A0A096NQH3_PAPAN Loading...

Germ cell-less 1, spermatosis associated

AlphaFold DB , UniProt , Accession A0A096NQH3, Species PAPAN (Papio anubis, Olive baboon), Gene GMCL1, Length 515 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	30.3	Very low	256 Å²	256	157.5 Å²	157.5	100%	1.261	83%	0.834	S	S	*	*				0	130.1	0	-51.5	172.6	-170.3	0	0	106.9
2	G	34.2	Very low	30.6	Very low	73 Å²	73	153.9 Å²	153.9	75%	0.753	83%	0.826	S	S	*	*			cis	-146.9	136.4	-21.8	0	0	0	0	0	106.2
3	S	29.4	Very low	30.4	Very low	106 Å²	106	160.6 Å²	160.6	74%	0.741	83%	0.833	S	S	*	*				96.9	100.6	90.5	-178.3	0	0	0	0	113.9
4	L	29.2	Very low	30.4	Very low	155 Å²	155	166.1 Å²	166.1	81%	0.812	84%	0.837	S	S	*	*			trans	64.6	118.5	142.6	-58.6	170.9	0	0	0	118.1
5	S	29.6	Very low	30.2	Very low	102 Å²	102	162 Å²	162	71%	0.713	84%	0.839	S	S	*	*				63.9	130.7	70.5	-171.4	0	0	0	0	112
6	S	29.3	Very low	30.2	Very low	90 Å²	90	162.4 Å²	162.4	63%	0.629	84%	0.842	S	S	*	*			cis	171	161.3	-2	51.2	0	0	0	0	104.4
7	R	29.3	Very low	30.1	Very low	243 Å²	243	158 Å²	158	92%	0.917	84%	0.835	S	S	*	*				178.4	147.6	127.3	-99	167.8	-174.4	-160.7	0.9	112.5
8	V	29.5	Very low	30	Very low	127 Å²	127	160.3 Å²	160.3	77%	0.77	84%	0.84	S	S	*	*			trans	-132.4	154.2	-172.4	159.7	0	0	0	0	108.1
9	L	28.2	Very low	29.9	Very low	156 Å²	156	161.7 Å²	161.7	82%	0.817	84%	0.842	S	S	*	*			trans	67.7	118.2	168	-77.1	161.2	0	0	0	119.4
10	R	27.8	Very low	29.8	Very low	248 Å²	248	158.9 Å²	158.9	94%	0.936	84%	0.843	S	S	*	*				-154.2	111	128.8	-106.1	179.4	-175	-164.2	0.7	110.4
11	Q	31.1	Very low	29.7	Very low	177 Å²	177	160.3 Å²	160.3	83%	0.827	85%	0.845	S	S	*	*			trans	-91.1	158.3	146.1	-77.8	-170.1	-10.2	0	0	107.6
12	P	34.8	Very low	29.2	Very low	114 Å²	114	152 Å²	152	74%	0.74	83%	0.825	S	S	*	*				-150.9	161.5	96	38.4	-21.1	0	0	0	117.4
13	R	28.1	Very low	28.8	Very low	241 Å²	241	153.2 Å²	153.2	91%	0.909	83%	0.828	S	S	*	*			trans	90.5	125.3	145.3	-85.1	172.6	177.1	-168.9	-2.7	121.8
14	R	30.2	Very low	28.7	Very low	238 Å²	238	160.4 Å²	160.4	90%	0.898	84%	0.839	S	S	*	*			trans	-62.5	154.4	162.1	-64.3	167.9	164.6	169.8	-7.3	112.2
15	A	27.7	Very low	28.7	Very low	104 Å²	104	158.2 Å²	158.2	86%	0.86	84%	0.843	S	S	*	*			trans	-126.2	154.1	142.8	0	0	0	0	0	109
16	L	29.3	Very low	28.5	Very low	169 Å²	169	157.3 Å²	157.3	89%	0.885	85%	0.85	S	S	*	*			trans	-96.8	163.8	-168.8	-89.3	142.5	0	0	0	113.5
17	A	28.8	Very low	28.4	Very low	87 Å²	87	156.9 Å²	156.9	72%	0.719	86%	0.86	S	S	*	*			trans	-47.3	158.6	176.3	0	0	0	0	0	116.7
18	Q	27.6	Very low	28.3	Very low	199 Å²	199	151 Å²	151	93%	0.93	86%	0.856	S	S	*	*			trans	-149.4	144.4	134.1	-114	167.1	16.2	0	0	112.1
19	Q	28.2	Very low	28.3	Very low	188 Å²	188	149.6 Å²	149.6	88%	0.879	86%	0.858	S	S	*	*			trans	-82.7	153.3	172.7	-63.4	164.4	-40.2	0	0	110
20	A	27.9	Very low	28.3	Very low	105 Å²	105	153.4 Å²	153.4	87%	0.868	86%	0.861	S	S	*	*			trans	-144.8	137.1	153.6	0	0	0	0	0	110.2
21	Q	27.5	Very low	28.4	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.883	86%	0.857	S	S	*	*			trans	-97.7	149.2	-179.1	-64.6	167.6	-11.6	0	0	111.1
22	G	25.2	Very low	28.4	Very low	82 Å²	82	150 Å²	150	85%	0.845	86%	0.857	S	S	*	*				78.2	109.5	129.5	0	0	0	0	0	121.3
23	A	26.7	Very low	28	Very low	98 Å²	98	151.2 Å²	151.2	81%	0.81	86%	0.857	S	S	*	*			trans	-172	113.7	133.6	0	0	0	0	0	107.2
