A0A096NEC2_PAPAN Loading...

Estrogen related receptor gamma AlphaSync

AlphaFold DB (P62508-3), UniProt , Accession A0A096NEC2, Species PAPAN (Papio anubis, Olive baboon), Gene ESRRG, Length 442 aa.

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(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 291.1 ms (Link to these results)

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