-Q281 PolarHBondContact O-NE2 3.33Å; S277-Q281 WeakPolarHBondContact O-CG 3.47Å; S277-Q281 PolarHBondContact O-N 3.02Å; L278-Q281 PolarHBondContact O-N 3.04Å; Q281-L285 WeakPolarHBondContact O-CG 3.35Å; Q281-L285 PolarHBondContact O-N 2.73Å
282	M	94.4	Very high	95.9	Very high	97 Å²	97	32.3 Å²	32.3	48%	0.478	20%	0.195	S	C	.	.	H	α-helix	trans	-65.9	-44.4	175	-72.8	177.3	64.9	0	0	111.9	L278 D280 L284 L285 Q286	L278-M282 HydrophobicContact CD1-CG 4.46Å; L278-M282 HydrophobicContact CG-SD 4.27Å; L278-M282 WeakPolarHBondContact O-CB 3.35Å; L278-M282 VanDerWaalsContact O-CG 3.28Å; L278-M282 WeakPolarHBondContact O-CG 3.44Å; L278-M282 PolarHBondContact O-N 2.89Å; D280-M282 VanDerWaalsContact C-N 3.31Å; D280-M282 PolarHBondContact O-N 2.99Å; M282-L284 PolarHBondContact O-N 3.44Å; M282-L285 PolarHBondContact O-N 2.87Å; M282-Q286 WeakPolarHBondContact O-CB 3.31Å; M282-Q286 WeakPolarHBondContact O-CG 3.48Å; M282-Q286 PolarHBondContact O-N 3.31Å
283	S	94.9	Very high	96.1	Very high	15 Å²	15	31.3 Å²	31.3	11%	0.105	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-43.5	178.3	-67	0	0	0	0	112.6	A279 D280 S287	A279-S283 VanDerWaalsContact O-CB 3.26Å; A279-S283 WeakPolarHBondContact O-CB 3.09Å; A279-S283 PolarHBondContact O-N 3.32Å; A279-S283 PolarHBondContact O-OG 3.15Å; D280-S283 PolarHBondContact O-N 3.05Å; D280-S283 VanDerWaalsContact O-N 3.14Å; S283-S287 WeakPolarHBondContact O-CB 3.48Å; S283-S287 PolarHBondContact O-N 3.16Å; S283-S287 PolarHBondContact O-OG 2.72Å
284	L	96.2	Very high	96.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.4	-51.1	175.5	-67.2	-173.8	0	0	0	110.7	F273 L276 D280 M282 S287 A288 L358 S361 I366 V372 L375	F273-L284 HydrophobicContact CD2-CD1 4.04Å; F273-L284 HydrophobicContact CE2-CB 4.05Å; F273-L284 HydrophobicContact CE2-CD1 3.81Å; L276-L284 HydrophobicContact CD1-CD1 3.47Å; L276-L284 VanDerWaalsContact CD1-CD1 3.47Å; D280-L284 WeakPolarHBondContact O-CG 3.24Å; D280-L284 PolarHBondContact O-N 2.9Å; M282-L284 PolarHBondContact O-N 3.44Å; L284-S287 PolarHBondContact O-N 2.84Å; L284-S287 VanDerWaalsContact O-N 3.16Å; L284-S287 PolarHBondContact O-OG 2.72Å; L284-A288 WeakPolarHBondContact O-CB 3.42Å; L284-A288 PolarHBondContact O-N 2.83Å; L284-L358 HydrophobicContact CB-CD1 4.11Å; L284-L358 HydrophobicContact CB-CG 4.43Å; L284-S361 VanDerWaalsContact CD2-CB 3.4Å; L284-I366 HydrophobicContact CD2-CD1 4.08Å; L284-V372 HydrophobicContact CD2-CG1 4.16Å; L284-L375 HydrophobicContact CD1-CD2 4.28Å
285	L	95.8	Very high	96.2	Very high	17 Å²	17	28.5 Å²	28.5	9%	0.089	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-50.3	178.4	-78.9	164.4	0	0	0	112.6	I263 I264 A267 F273 Q281 M282 S287 A288 W289 L358	I263-L285 HydrophobicContact CG2-CD2 4.16Å; I264-L285 HydrophobicContact CG1-CD1 4.29Å; I264-L285 HydrophobicContact CG1-CD2 4.23Å; I264-L285 HydrophobicContact CG2-CD1 4.42Å; A267-L285 HydrophobicContact CB-CD2 3.9Å; A267-L285 HydrophobicContact CB-CG 4.49Å; F273-L285 HydrophobicContact CZ-CD1 4.1Å; F273-L285 HydrophobicContact CZ-CG 4.13Å; Q281-L285 WeakPolarHBondContact O-CG 3.35Å; Q281-L285 PolarHBondContact O-N 2.73Å; M282-L285 PolarHBondContact O-N 2.87Å; L285-S287 PolarHBondContact O-N 3.33Å; L285-A288 PolarHBondContact O-N 2.81Å; L285-W289 WeakPolarHBondContact O-CB 3.31Å; L285-W289 PolarHBondContact O-N 3.15Å; L285-L358 HydrophobicContact CD2-CD1 3.99Å; L285-L358 HydrophobicContact CG-CD1 4.19Å
286	Q	94.6	Very high	96.4	Very high	66 Å²	66	23.2 Å²	23.2	31%	0.308	13%	0.131	S	C	.	.	H	α-helix	trans	-61.8	-30.2	177.1	-73.6	175.7	-39	0	0	112.2	M282 W289 M437 A440 K441	M282-Q286 WeakPolarHBondContact O-CB 3.31Å; M282-Q286 WeakPolarHBondContact O-CG 3.48Å; M282-Q286 PolarHBondContact O-N 3.31Å; Q286-W289 VanDerWaalsContact O-CD1 3.28Å; Q286-M437 HydrophobicContact CG-CE 4.33Å; Q286-M437 HydrophobicContact CG-SD 3.95Å; Q286-A440 HydrophobicContact CB-CB 3.95Å; Q286-A440 HydrophobicContact CG-CB 3.75Å; Q286-K441 VanDerWaalsContact O-CE 3.24Å; Q286-K441 WeakPolarHBondContact O-CE 3.46Å
287	S	94.1	Very high	96.5	Very high	13 Å²	13	23 Å²	23	9%	0.091	13%	0.13	C	C	.	.	H	α-helix	trans	-79.4	-29.1	177.1	76	0	0	0	0	114.8	S283 L284 L285 S361 K441	S283-S287 WeakPolarHBondContact O-CB 3.48Å; S283-S287 PolarHBondContact O-N 3.16Å; S283-S287 PolarHBondContact O-OG 2.72Å; L284-S287 PolarHBondContact O-N 2.84Å; L284-S287 VanDerWaalsContact O-N 3.16Å; L284-S287 PolarHBondContact O-OG 2.72Å; L285-S287 PolarHBondContact O-N 3.33Å; S287-S361 WeakPolarHBondContact CB-OG 3.26Å; S287-S361 VanDerWaalsContact OG-CB 3.24Å; S287-S361 WeakPolarHBondContact OG-CB 3.33Å; S287-S361 PolarHBondContact OG-OG 3.04Å; S287-K441 WeakPolarHBondContact O-CE 3.32Å; S287-K441 PolarHBondContact O-NZ 3.11Å
288	A	96	Very high	96.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-117.3	-9.8	-167.1	0	0	0	0	0	115.5	L284 L285 M290 E291 I292 A357 L358	L284-A288 WeakPolarHBondContact O-CB 3.42Å; L284-A288 PolarHBondContact O-N 2.83Å; L285-A288 PolarHBondContact O-N 2.81Å; A288-M290 VanDerWaalsContact C-N 3.34Å; A288-M290 PolarHBondContact O-N 3.1Å; A288-M290 VanDerWaalsContact O-N 3.17Å; A288-E291 WeakPolarHBondContact O-CA 3.32Å; A288-E291 WeakPolarHBondContact O-CB 3.41Å; A288-E291 PolarHBondContact O-N 3.07Å; A288-I292 HydrophobicContact CB-CD1 4.01Å; A288-I292 HydrophobicContact CB-CG1 4.5Å; A288-I292 WeakPolarHBondContact O-CG1 3.3Å; A288-I292 PolarHBondContact O-N 3.42Å; A288-A357 WeakPolarHBondContact CB-O 3.39Å; A288-L358 HydrophobicContact CB-CD1 4.13Å
289	W	96.6	Very high	96.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-51.1	-45.3	-170.6	68.9	-89.7	0	0	0	115.2	L260 L285 Q286 E291 I292 L293 V416 F434 M437 L438	L260-W289 HydrophobicContact CD1-CE3 4.21Å; L260-W289 HydrophobicContact CD1-CZ3 4.28Å; L260-W289 HydrophobicContact CD2-CB 3.68Å; L260-W289 HydrophobicContact CD2-CD2 4.04Å; L260-W289 HydrophobicContact CD2-CE3 3.76Å; L260-W289 HydrophobicContact CD2-CG 4.07Å; L260-W289 HydrophobicContact CG-CE3 4.23Å; L285-W289 WeakPolarHBondContact O-CB 3.31Å; L285-W289 PolarHBondContact O-N 3.15Å; Q286-W289 VanDerWaalsContact O-CD1 3.28Å; W289-E291 VanDerWaalsContact C-N 3.33Å; W289-E291 PolarHBondContact O-N 3.13Å; W289-I292 WeakPolarHBondContact O-CB 3.44Å; W289-I292 PolarHBondContact O-N 3.26Å; W289-L293 HydrophobicContact CE3-CD1 3.56Å; W289-L293 HydrophobicContact CE3-CG 4.47Å; W289-L293 HydrophobicContact CZ3-CD1 3.63Å; W289-L293 WeakPolarHBondContact O-CG 3.45Å; W289-L293 PolarHBondContact O-N 3.28Å; W289-V416 HydrophobicContact CZ2-CG2 4.36Å; W289-F434 HydrophobicContact CH2-CD2 4.08Å; W289-F434 AromaticContact CH2-CE2 3.74Å; W289-F434 HydrophobicContact CH2-CE2 3.74Å; W289-F434 HydrophobicContact CZ3-CD2 4.02Å; W289-F434 AromaticContact CZ3-CE2 3.71Å; W289-F434 HydrophobicContact CZ3-CE2 3.71Å; W289-M437 HydrophobicContact CB-CE 3.68Å; W289-M437 HydrophobicContact CD2-CB 4.15Å; W289-M437 HydrophobicContact CG-CB 4.43Å; W289-M437 HydrophobicContact CG-CE 3.69Å; W289-M437 HydrophobicContact CZ2-CB 4.01Å; W289-M437 WeakPolarHBondContact CZ2-O 3.39Å; W289-M437 PolarHBondContact NE1-O 3.32Å; W289-L438 HydrophobicContact CH2-CD2 3.86Å; W289-L438 HydrophobicContact CH2-CG 4.1Å; W289-L438 HydrophobicContact CZ2-CD2 3.91Å; W289-L438 HydrophobicContact CZ2-CG 4.15Å
290	M	97.4	Very high	96.8	Very high	8 Å²	8	19.5 Å²	19.5	4%	0.039	9%	0.094	C	C	.	.	H	α-helix	trans	-71	-28.8	-179.6	-178.6	66.9	81.5	0	0	112.2	A288 L293 I294 S412 A415 V416 F419	A288-M290 VanDerWaalsContact C-N 3.34Å; A288-M290 PolarHBondContact O-N 3.1Å; A288-M290 VanDerWaalsContact O-N 3.17Å; M290-L293 HydrophobicContact SD-CD1 4.4Å; M290-I294 HydrophobicContact CG-CD1 3.84Å; M290-I294 HydrophobicContact CG-CG1 4.47Å; M290-I294 WeakPolarHBondContact O-CB 3.13Å; M290-I294 WeakPolarHBondContact O-CD1 3.4Å; M290-I294 WeakPolarHBondContact O-CG1 3.3Å; M290-I294 PolarHBondContact O-N 3.01Å; M290-I294 HydrophobicContact SD-CD1 4.19Å; M290-I294 HydrophobicContact SD-CG1 4.34Å; M290-S412 WeakPolarHBondContact CB-OG 3.49Å; M290-A415 HydrophobicContact CE-CB 3.94Å; M290-A415 HydrophobicContact CG-CB 3.83Å; M290-A415 HydrophobicContact SD-CB 3.65Å; M290-V416 HydrophobicContact CB-CG2 3.99Å; M290-V416 HydrophobicContact CE-CG2 4.13Å; M290-V416 HydrophobicContact CG-CG2 4.01Å; M290-F419 HydrophobicContact CE-CD2 3.87Å; M290-F419 HydrophobicContact CE-CE2 4.38Å
291	E	97.7	Very high	97	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-68.2	-38.2	171.9	-63	173.5	-110.7	0	0	111.1	A288 W289 I294 L295 L408 R409 S412	A288-E291 WeakPolarHBondContact O-CA 3.32Å; A288-E291 WeakPolarHBondContact O-CB 3.41Å; A288-E291 PolarHBondContact O-N 3.07Å; W289-E291 VanDerWaalsContact C-N 3.33Å; W289-E291 PolarHBondContact O-N 3.13Å; E291-I294 PolarHBondContact O-N 3.33Å; E291-L295 WeakPolarHBondContact O-CB 3.37Å; E291-L295 WeakPolarHBondContact O-CG 3.41Å; E291-L295 PolarHBondContact O-N 3.38Å; E291-L408 HydrophobicContact CB-CD1 4.33Å; E291-L408 HydrophobicContact CB-CD2 3.95Å; E291-L408 HydrophobicContact CB-CG 3.9Å; E291-L408 HydrophobicContact CG-CD2 4.49Å; E291-L408 HydrophobicContact CG-CG 4.08Å; E291-R409 IonicContact OE1-CZ 2.72Å; E291-R409 IonicContact OE1-NE 2.64Å; E291-R409 PolarHBondContact OE1-NE 3.41Å; E291-R409 IonicContact OE1-NH2 2.66Å; E291-R409 PolarHBondContact OE1-NH2 3.11Å; E291-R409 IonicContact OE2-CZ 2.69Å; E291-R409 IonicContact OE2-NE 2.67Å; E291-R409 PolarHBondContact OE2-NE 3.05Å; E291-R409 IonicContact OE2-NH2 3.1Å; E291-R409 PolarHBondContact OE2-NH2 2.83Å; E291-R409 VanDerWaalsContact OE2-NH2 3.11Å; E291-S412 VanDerWaalsContact CG-CB 3.43Å; E291-S412 WeakPolarHBondContact CG-OG 3.35Å
292	I	97.8	Very high	97	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.015	10%	0.096	C	C	.	.	H	α-helix	trans	-67.4	-43.4	177.7	-63.2	161.4	0	0	0	110.5	I263 W266 A288 W289 G296 K354 L358	I263-I292 HydrophobicContact CB-CG2 4.49Å; I263-I292 HydrophobicContact CD1-CB 4.2Å; I263-I292 HydrophobicContact CD1-CG2 3.51Å; I263-I292 HydrophobicContact CG1-CG2 3.69Å; I263-I292 HydrophobicContact CG2-CD1 4.05Å; I263-I292 HydrophobicContact CG2-CG2 3.96Å; W266-I292 HydrophobicContact CZ3-CD1 4.07Å; W266-I292 HydrophobicContact CZ3-CG1 4.48Å; W266-I292 HydrophobicContact CZ3-CG2 4.21Å; A288-I292 HydrophobicContact CB-CD1 4.01Å; A288-I292 HydrophobicContact CB-CG1 4.5Å; A288-I292 WeakPolarHBondContact O-CG1 3.3Å; A288-I292 PolarHBondContact O-N 3.42Å; W289-I292 WeakPolarHBondContact O-CB 3.44Å; W289-I292 PolarHBondContact O-N 3.26Å; I292-G296 PolarHBondContact O-N 3.45Å; I292-G296 VanDerWaalsContact O-N 3.1Å; I292-K354 HydrophobicContact CB-CG 4.37Å; I292-K354 HydrophobicContact CG1-CG 4.33Å; I292-K354 HydrophobicContact CG2-CD 3.81Å; I292-K354 HydrophobicContact CG2-CG 3.81Å; I292-L358 HydrophobicContact CD1-CB 4.1Å; I292-L358 HydrophobicContact CD1-CD1 3.9Å
293	L	98	Very high	97.1	Very high	12 Å²	12	19.7 Å²	19.7	6%	0.063	11%	0.106	C	C	.	.	H	α-helix	trans	-61	-49.8	172.6	-68.9	176.6	0	0	0	111.7	A256 E259 I263 W289 M290 L295 G296 V297	A256-L293 HydrophobicContact CB-CD1 4.16Å; E259-L293 HydrophobicContact CB-CD2 3.37Å; E259-L293 HydrophobicContact CG-CD2 4.28Å; E259-L293 WeakPolarHBondContact OE2-CD2 3.21Å; I263-L293 HydrophobicContact CD1-CD2 3.58Å; I263-L293 HydrophobicContact CD1-CG 4.02Å; W289-L293 HydrophobicContact CE3-CD1 3.56Å; W289-L293 HydrophobicContact CE3-CG 4.47Å; W289-L293 HydrophobicContact CZ3-CD1 3.63Å; W289-L293 WeakPolarHBondContact O-CG 3.45Å; W289-L293 PolarHBondContact O-N 3.28Å; M290-L293 HydrophobicContact SD-CD1 4.4Å; L293-L295 VanDerWaalsContact C-N 3.35Å; L293-L295 PolarHBondContact O-N 2.98Å; L293-G296 WeakPolarHBondContact O-CA 3.46Å; L293-G296 PolarHBondContact O-N 2.88Å; L293-V297 PolarHBondContact O-N 2.89Å
294	I	98.4	Very high	97.2	Very high	5 Å²	5	22 Å²	22	3%	0.026	11%	0.114	C	C	.	.	H	α-helix	trans	-62.8	-41	-179.7	-71.4	165.4	0	0	0	111.1	M290 E291 G296 V297 V298 I333 L336 L408 T411 S412 A415	M290-I294 HydrophobicContact CG-CD1 3.84Å; M290-I294 HydrophobicContact CG-CG1 4.47Å; M290-I294 WeakPolarHBondContact O-CB 3.13Å; M290-I294 WeakPolarHBondContact O-CD1 3.4Å; M290-I294 WeakPolarHBondContact O-CG1 3.3Å; M290-I294 PolarHBondContact O-N 3.01Å; M290-I294 HydrophobicContact SD-CD1 4.19Å; M290-I294 HydrophobicContact SD-CG1 4.34Å; E291-I294 PolarHBondContact O-N 3.33Å; I294-G296 VanDerWaalsContact C-N 3.28Å; I294-G296 PolarHBondContact O-N 3.34Å; I294-V297 PolarHBondContact O-N 3.47Å; I294-V298 HydrophobicContact CG2-CG2 4.01Å; I294-V298 VanDerWaalsContact O-CB 3.25Å; I294-V298 WeakPolarHBondContact O-CB 3.2Å; I294-V298 WeakPolarHBondContact O-CG2 3.44Å; I294-V298 PolarHBondContact O-N 3.41Å; I294-I333 HydrophobicContact CG2-CG1 4.45Å; I294-L336 HydrophobicContact CG2-CD1 3.67Å; I294-L408 HydrophobicContact CB-CD1 4.12Å; I294-L408 HydrophobicContact CG2-CD1 3.74Å; I294-T411 HydrophobicContact CD1-CG2 4.24Å; I294-T411 HydrophobicContact CG2-CG2 4.47Å; I294-S412 VanDerWaalsContact CD1-CA 3.48Å; I294-A415 HydrophobicContact CD1-CB 3.88Å
295	L	98.1	Very high	97.1	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-58	-41.4	172.2	-81.2	175.4	0	0	0	111.6	E291 L293 V298 Y299 Y340 F350 K354 A357 L408	E291-L295 WeakPolarHBondContact O-CB 3.37Å; E291-L295 WeakPolarHBondContact O-CG 3.41Å; E291-L295 PolarHBondContact O-N 3.38Å; L293-L295 VanDerWaalsContact C-N 3.35Å; L293-L295 PolarHBondContact O-N 2.98Å; L295-V298 PolarHBondContact O-N 3.31Å; L295-Y299 VanDerWaalsContact O-CB 3.32Å; L295-Y299 WeakPolarHBondContact O-CB 3.24Å; L295-Y299 PolarHBondContact O-N 2.88Å; L295-Y340 HydrophobicContact CD2-CE2 4.13Å; L295-F350 HydrophobicContact CB-CE2 4.08Å; L295-F350 WeakPolarHBondContact O-CE2 3.16Å; L295-K354 HydrophobicContact CD1-CB 4.23Å; L295-K354 HydrophobicContact CD1-CG 4.22Å; L295-A357 HydrophobicContact CD1-CB 4.11Å; L295-L408 HydrophobicContact CD1-CD2 3.63Å; L295-L408 HydrophobicContact CD2-CD1 4.21Å; L295-L408 HydrophobicContact CD2-CD2 3.93Å; L295-L408 HydrophobicContact CG-CD1 3.9Å; L295-L408 HydrophobicContact CG-CD2 3.6Å; L295-L408 HydrophobicContact CG-CG 4.41Å
296	G	98.1	Very high	97.1	Very high	8 Å²	8	31.8 Å²	31.8	8%	0.082	16%	0.162	C	C	.	.	H	α-helix	trans	-57.4	-54.6	174.5	0	0	0	0	0	112.6	I292 L293 I294 V298 Y299 R300	I292-G296 PolarHBondContact O-N 3.45Å; I292-G296 VanDerWaalsContact O-N 3.1Å; L293-G296 WeakPolarHBondContact O-CA 3.46Å; L293-G296 PolarHBondContact O-N 2.88Å; I294-G296 VanDerWaalsContact C-N 3.28Å; I294-G296 PolarHBondContact O-N 3.34Å; G296-V298 VanDerWaalsContact C-N 3.35Å; G296-V298 PolarHBondContact O-N 3.37Å; G296-Y299 PolarHBondContact O-N 3.22Å; G296-R300 WeakPolarHBondContact O-CB 3.36Å; G296-R300 WeakPolarHBondContact O-CG 3.42Å; G296-R300 PolarHBondContact O-N 2.84Å