24	R	26.4	Very low	28.1	Very low	256 Å²	256	146.3 Å²	146.3	97%	0.966	85%	0.854	S	S	*	*				57.5	85.1	65.2	-84.3	-165.2	175.2	-173.4	0.9	115.9
25	A	29.6	Very low	27.9	Very low	109 Å²	109	138.4 Å²	138.4	90%	0.901	85%	0.847	S	S	*	*			trans	-152.3	145.6	136.4	0	0	0	0	0	106.9
26	G	26	Very low	27.8	Very low	84 Å²	84	141 Å²	141	87%	0.866	85%	0.847	S	S	*	*			cis	139.4	75	5.9	0	0	0	0	0	109.9
27	G	27.5	Very low	27.7	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	84%	0.844	S	S	*	*			trans	-156.1	114	-178.3	0	0	0	0	0	111.3
28	S	26.8	Very low	27.6	Very low	120 Å²	120	140.8 Å²	140.8	84%	0.839	85%	0.848	S	S	*	*			trans	-122.6	131.8	-172.5	177.4	0	0	0	0	111
29	A	29.1	Very low	27.5	Very low	97 Å²	97	136.6 Å²	136.6	80%	0.802	85%	0.847	S	S	*	*			trans	-153	81.1	165.6	0	0	0	0	0	112.4
30	R	27.9	Very low	27.4	Very low	236 Å²	236	130.9 Å²	130.9	89%	0.891	84%	0.839	S	S	*	*			trans	48	108.3	135.3	-63	179.4	176.3	-176.3	-2.5	119.6
31	R	29.5	Very low	27.2	Very low	226 Å²	226	134 Å²	134	85%	0.853	84%	0.835	S	S	*	*			trans	-70.6	157.2	135.3	-61.7	179.1	178.6	-177.1	-1.8	109.8
32	P	31	Very low	27.1	Very low	126 Å²	126	132.4 Å²	132.4	82%	0.818	83%	0.832	S	S	*	*			trans	-104.1	143.4	139.6	32	-22.9	0	0	0	110.4
33	D	27	Very low	27.1	Very low	140 Å²	140	136.7 Å²	136.7	75%	0.749	83%	0.828	S	S	*	*			trans	-143.4	110.8	175.6	-169.7	7.8	0	0	0	107.6
34	T	29.6	Very low	26.9	Very low	138 Å²	138	136.5 Å²	136.5	85%	0.847	82%	0.82	S	S	*	*			trans	-176.4	132.7	176.1	46.7	0	0	0	0	106
35	G	26	Very low	26.8	Very low	72 Å²	72	135 Å²	135	74%	0.742	82%	0.816	S	S	*	*			cis	-179.9	163.5	-5.9	0	0	0	0	0	108.3
36	D	26	Very low	26.6	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	81%	0.807	S	S	*	*			trans	-64.3	142.3	168.6	-71.4	-57.2	0	0	0	110.5
37	D	26.9	Very low	26.8	Very low	155 Å²	155	137.3 Å²	137.3	83%	0.829	81%	0.808	S	S	*	*				172.1	155.1	106.2	-110	-36.8	0	0	0	115
38	A	26.4	Very low	26.7	Very low	97 Å²	97	136.9 Å²	136.9	80%	0.802	80%	0.803	S	S	*	*			trans	62.3	135.8	146.9	0	0	0	0	0	123.6
39	A	27.3	Very low	26.7	Very low	111 Å²	111	136.3 Å²	136.3	92%	0.917	80%	0.799	S	S	*	*			trans	-70.1	164.9	172	0	0	0	0	0	115.8
40	G	25.2	Very low	26.7	Very low	68 Å²	68	141.2 Å²	141.2	70%	0.701	81%	0.805	S	S	*	*			trans	144.5	89.5	174	0	0	0	0	0	109.7
41	H	24.6	Very low	26.7	Very low	171 Å²	171	139.5 Å²	139.5	79%	0.792	80%	0.804	S	S	*	*				50.4	97.4	75.5	-130.9	-59.1	0	0	0	112.6
42	D	24.5	Very low	26.7	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	81%	0.809	S	S	*	*			trans	-152.1	155.4	143.2	-133.8	-20.1	0	0	0	115.5
43	F	24.3	Very low	26.5	Very low	172 Å²	172	144.1 Å²	144.1	75%	0.754	81%	0.81	S	S	*	*			trans	-80.1	177.1	177.4	-80.9	-95.8	0	0	0	110.2
44	C	22.9	Very low	26.5	Very low	95 Å²	95	149 Å²	149	64%	0.642	82%	0.818	S	S	*	*			cis	-172.9	155.6	-11.8	163.3	0	0	0	0	105.8
45	Y	25.6	Very low	26.3	Very low	224 Å²	224	147.3 Å²	147.3	88%	0.878	81%	0.812	S	S	*	*			trans	-167.1	132.8	131.4	-114.8	-76	0	0	0	111.6
46	C	25.6	Very low	26.3	Very low	107 Å²	107	149.2 Å²	149.2	72%	0.723	81%	0.814	S	S	*	*			trans	-131.4	157.5	167.9	-72.3	0	0	0	0	108.5
47	P	30	Very low	26.3	Very low	135 Å²	135	145.2 Å²	145.2	88%	0.877	81%	0.811	S	S	*	*			trans	-133.8	149.2	143.5	34.6	-22.1	0	0	0	112.9
48	G	25.4	Very low	26.4	Very low	71 Å²	71	142.9 Å²	142.9	73%	0.732	81%	0.813	S	S	*	*			trans	111.7	49.2	158.4	0	0	0	0	0	118.9
49	S	26.1	Very low	26.3	Very low	108 Å²	108	148.7 Å²	148.7	76%	0.755	82%	0.82	S	S	*	*				24.1	118.4	127.8	-55.7	0	0	0	0	120.8
50	H	29.3	Very low	26.2	Very low	200 Å²	200	149.2 Å²	149.2	93%	0.926	82%	0.816	S	S	*	*				-159.3	142.5	116.9	-97.2	-67.6	0	0	0	111
51	K	28.8	Very low	26.3	Very low	200 Å²	200	156.5 Å²	156.5	87%	0.87	82%	0.824	S	S	*	*			trans	-90.5	142.3	-166	-61.9	171.4	177.7	173.5	0	113.4
52	R	28.5	Very low	26.5	Very low	255 Å²	255	152.7 Å²	152.7	96%	0.962	82%	0.816	S	S	*	*			trans	-164.8	148.7	130.1	-102.8	156.6	-171.2	-163	1.9	112.3
53	K	27.1	Very low	26.6	Very low	195 Å²	195	153.5 Å²	153.5	85%	0.848	81%	0.814	S	S	*	*			trans	-34.5	132.9	-171.3	-73	170.4	170.8	-179.9	0	116.8
54	R	26	Very low	27.4	Very low	241 Å²	241	150 Å²	150	91%	0.909	81%	0.809	S	S	*	*				52.1	132.2	95.2	-74	-174.5	170.9	-175.9	-3.9	113.5
55	S	25.4	Very low	27.8	Very low	103 Å²	103	153 Å²	153	72%	0.72	82%	0.818	S	S	*	*			cis	-158.2	125.1	25	-134.7	0	0	0	0	109.3
56	S	26.4	Very low	28	Very low	113 Å²	113	147.7 Å²	147.7	79%	0.79	81%	0.814	S	S	*	*				70	124.7	84.8	78.6	0	0	0	0	118.4
57	G	26.8	Very low	28.8	Very low	75 Å²	75	152.2 Å²	152.2	77%	0.773	82%	0.824	S	S	*	*			trans	120	98.7	164.2	0	0	0	0	0	113
58	A	27.6	Very low	28.8	Very low	106 Å²	106	151.3 Å²	151.3	88%	0.876	82%	0.817	S	S	*	*				81.6	110.2	58	0	0	0	0	0	113.7
59	F	25.7	Very low	29.1	Very low	218 Å²	218	156 Å²	156	96%	0.956	83%	0.825	S	S	*	*			trans	-96.9	142.1	178	-95.7	-95.8	0	0	0	112.1
60	C	25	Very low	29.4	Very low	123 Å²	123	159.4 Å²	159.4	83%	0.831	83%	0.829	S	S	*	*			trans	-147.7	167.2	170.2	-156.1	0	0	0	0	110.8
61	Y	27.7	Very low	29.7	Very low	221 Å²	221	158 Å²	158	87%	0.867	83%	0.828	S	S	*	*			trans	-109	163.4	-172	-64.1	-93.4	0	0	0	111.9
62	C	27	Very low	30.1	Very low	91 Å²	91	157.5 Å²	157.5	62%	0.615	83%	0.829	S	S	*	*			cis	-158.8	165.7	2.4	-144.6	0	0	0	0	111.7
63	H	27.3	Very low	30.6	Very low	170 Å²	170	154.1 Å²	154.1	79%	0.787	82%	0.824	S	S	*	*			trans	63.5	161.9	160.6	-71.6	-67.1	0	0	0	118.8
64	P	41.7	Very low	31.1	Very low	99 Å²	99	154 Å²	154	64%	0.643	83%	0.827	S	S	*	*			cis	-130.8	178	-41.2	38.4	-23.2	0	0	0	112.8
65	D	31.3	Very low	31.7	Very low	157 Å²	157	145 Å²	145	84%	0.84	81%	0.808	S	S	*	*			trans	48	93.3	158.9	-57.4	-19.9	0	0	0	120.5
66	S	29.9	Very low	32.5	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	81%	0.808	S	S	*	*			trans	-162.9	122.8	140.7	39.3	0	0	0	0	112	T68	S66-T68 PolarHBondContact O-N 3.14Å
67	E	41.5	Very low	33.6	Very low	201 Å²	201	147.9 Å²	147.9	94%	0.939	80%	0.803	S	S	*	*			trans	-82.1	107.7	170.5	-68.7	-175.4	151.3	0	0	110.3
68	T	30.5	Very low	34.7	Very low	117 Å²	117	152 Å²	152	72%	0.718	80%	0.802	S	S	*	*			trans	-151.5	95.5	160.6	45.3	0	0	0	0	110.1	S66	S66-T68 PolarHBondContact O-N 3.14Å
69	D	31.4	Very low	35.7	Very low	168 Å²	168	155.1 Å²	155.1	90%	0.898	80%	0.798	S	S	*	*			trans	-84.5	111.5	162.1	-67.2	-39.4	0	0	0	108.5
70	E	32.4	Very low	36.8	Very low	181 Å²	181	153.4 Å²	153.4	85%	0.846	79%	0.785	S	S	*	*			trans	-125.1	95.8	165.9	-71.1	-170	164.5	0	0	108.9
71	D	36.4	Very low	38.2	Very low	169 Å²	169	153.4 Å²	153.4	90%	0.904	78%	0.776	S	S	*	*			trans	-86.3	119.2	168	-80.2	-41.6	0	0	0	109.6
72	E	36.9	Very low	39.5	Very low	191 Å²	191	150.3 Å²	150.3	89%	0.893	77%	0.774	S	S	*	*			trans	-86.8	110.8	171.3	-69.5	-175.3	158.3	0	0	111.5