297	V	98.5	Very high	97.2	Very high	8 Å²	8	32 Å²	32	5%	0.048	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-45.4	176.7	179.1	0	0	0	0	111.2	L293 I294 Y299 R300 S301 L308 Y310 I333	L293-V297 PolarHBondContact O-N 2.89Å; I294-V297 PolarHBondContact O-N 3.47Å; V297-Y299 PolarHBondContact O-N 3.09Å; V297-R300 PolarHBondContact O-N 3.12Å; V297-S301 WeakPolarHBondContact O-CB 3.5Å; V297-S301 PolarHBondContact O-N 3.25Å; V297-S301 PolarHBondContact O-OG 3.07Å; V297-L308 HydrophobicContact CG1-CB 4.29Å; V297-L308 HydrophobicContact CG1-CD2 4.44Å; V297-Y310 HydrophobicContact CG1-CD1 4.13Å; V297-Y310 HydrophobicContact CG1-CE1 4.25Å; V297-Y310 HydrophobicContact CG1-CG 4.47Å; V297-Y310 HydrophobicContact CG2-CD1 3.79Å; V297-Y310 HydrophobicContact CG2-CE1 4.24Å; V297-I333 HydrophobicContact CG1-CG2 4.37Å
298	V	98.5	Very high	97.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-45.6	179.4	164.8	0	0	0	0	111.5	I294 L295 G296 S301 L302 I333 L336 V337 Y340	I294-V298 HydrophobicContact CG2-CG2 4.01Å; I294-V298 VanDerWaalsContact O-CB 3.25Å; I294-V298 WeakPolarHBondContact O-CB 3.2Å; I294-V298 WeakPolarHBondContact O-CG2 3.44Å; I294-V298 PolarHBondContact O-N 3.41Å; L295-V298 PolarHBondContact O-N 3.31Å; G296-V298 VanDerWaalsContact C-N 3.35Å; G296-V298 PolarHBondContact O-N 3.37Å; V298-S301 PolarHBondContact O-N 3.24Å; V298-L302 WeakPolarHBondContact O-CG 2.94Å; V298-L302 PolarHBondContact O-N 2.66Å; V298-I333 HydrophobicContact CG2-CG2 3.64Å; V298-L336 HydrophobicContact CG1-CB 4.22Å; V298-L336 HydrophobicContact CG2-CB 3.68Å; V298-L336 HydrophobicContact CG2-CD1 4.24Å; V298-V337 HydrophobicContact CB-CG2 4.36Å; V298-V337 HydrophobicContact CG1-CG2 4.29Å; V298-V337 HydrophobicContact CG2-CG2 4.16Å; V298-Y340 HydrophobicContact CG1-CD2 3.56Å; V298-Y340 HydrophobicContact CG1-CE2 4.13Å; V298-Y340 HydrophobicContact CG1-CG 4.42Å
299	Y	98.2	Very high	97.5	Very high	74 Å²	74	31.7 Å²	31.7	29%	0.29	16%	0.16	S	C	.	.	H	α-helix	trans	-66.8	-43.6	179	-176.6	-98.1	0	0	0	112	L295 G296 V297 S301 L302 L345 K347 F350	L295-Y299 VanDerWaalsContact O-CB 3.32Å; L295-Y299 WeakPolarHBondContact O-CB 3.24Å; L295-Y299 PolarHBondContact O-N 2.88Å; G296-Y299 PolarHBondContact O-N 3.22Å; V297-Y299 PolarHBondContact O-N 3.09Å; Y299-S301 PolarHBondContact O-N 2.91Å; Y299-L302 HydrophobicContact CD2-CD1 3.72Å; Y299-L302 HydrophobicContact CE2-CD1 4.17Å; Y299-L302 HydrophobicContact CG-CD1 4.43Å; Y299-L302 WeakPolarHBondContact O-CG 3.44Å; Y299-L302 PolarHBondContact O-N 2.67Å; Y299-L345 HydrophobicContact CD2-CD2 4.15Å; Y299-K347 WeakPolarHBondContact OH-CB 3.43Å; Y299-F350 AromaticContact CD1-CD1 3.96Å; Y299-F350 HydrophobicContact CD1-CD1 3.96Å; Y299-F350 AromaticContact CD1-CE1 3.97Å; Y299-F350 HydrophobicContact CD1-CE1 3.97Å; Y299-F350 HydrophobicContact CD1-CG 4.25Å; Y299-F350 HydrophobicContact CD1-CZ 4.26Å; Y299-F350 HydrophobicContact CD2-CB 3.53Å; Y299-F350 AromaticContact CD2-CD1 3.91Å; Y299-F350 HydrophobicContact CD2-CD1 3.91Å; Y299-F350 AromaticContact CD2-CD2 3.77Å; Y299-F350 HydrophobicContact CD2-CD2 3.77Å; Y299-F350 HydrophobicContact CD2-CE2 4.47Å; Y299-F350 AromaticContact CD2-CG 3.44Å; Y299-F350 HydrophobicContact CD2-CG 3.44Å; Y299-F350 VanDerWaalsContact CD2-CG 3.44Å; Y299-F350 HydrophobicContact CE1-CD1 4.18Å; Y299-F350 HydrophobicContact CE1-CE1 4.43Å; Y299-F350 HydrophobicContact CE2-CB 3.7Å; Y299-F350 HydrophobicContact CE2-CD1 4.12Å; Y299-F350 AromaticContact CE2-CG 3.91Å; Y299-F350 HydrophobicContact CE2-CG 3.91Å; Y299-F350 HydrophobicContact CG-CB 4.26Å; Y299-F350 AromaticContact CG-CD1 3.83Å; Y299-F350 HydrophobicContact CG-CD1 3.83Å; Y299-F350 AromaticContact CG-CD2 3.7Å; Y299-F350 HydrophobicContact CG-CD2 3.7Å; Y299-F350 HydrophobicContact CG-CE1 4.07Å; Y299-F350 AromaticContact CG-CE2 3.94Å; Y299-F350 HydrophobicContact CG-CE2 3.94Å; Y299-F350 AromaticContact CG-CG 3.64Å; Y299-F350 HydrophobicContact CG-CG 3.64Å; Y299-F350 HydrophobicContact CG-CZ 4.12Å
300	R	97.9	Very high	97.6	Very high	53 Å²	53	32.6 Å²	32.6	20%	0.2	16%	0.164	C	C	.	.	H	α-helix	trans	-58.5	-31.6	173.5	-71.5	-173.6	-72.8	-107.2	16.6	112.6	E259 G296 V297 V309 Y310	E259-R300 IonicContact OE1-CZ 3.85Å; E259-R300 VanDerWaalsContact OE1-CZ 3.27Å; E259-R300 IonicContact OE1-NH1 2.69Å; E259-R300 PolarHBondContact OE1-NH1 2.99Å; E259-R300 IonicContact OE1-NH2 2.83Å; E259-R300 PolarHBondContact OE1-NH2 3.17Å; E259-R300 IonicContact OE2-NH2 3.12Å; E259-R300 PolarHBondContact OE2-NH2 3.1Å; G296-R300 WeakPolarHBondContact O-CB 3.36Å; G296-R300 WeakPolarHBondContact O-CG 3.42Å; G296-R300 PolarHBondContact O-N 2.84Å; V297-R300 PolarHBondContact O-N 3.12Å; R300-V309 HydrophobicContact CB-CB 3.85Å; R300-V309 HydrophobicContact CB-CG1 3.85Å; R300-V309 WeakPolarHBondContact CB-O 3.45Å; R300-V309 PolarHBondContact NE-O 3.14Å; R300-Y310 PolarHBondContact NE-O 3.3Å; R300-Y310 VanDerWaalsContact NE-O 3.1Å; R300-Y310 PolarHBondContact NH2-O 3.44Å
301	S	98.4	Very high	97.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-6.2	-176	-50.2	0	0	0	0	114.9	V297 V298 Y299 S303 F304 V309	V297-S301 WeakPolarHBondContact O-CB 3.5Å; V297-S301 PolarHBondContact O-N 3.25Å; V297-S301 PolarHBondContact O-OG 3.07Å; V298-S301 PolarHBondContact O-N 3.24Å; Y299-S301 PolarHBondContact O-N 2.91Å; S301-S303 PolarHBondContact O-N 3.43Å; S301-S303 VanDerWaalsContact O-N 3.13Å; S301-F304 PolarHBondContact O-N 3.05Å; S301-V309 PolarHBondContact OG-N 2.89Å
302	L	97.9	Very high	97.5	Very high	29 Å²	29	35.7 Å²	35.7	15%	0.152	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.1	-172.1	-67.3	175.5	0	0	0	114.7	V298 Y299 K341 L345	V298-L302 WeakPolarHBondContact O-CG 2.94Å; V298-L302 PolarHBondContact O-N 2.66Å; Y299-L302 HydrophobicContact CD2-CD1 3.72Å; Y299-L302 HydrophobicContact CE2-CD1 4.17Å; Y299-L302 HydrophobicContact CG-CD1 4.43Å; Y299-L302 WeakPolarHBondContact O-CG 3.44Å; Y299-L302 PolarHBondContact O-N 2.67Å; L302-K341 HydrophobicContact CD2-CB 4.14Å; L302-K341 WeakPolarHBondContact O-CD 3.35Å; L302-K341 WeakPolarHBondContact O-CE 3.11Å; L302-L345 HydrophobicContact CD1-CB 4.13Å; L302-L345 HydrophobicContact CD1-CD2 4.4Å
303	S	96.2	Very high	97.4	Very high	99 Å²	99	38.5 Å²	38.5	69%	0.692	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-5.4	178.9	50.7	0	0	0	0	114.8	S301	S301-S303 PolarHBondContact O-N 3.43Å; S301-S303 VanDerWaalsContact O-N 3.13Å
304	F	96.7	Very high	97.4	Very high	64 Å²	64	39.4 Å²	39.4	28%	0.281	20%	0.199	S	C	.	.	S	Bend	trans	-106.2	164.8	-175.2	-63.5	-99.1	0	0	0	110.8	S301 E307 V309 I315 K341	S301-F304 PolarHBondContact O-N 3.05Å; F304-E307 HydrophobicContact CB-CB 4.33Å; F304-E307 WeakPolarHBondContact CD1-OE2 3.43Å; F304-V309 HydrophobicContact CD1-CG2 4.3Å; F304-V309 HydrophobicContact CD2-CG2 3.42Å; F304-V309 VanDerWaalsContact CD2-CG2 3.42Å; F304-V309 HydrophobicContact CE1-CG2 4.32Å; F304-V309 HydrophobicContact CE2-CG2 3.46Å; F304-V309 VanDerWaalsContact CE2-CG2 3.46Å; F304-V309 HydrophobicContact CG-CG2 3.88Å; F304-V309 HydrophobicContact CZ-CG2 3.93Å; F304-I315 HydrophobicContact CE1-CD1 3.79Å; F304-I315 HydrophobicContact CZ-CD1 4.1Å; F304-K341 PolarHBondContact O-NZ 3.08Å
305	E	94.4	Very high	97.4	Very high	138 Å²	138	41.8 Å²	41.8	65%	0.645	21%	0.211	S	C	*	.	S	Bend	trans	-116.3	115.5	176.5	-59	-60.7	166.4	0	0	109.6	E307 K341	E305-E307 PolarHBondContact O-N 2.64Å; E305-K341 IonicContact OE1-NZ 3.21Å; E305-K341 PolarHBondContact OE1-NZ 3.39Å; E305-K341 IonicContact OE2-NZ 3.11Å; E305-K341 PolarHBondContact OE2-NZ 2.98Å
306	D	94.3	Very high	97.3	Very high	83 Å²	83	41.7 Å²	41.7	44%	0.444	21%	0.211	S	C	.	.	S	Bend	trans	59.6	10	177	-75.2	-49.3	0	0	0	117.6	L334 K338	D306-L334 WeakPolarHBondContact O-CD1 3.4Å; D306-K338 WeakPolarHBondContact OD1-CE 3.47Å; D306-K338 IonicContact OD1-NZ 3.98Å; D306-K338 PolarHBondContact OD1-NZ 2.67Å; D306-K338 IonicContact OD2-NZ 2.79Å; D306-K338 PolarHBondContact OD2-NZ 3.12Å
307	E	97.4	Very high	97.2	Very high	72 Å²	72	44.2 Å²	44.2	34%	0.336	22%	0.222	S	C	.	.			trans	-104.7	154.7	170.5	-61.2	165.5	132.7	0	0	111.6	F304 E305 I315 D317	F304-E307 HydrophobicContact CB-CB 4.33Å; F304-E307 WeakPolarHBondContact CD1-OE2 3.43Å; E305-E307 PolarHBondContact O-N 2.64Å; E307-I315 HydrophobicContact CB-CG2 3.94Å; E307-D317 HydrophobicContact CG-CB 4.42Å
308	L	98.6	Very high	97.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.3	171.1	-68.8	-174.7	0	0	0	112.8	V297 Y310 I315 M316 N330 I333 L334 V337	V297-L308 HydrophobicContact CG1-CB 4.29Å; V297-L308 HydrophobicContact CG1-CD2 4.44Å; L308-Y310 HydrophobicContact CB-CD2 4.24Å; L308-Y310 HydrophobicContact CB-CE2 3.87Å; L308-Y310 HydrophobicContact CD1-CE2 4.29Å; L308-Y310 PolarHBondContact O-N 3.1Å; L308-I315 CarbonylContact O-C 3.3Å; L308-I315 WeakPolarHBondContact O-CA 3.5Å; L308-M316 PolarHBondContact N-O 2.69Å; L308-M316 PolarHBondContact O-N 3.25Å; L308-N330 HydrophobicContact CD1-CB 4.41Å; L308-N330 WeakPolarHBondContact CD1-OD1 3.4Å; L308-N330 WeakPolarHBondContact CG-OD1 3.35Å; L308-I333 HydrophobicContact CD1-CB 3.73Å; L308-I333 HydrophobicContact CD1-CD1 4.08Å; L308-I333 HydrophobicContact CD1-CG1 4.49Å; L308-I333 HydrophobicContact CD1-CG2 3.76Å; L308-I333 HydrophobicContact CD2-CB 4.3Å; L308-I333 HydrophobicContact CD2-CG2 3.68Å; L308-I333 HydrophobicContact CG-CG2 4.42Å; L308-L334 HydrophobicContact CD2-CD2 3.67Å; L308-L334 HydrophobicContact CD2-CG 4.02Å; L308-L334 HydrophobicContact CG-CD2 4.16Å; L308-L334 HydrophobicContact CG-CG 4.23Å; L308-V337 HydrophobicContact CD2-CG2 3.83Å
309	V	98.3	Very high	97	Very high	5 Å²	5	54.1 Å²	54.1	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	87.8	178.6	-174.6	0	0	0	0	109.6	R300 S301 F304 A311 I315	R300-V309 HydrophobicContact CB-CB 3.85Å; R300-V309 HydrophobicContact CB-CG1 3.85Å; R300-V309 WeakPolarHBondContact CB-O 3.45Å; R300-V309 PolarHBondContact NE-O 3.14Å; S301-V309 PolarHBondContact OG-N 2.89Å; F304-V309 HydrophobicContact CD1-CG2 4.3Å; F304-V309 HydrophobicContact CD2-CG2 3.42Å; F304-V309 VanDerWaalsContact CD2-CG2 3.42Å; F304-V309 HydrophobicContact CE1-CG2 4.32Å; F304-V309 HydrophobicContact CE2-CG2 3.46Å; F304-V309 VanDerWaalsContact CE2-CG2 3.46Å; F304-V309 HydrophobicContact CG-CG2 3.88Å; F304-V309 HydrophobicContact CZ-CG2 3.93Å; V309-A311 WeakPolarHBondContact CG1-O 3.38Å; V309-I315 HydrophobicContact CG1-CG1 4.32Å; V309-I315 HydrophobicContact CG2-CD1 4.31Å; V309-I315 HydrophobicContact CG2-CG1 4.17Å; V309-I315 HydrophobicContact CG2-CG2 4.36Å
310	Y	98.3	Very high	96.9	Very high	19 Å²	19	54.6 Å²	54.6	8%	0.075	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-39.8	174.9	-73.6	-82.7	0	0	0	111.2	L252 V297 R300 L308 Y314 M316	L252-Y310 HydrophobicContact CD2-CD1 3.35Å; L252-Y310 HydrophobicContact CD2-CD2 4.01Å; L252-Y310 HydrophobicContact CD2-CE1 3.72Å; L252-Y310 HydrophobicContact CD2-CE2 4.33Å; L252-Y310 HydrophobicContact CD2-CG 3.5Å; L252-Y310 VanDerWaalsContact CD2-CG 3.5Å; V297-Y310 HydrophobicContact CG1-CD1 4.13Å; V297-Y310 HydrophobicContact CG1-CE1 4.25Å; V297-Y310 HydrophobicContact CG1-CG 4.47Å; V297-Y310 HydrophobicContact CG2-CD1 3.79Å; V297-Y310 HydrophobicContact CG2-CE1 4.24Å; R300-Y310 PolarHBondContact NE-O 3.3Å; R300-Y310 VanDerWaalsContact NE-O 3.1Å; R300-Y310 PolarHBondContact NH2-O 3.44Å; L308-Y310 HydrophobicContact CB-CD2 4.24Å; L308-Y310 HydrophobicContact CB-CE2 3.87Å; L308-Y310 HydrophobicContact CD1-CE2 4.29Å; L308-Y310 PolarHBondContact O-N 3.1Å; Y310-Y314 PolarHBondContact N-O 3.22Å; Y310-M316 HydrophobicContact CD2-CB 4.19Å; Y310-M316 HydrophobicContact CD2-CG 3.98Å; Y310-M316 HydrophobicContact CD2-SD 3.86Å; Y310-M316 HydrophobicContact CE2-CB 4Å; Y310-M316 HydrophobicContact CE2-CG 4.04Å; Y310-M316 HydrophobicContact CE2-SD 3.59Å; Y310-M316 VanDerWaalsContact CE2-SD 3.59Å
311	A	97.9	Very high	96.8	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	168.8	167.3	0	0	0	0	0	110.4	A235 L255 V309 D313 Y314	A235-A311 HydrophobicContact CB-CB 3.88Å; L255-A311 HydrophobicContact CD2-CB 4.13Å; V309-A311 WeakPolarHBondContact CG1-O 3.38Å; A311-D313 VanDerWaalsContact CB-OD1 3.25Å; A311-D313 WeakPolarHBondContact CB-OD1 3.17Å; A311-D313 PolarHBondContact O-N 2.58Å; A311-D313 VanDerWaalsContact O-N 3.13Å; A311-Y314 PolarHBondContact N-O 3.44Å; A311-Y314 CarbonylContact O-C 3.57Å; A311-Y314 PolarHBondContact O-N 3.28Å; A311-Y314 VanDerWaalsContact O-O 3.12Å
312	D	95.1	Very high	96.8	Very high	73 Å²	73	57.6 Å²	57.6	39%	0.39	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.6	177.3	-86.5	29.7	0	0	0	113.3	K232 Y234	K232-D312 WeakPolarHBondContact CD-OD1 3.49Å; K232-D312 VanDerWaalsContact CD-OD2 3.24Å; K232-D312 WeakPolarHBondContact CD-OD2 3.33Å; K232-D312 IonicContact NZ-OD1 2.73Å; K232-D312 PolarHBondContact NZ-OD1 3.09Å; K232-D312 IonicContact NZ-OD2 3.24Å; K232-D312 PolarHBondContact NZ-OD2 3.44Å; Y234-D312 HydrophobicContact CD1-CB 4.14Å; Y234-D312 HydrophobicContact CE1-CB 3.75Å
313	D	96.6	Very high	96.6	Very high	63 Å²	63	61 Å²	61	34%	0.337	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	4	177.2	65.6	-40.4	0	0	0	113.7	Y234 A235 M236 A311	Y234-D313 VanDerWaalsContact CA-OD1 3.26Å; Y234-D313 WeakPolarHBondContact CA-OD1 3.15Å; Y234-D313 WeakPolarHBondContact CB-OD1 3.25Å; Y234-D313 HydrophobicContact CD1-CB 4.02Å; A235-D313 PolarHBondContact N-OD1 2.95Å; A235-D313 PolarHBondContact N-OD2 3.19Å; M236-D313 WeakPolarHBondContact CA-OD2 3.45Å; M236-D313 PolarHBondContact N-OD2 3.29Å; A311-D313 VanDerWaalsContact CB-OD1 3.25Å; A311-D313 WeakPolarHBondContact CB-OD1 3.17Å; A311-D313 PolarHBondContact O-N 2.58Å; A311-D313 VanDerWaalsContact O-N 3.13Å
314	Y	97.5	Very high	96.5	Very high	30 Å²	30	56.5 Å²	56.5	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	96	-178.3	-163.4	-111.5	0	0	0	111.5	A235 P237 A248 T251 L252 Y310 A311 M316	A235-Y314 VanDerWaalsContact CB-CB 3.44Å; A235-Y314 HydrophobicContact CB-CD1 4.43Å; A235-Y314 HydrophobicContact CB-CG 3.99Å; P237-Y314 HydrophobicContact CB-CD2 4.3Å; P237-Y314 HydrophobicContact CB-CE2 4.45Å; P237-Y314 HydrophobicContact CG-CD2 4.09Å; A248-Y314 WeakPolarHBondContact CA-OH 3.44Å; A248-Y314 WeakPolarHBondContact CB-OH 3.37Å; T251-Y314 HydrophobicContact CG2-CD1 4.18Å; T251-Y314 HydrophobicContact CG2-CD2 4.15Å; T251-Y314 HydrophobicContact CG2-CE1 4.12Å; T251-Y314 HydrophobicContact CG2-CE2 4.06Å; T251-Y314 HydrophobicContact CG2-CG 4.22Å; L252-Y314 HydrophobicContact CD2-CD1 4.2Å; L252-Y314 HydrophobicContact CD2-CE1 3.82Å; L252-Y314 HydrophobicContact CG-CE1 4.03Å; Y310-Y314 PolarHBondContact N-O 3.22Å; A311-Y314 PolarHBondContact N-O 3.44Å; A311-Y314 CarbonylContact O-C 3.57Å; A311-Y314 PolarHBondContact O-N 3.28Å; A311-Y314 VanDerWaalsContact O-O 3.12Å; Y314-M316 HydrophobicContact CE1-CG 4Å; Y314-M316 HydrophobicContact CE1-SD 3.76Å
315	I	97.6	Very high	96.4	Very high	55 Å²	55	56.1 Å²	56.1	28%	0.282	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.8	176.2	-52.8	-179.7	0	0	0	107.5	F304 E307 L308 V309 Q320	F304-I315 HydrophobicContact CE1-CD1 3.79Å; F304-I315 HydrophobicContact CZ-CD1 4.1Å; E307-I315 HydrophobicContact CB-CG2 3.94Å; L308-I315 CarbonylContact O-C 3.3Å; L308-I315 WeakPolarHBondContact O-CA 3.5Å; V309-I315 HydrophobicContact CG1-CG1 4.32Å; V309-I315 HydrophobicContact CG2-CD1 4.31Å; V309-I315 HydrophobicContact CG2-CG1 4.17Å; V309-I315 HydrophobicContact CG2-CG2 4.36Å; I315-Q320 PolarHBondContact O-OE1 2.83Å