73	E	38.3	Very low	40.9	Very low	184 Å²	184	153.2 Å²	153.2	86%	0.86	78%	0.783	S	S	*	*			trans	-141	90.2	154.2	-81.2	-159.9	159.4	0	0	110.7
74	E	37.7	Very low	42.2	Very low	192 Å²	192	150.2 Å²	150.2	90%	0.897	78%	0.777	S	S	*	*			trans	-82	110.8	167	-77.5	-167.7	160.8	0	0	111.2
75	G	38.8	Very low	42.9	Very low	51 Å²	51	151 Å²	151	53%	0.526	78%	0.783	S	S	.	*			trans	-152.7	116.7	169.8	0	0	0	0	0	110.6
76	D	42.8	Very low	43.9	Very low	134 Å²	134	154.3 Å²	154.3	72%	0.717	78%	0.783	S	S	*	*			trans	54.9	80.3	179.6	-83.9	-37.1	0	0	0	117.2	Q78	D76-Q78 VanDerWaalsContact C-N 3.26Å; D76-Q78 PolarHBondContact O-N 3.18Å
77	E	49.5	Very low	45.1	Very low	144 Å²	144	160.1 Å²	160.1	67%	0.673	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-62	-29.1	169.3	-73.3	-161.1	103	0	0	113.8	Q79	E77-Q79 PolarHBondContact O-N 2.96Å
78	Q	48.8	Very low	45.9	Very low	161 Å²	161	159.5 Å²	159.5	75%	0.752	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-76.2	-17.7	-164.9	-139.7	69.6	16.7	0	0	115.1	D76	D76-Q78 VanDerWaalsContact C-N 3.26Å; D76-Q78 PolarHBondContact O-N 3.18Å
79	Q	48.9	Very low	47	Very low	172 Å²	172	164 Å²	164	80%	0.804	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-106.6	-9.7	-178.4	-97.7	179.7	-0.1	0	0	115.3	E77	E77-Q79 PolarHBondContact O-N 2.96Å
80	R	49.2	Very low	48.2	Very low	181 Å²	181	164 Å²	164	68%	0.683	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-10.3	177.7	-72.8	-179.7	173.1	172.9	-0.3	114.2
81	L	53.3	Low	49.5	Very low	124 Å²	124	163.4 Å²	163.4	65%	0.649	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-5.3	-171.6	-72.8	170	0	0	0	116.1
82	L	55.3	Low	51.7	Low	155 Å²	155	158.9 Å²	158.9	81%	0.812	77%	0.767	S	S	*	*	S	Bend	trans	-109.3	-16.5	-173.9	-72.2	172.1	0	0	0	116.1
83	N	56.4	Low	54.1	Low	152 Å²	152	154.8 Å²	154.8	81%	0.813	76%	0.755	S	S	*	*	S	Bend	trans	-125.5	4.6	-168.5	-78.9	-30.2	0	0	0	116.7
84	T	55	Low	56.4	Low	108 Å²	108	147.3 Å²	147.3	66%	0.663	72%	0.723	S	S	*	*			trans	-143.4	115.2	172.6	16.6	0	0	0	0	111.4	R86	T84-R86 PolarHBondContact O-N 3.44Å
85	P	57.3	Low	58.8	Low	116 Å²	116	145.2 Å²	145.2	75%	0.753	71%	0.711	S	S	*	*			trans	-63.7	124.9	169.1	24.2	-28.9	0	0	0	108.7	R87	P85-R87 VanDerWaalsContact C-N 3.32Å; P85-R87 PolarHBondContact O-N 2.97Å
86	R	51.8	Low	61.3	Low	225 Å²	225	149.1 Å²	149.1	85%	0.849	71%	0.711	S	S	*	*			trans	-58.4	94.8	171.9	-76.3	-172.2	176.8	-170.4	0	108.7	T84 K88	T84-R86 PolarHBondContact O-N 3.44Å; R86-K88 VanDerWaalsContact C-N 3.31Å; R86-K88 PolarHBondContact O-N 3.35Å
87	R	54.3	Low	63.7	Low	237 Å²	237	144.7 Å²	144.7	89%	0.894	69%	0.686	S	S	*	*			trans	-63.3	93	171.9	-78.3	-177.1	171.9	177.5	-2.4	108.1	P85 K89	P85-R87 VanDerWaalsContact C-N 3.32Å; P85-R87 PolarHBondContact O-N 2.97Å; R87-K89 PolarHBondContact O-N 2.74Å
88	K	57.9	Low	65.9	Low	187 Å²	187	139.7 Å²	139.7	81%	0.813	66%	0.662	S	S	*	*			trans	-49	127.1	157.6	-70.4	-177	176.7	-179.3	0	106.2	R86 L90	R86-K88 VanDerWaalsContact C-N 3.31Å; R86-K88 PolarHBondContact O-N 3.35Å; K88-L90 VanDerWaalsContact C-N 3.31Å; K88-L90 PolarHBondContact O-N 2.83Å
89	K	53.9	Low	68.1	Low	213 Å²	213	136.4 Å²	136.4	93%	0.926	65%	0.646	S	S	*	*			trans	-56.8	99	172.6	-81.6	-178.8	177.4	173.5	0	107.1	R87 K91	R87-K89 PolarHBondContact O-N 2.74Å; K89-K91 PolarHBondContact O-N 2.77Å
90	L	56.5	Low	70.3	Confident	168 Å²	168	128.9 Å²	128.9	88%	0.88	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-56.9	127	173.2	-84.7	138.4	0	0	0	106.7	K88 S92	K88-L90 VanDerWaalsContact C-N 3.31Å; K88-L90 PolarHBondContact O-N 2.83Å; L90-S92 PolarHBondContact O-N 3.39Å; L90-S92 VanDerWaalsContact O-N 3.13Å
91	K	61.1	Low	72.6	Confident	167 Å²	167	122 Å²	122	73%	0.726	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-55.1	123.5	164.6	-69.3	-177.7	179.5	-179.7	0	105.7	K89 T93	K89-K91 PolarHBondContact O-N 2.77Å; K91-T93 PolarHBondContact O-N 3.2Å
92	S	82.8	Confident	74.6	Confident	75 Å²	75	116.6 Å²	116.6	52%	0.524	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-49.7	136.5	176.7	172.7	0	0	0	0	109.2	L90 S94 K95 Y96	L90-S92 PolarHBondContact O-N 3.39Å; L90-S92 VanDerWaalsContact O-N 3.13Å; S92-S94 PolarHBondContact O-N 2.86Å; S92-S94 VanDerWaalsContact O-N 3.13Å; S92-K95 WeakPolarHBondContact O-CA 3.4Å; S92-K95 WeakPolarHBondContact O-CB 3.42Å; S92-K95 PolarHBondContact O-N 2.91Å; S92-Y96 PolarHBondContact O-N 3.09Å
93	T	86.6	Confident	76.6	Confident	104 Å²	104	112.8 Å²	112.8	64%	0.638	54%	0.54	S	S	*	.	H	α-helix	trans	-52.1	-38.5	-179.7	-46.6	0	0	0	0	111.1	K91 K95 Y96 I97	K91-T93 PolarHBondContact O-N 3.2Å; T93-K95 PolarHBondContact O-N 3.39Å; T93-Y96 PolarHBondContact O-N 3.13Å; T93-I97 HydrophobicContact CG2-CD1 3.97Å; T93-I97 WeakPolarHBondContact O-CB 3.43Å; T93-I97 WeakPolarHBondContact O-CG1 3.26Å; T93-I97 PolarHBondContact O-N 2.98Å
94	S	86.6	Confident	78.5	Confident	27 Å²	27	109.7 Å²	109.7	19%	0.189	52%	0.524	C	S	.	.	H	α-helix	trans	-58.1	-44.5	172.7	-179.1	0	0	0	0	113	S92 Y96 I97 Y98	S92-S94 PolarHBondContact O-N 2.86Å; S92-S94 VanDerWaalsContact O-N 3.13Å; S94-Y96 VanDerWaalsContact C-N 3.34Å; S94-Y96 PolarHBondContact O-N 3.07Å; S94-I97 PolarHBondContact O-N 3.2Å; S94-Y98 WeakPolarHBondContact O-CB 3.41Å; S94-Y98 PolarHBondContact O-N 2.97Å
95	K	88.1	Confident	80.4	Confident	148 Å²	148	105.1 Å²	105.1	64%	0.643	50%	0.498	S	S	*	.	H	α-helix	trans	-67.7	-32.6	176	-174.3	169.2	-175.8	169	0	112.6	S92 T93 Q99	S92-K95 WeakPolarHBondContact O-CA 3.4Å; S92-K95 WeakPolarHBondContact O-CB 3.42Å; S92-K95 PolarHBondContact O-N 2.91Å; T93-K95 PolarHBondContact O-N 3.39Å; K95-Q99 WeakPolarHBondContact O-CB 3.25Å; K95-Q99 PolarHBondContact O-N 3.41Å
96	Y	91.4	Very high	82.3	Confident	134 Å²	134	103.6 Å²	103.6	53%	0.525	48%	0.481	S	S	.	.	H	α-helix	trans	-69.7	-49.9	173.4	176	-102	0	0	0	111.1	S92 T93 S94 Y98 Q99 T100	S92-Y96 PolarHBondContact O-N 3.09Å; T93-Y96 PolarHBondContact O-N 3.13Å; S94-Y96 VanDerWaalsContact C-N 3.34Å; S94-Y96 PolarHBondContact O-N 3.07Å; Y96-Y98 PolarHBondContact O-N 3.32Å; Y96-Q99 PolarHBondContact O-N 3.49Å; Y96-T100 HydrophobicContact CE1-CG2 4.44Å; Y96-T100 HydrophobicContact CE2-CG2 4.34Å; Y96-T100 VanDerWaalsContact CE2-OG1 3.31Å; Y96-T100 WeakPolarHBondContact CE2-OG1 3.49Å; Y96-T100 WeakPolarHBondContact O-CB 3.46Å; Y96-T100 PolarHBondContact O-N 3.04Å