316	M	97.2	Very high	96.5	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.9	175.4	-69.7	-177.3	69.7	0	0	111.4	L252 L308 Y310 Y314 Q320 A324	L252-M316 HydrophobicContact CD1-SD 4.05Å; L308-M316 PolarHBondContact N-O 2.69Å; L308-M316 PolarHBondContact O-N 3.25Å; Y310-M316 HydrophobicContact CD2-CB 4.19Å; Y310-M316 HydrophobicContact CD2-CG 3.98Å; Y310-M316 HydrophobicContact CD2-SD 3.86Å; Y310-M316 HydrophobicContact CE2-CB 4Å; Y310-M316 HydrophobicContact CE2-CG 4.04Å; Y310-M316 HydrophobicContact CE2-SD 3.59Å; Y310-M316 VanDerWaalsContact CE2-SD 3.59Å; Y314-M316 HydrophobicContact CE1-CG 4Å; Y314-M316 HydrophobicContact CE1-SD 3.76Å; M316-Q320 VanDerWaalsContact CA-OE1 3.29Å; M316-Q320 HydrophobicContact CB-CB 4.41Å; M316-Q320 HydrophobicContact CE-CB 4.36Å; M316-A324 HydrophobicContact CE-CB 3.76Å
317	D	96.4	Very high	96.6	Very high	60 Å²	60	48 Å²	48	32%	0.321	25%	0.252	S	S	.	.			trans	-86	-173.7	169.4	70.1	31.2	0	0	0	112.4	E307 D319 Q320 S321	E307-D317 HydrophobicContact CG-CB 4.42Å; D317-D319 WeakPolarHBondContact OD1-CA 3.41Å; D317-D319 PolarHBondContact OD1-N 2.87Å; D317-Q320 WeakPolarHBondContact OD1-CB 3.36Å; D317-Q320 WeakPolarHBondContact OD1-CG 3.37Å; D317-Q320 PolarHBondContact OD1-N 3.39Å; D317-S321 WeakPolarHBondContact O-CB 3.32Å; D317-S321 PolarHBondContact O-N 3.09Å; D317-S321 PolarHBondContact O-OG 3.07Å
318	E	96.4	Very high	96.6	Very high	115 Å²	115	49.3 Å²	49.3	54%	0.537	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-41.6	178.5	-163.9	-172.1	148.4	0	0	113	S321 K322 L327	E318-S321 PolarHBondContact O-N 2.99Å; E318-K322 WeakPolarHBondContact O-CB 3.37Å; E318-K322 PolarHBondContact O-N 2.84Å; E318-L327 HydrophobicContact CG-CD1 3.48Å; E318-L327 VanDerWaalsContact CG-CD1 3.48Å
319	D	96.3	Very high	96.5	Very high	103 Å²	103	49.5 Å²	49.5	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-76.4	-35	-176.4	-90.4	-36.3	0	0	0	111.7	D317 K322 L323	D317-D319 WeakPolarHBondContact OD1-CA 3.41Å; D317-D319 PolarHBondContact OD1-N 2.87Å; D319-K322 PolarHBondContact O-N 3.12Å; D319-K322 IonicContact OD1-NZ 3.44Å; D319-K322 PolarHBondContact OD1-NZ 3.01Å; D319-L323 WeakPolarHBondContact O-CB 3.36Å; D319-L323 PolarHBondContact O-N 3.03Å
320	Q	95.6	Very high	96.5	Very high	84 Å²	84	49.3 Å²	49.3	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-65.1	-42.8	168.8	-67.3	174.2	-54.2	0	0	111.2	I315 M316 D317 K322 L323 A324	I315-Q320 PolarHBondContact O-OE1 2.83Å; M316-Q320 VanDerWaalsContact CA-OE1 3.29Å; M316-Q320 HydrophobicContact CB-CB 4.41Å; M316-Q320 HydrophobicContact CE-CB 4.36Å; D317-Q320 WeakPolarHBondContact OD1-CB 3.36Å; D317-Q320 WeakPolarHBondContact OD1-CG 3.37Å; D317-Q320 PolarHBondContact OD1-N 3.39Å; Q320-K322 VanDerWaalsContact C-N 3.29Å; Q320-K322 PolarHBondContact O-N 3.38Å; Q320-L323 PolarHBondContact O-N 2.97Å; Q320-A324 WeakPolarHBondContact O-CB 3.42Å; Q320-A324 PolarHBondContact O-N 2.84Å
321	S	96.6	Very high	96.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-37.1	175.3	-64.9	0	0	0	0	112.2	D317 E318 G325 L326 L327 N330	D317-S321 WeakPolarHBondContact O-CB 3.32Å; D317-S321 PolarHBondContact O-N 3.09Å; D317-S321 PolarHBondContact O-OG 3.07Å; E318-S321 PolarHBondContact O-N 2.99Å; S321-G325 PolarHBondContact O-N 2.9Å; S321-L326 CarbonylContact O-C 3.47Å; S321-L326 WeakPolarHBondContact O-CA 3.5Å; S321-L326 PolarHBondContact O-N 2.65Å; S321-L327 PolarHBondContact O-N 3.35Å; S321-N330 PolarHBondContact OG-OD1 3.43Å
322	K	96.5	Very high	96.5	Very high	115 Å²	115	52.3 Å²	52.3	50%	0.5	28%	0.28	S	S	.	.	H	α-helix	trans	-72.5	-40.1	176.2	176.5	177.4	160.1	-157.4	0	112.5	E318 D319 Q320 A324 G325 L327	E318-K322 WeakPolarHBondContact O-CB 3.37Å; E318-K322 PolarHBondContact O-N 2.84Å; D319-K322 PolarHBondContact O-N 3.12Å; D319-K322 IonicContact OD1-NZ 3.44Å; D319-K322 PolarHBondContact OD1-NZ 3.01Å; Q320-K322 VanDerWaalsContact C-N 3.29Å; Q320-K322 PolarHBondContact O-N 3.38Å; K322-A324 VanDerWaalsContact C-N 3.31Å; K322-A324 PolarHBondContact O-N 2.96Å; K322-G325 PolarHBondContact O-N 3.22Å; K322-L327 HydrophobicContact CB-CB 4.33Å; K322-L327 HydrophobicContact CB-CD2 4.27Å; K322-L327 HydrophobicContact CD-CD2 4.48Å; K322-L327 HydrophobicContact CG-CD2 4.37Å
323	L	94.7	Very high	96.6	Very high	100 Å²	100	49 Å²	49	52%	0.524	26%	0.263	S	S	.	.	H	α-helix	trans	-59.9	-41.5	171.2	179.9	64.5	0	0	0	111.4	D319 Q320 G325	D319-L323 WeakPolarHBondContact O-CB 3.36Å; D319-L323 PolarHBondContact O-N 3.03Å; Q320-L323 PolarHBondContact O-N 2.97Å; L323-G325 VanDerWaalsContact C-N 3.25Å; L323-G325 PolarHBondContact O-N 2.92Å
324	A	94.7	Very high	96.7	Very high	5 Å²	5	46.4 Å²	46.4	4%	0.041	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-1.7	178	0	0	0	0	0	114.9	A248 M316 Q320 K322 L326	A248-A324 HydrophobicContact CB-CB 3.78Å; M316-A324 HydrophobicContact CE-CB 3.76Å; Q320-A324 WeakPolarHBondContact O-CB 3.42Å; Q320-A324 PolarHBondContact O-N 2.84Å; K322-A324 VanDerWaalsContact C-N 3.31Å; K322-A324 PolarHBondContact O-N 2.96Å; A324-L326 HydrophobicContact CB-CB 4.38Å; A324-L326 HydrophobicContact CB-CD1 4.24Å; A324-L326 HydrophobicContact CB-CG 4.07Å; A324-L326 PolarHBondContact O-N 3.45Å
325	G	94.8	Very high	96.7	Very high	57 Å²	57	50.3 Å²	50.3	59%	0.588	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	10.7	-173.1	0	0	0	0	0	114.5	S321 K322 L323	S321-G325 PolarHBondContact O-N 2.9Å; K322-G325 PolarHBondContact O-N 3.22Å; L323-G325 VanDerWaalsContact C-N 3.25Å; L323-G325 PolarHBondContact O-N 2.92Å
326	L	96.1	Very high	96.7	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	25%	0.254	C	S	.	.			trans	-98.2	-1.9	-175.1	-66.1	-175.6	0	0	0	114.5	L249 L252 S321 A324 D328 L329 N330	L249-L326 HydrophobicContact CD2-CD1 3.83Å; L249-L326 HydrophobicContact CD2-CD2 3.91Å; L249-L326 HydrophobicContact CD2-CG 3.89Å; L252-L326 HydrophobicContact CD1-CD1 3.38Å; S321-L326 CarbonylContact O-C 3.47Å; S321-L326 WeakPolarHBondContact O-CA 3.5Å; S321-L326 PolarHBondContact O-N 2.65Å; A324-L326 HydrophobicContact CB-CB 4.38Å; A324-L326 HydrophobicContact CB-CD1 4.24Å; A324-L326 HydrophobicContact CB-CG 4.07Å; A324-L326 PolarHBondContact O-N 3.45Å; L326-D328 PolarHBondContact O-N 3.4Å; L326-L329 HydrophobicContact CD2-CD2 4.41Å; L326-L329 CarbonylContact O-C 3.56Å; L326-L329 WeakPolarHBondContact O-CA 3.29Å; L326-L329 WeakPolarHBondContact O-CB 3.42Å; L326-L329 PolarHBondContact O-N 3.43Å; L326-N330 PolarHBondContact O-N 2.83Å
327	L	96.6	Very high	96.8	Very high	46 Å²	46	47.9 Å²	47.9	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-45	-39.8	-178.1	179.2	60.3	0	0	0	113.5	E318 S321 K322 N330 N331	E318-L327 HydrophobicContact CG-CD1 3.48Å; E318-L327 VanDerWaalsContact CG-CD1 3.48Å; S321-L327 PolarHBondContact O-N 3.35Å; K322-L327 HydrophobicContact CB-CB 4.33Å; K322-L327 HydrophobicContact CB-CD2 4.27Å; K322-L327 HydrophobicContact CD-CD2 4.48Å; K322-L327 HydrophobicContact CG-CD2 4.37Å; L327-N330 PolarHBondContact O-N 3Å; L327-N331 WeakPolarHBondContact CD1-ND2 3.4Å; L327-N331 WeakPolarHBondContact O-CB 3.43Å; L327-N331 PolarHBondContact O-N 2.87Å; L327-N331 PolarHBondContact O-ND2 3.23Å
328	D	96.7	Very high	96.9	Very high	101 Å²	101	50.1 Å²	50.1	54%	0.54	26%	0.263	S	S	.	.	H	α-helix	trans	-71	-29.1	-178.7	-133	48	0	0	0	113.4	L326 K414	L326-D328 PolarHBondContact O-N 3.4Å; D328-K414 WeakPolarHBondContact O-CE 3.37Å; D328-K414 PolarHBondContact O-NZ 3.29Å; D328-K414 IonicContact OD2-NZ 2.69Å; D328-K414 PolarHBondContact OD2-NZ 3.42Å
329	L	97.1	Very high	96.9	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-84.2	-41.9	172.4	177.1	58.3	0	0	0	111.1	L326 N331 A332 I333 T411 A415	L326-L329 HydrophobicContact CD2-CD2 4.41Å; L326-L329 CarbonylContact O-C 3.56Å; L326-L329 WeakPolarHBondContact O-CA 3.29Å; L326-L329 WeakPolarHBondContact O-CB 3.42Å; L326-L329 PolarHBondContact O-N 3.43Å; L329-N331 VanDerWaalsContact C-N 3.31Å; L329-N331 PolarHBondContact O-N 3.48Å; L329-A332 WeakPolarHBondContact O-CA 3.46Å; L329-A332 WeakPolarHBondContact O-CB 3.13Å; L329-A332 PolarHBondContact O-N 3.49Å; L329-I333 HydrophobicContact CD1-CD1 4.08Å; L329-I333 HydrophobicContact CD1-CG1 4.19Å; L329-I333 HydrophobicContact CG-CD1 3.99Å; L329-I333 PolarHBondContact O-N 2.95Å; L329-T411 HydrophobicContact CD1-CG2 4.5Å; L329-A415 HydrophobicContact CD1-CB 3.8Å; L329-A415 HydrophobicContact CD2-CB 4.1Å
330	N	97.8	Very high	97	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-50.6	-51.8	173.4	-176.8	60.2	0	0	0	110.7	L308 S321 L326 L327 A332 I333 L334	L308-N330 HydrophobicContact CD1-CB 4.41Å; L308-N330 WeakPolarHBondContact CD1-OD1 3.4Å; L308-N330 WeakPolarHBondContact CG-OD1 3.35Å; S321-N330 PolarHBondContact OG-OD1 3.43Å; L326-N330 PolarHBondContact O-N 2.83Å; L327-N330 PolarHBondContact O-N 3Å; N330-A332 PolarHBondContact O-N 3.02Å; N330-I333 PolarHBondContact O-N 3.05Å; N330-L334 WeakPolarHBondContact ND2-CD1 3.5Å; N330-L334 WeakPolarHBondContact O-CB 3.37Å; N330-L334 WeakPolarHBondContact O-CG 3.44Å; N330-L334 PolarHBondContact O-N 3.1Å
331	N	97.6	Very high	97.1	Very high	70 Å²	70	42.6 Å²	42.6	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-62.6	-24.3	177.1	-78.7	-43.3	0	0	0	114.7	L327 L329 Q335	L327-N331 WeakPolarHBondContact CD1-ND2 3.4Å; L327-N331 WeakPolarHBondContact O-CB 3.43Å; L327-N331 PolarHBondContact O-N 2.87Å; L327-N331 PolarHBondContact O-ND2 3.23Å; L329-N331 VanDerWaalsContact C-N 3.31Å; L329-N331 PolarHBondContact O-N 3.48Å; N331-Q335 WeakPolarHBondContact O-CG 3.41Å; N331-Q335 PolarHBondContact O-NE2 3.22Å
332	A	98	Very high	97	Very high	13 Å²	13	46.9 Å²	46.9	11%	0.107	25%	0.252	C	S	.	.	H	α-helix	trans	-81.1	-40.4	174.9	0	0	0	0	0	111.5	L329 N330 Q335 T411 K414	L329-A332 WeakPolarHBondContact O-CA 3.46Å; L329-A332 WeakPolarHBondContact O-CB 3.13Å; L329-A332 PolarHBondContact O-N 3.49Å; N330-A332 PolarHBondContact O-N 3.02Å; A332-Q335 WeakPolarHBondContact O-CB 3.44Å; A332-Q335 PolarHBondContact O-N 3.2Å; A332-T411 HydrophobicContact CB-CG2 3.92Å; A332-K414 HydrophobicContact CB-CD 4.29Å
333	I	98.5	Very high	97	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-68.3	-39.3	175	-59.8	170.2	0	0	0	110.3	I294 V297 V298 L308 L329 N330 Q335 L336 V337 T411	I294-I333 HydrophobicContact CG2-CG1 4.45Å; V297-I333 HydrophobicContact CG1-CG2 4.37Å; V298-I333 HydrophobicContact CG2-CG2 3.64Å; L308-I333 HydrophobicContact CD1-CB 3.73Å; L308-I333 HydrophobicContact CD1-CD1 4.08Å; L308-I333 HydrophobicContact CD1-CG1 4.49Å; L308-I333 HydrophobicContact CD1-CG2 3.76Å; L308-I333 HydrophobicContact CD2-CB 4.3Å; L308-I333 HydrophobicContact CD2-CG2 3.68Å; L308-I333 HydrophobicContact CG-CG2 4.42Å; L329-I333 HydrophobicContact CD1-CD1 4.08Å; L329-I333 HydrophobicContact CD1-CG1 4.19Å; L329-I333 HydrophobicContact CG-CD1 3.99Å; L329-I333 PolarHBondContact O-N 2.95Å; N330-I333 PolarHBondContact O-N 3.05Å; I333-Q335 PolarHBondContact O-N 2.74Å; I333-L336 WeakPolarHBondContact O-CA 3.47Å; I333-L336 WeakPolarHBondContact O-CB 3.36Å; I333-L336 PolarHBondContact O-N 2.9Å; I333-V337 PolarHBondContact O-N 3.1Å; I333-T411 HydrophobicContact CG1-CG2 3.73Å
334	L	98.2	Very high	97	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-25.9	174.4	-75.6	174.5	0	0	0	113.5	D306 L308 N330 V337 K338	D306-L334 WeakPolarHBondContact O-CD1 3.4Å; L308-L334 HydrophobicContact CD2-CD2 3.67Å; L308-L334 HydrophobicContact CD2-CG 4.02Å; L308-L334 HydrophobicContact CG-CD2 4.16Å; L308-L334 HydrophobicContact CG-CG 4.23Å; N330-L334 WeakPolarHBondContact ND2-CD1 3.5Å; N330-L334 WeakPolarHBondContact O-CB 3.37Å; N330-L334 WeakPolarHBondContact O-CG 3.44Å; N330-L334 PolarHBondContact O-N 3.1Å; L334-V337 HydrophobicContact CD2-CG2 4.5Å; L334-V337 PolarHBondContact O-N 2.89Å; L334-K338 WeakPolarHBondContact O-CB 3.18Å; L334-K338 VanDerWaalsContact O-CG 3.27Å; L334-K338 WeakPolarHBondContact O-CG 3.01Å; L334-K338 PolarHBondContact O-N 2.72Å
335	Q	97.7	Very high	97.1	Very high	112 Å²	112	46.1 Å²	46.1	52%	0.523	25%	0.245	S	C	.	.	H	α-helix	trans	-67.7	-37.2	170.8	-72.5	169.8	46.1	0	0	112	N331 A332 I333 K339	N331-Q335 WeakPolarHBondContact O-CG 3.41Å; N331-Q335 PolarHBondContact O-NE2 3.22Å; A332-Q335 WeakPolarHBondContact O-CB 3.44Å; A332-Q335 PolarHBondContact O-N 3.2Å; I333-Q335 PolarHBondContact O-N 2.74Å; Q335-K339 VanDerWaalsContact O-CB 3.25Å; Q335-K339 WeakPolarHBondContact O-CB 3.41Å; Q335-K339 PolarHBondContact O-N 3.1Å
336	L	98	Very high	97.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-45.7	171.1	-69.9	165.3	0	0	0	111	I294 V298 I333 K338 K339 Y340 L407 L408 T411	I294-L336 HydrophobicContact CG2-CD1 3.67Å; V298-L336 HydrophobicContact CG1-CB 4.22Å; V298-L336 HydrophobicContact CG2-CB 3.68Å; V298-L336 HydrophobicContact CG2-CD1 4.24Å; I333-L336 WeakPolarHBondContact O-CA 3.47Å; I333-L336 WeakPolarHBondContact O-CB 3.36Å; I333-L336 PolarHBondContact O-N 2.9Å; L336-K338 PolarHBondContact O-N 3Å; L336-K339 WeakPolarHBondContact O-CB 3.31Å; L336-K339 PolarHBondContact O-N 3.13Å; L336-K339 VanDerWaalsContact O-N 3.15Å; L336-Y340 HydrophobicContact CB-CD2 4.41Å; L336-Y340 HydrophobicContact CB-CE2 4.47Å; L336-Y340 HydrophobicContact CD2-CE2 4.14Å; L336-Y340 VanDerWaalsContact O-CD2 3.24Å; L336-Y340 WeakPolarHBondContact O-CD2 3.4Å; L336-Y340 PolarHBondContact O-N 3.22Å; L336-L407 HydrophobicContact CD2-CB 4.1Å; L336-L407 HydrophobicContact CD2-CD2 3.86Å; L336-L407 HydrophobicContact CD2-CG 3.73Å; L336-L407 HydrophobicContact CG-CD2 4.38Å; L336-L407 HydrophobicContact CG-CG 4.25Å; L336-L408 HydrophobicContact CD1-CD1 4.03Å; L336-L408 HydrophobicContact CD2-CB 4.39Å; L336-T411 HydrophobicContact CD1-CG2 4.02Å
337	V	98.5	Very high	97.2	Very high	6 Å²	6	51.3 Å²	51.3	4%	0.036	25%	0.252	C	S	.	.	H	α-helix	trans	-54.7	-53.3	175.7	179.1	0	0	0	0	110.4	V298 L308 I333 L334 K339 Y340 K341	V298-V337 HydrophobicContact CB-CG2 4.36Å; V298-V337 HydrophobicContact CG1-CG2 4.29Å; V298-V337 HydrophobicContact CG2-CG2 4.16Å; L308-V337 HydrophobicContact CD2-CG2 3.83Å; I333-V337 PolarHBondContact O-N 3.1Å; L334-V337 HydrophobicContact CD2-CG2 4.5Å; L334-V337 PolarHBondContact O-N 2.89Å; V337-K339 VanDerWaalsContact C-N 3.3Å; V337-K339 PolarHBondContact O-N 3.01Å; V337-Y340 PolarHBondContact O-N 2.94Å; V337-K341 WeakPolarHBondContact O-CB 3.48Å; V337-K341 PolarHBondContact O-N 2.84Å
338	K	97.8	Very high	97.2	Very high	107 Å²	107	51.7 Å²	51.7	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-59.8	-38.3	178.3	-71.5	170.9	-178.4	-178.5	0	112.2	D306 L334 L336 S342	D306-K338 WeakPolarHBondContact OD1-CE 3.47Å; D306-K338 IonicContact OD1-NZ 3.98Å; D306-K338 PolarHBondContact OD1-NZ 2.67Å; D306-K338 IonicContact OD2-NZ 2.79Å; D306-K338 PolarHBondContact OD2-NZ 3.12Å; L334-K338 WeakPolarHBondContact O-CB 3.18Å; L334-K338 VanDerWaalsContact O-CG 3.27Å; L334-K338 WeakPolarHBondContact O-CG 3.01Å; L334-K338 PolarHBondContact O-N 2.72Å; L336-K338 PolarHBondContact O-N 3Å; K338-S342 WeakPolarHBondContact O-CB 3.25Å; K338-S342 PolarHBondContact O-N 3.41Å