97	I	93.9	Very high	84.3	Confident	40 Å²	40	99.8 Å²	99.8	21%	0.205	48%	0.477	C	S	.	.	H	α-helix	trans	-54.2	-50.7	176.3	-74.6	167.1	0	0	0	111	T93 S94 Q99 L101 F102 Y125 Y170	T93-I97 HydrophobicContact CG2-CD1 3.97Å; T93-I97 WeakPolarHBondContact O-CB 3.43Å; T93-I97 WeakPolarHBondContact O-CG1 3.26Å; T93-I97 PolarHBondContact O-N 2.98Å; S94-I97 PolarHBondContact O-N 3.2Å; I97-Q99 PolarHBondContact O-N 3.37Å; I97-L101 HydrophobicContact CG2-CD1 4.25Å; I97-L101 WeakPolarHBondContact O-CA 3.41Å; I97-L101 VanDerWaalsContact O-CB 3.31Å; I97-L101 WeakPolarHBondContact O-CB 3.26Å; I97-L101 PolarHBondContact O-N 2.77Å; I97-F102 PolarHBondContact O-N 2.86Å; I97-Y125 HydrophobicContact CG2-CE1 4.13Å; I97-Y125 WeakPolarHBondContact CG2-OH 3.45Å; I97-Y170 HydrophobicContact CG2-CD1 4.07Å; I97-Y170 WeakPolarHBondContact CG2-O 3.14Å
98	Y	94.5	Very high	86.3	Confident	39 Å²	39	90.5 Å²	90.5	15%	0.153	45%	0.449	C	S	.	.	I	π-helix	trans	-62	-39.7	179.8	-173.5	-91.3	0	0	0	113	S94 Y96 F102 L103 G167 R171	S94-Y98 WeakPolarHBondContact O-CB 3.41Å; S94-Y98 PolarHBondContact O-N 2.97Å; Y96-Y98 PolarHBondContact O-N 3.32Å; Y98-F102 AromaticContact CD2-CD1 3.97Å; Y98-F102 HydrophobicContact CD2-CD1 3.97Å; Y98-F102 HydrophobicContact CE1-CD1 4.31Å; Y98-F102 AromaticContact CE2-CD1 3.53Å; Y98-F102 HydrophobicContact CE2-CD1 3.53Å; Y98-F102 AromaticContact CE2-CE1 3.92Å; Y98-F102 HydrophobicContact CE2-CE1 3.92Å; Y98-F102 AromaticContact CZ-CD1 3.7Å; Y98-F102 AromaticContact CZ-CE1 3.9Å; Y98-F102 WeakPolarHBondContact O-CB 3.33Å; Y98-F102 PolarHBondContact O-N 3.31Å; Y98-L103 HydrophobicContact CD1-CD1 4.05Å; Y98-L103 HydrophobicContact CD1-CG 4.12Å; Y98-L103 HydrophobicContact CE1-CD1 3.76Å; Y98-L103 HydrophobicContact CE1-CD2 4.03Å; Y98-L103 HydrophobicContact CE1-CG 3.83Å; Y98-L103 PolarHBondContact O-N 3.18Å; Y98-G167 WeakPolarHBondContact CE2-O 3.48Å; Y98-R171 HydrophobicContact CD2-CB 4.16Å; Y98-R171 HydrophobicContact CD2-CG 3.84Å; Y98-R171 HydrophobicContact CE2-CG 4.18Å; Y98-R171 PolarHBondContact OH-NH1 3.01Å
99	Q	94.8	Very high	88.1	Confident	92 Å²	92	85.1 Å²	85.1	43%	0.43	43%	0.429	S	S	.	.	I	π-helix	trans	-72.4	-52.8	178.2	-176.2	65.4	62.2	0	0	112.1	K95 Y96 I97 L103 N104	K95-Q99 WeakPolarHBondContact O-CB 3.25Å; K95-Q99 PolarHBondContact O-N 3.41Å; Y96-Q99 PolarHBondContact O-N 3.49Å; I97-Q99 PolarHBondContact O-N 3.37Å; Q99-L103 WeakPolarHBondContact O-CB 3.46Å; Q99-L103 PolarHBondContact O-N 3.03Å; Q99-N104 PolarHBondContact NE2-OD1 3.28Å; Q99-N104 VanDerWaalsContact O-CG 3.23Å; Q99-N104 PolarHBondContact O-N 2.89Å; Q99-N104 PolarHBondContact O-OD1 3.34Å; Q99-N104 VanDerWaalsContact O-OD1 3.14Å
100	T	95.9	Very high	90.1	Very high	15 Å²	15	75.1 Å²	75.1	9%	0.092	39%	0.385	C	S	.	.	I	π-helix	trans	-78.6	-43.4	-169.7	-69.2	0	0	0	0	112.1	Y96 N104 E106	Y96-T100 HydrophobicContact CE1-CG2 4.44Å; Y96-T100 HydrophobicContact CE2-CG2 4.34Å; Y96-T100 VanDerWaalsContact CE2-OG1 3.31Å; Y96-T100 WeakPolarHBondContact CE2-OG1 3.49Å; Y96-T100 WeakPolarHBondContact O-CB 3.46Å; Y96-T100 PolarHBondContact O-N 3.04Å; T100-N104 WeakPolarHBondContact O-CB 3.43Å; T100-E106 HydrophobicContact CG2-CB 4.2Å; T100-E106 HydrophobicContact CG2-CG 4.39Å; T100-E106 WeakPolarHBondContact CG2-OE2 3.27Å; T100-E106 WeakPolarHBondContact O-CB 3.29Å; T100-E106 PolarHBondContact O-N 2.88Å
101	L	96.4	Very high	92	Very high	35 Å²	35	70.4 Å²	70.4	18%	0.183	36%	0.358	C	S	.	.	I	π-helix	trans	-87.3	-46.2	-177.6	-55.3	-172.8	0	0	0	112	I97 G105 E106 H122 Y125 Y170	I97-L101 HydrophobicContact CG2-CD1 4.25Å; I97-L101 WeakPolarHBondContact O-CA 3.41Å; I97-L101 VanDerWaalsContact O-CB 3.31Å; I97-L101 WeakPolarHBondContact O-CB 3.26Å; I97-L101 PolarHBondContact O-N 2.77Å; L101-G105 VanDerWaalsContact O-CA 3.31Å; L101-G105 WeakPolarHBondContact O-CA 3.03Å; L101-G105 PolarHBondContact O-N 2.88Å; L101-E106 WeakPolarHBondContact CD2-O 3.41Å; L101-H122 PolarHBondContact O-CE1 3.02Å; L101-H122 VanDerWaalsContact O-CE1 3.29Å; L101-Y125 HydrophobicContact CD1-CE2 3.7Å; L101-Y170 HydrophobicContact CB-CD1 4.09Å; L101-Y170 HydrophobicContact CB-CE1 3.97Å