339	K	97.2	Very high	97.2	Very high	83 Å²	83	46.9 Å²	46.9	36%	0.361	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-53.9	175.5	177.1	58.3	176.6	174	0	112.2	Q335 L336 V337 S342 M343 T404	Q335-K339 VanDerWaalsContact O-CB 3.25Å; Q335-K339 WeakPolarHBondContact O-CB 3.41Å; Q335-K339 PolarHBondContact O-N 3.1Å; L336-K339 WeakPolarHBondContact O-CB 3.31Å; L336-K339 PolarHBondContact O-N 3.13Å; L336-K339 VanDerWaalsContact O-N 3.15Å; V337-K339 VanDerWaalsContact C-N 3.3Å; V337-K339 PolarHBondContact O-N 3.01Å; K339-S342 PolarHBondContact O-N 3.2Å; K339-S342 PolarHBondContact O-OG 3.19Å; K339-M343 HydrophobicContact CD-SD 4.33Å; K339-M343 PolarHBondContact O-N 2.99Å; K339-T404 HydrophobicContact CD-CG2 4.42Å; K339-T404 HydrophobicContact CG-CG2 3.88Å
340	Y	97.9	Very high	97.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-70.7	-36.4	-178.4	-74.1	-69.3	0	0	0	112.8	L295 V298 L336 V337 S342 M343 K344 L345 L353 T404	L295-Y340 HydrophobicContact CD2-CE2 4.13Å; V298-Y340 HydrophobicContact CG1-CD2 3.56Å; V298-Y340 HydrophobicContact CG1-CE2 4.13Å; V298-Y340 HydrophobicContact CG1-CG 4.42Å; L336-Y340 HydrophobicContact CB-CD2 4.41Å; L336-Y340 HydrophobicContact CB-CE2 4.47Å; L336-Y340 HydrophobicContact CD2-CE2 4.14Å; L336-Y340 VanDerWaalsContact O-CD2 3.24Å; L336-Y340 WeakPolarHBondContact O-CD2 3.4Å; L336-Y340 PolarHBondContact O-N 3.22Å; V337-Y340 PolarHBondContact O-N 2.94Å; Y340-S342 VanDerWaalsContact C-N 3.31Å; Y340-S342 PolarHBondContact O-N 2.88Å; Y340-M343 CarbonylContact O-C 3.41Å; Y340-M343 WeakPolarHBondContact O-CA 3.24Å; Y340-M343 PolarHBondContact O-N 3.38Å; Y340-K344 PolarHBondContact O-N 2.8Å; Y340-L345 HydrophobicContact CD1-CB 4.16Å; Y340-L345 HydrophobicContact CD1-CD1 3.96Å; Y340-L345 HydrophobicContact CD1-CD2 3.68Å; Y340-L345 HydrophobicContact CD1-CG 4.16Å; Y340-L345 HydrophobicContact CE1-CD1 4.23Å; Y340-L345 HydrophobicContact CE1-CD2 4.14Å; Y340-L345 HydrophobicContact CG-CD2 3.98Å; Y340-L345 PolarHBondContact O-N 3.34Å; Y340-L353 HydrophobicContact CE1-CD1 3.88Å; Y340-T404 HydrophobicContact CE1-CG2 4.15Å; Y340-T404 VanDerWaalsContact CZ-OG1 3.26Å; Y340-T404 PolarHBondContact OH-OG1 2.81Å
341	K	97.4	Very high	97.3	Very high	61 Å²	61	47 Å²	47	27%	0.265	23%	0.228	S	C	.	.	H	α-helix	trans	-60.5	-39.2	172.3	-168	173.3	-174.2	178.5	0	111.8	L302 F304 E305 V337 M343 K344	L302-K341 HydrophobicContact CD2-CB 4.14Å; L302-K341 WeakPolarHBondContact O-CD 3.35Å; L302-K341 WeakPolarHBondContact O-CE 3.11Å; F304-K341 PolarHBondContact O-NZ 3.08Å; E305-K341 IonicContact OE1-NZ 3.21Å; E305-K341 PolarHBondContact OE1-NZ 3.39Å; E305-K341 IonicContact OE2-NZ 3.11Å; E305-K341 PolarHBondContact OE2-NZ 2.98Å; V337-K341 WeakPolarHBondContact O-CB 3.48Å; V337-K341 PolarHBondContact O-N 2.84Å; K341-M343 VanDerWaalsContact C-N 3.25Å; K341-M343 PolarHBondContact O-N 2.97Å; K341-K344 PolarHBondContact O-N 3.39Å
342	S	95.9	Very high	97.3	Very high	90 Å²	90	43.7 Å²	43.7	63%	0.629	21%	0.21	S	C	*	.	H	α-helix	trans	-66.1	-24.2	173.4	79.7	0	0	0	0	114.2	K338 K339 Y340	K338-S342 WeakPolarHBondContact O-CB 3.25Å; K338-S342 PolarHBondContact O-N 3.41Å; K339-S342 PolarHBondContact O-N 3.2Å; K339-S342 PolarHBondContact O-OG 3.19Å; Y340-S342 VanDerWaalsContact C-N 3.31Å; Y340-S342 PolarHBondContact O-N 2.88Å
343	M	94.9	Very high	97.2	Very high	23 Å²	23	43.1 Å²	43.1	11%	0.113	21%	0.205	C	C	.	.	H	α-helix	trans	-89.7	-15.3	176.4	-69.3	176.6	54.1	0	0	112.9	K339 Y340 K341 R397 K400 M401 T404	K339-M343 HydrophobicContact CD-SD 4.33Å; K339-M343 PolarHBondContact O-N 2.99Å; Y340-M343 CarbonylContact O-C 3.41Å; Y340-M343 WeakPolarHBondContact O-CA 3.24Å; Y340-M343 PolarHBondContact O-N 3.38Å; K341-M343 VanDerWaalsContact C-N 3.25Å; K341-M343 PolarHBondContact O-N 2.97Å; M343-R397 PolarHBondContact O-NH1 2.96Å; M343-R397 PolarHBondContact O-NH2 3.22Å; M343-K400 HydrophobicContact CE-CB 3.91Å; M343-M401 HydrophobicContact CE-CB 4.41Å; M343-M401 HydrophobicContact CE-CG 3.52Å; M343-T404 HydrophobicContact SD-CG2 4.31Å
344	K	96.1	Very high	97.2	Very high	165 Å²	165	43.4 Å²	43.4	72%	0.717	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	69	-166.1	-52.7	177.7	-176.3	178.3	0	110.8	Y340 K341 E346 R397	Y340-K344 PolarHBondContact O-N 2.8Å; K341-K344 PolarHBondContact O-N 3.39Å; K344-E346 PolarHBondContact O-N 2.96Å; K344-R397 PolarHBondContact O-NH2 3.29Å
345	L	97	Very high	97.2	Very high	15 Å²	15	43.1 Å²	43.1	8%	0.079	21%	0.205	C	C	.	.			trans	-64.6	124.2	177.3	-176.4	72.7	0	0	0	110.8	Y299 L302 Y340 E349 F350 L353	Y299-L345 HydrophobicContact CD2-CD2 4.15Å; L302-L345 HydrophobicContact CD1-CB 4.13Å; L302-L345 HydrophobicContact CD1-CD2 4.4Å; Y340-L345 HydrophobicContact CD1-CB 4.16Å; Y340-L345 HydrophobicContact CD1-CD1 3.96Å; Y340-L345 HydrophobicContact CD1-CD2 3.68Å; Y340-L345 HydrophobicContact CD1-CG 4.16Å; Y340-L345 HydrophobicContact CE1-CD1 4.23Å; Y340-L345 HydrophobicContact CE1-CD2 4.14Å; Y340-L345 HydrophobicContact CG-CD2 3.98Å; Y340-L345 PolarHBondContact O-N 3.34Å; L345-E349 WeakPolarHBondContact CA-OE2 3.42Å; L345-E349 HydrophobicContact CD1-CB 3.58Å; L345-E349 HydrophobicContact CG-CB 4.49Å; L345-F350 HydrophobicContact CD2-CB 3.99Å; L345-F350 HydrophobicContact CG-CB 4.26Å; L345-L353 HydrophobicContact CD1-CD1 3.81Å
346	E	96.1	Very high	97.2	Very high	85 Å²	85	37.9 Å²	37.9	40%	0.397	18%	0.18	S	C	.	.			trans	-93.3	167.7	177.9	-50.1	-156.4	172.5	0	0	111.3	K344 E348 E349 F350 H391	K344-E346 PolarHBondContact O-N 2.96Å; E346-E348 PolarHBondContact O-N 3.02Å; E346-E349 HydrophobicContact CB-CG 4.15Å; E346-E349 PolarHBondContact N-OE2 2.72Å; E346-E349 PolarHBondContact O-N 3.2Å; E346-F350 WeakPolarHBondContact O-CB 3.47Å; E346-F350 PolarHBondContact O-N 3.48Å; E346-H391 IonicContact OE1-CE1 2.65Å; E346-H391 IonicContact OE1-NE2 3.11Å
347	K	96.7	Very high	97.2	Very high	85 Å²	85	37.9 Å²	37.9	37%	0.37	18%	0.18	S	C	.	.	H	α-helix	trans	-66.9	-41.1	-171.2	-169.7	-172.6	172.7	-165.1	0	111.5	L226 Y299 E349 F350 V351	L226-K347 HydrophobicContact CD2-CB 4.33Å; L226-K347 HydrophobicContact CD2-CD 3.81Å; L226-K347 HydrophobicContact CD2-CG 3.91Å; Y299-K347 WeakPolarHBondContact OH-CB 3.43Å; K347-E349 VanDerWaalsContact C-N 3.35Å; K347-F350 WeakPolarHBondContact O-CB 3.46Å; K347-F350 PolarHBondContact O-N 2.8Å; K347-V351 PolarHBondContact O-N 2.84Å
348	E	96.1	Very high	97.1	Very high	54 Å²	54	37.6 Å²	37.6	25%	0.252	18%	0.179	S	C	.	.	H	α-helix	trans	-57.4	-46.8	177.3	-73.9	68.5	-162	0	0	111.3	V222 L226 E346 V351 T352 Y386	V222-E348 HydrophobicContact CG1-CB 3.71Å; V222-E348 HydrophobicContact CG1-CG 3.82Å; L226-E348 HydrophobicContact CD1-CG 3.97Å; L226-E348 WeakPolarHBondContact CD1-OE1 3.21Å; L226-E348 HydrophobicContact CD2-CG 4.18Å; L226-E348 HydrophobicContact CG-CG 4.36Å; E346-E348 PolarHBondContact O-N 3.02Å; E348-V351 WeakPolarHBondContact O-CG2 3.5Å; E348-T352 VanDerWaalsContact O-CB 3.3Å; E348-T352 WeakPolarHBondContact O-CB 3.35Å; E348-T352 PolarHBondContact O-N 3.4Å; E348-T352 VanDerWaalsContact O-N 3.12Å; E348-T352 PolarHBondContact O-OG1 3.21Å; E348-Y386 HydrophobicContact CB-CD2 4.26Å; E348-Y386 HydrophobicContact CB-CE1 3.94Å; E348-Y386 HydrophobicContact CB-CE2 3.53Å; E348-Y386 WeakPolarHBondContact CB-OH 3.35Å; E348-Y386 HydrophobicContact CG-CD2 4.5Å; E348-Y386 HydrophobicContact CG-CE2 3.58Å
349	E	96.9	Very high	97	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-43.2	176.8	-53.2	176.3	151.6	0	0	110.7	L345 E346 K347 T352 L353 Y386 H391 R397 M401	L345-E349 WeakPolarHBondContact CA-OE2 3.42Å; L345-E349 HydrophobicContact CD1-CB 3.58Å; L345-E349 HydrophobicContact CG-CB 4.49Å; E346-E349 HydrophobicContact CB-CG 4.15Å; E346-E349 PolarHBondContact N-OE2 2.72Å; E346-E349 PolarHBondContact O-N 3.2Å; K347-E349 VanDerWaalsContact C-N 3.35Å; E349-T352 PolarHBondContact O-N 2.96Å; E349-L353 WeakPolarHBondContact O-CB 3.2Å; E349-L353 VanDerWaalsContact O-CG 3.31Å; E349-L353 WeakPolarHBondContact O-CG 3.32Å; E349-L353 PolarHBondContact O-N 3.4Å; E349-Y386 HydrophobicContact CG-CD1 4.23Å; E349-Y386 HydrophobicContact CG-CE1 3.66Å; E349-H391 IonicContact OE1-CD2 3.45Å; E349-H391 PolarHBondContact OE1-CD2 2.98Å; E349-H391 IonicContact OE1-NE2 3.86Å; E349-H391 PolarHBondContact OE1-NE2 2.7Å; E349-R397 IonicContact OE1-CZ 3.49Å; E349-R397 IonicContact OE1-NE 2.56Å; E349-R397 PolarHBondContact OE1-NE 2.82Å; E349-R397 IonicContact OE1-NH2 2.69Å; E349-R397 PolarHBondContact OE1-NH2 2.79Å; E349-R397 IonicContact OE2-CZ 3.43Å; E349-R397 IonicContact OE2-NH2 3.89Å; E349-R397 PolarHBondContact OE2-NH2 2.93Å; E349-M401 HydrophobicContact CB-CE 3.97Å; E349-M401 HydrophobicContact CB-SD 4.2Å; E349-M401 HydrophobicContact CG-CE 3.79Å; E349-M401 HydrophobicContact CG-SD 4.45Å; E349-M401 WeakPolarHBondContact OE1-CE 3.36Å; E349-M401 VanDerWaalsContact OE2-CE 3.29Å; E349-M401 WeakPolarHBondContact OE2-CE 3.49Å
350	F	98	Very high	96.7	Very high	7 Å²	7	31.2 Å²	31.2	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-52.7	175.8	161	-108.2	0	0	0	112.6	E229 L295 Y299 L345 E346 K347 T352 L353 K354	E229-F350 WeakPolarHBondContact OE1-CE1 3.46Å; L295-F350 HydrophobicContact CB-CE2 4.08Å; L295-F350 WeakPolarHBondContact O-CE2 3.16Å; Y299-F350 AromaticContact CD1-CD1 3.96Å; Y299-F350 HydrophobicContact CD1-CD1 3.96Å; Y299-F350 AromaticContact CD1-CE1 3.97Å; Y299-F350 HydrophobicContact CD1-CE1 3.97Å; Y299-F350 HydrophobicContact CD1-CG 4.25Å; Y299-F350 HydrophobicContact CD1-CZ 4.26Å; Y299-F350 HydrophobicContact CD2-CB 3.53Å; Y299-F350 AromaticContact CD2-CD1 3.91Å; Y299-F350 HydrophobicContact CD2-CD1 3.91Å; Y299-F350 AromaticContact CD2-CD2 3.77Å; Y299-F350 HydrophobicContact CD2-CD2 3.77Å; Y299-F350 HydrophobicContact CD2-CE2 4.47Å; Y299-F350 AromaticContact CD2-CG 3.44Å; Y299-F350 HydrophobicContact CD2-CG 3.44Å; Y299-F350 VanDerWaalsContact CD2-CG 3.44Å; Y299-F350 HydrophobicContact CE1-CD1 4.18Å; Y299-F350 HydrophobicContact CE1-CE1 4.43Å; Y299-F350 HydrophobicContact CE2-CB 3.7Å; Y299-F350 HydrophobicContact CE2-CD1 4.12Å; Y299-F350 AromaticContact CE2-CG 3.91Å; Y299-F350 HydrophobicContact CE2-CG 3.91Å; Y299-F350 HydrophobicContact CG-CB 4.26Å; Y299-F350 AromaticContact CG-CD1 3.83Å; Y299-F350 HydrophobicContact CG-CD1 3.83Å; Y299-F350 AromaticContact CG-CD2 3.7Å; Y299-F350 HydrophobicContact CG-CD2 3.7Å; Y299-F350 HydrophobicContact CG-CE1 4.07Å; Y299-F350 AromaticContact CG-CE2 3.94Å; Y299-F350 HydrophobicContact CG-CE2 3.94Å; Y299-F350 AromaticContact CG-CG 3.64Å; Y299-F350 HydrophobicContact CG-CG 3.64Å; Y299-F350 HydrophobicContact CG-CZ 4.12Å; L345-F350 HydrophobicContact CD2-CB 3.99Å; L345-F350 HydrophobicContact CG-CB 4.26Å; E346-F350 WeakPolarHBondContact O-CB 3.47Å; E346-F350 PolarHBondContact O-N 3.48Å; K347-F350 WeakPolarHBondContact O-CB 3.46Å; K347-F350 PolarHBondContact O-N 2.8Å; F350-T352 VanDerWaalsContact C-N 3.26Å; F350-T352 PolarHBondContact O-N 3.2Å; F350-L353 PolarHBondContact O-N 3.34Å; F350-K354 HydrophobicContact CE2-CD 4.33Å; F350-K354 HydrophobicContact CZ-CD 4.04Å; F350-K354 WeakPolarHBondContact O-CB 3.46Å; F350-K354 PolarHBondContact O-N 2.83Å
351	V	97.7	Very high	95.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.5	-33.3	-179.1	-60.8	0	0	0	0	111.7	L225 L226 E229 K347 E348 K354 A355	L225-V351 HydrophobicContact CB-CB 4.1Å; L225-V351 HydrophobicContact CB-CG2 3.72Å; L226-V351 HydrophobicContact CD2-CG2 4.06Å; L226-V351 HydrophobicContact CG-CG2 4.31Å; E229-V351 HydrophobicContact CB-CG1 4.02Å; E229-V351 HydrophobicContact CG-CG1 3.79Å; K347-V351 PolarHBondContact O-N 2.84Å; E348-V351 WeakPolarHBondContact O-CG2 3.5Å; V351-K354 PolarHBondContact O-N 3.11Å; V351-A355 PolarHBondContact O-N 2.68Å; V351-A355 VanDerWaalsContact O-N 3.09Å
352	T	97.6	Very high	95	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.6	-46.6	175.6	-55.2	0	0	0	0	111.4	E348 E349 F350 K354 A355 I356 L383	E348-T352 VanDerWaalsContact O-CB 3.3Å; E348-T352 WeakPolarHBondContact O-CB 3.35Å; E348-T352 PolarHBondContact O-N 3.4Å; E348-T352 VanDerWaalsContact O-N 3.12Å; E348-T352 PolarHBondContact O-OG1 3.21Å; E349-T352 PolarHBondContact O-N 2.96Å; F350-T352 VanDerWaalsContact C-N 3.26Å; F350-T352 PolarHBondContact O-N 3.2Å; T352-K354 VanDerWaalsContact C-N 3.3Å; T352-K354 PolarHBondContact O-N 2.82Å; T352-A355 PolarHBondContact O-N 3.06Å; T352-I356 HydrophobicContact CG2-CD1 3.92Å; T352-I356 VanDerWaalsContact O-CG1 3.31Å; T352-I356 WeakPolarHBondContact O-CG1 3.21Å; T352-I356 PolarHBondContact O-N 2.98Å; T352-L383 HydrophobicContact CG2-CB 3.84Å; T352-L383 HydrophobicContact CG2-CD1 4.02Å; T352-L383 HydrophobicContact CG2-CG 4.45Å
353	L	97.8	Very high	94.1	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-35.4	174.4	-76	167.7	0	0	0	112.7	Y340 L345 E349 F350 I356 A357 M401 L405	Y340-L353 HydrophobicContact CE1-CD1 3.88Å; L345-L353 HydrophobicContact CD1-CD1 3.81Å; E349-L353 WeakPolarHBondContact O-CB 3.2Å; E349-L353 VanDerWaalsContact O-CG 3.31Å; E349-L353 WeakPolarHBondContact O-CG 3.32Å; E349-L353 PolarHBondContact O-N 3.4Å; F350-L353 PolarHBondContact O-N 3.34Å; L353-I356 PolarHBondContact O-N 2.87Å; L353-A357 WeakPolarHBondContact O-CB 3.36Å; L353-A357 PolarHBondContact O-N 2.98Å; L353-M401 HydrophobicContact CD1-CB 4.02Å; L353-M401 HydrophobicContact CD1-CG 4.25Å; L353-M401 HydrophobicContact CD1-SD 4.24Å; L353-M401 HydrophobicContact CD2-CB 3.91Å; L353-M401 HydrophobicContact CG-CB 4.43Å; L353-L405 HydrophobicContact CD2-CD2 4.39Å
354	K	97.7	Very high	93.2	Very high	10 Å²	10	39.4 Å²	39.4	4%	0.043	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-42.2	175.1	-154.3	178	72.6	176.1	0	111.3	E229 W266 I292 L295 F350 V351 T352 A357 L358	E229-K354 IonicContact OE1-NZ 3.67Å; E229-K354 PolarHBondContact OE1-NZ 3.24Å; E229-K354 WeakPolarHBondContact OE2-CE 3.49Å; E229-K354 IonicContact OE2-NZ 2.82Å; E229-K354 PolarHBondContact OE2-NZ 2.73Å; W266-K354 HydrophobicContact CH2-CB 4.09Å; W266-K354 HydrophobicContact CH2-CD 4.28Å; W266-K354 HydrophobicContact CH2-CG 3.82Å; W266-K354 HydrophobicContact CZ2-CB 4.16Å; W266-K354 HydrophobicContact CZ2-CD 4.29Å; W266-K354 HydrophobicContact CZ2-CG 4.15Å; W266-K354 HydrophobicContact CZ3-CG 4.49Å; I292-K354 HydrophobicContact CB-CG 4.37Å; I292-K354 HydrophobicContact CG1-CG 4.33Å; I292-K354 HydrophobicContact CG2-CD 3.81Å; I292-K354 HydrophobicContact CG2-CG 3.81Å; L295-K354 HydrophobicContact CD1-CB 4.23Å; L295-K354 HydrophobicContact CD1-CG 4.22Å; F350-K354 HydrophobicContact CE2-CD 4.33Å; F350-K354 HydrophobicContact CZ-CD 4.04Å; F350-K354 WeakPolarHBondContact O-CB 3.46Å; F350-K354 PolarHBondContact O-N 2.83Å; V351-K354 PolarHBondContact O-N 3.11Å; T352-K354 VanDerWaalsContact C-N 3.3Å; T352-K354 PolarHBondContact O-N 2.82Å; K354-A357 PolarHBondContact O-N 3Å; K354-L358 PolarHBondContact O-N 3.23Å