102	F	96.8	Very high	93.8	Very high	11 Å²	11	62.5 Å²	62.5	5%	0.048	32%	0.323	C	S	.	.	I	π-helix	trans	-85.8	-51.9	-175.4	176.6	-113.9	0	0	0	113.9	I97 Y98 L121 Q163 F166 G167 Y170	I97-F102 PolarHBondContact O-N 2.86Å; Y98-F102 AromaticContact CD2-CD1 3.97Å; Y98-F102 HydrophobicContact CD2-CD1 3.97Å; Y98-F102 HydrophobicContact CE1-CD1 4.31Å; Y98-F102 AromaticContact CE2-CD1 3.53Å; Y98-F102 HydrophobicContact CE2-CD1 3.53Å; Y98-F102 AromaticContact CE2-CE1 3.92Å; Y98-F102 HydrophobicContact CE2-CE1 3.92Å; Y98-F102 AromaticContact CZ-CD1 3.7Å; Y98-F102 AromaticContact CZ-CE1 3.9Å; Y98-F102 WeakPolarHBondContact O-CB 3.33Å; Y98-F102 PolarHBondContact O-N 3.31Å; F102-L121 HydrophobicContact CD2-CD2 3.62Å; F102-L121 HydrophobicContact CE2-CD2 3.7Å; F102-Q163 VanDerWaalsContact CE1-NE2 3.32Å; F102-Q163 HydrophobicContact CZ-CG 4.4Å; F102-Q163 VanDerWaalsContact CZ-O 3.25Å; F102-Q163 WeakPolarHBondContact CZ-O 3.35Å; F102-F166 HydrophobicContact CE2-CB 3.6Å; F102-F166 HydrophobicContact CZ-CB 4.06Å; F102-G167 VanDerWaalsContact CZ-CA 3.48Å; F102-Y170 HydrophobicContact CB-CD1 4Å; F102-Y170 HydrophobicContact CB-CD2 3.69Å; F102-Y170 HydrophobicContact CB-CE1 4.31Å; F102-Y170 HydrophobicContact CB-CE2 4.04Å; F102-Y170 HydrophobicContact CB-CG 3.67Å; F102-Y170 AromaticContact CD2-CD2 3.8Å; F102-Y170 HydrophobicContact CD2-CD2 3.8Å; F102-Y170 AromaticContact CD2-CE2 3.66Å; F102-Y170 HydrophobicContact CD2-CE2 3.66Å; F102-Y170 AromaticContact CG-CD2 3.88Å; F102-Y170 HydrophobicContact CG-CD2 3.88Å; F102-Y170 HydrophobicContact CG-CE2 4.16Å; F102-Y170 HydrophobicContact CG-CG 4.32Å
103	L	95.9	Very high	94.5	Very high	75 Å²	75	60.4 Å²	60.4	39%	0.393	31%	0.309	S	S	.	.	I	π-helix	trans	-76.6	-37.5	-177	-64.1	-177.6	0	0	0	113.6	Y98 Q99	Y98-L103 HydrophobicContact CD1-CD1 4.05Å; Y98-L103 HydrophobicContact CD1-CG 4.12Å; Y98-L103 HydrophobicContact CE1-CD1 3.76Å; Y98-L103 HydrophobicContact CE1-CD2 4.03Å; Y98-L103 HydrophobicContact CE1-CG 3.83Å; Y98-L103 PolarHBondContact O-N 3.18Å; Q99-L103 WeakPolarHBondContact O-CB 3.46Å; Q99-L103 PolarHBondContact O-N 3.03Å
104	N	96.4	Very high	95	Very high	87 Å²	87	55.8 Å²	55.8	47%	0.465	28%	0.281	S	S	.	.	S	Bend	trans	-89.5	-16.5	178.8	-57.4	-1.1	0	0	0	113.2	Q99 T100 E106	Q99-N104 PolarHBondContact NE2-OD1 3.28Å; Q99-N104 VanDerWaalsContact O-CG 3.23Å; Q99-N104 PolarHBondContact O-N 2.89Å; Q99-N104 PolarHBondContact O-OD1 3.34Å; Q99-N104 VanDerWaalsContact O-OD1 3.14Å; T100-N104 WeakPolarHBondContact O-CB 3.43Å; N104-E106 VanDerWaalsContact C-N 3.29Å; N104-E106 HydrophobicContact CB-CG 3.89Å; N104-E106 PolarHBondContact ND2-OE1 3.08Å; N104-E106 PolarHBondContact O-N 2.78Å
105	G	95.6	Very high	95.4	Very high	12 Å²	12	58.9 Å²	58.9	12%	0.124	30%	0.295	C	S	.	.			trans	68.7	18.1	-176.9	0	0	0	0	0	115.1	L101 N107 S108	L101-G105 VanDerWaalsContact O-CA 3.31Å; L101-G105 WeakPolarHBondContact O-CA 3.03Å; L101-G105 PolarHBondContact O-N 2.88Å; G105-N107 PolarHBondContact O-N 2.98Å; G105-S108 WeakPolarHBondContact O-CB 3.42Å; G105-S108 PolarHBondContact O-N 3.37Å; G105-S108 PolarHBondContact O-OG 3.05Å