355	A	98.1	Very high	92.5	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-67.7	-40.5	174.3	0	0	0	0	0	112.6	L225 W266 I270 V351 T352 L358 A359 L379	L225-A355 HydrophobicContact CD1-CB 3.85Å; L225-A355 HydrophobicContact CD2-CB 3.94Å; W266-A355 HydrophobicContact CZ2-CB 4.41Å; I270-A355 HydrophobicContact CD1-CB 4.21Å; I270-A355 HydrophobicContact CG2-CB 4.36Å; V351-A355 PolarHBondContact O-N 2.68Å; V351-A355 VanDerWaalsContact O-N 3.09Å; T352-A355 PolarHBondContact O-N 3.06Å; A355-L358 PolarHBondContact O-N 3.36Å; A355-A359 PolarHBondContact O-N 2.76Å; A355-A359 VanDerWaalsContact O-N 3.12Å; A355-L379 HydrophobicContact CB-CD1 4.1Å; A355-L379 HydrophobicContact CB-CD2 3.79Å
356	I	98	Very high	92.3	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-42.5	174.6	-68.2	163.7	0	0	0	110.7	T352 L353 L358 A359 N360 L379 L383 L402 L405	T352-I356 HydrophobicContact CG2-CD1 3.92Å; T352-I356 VanDerWaalsContact O-CG1 3.31Å; T352-I356 WeakPolarHBondContact O-CG1 3.21Å; T352-I356 PolarHBondContact O-N 2.98Å; L353-I356 PolarHBondContact O-N 2.87Å; I356-L358 VanDerWaalsContact C-N 3.3Å; I356-L358 PolarHBondContact O-N 3.38Å; I356-A359 PolarHBondContact O-N 2.95Å; I356-A359 VanDerWaalsContact O-N 3.12Å; I356-N360 WeakPolarHBondContact O-CB 3.44Å; I356-N360 PolarHBondContact O-N 2.96Å; I356-L379 HydrophobicContact CG1-CB 3.79Å; I356-L383 HydrophobicContact CD1-CB 4.24Å; I356-L383 HydrophobicContact CD1-CD2 3.92Å; I356-L402 HydrophobicContact CD1-CD2 4.16Å; I356-L402 HydrophobicContact CG2-CD2 4.01Å; I356-L405 HydrophobicContact CG2-CD1 3.82Å
357	A	97.4	Very high	92.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-38	176.8	0	0	0	0	0	112.4	A288 L295 L353 K354 L405 L408	A288-A357 WeakPolarHBondContact CB-O 3.39Å; L295-A357 HydrophobicContact CD1-CB 4.11Å; L353-A357 WeakPolarHBondContact O-CB 3.36Å; L353-A357 PolarHBondContact O-N 2.98Å; K354-A357 PolarHBondContact O-N 3Å; A357-L405 HydrophobicContact CB-CD2 4.47Å; A357-L408 HydrophobicContact CB-CD2 4.26Å
358	L	97.1	Very high	92.1	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-41.7	172.5	-178.5	66.8	0	0	0	112.7	W266 A267 I270 F273 L284 L285 A288 I292 K354 A355 I356	W266-L358 HydrophobicContact CZ3-CD2 4.16Å; A267-L358 HydrophobicContact CB-CD2 3.74Å; I270-L358 HydrophobicContact CD1-CD2 3.43Å; I270-L358 VanDerWaalsContact CD1-CD2 3.43Å; F273-L358 HydrophobicContact CD2-CD2 3.76Å; F273-L358 HydrophobicContact CD2-CG 4.44Å; F273-L358 HydrophobicContact CE2-CD1 4.38Å; F273-L358 HydrophobicContact CE2-CD2 3.63Å; F273-L358 HydrophobicContact CE2-CG 4.1Å; F273-L358 HydrophobicContact CZ-CD2 4.38Å; L284-L358 HydrophobicContact CB-CD1 4.11Å; L284-L358 HydrophobicContact CB-CG 4.43Å; L285-L358 HydrophobicContact CD2-CD1 3.99Å; L285-L358 HydrophobicContact CG-CD1 4.19Å; A288-L358 HydrophobicContact CB-CD1 4.13Å; I292-L358 HydrophobicContact CD1-CB 4.1Å; I292-L358 HydrophobicContact CD1-CD1 3.9Å; K354-L358 PolarHBondContact O-N 3.23Å; A355-L358 PolarHBondContact O-N 3.36Å; I356-L358 VanDerWaalsContact C-N 3.3Å; I356-L358 PolarHBondContact O-N 3.38Å
359	A	96.3	Very high	92	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-77.8	-25.9	-178.3	0	0	0	0	0	113.3	A355 I356 S361 L375 Q376 L379	A355-A359 PolarHBondContact O-N 2.76Å; A355-A359 VanDerWaalsContact O-N 3.12Å; I356-A359 PolarHBondContact O-N 2.95Å; I356-A359 VanDerWaalsContact O-N 3.12Å; A359-S361 VanDerWaalsContact C-N 3.29Å; A359-S361 PolarHBondContact O-N 3.07Å; A359-L375 HydrophobicContact CB-CD2 4.16Å; A359-L375 HydrophobicContact CB-CG 4.13Å; A359-Q376 HydrophobicContact CB-CG 3.83Å; A359-Q376 PolarHBondContact O-NE2 3.47Å; A359-L379 HydrophobicContact CB-CD1 3.85Å
360	N	90.9	Very high	91.9	Very high	55 Å²	55	49.8 Å²	49.8	29%	0.294	26%	0.256	S	S	.	.	S	Bend	trans	-85.9	61	-177	-172	58.6	0	0	0	112.3	I356 R409	I356-N360 WeakPolarHBondContact O-CB 3.44Å; I356-N360 PolarHBondContact O-N 2.96Å; N360-R409 PolarHBondContact O-NH2 3.17Å
361	S	80.4	Confident	91.8	Very high	24 Å²	24	50.4 Å²	50.4	17%	0.168	26%	0.262	C	S	.	.			trans	-82.9	138.2	-175.8	-174.5	0	0	0	0	113.7	L284 S287 A359 S363	L284-S361 VanDerWaalsContact CD2-CB 3.4Å; S287-S361 WeakPolarHBondContact CB-OG 3.26Å; S287-S361 VanDerWaalsContact OG-CB 3.24Å; S287-S361 WeakPolarHBondContact OG-CB 3.33Å; S287-S361 PolarHBondContact OG-OG 3.04Å; A359-S361 VanDerWaalsContact C-N 3.29Å; A359-S361 PolarHBondContact O-N 3.07Å; S361-S363 VanDerWaalsContact C-N 3.26Å; S361-S363 VanDerWaalsContact OG-CB 3.25Å; S361-S363 WeakPolarHBondContact OG-CB 3.5Å; S361-S363 PolarHBondContact OG-N 3.27Å
362	D	77.3	Confident	91.8	Very high	114 Å²	114	50.7 Å²	50.7	61%	0.61	26%	0.264	S	S	*	.			trans	-85.2	8.2	167.7	-64.3	-15.3	0	0	0	112.5	M364 R409	D362-M364 PolarHBondContact O-N 3.01Å; D362-R409 IonicContact OD1-CZ 3.64Å; D362-R409 IonicContact OD1-NH1 2.77Å; D362-R409 PolarHBondContact OD1-NH1 3.39Å; D362-R409 IonicContact OD2-CZ 2.81Å; D362-R409 IonicContact OD2-NE 2.72Å; D362-R409 IonicContact OD2-NH1 3.47Å; D362-R409 PolarHBondContact OD2-NH1 3.29Å
363	S	78.8	Confident	91.6	Very high	32 Å²	32	54.7 Å²	54.7	22%	0.224	28%	0.283	C	S	.	.			trans	-62.7	124.8	-174	-179.1	0	0	0	0	112.3	S361 H365	S361-S363 VanDerWaalsContact C-N 3.26Å; S361-S363 VanDerWaalsContact OG-CB 3.25Å; S361-S363 WeakPolarHBondContact OG-CB 3.5Å; S361-S363 PolarHBondContact OG-N 3.27Å; S363-H365 PolarHBondContact O-N 2.74Å; S363-H365 PolarHBondContact OG-N 3.19Å
364	M	74.5	Confident	91.5	Very high	176 Å²	176	59.7 Å²	59.7	87%	0.867	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	3.6	173.7	-62.9	-175.1	66.9	0	0	113.6	D362	D362-M364 PolarHBondContact O-N 3.01Å
365	H	83	Confident	91.5	Very high	145 Å²	145	59.5 Å²	59.5	67%	0.671	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	13.9	-167.6	-57.5	-44.8	0	0	0	114.6	S363 E367	S363-H365 PolarHBondContact O-N 2.74Å; S363-H365 PolarHBondContact OG-N 3.19Å; H365-E367 PolarHBondContact O-N 3.46Å
366	I	92.2	Very high	91.4	Very high	32 Å²	32	61 Å²	61	16%	0.164	31%	0.311	C	S	.	.			trans	-64.6	126.1	174.7	-58.7	-57	0	0	0	110.8	D280 L284 V369 V372	D280-I366 WeakPolarHBondContact OD1-CA 3.26Å; L284-I366 HydrophobicContact CD2-CD1 4.08Å; I366-V369 HydrophobicContact CB-CG2 4.23Å; I366-V369 HydrophobicContact CG2-CB 4.48Å; I366-V369 HydrophobicContact CG2-CG2 3.9Å; I366-V372 HydrophobicContact CD1-CG2 4.49Å; I366-V372 HydrophobicContact CG2-CB 4.22Å; I366-V372 HydrophobicContact CG2-CG2 3.61Å
367	E	93.9	Very high	91.3	Very high	136 Å²	136	64.7 Å²	64.7	64%	0.636	33%	0.33	S	S	*	.	S	Bend	trans	-80.6	-54.7	-179.4	-61.6	-174.1	132.2	0	0	111.7	S277 A279 D280 H365	S277-E367 VanDerWaalsContact CB-OE2 3.26Å; S277-E367 WeakPolarHBondContact CB-OE2 3.25Å; S277-E367 PolarHBondContact OG-OE2 3.39Å; A279-E367 HydrophobicContact CB-CG 4.45Å; D280-E367 PolarHBondContact OD1-N 3.16Å; H365-E367 PolarHBondContact O-N 3.46Å
368	D	94.6	Very high	91.2	Very high	75 Å²	75	67.2 Å²	67.2	40%	0.401	35%	0.346	S	S	.	.			trans	-107.6	81.1	175.7	-166.9	-15.6	0	0	0	111.4	D280 E370 A371 V372	D280-D368 PolarHBondContact OD2-N 2.87Å; D280-D368 VanDerWaalsContact OD2-N 3.16Å; D368-E370 PolarHBondContact O-N 3.16Å; D368-E370 WeakPolarHBondContact OD1-CA 3.25Å; D368-E370 WeakPolarHBondContact OD1-CB 3.44Å; D368-E370 PolarHBondContact OD1-N 2.74Å; D368-A371 HydrophobicContact CB-CB 3.83Å; D368-A371 VanDerWaalsContact CG-CB 3.43Å; D368-A371 PolarHBondContact O-N 2.99Å; D368-A371 PolarHBondContact OD1-N 3.17Å; D368-V372 PolarHBondContact O-N 3.31Å
369	V	94	Very high	91.2	Very high	96 Å²	96	67.2 Å²	67.2	58%	0.582	35%	0.346	S	S	*	.	H	α-helix	trans	-56.7	-31.3	174.1	-177.6	0	0	0	0	111.7	I366 Q373	I366-V369 HydrophobicContact CB-CG2 4.23Å; I366-V369 HydrophobicContact CG2-CB 4.48Å; I366-V369 HydrophobicContact CG2-CG2 3.9Å; V369-Q373 VanDerWaalsContact O-CB 3.32Å; V369-Q373 WeakPolarHBondContact O-CB 3.42Å; V369-Q373 PolarHBondContact O-N 2.97Å
370	E	95.3	Very high	91.2	Very high	137 Å²	137	69.3 Å²	69.3	64%	0.64	36%	0.355	S	S	*	.	H	α-helix	trans	-73.8	-27.4	175.2	-59.2	-165	178.1	0	0	112.5	D368 K374	D368-E370 PolarHBondContact O-N 3.16Å; D368-E370 WeakPolarHBondContact OD1-CA 3.25Å; D368-E370 WeakPolarHBondContact OD1-CB 3.44Å; D368-E370 PolarHBondContact OD1-N 2.74Å; E370-K374 VanDerWaalsContact C-NZ 3.28Å; E370-K374 WeakPolarHBondContact O-CD 3.46Å; E370-K374 VanDerWaalsContact O-CE 3.3Å; E370-K374 WeakPolarHBondContact O-CE 3.29Å; E370-K374 WeakPolarHBondContact O-CG 3.43Å; E370-K374 PolarHBondContact O-N 3.14Å; E370-K374 PolarHBondContact O-NZ 3.4Å; E370-K374 IonicContact OE2-NZ 2.82Å; E370-K374 PolarHBondContact OE2-NZ 3.03Å; E370-K374 VanDerWaalsContact OE2-NZ 3.1Å
371	A	96	Very high	91.4	Very high	20 Å²	20	72.5 Å²	72.5	17%	0.165	37%	0.368	C	S	.	.	H	α-helix	trans	-76.9	-41.2	176.1	0	0	0	0	0	111.3	L276 D368 K374 L375	L276-A371 HydrophobicContact CD2-CB 3.57Å; D368-A371 HydrophobicContact CB-CB 3.83Å; D368-A371 VanDerWaalsContact CG-CB 3.43Å; D368-A371 PolarHBondContact O-N 2.99Å; D368-A371 PolarHBondContact OD1-N 3.17Å; A371-K374 PolarHBondContact O-N 3.4Å; A371-L375 PolarHBondContact O-N 3.24Å; A371-L375 VanDerWaalsContact O-N 3.1Å
372	V	95.9	Very high	92.2	Very high	7 Å²	7	71.6 Å²	71.6	4%	0.042	36%	0.362	C	S	.	.	H	α-helix	trans	-62.9	-41.2	172.3	176.9	0	0	0	0	111.2	L276 L284 I366 D368 K374 L375 Q376	L276-V372 HydrophobicContact CD1-CG2 4.19Å; L276-V372 HydrophobicContact CD2-CG2 4.11Å; L284-V372 HydrophobicContact CD2-CG1 4.16Å; I366-V372 HydrophobicContact CD1-CG2 4.49Å; I366-V372 HydrophobicContact CG2-CB 4.22Å; I366-V372 HydrophobicContact CG2-CG2 3.61Å; D368-V372 PolarHBondContact O-N 3.31Å; V372-K374 PolarHBondContact O-N 3.34Å; V372-L375 WeakPolarHBondContact O-CB 3.38Å; V372-L375 PolarHBondContact O-N 2.54Å; V372-Q376 WeakPolarHBondContact O-CG 3.14Å; V372-Q376 PolarHBondContact O-N 3.03Å
373	Q	95.2	Very high	93	Very high	84 Å²	84	66.2 Å²	66.2	39%	0.393	33%	0.333	S	S	.	.	H	α-helix	trans	-59.9	-43.6	173.8	-172	64.5	68.6	0	0	111.9	V369 L375 Q376 D377	V369-Q373 VanDerWaalsContact O-CB 3.32Å; V369-Q373 WeakPolarHBondContact O-CB 3.42Å; V369-Q373 PolarHBondContact O-N 2.97Å; Q373-L375 VanDerWaalsContact C-N 3.27Å; Q373-L375 PolarHBondContact O-N 3.49Å; Q373-Q376 WeakPolarHBondContact O-CB 3.49Å; Q373-Q376 PolarHBondContact O-N 2.86Å; Q373-Q376 VanDerWaalsContact O-N 3.15Å; Q373-D377 PolarHBondContact NE2-OD1 3.21Å; Q373-D377 WeakPolarHBondContact O-CB 3.45Å; Q373-D377 PolarHBondContact O-N 2.86Å
374	K	95.9	Very high	93.8	Very high	105 Å²	105	70.1 Å²	70.1	46%	0.457	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-34.1	176.9	-69.5	160.5	-162.8	115.6	0	112.4	E370 A371 V372 V378	E370-K374 VanDerWaalsContact C-NZ 3.28Å; E370-K374 WeakPolarHBondContact O-CD 3.46Å; E370-K374 VanDerWaalsContact O-CE 3.3Å; E370-K374 WeakPolarHBondContact O-CE 3.29Å; E370-K374 WeakPolarHBondContact O-CG 3.43Å; E370-K374 PolarHBondContact O-N 3.14Å; E370-K374 PolarHBondContact O-NZ 3.4Å; E370-K374 IonicContact OE2-NZ 2.82Å; E370-K374 PolarHBondContact OE2-NZ 3.03Å; E370-K374 VanDerWaalsContact OE2-NZ 3.1Å; A371-K374 PolarHBondContact O-N 3.4Å; V372-K374 PolarHBondContact O-N 3.34Å; K374-V378 VanDerWaalsContact O-CG2 3.3Å; K374-V378 WeakPolarHBondContact O-CG2 3.41Å; K374-V378 PolarHBondContact O-N 3.24Å
375	L	96.5	Very high	94.7	Very high	7 Å²	7	66 Å²	66	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-45.8	173.1	176.7	61.8	0	0	0	111.5	I270 P271 F273 L276 L284 A359 A371 V372 Q373 V378 L379	I270-L375 HydrophobicContact CG2-CD1 4.21Å; P271-L375 WeakPolarHBondContact O-CD1 3.14Å; F273-L375 HydrophobicContact CB-CD2 4.32Å; F273-L375 HydrophobicContact CD2-CD2 4.22Å; L276-L375 HydrophobicContact CD1-CD2 3.91Å; L284-L375 HydrophobicContact CD1-CD2 4.28Å; A359-L375 HydrophobicContact CB-CD2 4.16Å; A359-L375 HydrophobicContact CB-CG 4.13Å; A371-L375 PolarHBondContact O-N 3.24Å; A371-L375 VanDerWaalsContact O-N 3.1Å; V372-L375 WeakPolarHBondContact O-CB 3.38Å; V372-L375 PolarHBondContact O-N 2.54Å; Q373-L375 VanDerWaalsContact C-N 3.27Å; Q373-L375 PolarHBondContact O-N 3.49Å; L375-V378 PolarHBondContact O-N 3.33Å; L375-L379 HydrophobicContact CD1-CD1 3.95Å; L375-L379 HydrophobicContact CD1-CG 4.33Å; L375-L379 HydrophobicContact CG-CD1 4.05Å; L375-L379 VanDerWaalsContact O-CG 3.3Å; L375-L379 WeakPolarHBondContact O-CG 3.19Å; L375-L379 PolarHBondContact O-N 3.31Å; L375-L379 VanDerWaalsContact O-N 3.14Å
376	Q	96.6	Very high	95.2	Very high	32 Å²	32	59.8 Å²	59.8	15%	0.15	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-45.5	174.8	-67.9	175.5	4.6	0	0	111.7	A359 V372 Q373 V378 L379 H380	A359-Q376 HydrophobicContact CB-CG 3.83Å; A359-Q376 PolarHBondContact O-NE2 3.47Å; V372-Q376 WeakPolarHBondContact O-CG 3.14Å; V372-Q376 PolarHBondContact O-N 3.03Å; Q373-Q376 WeakPolarHBondContact O-CB 3.49Å; Q373-Q376 PolarHBondContact O-N 2.86Å; Q373-Q376 VanDerWaalsContact O-N 3.15Å; Q376-V378 PolarHBondContact O-N 3.41Å; Q376-L379 PolarHBondContact O-N 2.78Å; Q376-H380 WeakPolarHBondContact O-CB 3.48Å; Q376-H380 VanDerWaalsContact O-CG 3.24Å; Q376-H380 PolarHBondContact O-N 3.46Å; Q376-H380 PolarHBondContact O-ND1 3.28Å
377	D	95.7	Very high	95.3	Very high	79 Å²	79	58.7 Å²	58.7	42%	0.422	30%	0.295	S	S	.	.	H	α-helix	trans	-58.2	-47.9	-179.8	-66.3	-11.8	0	0	0	111.1	Q373 L379 H380 E381	Q373-D377 PolarHBondContact NE2-OD1 3.21Å; Q373-D377 WeakPolarHBondContact O-CB 3.45Å; Q373-D377 PolarHBondContact O-N 2.86Å; D377-L379 VanDerWaalsContact C-N 3.34Å; D377-L379 PolarHBondContact O-N 2.81Å; D377-H380 PolarHBondContact O-N 3.11Å; D377-E381 WeakPolarHBondContact O-CB 3.39Å; D377-E381 PolarHBondContact O-N 3.49Å
378	V	95.6	Very high	95.2	Very high	53 Å²	53	55.4 Å²	55.4	32%	0.321	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-37.6	177.9	167.4	0	0	0	0	112.2	I221 K374 L375 Q376 A382	I221-V378 HydrophobicContact CD1-CG1 3.92Å; I221-V378 HydrophobicContact CG1-CG1 4.14Å; K374-V378 VanDerWaalsContact O-CG2 3.3Å; K374-V378 WeakPolarHBondContact O-CG2 3.41Å; K374-V378 PolarHBondContact O-N 3.24Å; L375-V378 PolarHBondContact O-N 3.33Å; Q376-V378 PolarHBondContact O-N 3.41Å; V378-A382 VanDerWaalsContact O-CB 3.23Å; V378-A382 WeakPolarHBondContact O-CB 3.4Å; V378-A382 PolarHBondContact O-N 3.36Å
379	L	97	Very high	95	Very high	1 Å²	1	53 Å²	53	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-75.3	-33.2	178.2	-67.5	169.9	0	0	0	112.4	I221 L225 I270 A355 I356 A359 L375 Q376 D377 L383	I221-L379 HydrophobicContact CG2-CD2 4.14Å; L225-L379 HydrophobicContact CD1-CD2 4.19Å; I270-L379 HydrophobicContact CG2-CD1 4.49Å; I270-L379 HydrophobicContact CG2-CD2 4.31Å; A355-L379 HydrophobicContact CB-CD1 4.1Å; A355-L379 HydrophobicContact CB-CD2 3.79Å; I356-L379 HydrophobicContact CG1-CB 3.79Å; A359-L379 HydrophobicContact CB-CD1 3.85Å; L375-L379 HydrophobicContact CD1-CD1 3.95Å; L375-L379 HydrophobicContact CD1-CG 4.33Å; L375-L379 HydrophobicContact CG-CD1 4.05Å; L375-L379 VanDerWaalsContact O-CG 3.3Å; L375-L379 WeakPolarHBondContact O-CG 3.19Å; L375-L379 PolarHBondContact O-N 3.31Å; L375-L379 VanDerWaalsContact O-N 3.14Å; Q376-L379 PolarHBondContact O-N 2.78Å; D377-L379 VanDerWaalsContact C-N 3.34Å; D377-L379 PolarHBondContact O-N 2.81Å; L379-L383 PolarHBondContact O-N 3.2Å
380	H	96.2	Very high	94.8	Very high	46 Å²	46	52.9 Å²	52.9	21%	0.213	28%	0.276	C	S	.	.	H	α-helix	trans	-72.3	-40.1	172.9	-68.3	150.5	0	0	0	112.5	Q376 D377 L383 Q384	Q376-H380 WeakPolarHBondContact O-CB 3.48Å; Q376-H380 VanDerWaalsContact O-CG 3.24Å; Q376-H380 PolarHBondContact O-N 3.46Å; Q376-H380 PolarHBondContact O-ND1 3.28Å; D377-H380 PolarHBondContact O-N 3.11Å; H380-L383 PolarHBondContact O-N 2.97Å; H380-Q384 WeakPolarHBondContact O-CB 3.33Å; H380-Q384 VanDerWaalsContact O-CG 3.28Å; H380-Q384 WeakPolarHBondContact O-CG 3.4Å; H380-Q384 PolarHBondContact O-N 2.98Å
381	E	95.3	Very high	94.5	Very high	121 Å²	121	47.2 Å²	47.2	57%	0.565	25%	0.25	S	C	*	.	H	α-helix	trans	-61.4	-45.8	172.2	-172.7	171.5	-149.6	0	0	110	D377 L383 Q384 D385	D377-E381 WeakPolarHBondContact O-CB 3.39Å; D377-E381 PolarHBondContact O-N 3.49Å; E381-L383 PolarHBondContact O-N 2.76Å; E381-Q384 PolarHBondContact O-N 3.49Å; E381-D385 WeakPolarHBondContact O-CB 3.46Å; E381-D385 PolarHBondContact O-N 2.75Å
382	A	95.7	Very high	94.1	Very high	5 Å²	5	52.7 Å²	52.7	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-39.3	174.8	0	0	0	0	0	113.9	N219 I221 V222 V378 Y386	N219-A382 PolarHBondContact ND2-O 2.85Å; I221-A382 HydrophobicContact CB-CB 3.57Å; I221-A382 HydrophobicContact CG1-CB 4.13Å; I221-A382 HydrophobicContact CG2-CB 3.55Å; V222-A382 HydrophobicContact CG2-CB 4.47Å; V378-A382 VanDerWaalsContact O-CB 3.23Å; V378-A382 WeakPolarHBondContact O-CB 3.4Å; V378-A382 PolarHBondContact O-N 3.36Å; A382-Y386 WeakPolarHBondContact O-CB 3.24Å; A382-Y386 PolarHBondContact O-N 3.07Å
383	L	96	Very high	93.9	Very high	1 Å²	1	59 Å²	59	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-48.7	173.1	-175.6	61.6	0	0	0	110.7	T352 I356 L379 H380 E381 D385 Y386 E387 A398 M401 L402	T352-L383 HydrophobicContact CG2-CB 3.84Å; T352-L383 HydrophobicContact CG2-CD1 4.02Å; T352-L383 HydrophobicContact CG2-CG 4.45Å; I356-L383 HydrophobicContact CD1-CB 4.24Å; I356-L383 HydrophobicContact CD1-CD2 3.92Å; L379-L383 PolarHBondContact O-N 3.2Å; H380-L383 PolarHBondContact O-N 2.97Å; E381-L383 PolarHBondContact O-N 2.76Å; L383-D385 PolarHBondContact O-N 2.76Å; L383-Y386 PolarHBondContact O-N 3.01Å; L383-E387 HydrophobicContact CD1-CG 4.23Å; L383-E387 HydrophobicContact CG-CG 4.37Å; L383-E387 WeakPolarHBondContact O-CG 3.26Å; L383-E387 PolarHBondContact O-N 3.38Å; L383-A398 HydrophobicContact CD2-CB 4.06Å; L383-A398 HydrophobicContact CG-CB 4Å; L383-M401 HydrophobicContact CD1-SD 4.08Å; L383-L402 HydrophobicContact CD2-CD2 4.25Å; L383-L402 HydrophobicContact CD2-CG 4.3Å
384	Q	94.9	Very high	93.8	Very high	115 Å²	115	56.3 Å²	56.3	54%	0.537	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-42.3	-177.8	-72.6	173	24	0	0	112.8	H380 E381 A388 A398	H380-Q384 WeakPolarHBondContact O-CB 3.33Å; H380-Q384 VanDerWaalsContact O-CG 3.28Å; H380-Q384 WeakPolarHBondContact O-CG 3.4Å; H380-Q384 PolarHBondContact O-N 2.98Å; E381-Q384 PolarHBondContact O-N 3.49Å; Q384-A388 VanDerWaalsContact O-CB 3.22Å; Q384-A388 WeakPolarHBondContact O-CB 3.36Å; Q384-A388 PolarHBondContact O-N 3.3Å; Q384-A398 HydrophobicContact CG-CB 4.37Å
385	D	93.3	Very high	93.5	Very high	88 Å²	88	56.9 Å²	56.9	47%	0.471	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-35.9	176.5	-87	-2	0	0	0	112.5	E381 L383 G389	E381-D385 WeakPolarHBondContact O-CB 3.46Å; E381-D385 PolarHBondContact O-N 2.75Å; L383-D385 PolarHBondContact O-N 2.76Å; D385-G389 PolarHBondContact O-N 2.9Å
386	Y	94.2	Very high	93.4	Very high	15 Å²	15	64.6 Å²	64.6	6%	0.059	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-51.3	175.4	180	-97.2	0	0	0	111.5	N219 V222 E348 E349 A382 L383 A388 G389 Q390	N219-Y386 PolarHBondContact ND2-N 2.79Å; V222-Y386 HydrophobicContact CG1-CD2 4.21Å; E348-Y386 HydrophobicContact CB-CD2 4.26Å; E348-Y386 HydrophobicContact CB-CE1 3.94Å; E348-Y386 HydrophobicContact CB-CE2 3.53Å; E348-Y386 WeakPolarHBondContact CB-OH 3.35Å; E348-Y386 HydrophobicContact CG-CD2 4.5Å; E348-Y386 HydrophobicContact CG-CE2 3.58Å; E349-Y386 HydrophobicContact CG-CD1 4.23Å; E349-Y386 HydrophobicContact CG-CE1 3.66Å; A382-Y386 WeakPolarHBondContact O-CB 3.24Å; A382-Y386 PolarHBondContact O-N 3.07Å; L383-Y386 PolarHBondContact O-N 3.01Å; Y386-A388 VanDerWaalsContact C-N 3.32Å; Y386-A388 PolarHBondContact O-N 3.4Å; Y386-G389 PolarHBondContact O-N 3.42Å; Y386-Q390 HydrophobicContact CD2-CG 4.13Å; Y386-Q390 HydrophobicContact CE1-CB 4.47Å; Y386-Q390 HydrophobicContact CE1-CG 4.17Å; Y386-Q390 HydrophobicContact CE2-CG 3.64Å; Y386-Q390 PolarHBondContact O-N 2.87Å
387	E	94.3	Very high	93.3	Very high	10 Å²	10	64.3 Å²	64.3	5%	0.047	33%	0.332	C	S	.	.	H	α-helix	trans	-60.9	-39.8	178.5	-63.6	-55.2	146.8	0	0	112.3	L383 G389 H391 R397 A398 M401	L383-E387 HydrophobicContact CD1-CG 4.23Å; L383-E387 HydrophobicContact CG-CG 4.37Å; L383-E387 WeakPolarHBondContact O-CG 3.26Å; L383-E387 PolarHBondContact O-N 3.38Å; E387-G389 PolarHBondContact O-N 3.4Å; E387-H391 CarbonylContact O-C 3.57Å; E387-H391 WeakPolarHBondContact O-CA 3.32Å; E387-H391 PolarHBondContact O-N 3.43Å; E387-H391 IonicContact OE2-CD2 2.74Å; E387-H391 PolarHBondContact OE2-CD2 2.82Å; E387-H391 IonicContact OE2-CG 3.41Å; E387-R397 VanDerWaalsContact OE2-CB 3.25Å; E387-R397 WeakPolarHBondContact OE2-CB 3.35Å; E387-R397 WeakPolarHBondContact OE2-CD 3.28Å; E387-R397 WeakPolarHBondContact OE2-CG 3.43Å; E387-R397 IonicContact OE2-NE 2.81Å; E387-R397 PolarHBondContact OE2-NE 2.94Å; E387-A398 HydrophobicContact CB-CB 4.44Å; E387-A398 HydrophobicContact CG-CB 3.8Å; E387-M401 WeakPolarHBondContact OE1-CE 3.41Å
388	A	91.3	Very high	93.3	Very high	67 Å²	67	61.2 Å²	61.2	55%	0.554	32%	0.317	S	S	*	.	H	α-helix	trans	-67.6	-23.1	176.8	0	0	0	0	0	113.3	Q384 Y386	Q384-A388 VanDerWaalsContact O-CB 3.22Å; Q384-A388 WeakPolarHBondContact O-CB 3.36Å; Q384-A388 PolarHBondContact O-N 3.3Å; Y386-A388 VanDerWaalsContact C-N 3.32Å; Y386-A388 PolarHBondContact O-N 3.4Å
389	G	89.1	Confident	93.3	Very high	24 Å²	24	60.3 Å²	60.3	25%	0.247	32%	0.319	C	S	.	.	H	α-helix	trans	-87	-44.8	176.2	0	0	0	0	0	114	D385 Y386 E387	D385-G389 PolarHBondContact O-N 2.9Å; Y386-G389 PolarHBondContact O-N 3.42Å; E387-G389 PolarHBondContact O-N 3.4Å
390	Q	90.4	Very high	93.3	Very high	93 Å²	93	64.2 Å²	64.2	44%	0.435	34%	0.336	S	S	.	.	H	α-helix	trans	-96.2	-37.3	-173.5	-57	-65.1	4.5	0	0	113.9	Y386	Y386-Q390 HydrophobicContact CD2-CG 4.13Å; Y386-Q390 HydrophobicContact CE1-CB 4.47Å; Y386-Q390 HydrophobicContact CE1-CG 4.17Å; Y386-Q390 HydrophobicContact CE2-CG 3.64Å; Y386-Q390 PolarHBondContact O-N 2.87Å
391	H	89.5	Confident	93.2	Very high	18 Å²	18	62 Å²	62	8%	0.083	33%	0.326	C	S	.	.			trans	-115.9	49.2	-170.5	-69.6	-58.6	0	0	0	112.6	E346 E349 E387 E393 D394 R397	E346-H391 IonicContact OE1-CE1 2.65Å; E346-H391 IonicContact OE1-NE2 3.11Å; E349-H391 IonicContact OE1-CD2 3.45Å; E349-H391 PolarHBondContact OE1-CD2 2.98Å; E349-H391 IonicContact OE1-NE2 3.86Å; E349-H391 PolarHBondContact OE1-NE2 2.7Å; E387-H391 CarbonylContact O-C 3.57Å; E387-H391 WeakPolarHBondContact O-CA 3.32Å; E387-H391 PolarHBondContact O-N 3.43Å; E387-H391 IonicContact OE2-CD2 2.74Å; E387-H391 PolarHBondContact OE2-CD2 2.82Å; E387-H391 IonicContact OE2-CG 3.41Å; H391-E393 VanDerWaalsContact C-OE2 3.28Å; H391-E393 WeakPolarHBondContact CA-OE2 3.27Å; H391-E393 IonicContact CG-OE1 2.8Å; H391-E393 IonicContact ND1-OE1 2.72Å; H391-E393 PolarHBondContact ND1-OE1 2.91Å; H391-E393 VanDerWaalsContact ND1-OE1 3.11Å; H391-E393 PolarHBondContact O-N 3.17Å; H391-D394 CarbonylContact O-C 3.56Å; H391-D394 PolarHBondContact O-N 2.68Å; H391-R397 VanDerWaalsContact CD2-CD 3.43Å; H391-R397 WeakPolarHBondContact CD2-CD 3.42Å; H391-R397 PolarHBondContact CD2-NE 2.82Å; H391-R397 VanDerWaalsContact CG-CD 3.45Å; H391-R397 PolarHBondContact NE2-NE 2.88Å
392	M	87.9	Confident	93.3	Very high	136 Å²	136	58.7 Å²	58.7	67%	0.67	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.2	-179.6	-57.1	-170.4	80.5	0	0	113.7
393	E	91.9	Very high	93.4	Very high	138 Å²	138	65.8 Å²	65.8	65%	0.645	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.8	177.8	72.7	-72.7	172.2	0	0	114.7	H391	H391-E393 VanDerWaalsContact C-OE2 3.28Å; H391-E393 WeakPolarHBondContact CA-OE2 3.27Å; H391-E393 IonicContact CG-OE1 2.8Å; H391-E393 IonicContact ND1-OE1 2.72Å; H391-E393 PolarHBondContact ND1-OE1 2.91Å; H391-E393 VanDerWaalsContact ND1-OE1 3.11Å; H391-E393 PolarHBondContact O-N 3.17Å
394	D	91.7	Very high	93.4	Very high	28 Å²	28	65.9 Å²	65.9	15%	0.15	35%	0.346	C	S	.	.			trans	-132.3	76.2	179.6	-172.7	33.6	0	0	0	111.7	H391 R396 R397 K400	H391-D394 CarbonylContact O-C 3.56Å; H391-D394 PolarHBondContact O-N 2.68Å; D394-R396 PolarHBondContact O-N 3.18Å; D394-R396 IonicContact OD1-NE 3.92Å; D394-R396 IonicContact OD1-NH2 2.71Å; D394-R397 HydrophobicContact CB-CB 4.4Å; D394-R397 VanDerWaalsContact O-CB 3.32Å; D394-R397 WeakPolarHBondContact O-CB 3.27Å; D394-R397 PolarHBondContact O-N 3.22Å; D394-K400 IonicContact OD1-NZ 3.38Å; D394-K400 PolarHBondContact OD1-NZ 3.22Å; D394-K400 WeakPolarHBondContact OD2-CD 3.28Å; D394-K400 IonicContact OD2-NZ 3.94Å; D394-K400 PolarHBondContact OD2-NZ 3.41Å
395	P	90	Very high	93.5	Very high	117 Å²	117	61 Å²	61	76%	0.76	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	19.5	179.3	29.3	-38.1	0	0	0	114.7
396	R	93.9	Very high	93.7	Very high	170 Å²	170	61 Å²	61	64%	0.642	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	1.9	172.3	-64.2	165.4	-65.3	-154.5	-4.3	112	D394 G399 K400	D394-R396 PolarHBondContact O-N 3.18Å; D394-R396 IonicContact OD1-NE 3.92Å; D394-R396 IonicContact OD1-NH2 2.71Å; R396-G399 PolarHBondContact O-N 3.28Å; R396-G399 VanDerWaalsContact O-N 3.11Å; R396-K400 WeakPolarHBondContact O-CG 3.23Å; R396-K400 PolarHBondContact O-N 2.95Å
397	R	95.1	Very high	93.8	Very high	25 Å²	25	62.6 Å²	62.6	9%	0.094	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-47	-173.5	-173.3	168.1	166.7	105.8	4.1	112.5	M343 K344 E349 E387 H391 D394 G399 K400 M401	M343-R397 PolarHBondContact O-NH1 2.96Å; M343-R397 PolarHBondContact O-NH2 3.22Å; K344-R397 PolarHBondContact O-NH2 3.29Å; E349-R397 IonicContact OE1-CZ 3.49Å; E349-R397 IonicContact OE1-NE 2.56Å; E349-R397 PolarHBondContact OE1-NE 2.82Å; E349-R397 IonicContact OE1-NH2 2.69Å; E349-R397 PolarHBondContact OE1-NH2 2.79Å; E349-R397 IonicContact OE2-CZ 3.43Å; E349-R397 IonicContact OE2-NH2 3.89Å; E349-R397 PolarHBondContact OE2-NH2 2.93Å; E387-R397 VanDerWaalsContact OE2-CB 3.25Å; E387-R397 WeakPolarHBondContact OE2-CB 3.35Å; E387-R397 WeakPolarHBondContact OE2-CD 3.28Å; E387-R397 WeakPolarHBondContact OE2-CG 3.43Å; E387-R397 IonicContact OE2-NE 2.81Å; E387-R397 PolarHBondContact OE2-NE 2.94Å; H391-R397 VanDerWaalsContact CD2-CD 3.43Å; H391-R397 WeakPolarHBondContact CD2-CD 3.42Å; H391-R397 PolarHBondContact CD2-NE 2.82Å; H391-R397 VanDerWaalsContact CG-CD 3.45Å; H391-R397 PolarHBondContact NE2-NE 2.88Å; D394-R397 HydrophobicContact CB-CB 4.4Å; D394-R397 VanDerWaalsContact O-CB 3.32Å; D394-R397 WeakPolarHBondContact O-CB 3.27Å; D394-R397 PolarHBondContact O-N 3.22Å; R397-G399 VanDerWaalsContact C-N 3.32Å; R397-G399 PolarHBondContact O-N 3.36Å; R397-K400 WeakPolarHBondContact O-CB 3.41Å; R397-K400 PolarHBondContact O-N 2.87Å; R397-K400 VanDerWaalsContact O-N 3.07Å; R397-M401 HydrophobicContact CG-CE 3.62Å; R397-M401 WeakPolarHBondContact O-CG 3.32Å; R397-M401 PolarHBondContact O-N 3.45Å
398	A	95.7	Very high	94	Very high	14 Å²	14	62.1 Å²	62.1	12%	0.116	34%	0.336	C	S	.	.	H	α-helix	trans	-49.6	-50.5	168.9	0	0	0	0	0	112.2	L383 Q384 E387 K400 M401 L402	L383-A398 HydrophobicContact CD2-CB 4.06Å; L383-A398 HydrophobicContact CG-CB 4Å; Q384-A398 HydrophobicContact CG-CB 4.37Å; E387-A398 HydrophobicContact CB-CB 4.44Å; E387-A398 HydrophobicContact CG-CB 3.8Å; A398-K400 PolarHBondContact O-N 3.01Å; A398-M401 WeakPolarHBondContact O-CB 3.49Å; A398-M401 PolarHBondContact O-N 2.97Å; A398-L402 WeakPolarHBondContact O-CG 3.34Å; A398-L402 PolarHBondContact O-N 3.42Å
399	G	96.3	Very high	94.2	Very high	35 Å²	35	60.4 Å²	60.4	36%	0.361	32%	0.315	S	S	.	.	H	α-helix	trans	-62.6	-40.2	178.8	0	0	0	0	0	113.2	R396 R397 M401 L402 M403	R396-G399 PolarHBondContact O-N 3.28Å; R396-G399 VanDerWaalsContact O-N 3.11Å; R397-G399 VanDerWaalsContact C-N 3.32Å; R397-G399 PolarHBondContact O-N 3.36Å; G399-M401 PolarHBondContact O-N 3.21Å; G399-L402 PolarHBondContact O-N 3.06Å; G399-M403 WeakPolarHBondContact O-CB 3.28Å; G399-M403 VanDerWaalsContact O-CG 3.26Å; G399-M403 WeakPolarHBondContact O-CG 3.42Å; G399-M403 PolarHBondContact O-N 2.84Å
400	K	95.7	Very high	94.6	Very high	83 Å²	83	65.6 Å²	65.6	36%	0.361	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-31.8	175.3	-72.3	164.7	171	170.7	0	112.5	M343 D394 R396 R397 A398	M343-K400 HydrophobicContact CE-CB 3.91Å; D394-K400 IonicContact OD1-NZ 3.38Å; D394-K400 PolarHBondContact OD1-NZ 3.22Å; D394-K400 WeakPolarHBondContact OD2-CD 3.28Å; D394-K400 IonicContact OD2-NZ 3.94Å; D394-K400 PolarHBondContact OD2-NZ 3.41Å; R396-K400 WeakPolarHBondContact O-CG 3.23Å; R396-K400 PolarHBondContact O-N 2.95Å; R397-K400 WeakPolarHBondContact O-CB 3.41Å; R397-K400 PolarHBondContact O-N 2.87Å; R397-K400 VanDerWaalsContact O-N 3.07Å; A398-K400 PolarHBondContact O-N 3.01Å
401	M	95.8	Very high	94.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-77.8	-45.3	175.5	-65.3	171.7	-176.2	0	0	112.6	M343 E349 L353 L383 E387 R397 A398 G399 M403 T404	M343-M401 HydrophobicContact CE-CB 4.41Å; M343-M401 HydrophobicContact CE-CG 3.52Å; E349-M401 HydrophobicContact CB-CE 3.97Å; E349-M401 HydrophobicContact CB-SD 4.2Å; E349-M401 HydrophobicContact CG-CE 3.79Å; E349-M401 HydrophobicContact CG-SD 4.45Å; E349-M401 WeakPolarHBondContact OE1-CE 3.36Å; E349-M401 VanDerWaalsContact OE2-CE 3.29Å; E349-M401 WeakPolarHBondContact OE2-CE 3.49Å; L353-M401 HydrophobicContact CD1-CB 4.02Å; L353-M401 HydrophobicContact CD1-CG 4.25Å; L353-M401 HydrophobicContact CD1-SD 4.24Å; L353-M401 HydrophobicContact CD2-CB 3.91Å; L353-M401 HydrophobicContact CG-CB 4.43Å; L383-M401 HydrophobicContact CD1-SD 4.08Å; E387-M401 WeakPolarHBondContact OE1-CE 3.41Å; R397-M401 HydrophobicContact CG-CE 3.62Å; R397-M401 WeakPolarHBondContact O-CG 3.32Å; R397-M401 PolarHBondContact O-N 3.45Å; A398-M401 WeakPolarHBondContact O-CB 3.49Å; A398-M401 PolarHBondContact O-N 2.97Å; G399-M401 PolarHBondContact O-N 3.21Å; M401-M403 PolarHBondContact O-N 3.27Å; M401-M403 VanDerWaalsContact O-N 3.16Å; M401-T404 PolarHBondContact O-N 2.79Å; M401-T404 PolarHBondContact O-OG1 3.48Å
402	L	96.8	Very high	95.3	Very high	51 Å²	51	60.6 Å²	60.6	27%	0.267	31%	0.31	S	S	.	.	H	α-helix	trans	-58.3	-30.9	174.4	-64.6	175.6	0	0	0	111.4	I356 L383 A398 G399 T404 L405	I356-L402 HydrophobicContact CD1-CD2 4.16Å; I356-L402 HydrophobicContact CG2-CD2 4.01Å; L383-L402 HydrophobicContact CD2-CD2 4.25Å; L383-L402 HydrophobicContact CD2-CG 4.3Å; A398-L402 WeakPolarHBondContact O-CG 3.34Å; A398-L402 PolarHBondContact O-N 3.42Å; G399-L402 PolarHBondContact O-N 3.06Å; L402-T404 VanDerWaalsContact C-N 3.26Å; L402-T404 PolarHBondContact O-N 3.42Å; L402-L405 HydrophobicContact CD2-CD1 3.95Å; L402-L405 WeakPolarHBondContact O-CB 3.42Å; L402-L405 PolarHBondContact O-N 2.78Å
403	M	96.8	Very high	95.7	Very high	154 Å²	154	58.1 Å²	58.1	76%	0.759	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-3.9	172.3	-71.4	-178	77	0	0	115.7	G399 M401	G399-M403 WeakPolarHBondContact O-CB 3.28Å; G399-M403 VanDerWaalsContact O-CG 3.26Å; G399-M403 WeakPolarHBondContact O-CG 3.42Å; G399-M403 PolarHBondContact O-N 2.84Å; M401-M403 PolarHBondContact O-N 3.27Å; M401-M403 VanDerWaalsContact O-N 3.16Å
404	T	96.8	Very high	95.9	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.012	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-21.6	169.5	68.5	0	0	0	0	113	K339 Y340 M343 M401 L402 P406 L407 L408	K339-T404 HydrophobicContact CD-CG2 4.42Å; K339-T404 HydrophobicContact CG-CG2 3.88Å; Y340-T404 HydrophobicContact CE1-CG2 4.15Å; Y340-T404 VanDerWaalsContact CZ-OG1 3.26Å; Y340-T404 PolarHBondContact OH-OG1 2.81Å; M343-T404 HydrophobicContact SD-CG2 4.31Å; M401-T404 PolarHBondContact O-N 2.79Å; M401-T404 PolarHBondContact O-OG1 3.48Å; L402-T404 VanDerWaalsContact C-N 3.26Å; L402-T404 PolarHBondContact O-N 3.42Å; T404-P406 VanDerWaalsContact C-CD 3.43Å; T404-P406 VanDerWaalsContact C-N 3.32Å; T404-L407 WeakPolarHBondContact O-CB 3.46Å; T404-L407 PolarHBondContact O-N 2.78Å; T404-L408 PolarHBondContact O-N 3.33Å; T404-L408 VanDerWaalsContact O-N 3.09Å
405	L	97.1	Very high	96.2	Very high	13 Å²	13	53.5 Å²	53.5	7%	0.068	28%	0.279	C	S	.	.	H	α-helix	trans	-54.7	-36.8	-178.5	-60.2	174.6	0	0	0	113.7	L353 I356 A357 L402 L407 L408 R409	L353-L405 HydrophobicContact CD2-CD2 4.39Å; I356-L405 HydrophobicContact CG2-CD1 3.82Å; A357-L405 HydrophobicContact CB-CD2 4.47Å; L402-L405 HydrophobicContact CD2-CD1 3.95Å; L402-L405 WeakPolarHBondContact O-CB 3.42Å; L402-L405 PolarHBondContact O-N 2.78Å; L405-L407 VanDerWaalsContact C-N 3.34Å; L405-L407 PolarHBondContact O-N 3.25Å; L405-L408 HydrophobicContact CD2-CD2 4.15Å; L405-L408 WeakPolarHBondContact O-CB 3.28Å; L405-L408 PolarHBondContact O-N 3.35Å; L405-R409 WeakPolarHBondContact O-CB 3.25Å; L405-R409 PolarHBondContact O-N 3.2Å
406	P	96.6	Very high	96.5	Very high	89 Å²	89	48.3 Å²	48.3	58%	0.578	25%	0.246	S	C	*	.	H	α-helix	trans	-63.3	-34.4	174.6	-24.8	36.1	0	0	0	114.1	T404 Q410	T404-P406 VanDerWaalsContact C-CD 3.43Å; T404-P406 VanDerWaalsContact C-N 3.32Å; P406-Q410 WeakPolarHBondContact O-CB 3.36Å; P406-Q410 PolarHBondContact O-N 3.33Å
407	L	97.1	Very high	96.6	Very high	47 Å²	47	44.6 Å²	44.6	25%	0.246	24%	0.235	C	C	.	.	H	α-helix	trans	-74.9	-34.5	176.2	-177.7	62.1	0	0	0	111.2	L336 T404 L405 Q410 T411	L336-L407 HydrophobicContact CD2-CB 4.1Å; L336-L407 HydrophobicContact CD2-CD2 3.86Å; L336-L407 HydrophobicContact CD2-CG 3.73Å; L336-L407 HydrophobicContact CG-CD2 4.38Å; L336-L407 HydrophobicContact CG-CG 4.25Å; T404-L407 WeakPolarHBondContact O-CB 3.46Å; T404-L407 PolarHBondContact O-N 2.78Å; L405-L407 VanDerWaalsContact C-N 3.34Å; L405-L407 PolarHBondContact O-N 3.25Å; L407-Q410 PolarHBondContact O-N 3.31Å; L407-T411 WeakPolarHBondContact O-CB 3.47Å; L407-T411 PolarHBondContact O-N 2.95Å; L407-T411 PolarHBondContact O-OG1 3.37Å
408	L	97.9	Very high	96.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-50.9	172.1	178.4	65	0	0	0	111	E291 I294 L295 L336 A357 T404 L405 Q410 T411 S412	E291-L408 HydrophobicContact CB-CD1 4.33Å; E291-L408 HydrophobicContact CB-CD2 3.95Å; E291-L408 HydrophobicContact CB-CG 3.9Å; E291-L408 HydrophobicContact CG-CD2 4.49Å; E291-L408 HydrophobicContact CG-CG 4.08Å; I294-L408 HydrophobicContact CB-CD1 4.12Å; I294-L408 HydrophobicContact CG2-CD1 3.74Å; L295-L408 HydrophobicContact CD1-CD2 3.63Å; L295-L408 HydrophobicContact CD2-CD1 4.21Å; L295-L408 HydrophobicContact CD2-CD2 3.93Å; L295-L408 HydrophobicContact CG-CD1 3.9Å; L295-L408 HydrophobicContact CG-CD2 3.6Å; L295-L408 HydrophobicContact CG-CG 4.41Å; L336-L408 HydrophobicContact CD1-CD1 4.03Å; L336-L408 HydrophobicContact CD2-CB 4.39Å; A357-L408 HydrophobicContact CB-CD2 4.26Å; T404-L408 PolarHBondContact O-N 3.33Å; T404-L408 VanDerWaalsContact O-N 3.09Å; L405-L408 HydrophobicContact CD2-CD2 4.15Å; L405-L408 WeakPolarHBondContact O-CB 3.28Å; L405-L408 PolarHBondContact O-N 3.35Å; L408-Q410 VanDerWaalsContact C-N 3.34Å; L408-Q410 PolarHBondContact O-N 3.03Å; L408-T411 PolarHBondContact O-N 3.42Å; L408-S412 VanDerWaalsContact O-CB 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.4Å; L408-S412 PolarHBondContact O-N 3.49Å
409	R	96.5	Very high	96.6	Very high	32 Å²	32	45.6 Å²	45.6	12%	0.121	24%	0.238	C	C	.	.	H	α-helix	trans	-54.2	-46.6	173.9	179.7	60.3	50.4	71.3	0.3	111.6	E291 N360 D362 L405 S412 T413	E291-R409 IonicContact OE1-CZ 2.72Å; E291-R409 IonicContact OE1-NE 2.64Å; E291-R409 PolarHBondContact OE1-NE 3.41Å; E291-R409 IonicContact OE1-NH2 2.66Å; E291-R409 PolarHBondContact OE1-NH2 3.11Å; E291-R409 IonicContact OE2-CZ 2.69Å; E291-R409 IonicContact OE2-NE 2.67Å; E291-R409 PolarHBondContact OE2-NE 3.05Å; E291-R409 IonicContact OE2-NH2 3.1Å; E291-R409 PolarHBondContact OE2-NH2 2.83Å; E291-R409 VanDerWaalsContact OE2-NH2 3.11Å; N360-R409 PolarHBondContact O-NH2 3.17Å; D362-R409 IonicContact OD1-CZ 3.64Å; D362-R409 IonicContact OD1-NH1 2.77Å; D362-R409 PolarHBondContact OD1-NH1 3.39Å; D362-R409 IonicContact OD2-CZ 2.81Å; D362-R409 IonicContact OD2-NE 2.72Å; D362-R409 IonicContact OD2-NH1 3.47Å; D362-R409 PolarHBondContact OD2-NH1 3.29Å; L405-R409 WeakPolarHBondContact O-CB 3.25Å; L405-R409 PolarHBondContact O-N 3.2Å; R409-S412 PolarHBondContact O-N 3.13Å; R409-T413 PolarHBondContact O-N 3.21Å; R409-T413 PolarHBondContact O-OG1 3.06Å
410	Q	96.7	Very high	96.6	Very high	132 Å²	132	46.5 Å²	46.5	62%	0.617	23%	0.231	S	C	*	.	H	α-helix	trans	-61.3	-46	176.6	-173.9	179.4	20.1	0	0	112.7	P406 L407 L408 S412 T413 K414	P406-Q410 WeakPolarHBondContact O-CB 3.36Å; P406-Q410 PolarHBondContact O-N 3.33Å; L407-Q410 PolarHBondContact O-N 3.31Å; L408-Q410 VanDerWaalsContact C-N 3.34Å; L408-Q410 PolarHBondContact O-N 3.03Å; Q410-S412 VanDerWaalsContact C-N 3.34Å; Q410-T413 PolarHBondContact O-N 3Å; Q410-K414 PolarHBondContact O-N 3.05Å
411	T	98	Very high	96.6	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-36.9	179.7	-52.6	0	0	0	0	111.2	I294 L329 A332 I333 L336 L407 L408 K414 A415	I294-T411 HydrophobicContact CD1-CG2 4.24Å; I294-T411 HydrophobicContact CG2-CG2 4.47Å; L329-T411 HydrophobicContact CD1-CG2 4.5Å; A332-T411 HydrophobicContact CB-CG2 3.92Å; I333-T411 HydrophobicContact CG1-CG2 3.73Å; L336-T411 HydrophobicContact CD1-CG2 4.02Å; L407-T411 WeakPolarHBondContact O-CB 3.47Å; L407-T411 PolarHBondContact O-N 2.95Å; L407-T411 PolarHBondContact O-OG1 3.37Å; L408-T411 PolarHBondContact O-N 3.42Å; T411-K414 PolarHBondContact O-N 3.36Å; T411-A415 WeakPolarHBondContact O-CB 3.49Å; T411-A415 PolarHBondContact O-N 2.96Å
412	S	97	Very high	96.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-47.6	172.5	168.5	0	0	0	0	112.5	M290 E291 I294 L408 R409 Q410 K414 A415 V416	M290-S412 WeakPolarHBondContact CB-OG 3.49Å; E291-S412 VanDerWaalsContact CG-CB 3.43Å; E291-S412 WeakPolarHBondContact CG-OG 3.35Å; I294-S412 VanDerWaalsContact CD1-CA 3.48Å; L408-S412 VanDerWaalsContact O-CB 3.31Å; L408-S412 WeakPolarHBondContact O-CB 3.4Å; L408-S412 PolarHBondContact O-N 3.49Å; R409-S412 PolarHBondContact O-N 3.13Å; Q410-S412 VanDerWaalsContact C-N 3.34Å; S412-K414 VanDerWaalsContact C-N 3.3Å; S412-K414 PolarHBondContact O-N 2.9Å; S412-A415 PolarHBondContact O-N 3.08Å; S412-A415 VanDerWaalsContact O-N 3.17Å; S412-V416 WeakPolarHBondContact O-CG2 3.48Å; S412-V416 PolarHBondContact O-N 3.07Å
413	T	95.9	Very high	96.4	Very high	85 Å²	85	46.6 Å²	46.6	52%	0.521	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-40.2	174.4	-61.2	0	0	0	0	111.6	R409 Q410 Q417	R409-T413 PolarHBondContact O-N 3.21Å; R409-T413 PolarHBondContact O-OG1 3.06Å; Q410-T413 PolarHBondContact O-N 3Å; T413-Q417 PolarHBondContact O-N 2.98Å; T413-Q417 VanDerWaalsContact O-N 3.11Å
414	K	96.7	Very high	96.4	Very high	66 Å²	66	45.1 Å²	45.1	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-62.2	-45.8	174	-174.3	171.2	-174.9	175.3	0	111.5	D328 A332 Q410 T411 S412 Q417 H418	D328-K414 WeakPolarHBondContact O-CE 3.37Å; D328-K414 PolarHBondContact O-NZ 3.29Å; D328-K414 IonicContact OD2-NZ 2.69Å; D328-K414 PolarHBondContact OD2-NZ 3.42Å; A332-K414 HydrophobicContact CB-CD 4.29Å; Q410-K414 PolarHBondContact O-N 3.05Å; T411-K414 PolarHBondContact O-N 3.36Å; S412-K414 VanDerWaalsContact C-N 3.3Å; S412-K414 PolarHBondContact O-N 2.9Å; K414-Q417 PolarHBondContact O-N 3.4Å; K414-H418 WeakPolarHBondContact CE-NE2 3.08Å; K414-H418 PolarHBondContact O-CD2 2.93Å; K414-H418 PolarHBondContact O-N 3.43Å
415	A	97.5	Very high	96.3	Very high	2 Å²	2	50.4 Å²	50.4	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-47.6	179	0	0	0	0	0	112.5	M290 I294 L329 T411 S412 Q417 H418 F419	M290-A415 HydrophobicContact CE-CB 3.94Å; M290-A415 HydrophobicContact CG-CB 3.83Å; M290-A415 HydrophobicContact SD-CB 3.65Å; I294-A415 HydrophobicContact CD1-CB 3.88Å; L329-A415 HydrophobicContact CD1-CB 3.8Å; L329-A415 HydrophobicContact CD2-CB 4.1Å; T411-A415 WeakPolarHBondContact O-CB 3.49Å; T411-A415 PolarHBondContact O-N 2.96Å; S412-A415 PolarHBondContact O-N 3.08Å; S412-A415 VanDerWaalsContact O-N 3.17Å; A415-Q417 VanDerWaalsContact C-N 3.31Å; A415-Q417 PolarHBondContact O-N 2.91Å; A415-H418 PolarHBondContact O-N 3.32Å; A415-F419 WeakPolarHBondContact O-CD2 3.44Å; A415-F419 PolarHBondContact O-N 3.11Å
416	V	97	Very high	96.1	Very high	9 Å²	9	52.9 Å²	52.9	6%	0.055	28%	0.281	C	S	.	.	H	α-helix	trans	-55	-47.4	174.5	169.5	0	0	0	0	110.6	W289 M290 S412 H418 F419 Y420 L438 K441 V442	W289-V416 HydrophobicContact CZ2-CG2 4.36Å; M290-V416 HydrophobicContact CB-CG2 3.99Å; M290-V416 HydrophobicContact CE-CG2 4.13Å; M290-V416 HydrophobicContact CG-CG2 4.01Å; S412-V416 WeakPolarHBondContact O-CG2 3.48Å; S412-V416 PolarHBondContact O-N 3.07Å; V416-H418 PolarHBondContact O-N 3.43Å; V416-F419 PolarHBondContact O-N 3.34Å; V416-Y420 VanDerWaalsContact O-CB 3.28Å; V416-Y420 WeakPolarHBondContact O-CB 3.49Å; V416-Y420 PolarHBondContact O-N 3.34Å; V416-L438 HydrophobicContact CG1-CD2 4.26Å; V416-K441 HydrophobicContact CG1-CB 3.9Å; V416-K441 HydrophobicContact CG2-CG 4.45Å; V416-V442 HydrophobicContact CG1-CG2 3.96Å
417	Q	95.9	Very high	95.9	Very high	91 Å²	91	54.2 Å²	54.2	43%	0.425	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-39.4	-179.7	-170.6	65.7	68	0	0	112.6	T413 K414 A415 N421	T413-Q417 PolarHBondContact O-N 2.98Å; T413-Q417 VanDerWaalsContact O-N 3.11Å; K414-Q417 PolarHBondContact O-N 3.4Å; A415-Q417 VanDerWaalsContact C-N 3.31Å; A415-Q417 PolarHBondContact O-N 2.91Å; Q417-N421 PolarHBondContact NE2-OD1 2.75Å; Q417-N421 WeakPolarHBondContact O-CB 3.46Å; Q417-N421 PolarHBondContact O-N 2.72Å; Q417-N421 PolarHBondContact O-OD1 3.1Å
418	H	94.9	Very high	95.7	Very high	42 Å²	42	52.5 Å²	52.5	19%	0.194	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-50.3	174.9	-77.3	-74.1	0	0	0	111.7	K414 A415 V416 Y420 N421 I422	K414-H418 WeakPolarHBondContact CE-NE2 3.08Å; K414-H418 PolarHBondContact O-CD2 2.93Å; K414-H418 PolarHBondContact O-N 3.43Å; A415-H418 PolarHBondContact O-N 3.32Å; V416-H418 PolarHBondContact O-N 3.43Å; H418-Y420 VanDerWaalsContact C-N 3.34Å; H418-Y420 PolarHBondContact O-N 3.22Å; H418-N421 PolarHBondContact O-N 2.78Å; H418-I422 WeakPolarHBondContact O-CD1 3.39Å; H418-I422 VanDerWaalsContact O-CG1 3.32Å; H418-I422 WeakPolarHBondContact O-CG1 3.17Å; H418-I422 PolarHBondContact O-N 3.01Å
419	F	96.3	Very high	95.5	Very high	18 Å²	18	56.3 Å²	56.3	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-33.8	179.3	-76.3	-71.3	0	0	0	112.9	L252 M290 A415 V416 I422 K423 F434 L438	L252-F419 HydrophobicContact CB-CZ 4.41Å; M290-F419 HydrophobicContact CE-CD2 3.87Å; M290-F419 HydrophobicContact CE-CE2 4.38Å; A415-F419 WeakPolarHBondContact O-CD2 3.44Å; A415-F419 PolarHBondContact O-N 3.11Å; V416-F419 PolarHBondContact O-N 3.34Å; F419-I422 HydrophobicContact CD1-CD1 4.2Å; F419-I422 PolarHBondContact O-N 3.39Å; F419-K423 WeakPolarHBondContact O-CB 3.49Å; F419-K423 PolarHBondContact O-N 2.83Å; F419-F434 HydrophobicContact CB-CE1 4.37Å; F419-F434 HydrophobicContact CB-CZ 4.08Å; F419-F434 HydrophobicContact CD1-CE1 4.08Å; F419-F434 AromaticContact CD1-CZ 3.77Å; F419-F434 HydrophobicContact CD1-CZ 3.77Å; F419-F434 HydrophobicContact CD2-CZ 4.3Å; F419-F434 HydrophobicContact CE1-CZ 4.27Å; F419-F434 HydrophobicContact CG-CE1 4.35Å; F419-F434 AromaticContact CG-CZ 3.8Å; F419-F434 HydrophobicContact CG-CZ 3.8Å; F419-L438 HydrophobicContact CB-CD1 4.17Å; F419-L438 HydrophobicContact CB-CD2 3.88Å
420	Y	96	Very high	95.4	Very high	55 Å²	55	56.2 Å²	56.2	22%	0.216	30%	0.295	C	S	.	.	H	α-helix	trans	-65.5	-38.8	172.3	-167.7	-86.2	0	0	0	112	V416 H418 K423 L424 V442	V416-Y420 VanDerWaalsContact O-CB 3.28Å; V416-Y420 WeakPolarHBondContact O-CB 3.49Å; V416-Y420 PolarHBondContact O-N 3.34Å; H418-Y420 VanDerWaalsContact C-N 3.34Å; H418-Y420 PolarHBondContact O-N 3.22Å; Y420-K423 WeakPolarHBondContact O-CB 3.45Å; Y420-K423 PolarHBondContact O-N 3.33Å; Y420-L424 HydrophobicContact CD1-CD1 3.98Å; Y420-L424 HydrophobicContact CD1-CG 4.14Å; Y420-L424 HydrophobicContact CE1-CD1 3.78Å; Y420-L424 HydrophobicContact CE1-CD2 4.22Å; Y420-L424 HydrophobicContact CE1-CG 3.98Å; Y420-L424 WeakPolarHBondContact O-CG 3.47Å; Y420-L424 PolarHBondContact O-N 2.96Å; Y420-V442 HydrophobicContact CD1-CG1 4.44Å; Y420-V442 HydrophobicContact CD2-CB 3.93Å; Y420-V442 HydrophobicContact CD2-CG1 4.2Å; Y420-V442 HydrophobicContact CD2-CG2 3.59Å; Y420-V442 HydrophobicContact CE1-CG1 4.05Å; Y420-V442 HydrophobicContact CE2-CB 3.67Å; Y420-V442 HydrophobicContact CE2-CG1 3.78Å; Y420-V442 HydrophobicContact CE2-CG2 3.9Å; Y420-V442 HydrophobicContact CG-CG2 4.03Å
421	N	94.9	Very high	95.4	Very high	68 Å²	68	54.6 Å²	54.6	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-64.3	-44.2	173.4	-67.3	-4.1	0	0	0	111.3	Q417 H418 K423 L424 E425	Q417-N421 PolarHBondContact NE2-OD1 2.75Å; Q417-N421 WeakPolarHBondContact O-CB 3.46Å; Q417-N421 PolarHBondContact O-N 2.72Å; Q417-N421 PolarHBondContact O-OD1 3.1Å; H418-N421 PolarHBondContact O-N 2.78Å; N421-K423 VanDerWaalsContact C-N 3.29Å; N421-K423 PolarHBondContact O-N 3.5Å; N421-L424 WeakPolarHBondContact O-CB 3.3Å; N421-L424 PolarHBondContact O-N 3.39Å; N421-L424 VanDerWaalsContact O-N 3.08Å; N421-E425 PolarHBondContact O-N 3.41Å
422	I	94.4	Very high	95.3	Very high	19 Å²	19	61.2 Å²	61.2	10%	0.097	32%	0.316	C	S	.	.	H	α-helix	trans	-60.8	-39.3	176.6	-65.5	158.6	0	0	0	111.1	L249 H418 F419 E425 G426 V428 M430	L249-I422 HydrophobicContact CD1-CD1 3.9Å; L249-I422 HydrophobicContact CD1-CG1 4.15Å; L249-I422 HydrophobicContact CD1-CG2 4.17Å; L249-I422 HydrophobicContact CD2-CD1 3.76Å; L249-I422 HydrophobicContact CG-CD1 4.4Å; H418-I422 WeakPolarHBondContact O-CD1 3.39Å; H418-I422 VanDerWaalsContact O-CG1 3.32Å; H418-I422 WeakPolarHBondContact O-CG1 3.17Å; H418-I422 PolarHBondContact O-N 3.01Å; F419-I422 HydrophobicContact CD1-CD1 4.2Å; F419-I422 PolarHBondContact O-N 3.39Å; I422-E425 PolarHBondContact O-N 2.89Å; I422-G426 PolarHBondContact O-N 3.39Å; I422-V428 HydrophobicContact CG2-CB 3.81Å; I422-V428 HydrophobicContact CG2-CG1 4.47Å; I422-V428 HydrophobicContact CG2-CG2 3.67Å; I422-M430 HydrophobicContact CB-CE 4.08Å; I422-M430 HydrophobicContact CG2-CE 3.71Å
423	K	95.1	Very high	95.2	Very high	49 Å²	49	63.1 Å²	63.1	21%	0.213	33%	0.326	C	S	.	.	H	α-helix	trans	-58.9	-46.1	171.6	174	-168.8	173.1	179.7	0	111.8	F419 Y420 N421 E425 G426 M430 L435 E439	F419-K423 WeakPolarHBondContact O-CB 3.49Å; F419-K423 PolarHBondContact O-N 2.83Å; Y420-K423 WeakPolarHBondContact O-CB 3.45Å; Y420-K423 PolarHBondContact O-N 3.33Å; N421-K423 VanDerWaalsContact C-N 3.29Å; N421-K423 PolarHBondContact O-N 3.5Å; K423-E425 VanDerWaalsContact C-N 3.26Å; K423-E425 PolarHBondContact O-N 2.65Å; K423-G426 PolarHBondContact O-N 2.89Å; K423-G426 VanDerWaalsContact O-N 3.11Å; K423-M430 HydrophobicContact CB-CE 4.09Å; K423-M430 HydrophobicContact CB-SD 3.88Å; K423-M430 HydrophobicContact CG-SD 4.44Å; K423-L435 HydrophobicContact CD-CD2 3.65Å; K423-L435 HydrophobicContact CG-CD2 3.81Å; K423-E439 VanDerWaalsContact NZ-CD 3.32Å; K423-E439 IonicContact NZ-OE1 3.27Å; K423-E439 PolarHBondContact NZ-OE1 2.77Å
424	L	95.3	Very high	95.2	Very high	122 Å²	122	59.1 Å²	59.1	64%	0.639	30%	0.301	S	S	*	.	H	α-helix	trans	-64.2	-28.9	178.1	-69.7	178.7	0	0	0	113	Y420 N421 G426	Y420-L424 HydrophobicContact CD1-CD1 3.98Å; Y420-L424 HydrophobicContact CD1-CG 4.14Å; Y420-L424 HydrophobicContact CE1-CD1 3.78Å; Y420-L424 HydrophobicContact CE1-CD2 4.22Å; Y420-L424 HydrophobicContact CE1-CG 3.98Å; Y420-L424 WeakPolarHBondContact O-CG 3.47Å; Y420-L424 PolarHBondContact O-N 2.96Å; N421-L424 WeakPolarHBondContact O-CB 3.3Å; N421-L424 PolarHBondContact O-N 3.39Å; N421-L424 VanDerWaalsContact O-N 3.08Å; L424-G426 VanDerWaalsContact C-N 3.31Å
425	E	94.6	Very high	95.2	Very high	114 Å²	114	58.2 Å²	58.2	53%	0.533	30%	0.299	S	S	.	.	H	α-helix	trans	-73.2	-20.8	173.9	-69.5	-174.2	-147.2	0	0	113.5	N421 I422 K423 K427	N421-E425 PolarHBondContact O-N 3.41Å; I422-E425 PolarHBondContact O-N 2.89Å; K423-E425 VanDerWaalsContact C-N 3.26Å; K423-E425 PolarHBondContact O-N 2.65Å; E425-K427 HydrophobicContact CB-CD 4.33Å; E425-K427 HydrophobicContact CB-CG 4.3Å; E425-K427 PolarHBondContact O-N 3.17Å; E425-K427 VanDerWaalsContact O-N 3.09Å; E425-K427 WeakPolarHBondContact OE2-CD 3.45Å; E425-K427 WeakPolarHBondContact OE2-CE 3.32Å; E425-K427 IonicContact OE2-NZ 3.22Å; E425-K427 PolarHBondContact OE2-NZ 2.97Å
426	G	93.7	Very high	95.1	Very high	64 Å²	64	62.4 Å²	62.4	66%	0.66	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	8.4	174.8	0	0	0	0	0	116	I422 K423 L424	I422-G426 PolarHBondContact O-N 3.39Å; K423-G426 PolarHBondContact O-N 2.89Å; K423-G426 VanDerWaalsContact O-N 3.11Å; L424-G426 VanDerWaalsContact C-N 3.31Å
427	K	91.6	Very high	95	Very high	117 Å²	117	62.5 Å²	62.5	51%	0.509	32%	0.318	S	S	.	.			trans	-78.5	-29.4	-177.2	-63.9	171.5	-178.2	166.5	0	114.1	E425	E425-K427 HydrophobicContact CB-CD 4.33Å; E425-K427 HydrophobicContact CB-CG 4.3Å; E425-K427 PolarHBondContact O-N 3.17Å; E425-K427 VanDerWaalsContact O-N 3.09Å; E425-K427 WeakPolarHBondContact OE2-CD 3.45Å; E425-K427 WeakPolarHBondContact OE2-CE 3.32Å; E425-K427 IonicContact OE2-NZ 3.22Å; E425-K427 PolarHBondContact OE2-NZ 2.97Å
428	V	94.6	Very high	95	Very high	12 Å²	12	58.2 Å²	58.2	7%	0.073	30%	0.298	C	S	.	.	S	Bend	trans	-110	124.4	-170.6	177.5	0	0	0	0	108.1	L249 I422	L249-V428 HydrophobicContact CB-CG1 4.09Å; L249-V428 HydrophobicContact CB-CG2 3.75Å; L249-V428 HydrophobicContact CD1-CG2 4.08Å; I422-V428 HydrophobicContact CG2-CB 3.81Å; I422-V428 HydrophobicContact CG2-CG1 4.47Å; I422-V428 HydrophobicContact CG2-CG2 3.67Å
429	P	93.2	Very high	94.9	Very high	80 Å²	80	61.4 Å²	61.4	52%	0.519	31%	0.313	S	S	.	.			trans	-64	140.7	172.9	29.3	-34.3	0	0	0	109.6	T250	T250-P429 HydrophobicContact CG2-CG 3.93Å
430	M	94.9	Very high	94.5	Very high	29 Å²	29	62.6 Å²	62.6	14%	0.143	33%	0.326	C	S	.	.			trans	-133.4	135.5	176.3	-68.2	-177	-176.4	0	0	109.3	C253 I422 K423 F434 L435 L438	C253-M430 HydrophobicContact CB-CG 4.32Å; I422-M430 HydrophobicContact CB-CE 4.08Å; I422-M430 HydrophobicContact CG2-CE 3.71Å; K423-M430 HydrophobicContact CB-CE 4.09Å; K423-M430 HydrophobicContact CB-SD 3.88Å; K423-M430 HydrophobicContact CG-SD 4.44Å; M430-F434 HydrophobicContact CB-CD1 4.25Å; M430-F434 HydrophobicContact CE-CE1 4.29Å; M430-F434 HydrophobicContact CG-CD1 4.14Å; M430-F434 HydrophobicContact CG-CE1 4.34Å; M430-F434 HydrophobicContact SD-CD1 3.95Å; M430-F434 HydrophobicContact SD-CE1 3.88Å; M430-L435 HydrophobicContact CB-CD1 4.14Å; M430-L435 HydrophobicContact CB-CD2 3.76Å; M430-L435 HydrophobicContact CB-CG 3.74Å; M430-L435 HydrophobicContact CG-CD2 4.41Å; M430-L435 WeakPolarHBondContact O-CD1 3.4Å; M430-L435 HydrophobicContact SD-CD2 3.82Å; M430-L438 HydrophobicContact SD-CD1 4.08Å
431	H	95.3	Very high	93.9	Very high	98 Å²	98	63.1 Å²	63.1	45%	0.454	33%	0.33	S	S	.	.			trans	-69.9	155.2	176.2	-78.4	-80.8	0	0	0	111.9	D254 D257 L433 F434 L435	D254-H431 IonicContact OD1-CD2 2.62Å; D254-H431 PolarHBondContact OD1-CD2 3.41Å; D254-H431 IonicContact OD1-NE2 3.9Å; D257-H431 HydrophobicContact CB-CB 3.84Å; D257-H431 WeakPolarHBondContact OD1-CB 3.47Å; D257-H431 IonicContact OD2-CG 3.39Å; H431-L433 VanDerWaalsContact C-N 3.35Å; H431-L433 PolarHBondContact O-N 3.37Å; H431-F434 PolarHBondContact O-N 3.38Å; H431-L435 WeakPolarHBondContact O-CG 3.29Å; H431-L435 PolarHBondContact O-N 3.36Å
432	K	95.7	Very high	93	Very high	145 Å²	145	65.2 Å²	65.2	63%	0.63	35%	0.345	S	S	*	.	H	α-helix	trans	-59.8	-41.5	-170.4	-180	-178.2	170.3	-164	0	112.7	L435 E436	K432-L435 PolarHBondContact O-N 2.99Å; K432-E436 WeakPolarHBondContact CE-OE1 3.3Å; K432-E436 WeakPolarHBondContact CE-OE2 3.43Å; K432-E436 HydrophobicContact CG-CG 4.49Å; K432-E436 IonicContact NZ-OE1 2.64Å; K432-E436 PolarHBondContact NZ-OE1 3.36Å; K432-E436 IonicContact NZ-OE2 2.85Å; K432-E436 PolarHBondContact O-N 3.45Å
433	L	96	Very high	93	Very high	40 Å²	40	67.5 Å²	67.5	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-68.3	-46	-177	171.4	65.5	0	0	0	110.7	D257 L260 V261 I264 H431 L435 E436 M437	D257-L433 WeakPolarHBondContact OD1-CB 3.41Å; D257-L433 PolarHBondContact OD1-N 3.21Å; L260-L433 HydrophobicContact CB-CD2 3.95Å; L260-L433 HydrophobicContact CB-CG 4.4Å; L260-L433 HydrophobicContact CD1-CG 4.43Å; V261-L433 HydrophobicContact CG2-CD2 3.62Å; I264-L433 HydrophobicContact CD1-CD1 3.98Å; I264-L433 HydrophobicContact CD1-CD2 3.97Å; H431-L433 VanDerWaalsContact C-N 3.35Å; H431-L433 PolarHBondContact O-N 3.37Å; L433-L435 VanDerWaalsContact C-N 3.27Å; L433-L435 PolarHBondContact O-N 3.03Å; L433-E436 PolarHBondContact O-N 3.08Å; L433-M437 HydrophobicContact CD1-CG 3.96Å; L433-M437 HydrophobicContact CG-CG 4.42Å; L433-M437 WeakPolarHBondContact O-CB 3.36Å; L433-M437 VanDerWaalsContact O-CG 3.23Å; L433-M437 WeakPolarHBondContact O-CG 3.5Å; L433-M437 PolarHBondContact O-N 2.75Å
434	F	96.1	Very high	92.8	Very high	1 Å²	1	68.5 Å²	68.5	0%	0.004	37%	0.365	C	S	.	.	H	α-helix	trans	-56.5	-40.3	173	-172.2	-111.2	0	0	0	112.3	C253 A256 D257 L260 W289 F419 M430 H431 M437 L438	C253-F434 HydrophobicContact CB-CD1 4.45Å; C253-F434 HydrophobicContact CB-CE1 4.22Å; A256-F434 HydrophobicContact CB-CD2 3.79Å; A256-F434 HydrophobicContact CB-CE2 3.5Å; A256-F434 HydrophobicContact CB-CZ 4.29Å; D257-F434 HydrophobicContact CB-CB 4.18Å; D257-F434 WeakPolarHBondContact OD1-CB 3.43Å; D257-F434 PolarHBondContact OD1-N 2.93Å; L260-F434 HydrophobicContact CD1-CB 4.24Å; L260-F434 HydrophobicContact CD1-CD2 3.86Å; W289-F434 HydrophobicContact CH2-CD2 4.08Å; W289-F434 AromaticContact CH2-CE2 3.74Å; W289-F434 HydrophobicContact CH2-CE2 3.74Å; W289-F434 HydrophobicContact CZ3-CD2 4.02Å; W289-F434 AromaticContact CZ3-CE2 3.71Å; W289-F434 HydrophobicContact CZ3-CE2 3.71Å; F419-F434 HydrophobicContact CB-CE1 4.37Å; F419-F434 HydrophobicContact CB-CZ 4.08Å; F419-F434 HydrophobicContact CD1-CE1 4.08Å; F419-F434 AromaticContact CD1-CZ 3.77Å; F419-F434 HydrophobicContact CD1-CZ 3.77Å; F419-F434 HydrophobicContact CD2-CZ 4.3Å; F419-F434 HydrophobicContact CE1-CZ 4.27Å; F419-F434 HydrophobicContact CG-CE1 4.35Å; F419-F434 AromaticContact CG-CZ 3.8Å; F419-F434 HydrophobicContact CG-CZ 3.8Å; M430-F434 HydrophobicContact CB-CD1 4.25Å; M430-F434 HydrophobicContact CE-CE1 4.29Å; M430-F434 HydrophobicContact CG-CD1 4.14Å; M430-F434 HydrophobicContact CG-CE1 4.34Å; M430-F434 HydrophobicContact SD-CD1 3.95Å; M430-F434 HydrophobicContact SD-CE1 3.88Å; H431-F434 PolarHBondContact O-N 3.38Å; F434-M437 PolarHBondContact O-N 3.28Å; F434-L438 HydrophobicContact CD1-CD1 3.85Å; F434-L438 HydrophobicContact CE1-CD1 3.63Å; F434-L438 HydrophobicContact CE1-CG 4.44Å; F434-L438 HydrophobicContact CZ-CD1 4.15Å; F434-L438 WeakPolarHBondContact O-CG 2.78Å; F434-L438 PolarHBondContact O-N 3.34Å
435	L	96	Very high	92.7	Very high	48 Å²	48	65.5 Å²	65.5	25%	0.251	35%	0.349	S	S	.	.	H	α-helix	trans	-63.9	-46.6	174.2	-71.9	171.9	0	0	0	113.1	K423 M430 H431 K432 L433 M437 L438 E439	K423-L435 HydrophobicContact CD-CD2 3.65Å; K423-L435 HydrophobicContact CG-CD2 3.81Å; M430-L435 HydrophobicContact CB-CD1 4.14Å; M430-L435 HydrophobicContact CB-CD2 3.76Å; M430-L435 HydrophobicContact CB-CG 3.74Å; M430-L435 HydrophobicContact CG-CD2 4.41Å; M430-L435 WeakPolarHBondContact O-CD1 3.4Å; M430-L435 HydrophobicContact SD-CD2 3.82Å; H431-L435 WeakPolarHBondContact O-CG 3.29Å; H431-L435 PolarHBondContact O-N 3.36Å; K432-L435 PolarHBondContact O-N 2.99Å; L433-L435 VanDerWaalsContact C-N 3.27Å; L433-L435 PolarHBondContact O-N 3.03Å; L435-M437 VanDerWaalsContact C-N 3.3Å; L435-M437 PolarHBondContact O-N 2.62Å; L435-L438 PolarHBondContact O-N 2.85Å; L435-E439 WeakPolarHBondContact O-CG 3.15Å; L435-E439 PolarHBondContact O-N 2.64Å
436	E	95.5	Very high	92.6	Very high	90 Å²	90	62.6 Å²	62.6	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-35.8	176.6	-75.1	177.5	151.5	0	0	111.7	K432 L433 E439 A440	K432-E436 WeakPolarHBondContact CE-OE1 3.3Å; K432-E436 WeakPolarHBondContact CE-OE2 3.43Å; K432-E436 HydrophobicContact CG-CG 4.49Å; K432-E436 IonicContact NZ-OE1 2.64Å; K432-E436 PolarHBondContact NZ-OE1 3.36Å; K432-E436 IonicContact NZ-OE2 2.85Å; K432-E436 PolarHBondContact O-N 3.45Å; L433-E436 PolarHBondContact O-N 3.08Å; E436-E439 PolarHBondContact O-N 3.09Å; E436-A440 WeakPolarHBondContact O-CB 3.49Å; E436-A440 PolarHBondContact O-N 3.06Å
437	M	95.3	Very high	92.5	Very high	11 Å²	11	62.6 Å²	62.6	5%	0.054	32%	0.319	C	S	.	.	H	α-helix	trans	-76.6	-27.5	178.6	-63.9	-64.2	-78.5	0	0	113.2	L260 Q286 W289 L433 F434 L435	L260-M437 HydrophobicContact CD1-CB 4.17Å; L260-M437 HydrophobicContact CD1-CG 4.09Å; L260-M437 HydrophobicContact CD2-CE 4.06Å; L260-M437 HydrophobicContact CD2-CG 4.22Å; Q286-M437 HydrophobicContact CG-CE 4.33Å; Q286-M437 HydrophobicContact CG-SD 3.95Å; W289-M437 HydrophobicContact CB-CE 3.68Å; W289-M437 HydrophobicContact CD2-CB 4.15Å; W289-M437 HydrophobicContact CG-CB 4.43Å; W289-M437 HydrophobicContact CG-CE 3.69Å; W289-M437 HydrophobicContact CZ2-CB 4.01Å; W289-M437 WeakPolarHBondContact CZ2-O 3.39Å; W289-M437 PolarHBondContact NE1-O 3.32Å; L433-M437 HydrophobicContact CD1-CG 3.96Å; L433-M437 HydrophobicContact CG-CG 4.42Å; L433-M437 WeakPolarHBondContact O-CB 3.36Å; L433-M437 VanDerWaalsContact O-CG 3.23Å; L433-M437 WeakPolarHBondContact O-CG 3.5Å; L433-M437 PolarHBondContact O-N 2.75Å; F434-M437 PolarHBondContact O-N 3.28Å; L435-M437 VanDerWaalsContact C-N 3.3Å; L435-M437 PolarHBondContact O-N 2.62Å
438	L	95	Very high	92.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-72	-38.8	167.1	-75.2	170.4	0	0	0	112.1	W289 V416 F419 M430 F434 L435 K441	W289-L438 HydrophobicContact CH2-CD2 3.86Å; W289-L438 HydrophobicContact CH2-CG 4.1Å; W289-L438 HydrophobicContact CZ2-CD2 3.91Å; W289-L438 HydrophobicContact CZ2-CG 4.15Å; V416-L438 HydrophobicContact CG1-CD2 4.26Å; F419-L438 HydrophobicContact CB-CD1 4.17Å; F419-L438 HydrophobicContact CB-CD2 3.88Å; M430-L438 HydrophobicContact SD-CD1 4.08Å; F434-L438 HydrophobicContact CD1-CD1 3.85Å; F434-L438 HydrophobicContact CE1-CD1 3.63Å; F434-L438 HydrophobicContact CE1-CG 4.44Å; F434-L438 HydrophobicContact CZ-CD1 4.15Å; F434-L438 WeakPolarHBondContact O-CG 2.78Å; F434-L438 PolarHBondContact O-N 3.34Å; L435-L438 PolarHBondContact O-N 2.85Å; L438-K441 PolarHBondContact O-N 3.38Å
439	E	92.6	Very high	92.4	Very high	109 Å²	109	62.3 Å²	62.3	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-69	-33.7	177.5	-74.3	175.8	-178.3	0	0	112.8	K423 L435 E436 K441	K423-E439 VanDerWaalsContact NZ-CD 3.32Å; K423-E439 IonicContact NZ-OE1 3.27Å; K423-E439 PolarHBondContact NZ-OE1 2.77Å; L435-E439 WeakPolarHBondContact O-CG 3.15Å; L435-E439 PolarHBondContact O-N 2.64Å; E436-E439 PolarHBondContact O-N 3.09Å; E439-K441 PolarHBondContact O-N 3.08Å
440	A	89.1	Confident	92.4	Very high	43 Å²	43	60.9 Å²	60.9	36%	0.355	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	3.3	174.4	0	0	0	0	0	114.6	Q286 E436	Q286-A440 HydrophobicContact CB-CB 3.95Å; Q286-A440 HydrophobicContact CG-CB 3.75Å; E436-A440 WeakPolarHBondContact O-CB 3.49Å; E436-A440 PolarHBondContact O-N 3.06Å
441	K	82.4	Confident	92.2	Very high	66 Å²	66	63.6 Å²	63.6	29%	0.287	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-5.5	-171.6	-91	-64.5	-159.2	174.9	0	115.5	Q286 S287 V416 L438 E439	Q286-K441 VanDerWaalsContact O-CE 3.24Å; Q286-K441 WeakPolarHBondContact O-CE 3.46Å; S287-K441 WeakPolarHBondContact O-CE 3.32Å; S287-K441 PolarHBondContact O-NZ 3.11Å; V416-K441 HydrophobicContact CG1-CB 3.9Å; V416-K441 HydrophobicContact CG2-CG 4.45Å; L438-K441 PolarHBondContact O-N 3.38Å; E439-K441 PolarHBondContact O-N 3.08Å
442	V	77.1	Confident	91.9	Very high	112 Å²	112	60.5 Å²	60.5	68%	0.679	31%	0.309	S	S	*	.			trans	-134.3	0	-173.2	-178	0	0	0	0	111.2	V416 Y420	V416-V442 HydrophobicContact CG1-CG2 3.96Å; Y420-V442 HydrophobicContact CD1-CG1 4.44Å; Y420-V442 HydrophobicContact CD2-CB 3.93Å; Y420-V442 HydrophobicContact CD2-CG1 4.2Å; Y420-V442 HydrophobicContact CD2-CG2 3.59Å; Y420-V442 HydrophobicContact CE1-CG1 4.05Å; Y420-V442 HydrophobicContact CE2-CB 3.67Å; Y420-V442 HydrophobicContact CE2-CG1 3.78Å; Y420-V442 HydrophobicContact CE2-CG2 3.9Å; Y420-V442 HydrophobicContact CG-CG2 4.03Å

Retrieved 442 of 442 residues in 77.2 ms (Link to these results)

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