106	E	96.5	Very high	95.7	Very high	84 Å²	84	55.8 Å²	55.8	39%	0.393	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	119.9	-171.9	-68.5	174.5	-130.7	0	0	112.1	T100 L101 N104 S108 H122	T100-E106 HydrophobicContact CG2-CB 4.2Å; T100-E106 HydrophobicContact CG2-CG 4.39Å; T100-E106 WeakPolarHBondContact CG2-OE2 3.27Å; T100-E106 WeakPolarHBondContact O-CB 3.29Å; T100-E106 PolarHBondContact O-N 2.88Å; L101-E106 WeakPolarHBondContact CD2-O 3.41Å; N104-E106 VanDerWaalsContact C-N 3.29Å; N104-E106 HydrophobicContact CB-CG 3.89Å; N104-E106 PolarHBondContact ND2-OE1 3.08Å; N104-E106 PolarHBondContact O-N 2.78Å; E106-S108 VanDerWaalsContact C-N 3.34Å; E106-H122 PolarHBondContact O-NE2 3.19Å
107	N	94.3	Very high	96	Very high	145 Å²	145	54.4 Å²	54.4	78%	0.775	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	25	-176.6	-46.7	-66.9	0	0	0	115.5	G105 H122	G105-N107 PolarHBondContact O-N 2.98Å; N107-H122 PolarHBondContact O-NE2 3.15Å
108	S	96.6	Very high	96.2	Very high	42 Å²	42	57 Å²	57	29%	0.294	32%	0.315	S	S	.	.			trans	-54.6	135.1	169.6	58.3	0	0	0	0	112.4	G105 E106 L121 H122	G105-S108 WeakPolarHBondContact O-CB 3.42Å; G105-S108 PolarHBondContact O-N 3.37Å; G105-S108 PolarHBondContact O-OG 3.05Å; E106-S108 VanDerWaalsContact C-N 3.34Å; S108-L121 CarbonylContact C-O 3.59Å; S108-L121 VanDerWaalsContact CA-O 3.25Å; S108-L121 WeakPolarHBondContact CA-O 3.38Å; S108-L121 WeakPolarHBondContact CB-O 3.42Å; S108-H122 PolarHBondContact N-NE2 3.15Å
109	D	95.1	Very high	96.3	Very high	75 Å²	75	55.9 Å²	55.9	40%	0.401	31%	0.31	S	S	.	.			trans	-107.8	-0.1	178.2	66.1	-6.6	0	0	0	113.3	L121 H122 K123	D109-L121 PolarHBondContact N-O 3.13Å; D109-L121 VanDerWaalsContact N-O 3.15Å; D109-H122 VanDerWaalsContact OD1-CA 3.23Å; D109-H122 WeakPolarHBondContact OD1-CA 3.36Å; D109-K123 PolarHBondContact OD1-N 2.91Å
110	I	96.1	Very high	96.5	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	147.1	178.1	-174.9	161.2	0	0	0	111.9	I112 L121 K123 L126 F136 N146 I148	I110-I112 HydrophobicContact CD1-CD1 4Å; I110-I112 HydrophobicContact CG1-CD1 4.1Å; I110-L121 HydrophobicContact CG2-CB 4.25Å; I110-L121 WeakPolarHBondContact CG2-O 3.38Å; I110-L121 PolarHBondContact N-O 3.38Å; I110-L121 CarbonylContact O-C 3.53Å; I110-L121 PolarHBondContact O-N 2.83Å; I110-L121 VanDerWaalsContact O-O 3.07Å; I110-K123 HydrophobicContact CB-CG 4.01Å; I110-K123 HydrophobicContact CD1-CG 4.25Å; I110-K123 HydrophobicContact CG2-CG 3.8Å; I110-L126 HydrophobicContact CG2-CD1 3.8Å; I110-F136 HydrophobicContact CD1-CE1 3.68Å; I110-F136 HydrophobicContact CD1-CZ 3.49Å; I110-F136 VanDerWaalsContact CD1-CZ 3.49Å; I110-N146 CarbonylContact C-O 3.54Å; I110-N146 WeakPolarHBondContact CA-O 3.5Å; I110-I148 HydrophobicContact CD1-CD1 3.76Å; I110-I148 HydrophobicContact CD1-CG1 4.07Å
111	K	97.4	Very high	96.6	Very high	70 Å²	70	52.4 Å²	52.4	30%	0.304	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.8	168.4	-67.8	173.7	160.9	-145.5	0	110.5	E118 W119 N146 I147 I148	K111-E118 HydrophobicContact CB-CG 4.26Å; K111-E118 HydrophobicContact CD-CG 4.32Å; K111-E118 WeakPolarHBondContact CD-OE2 3.37Å; K111-E118 WeakPolarHBondContact CE-OE1 3.14Å; K111-E118 HydrophobicContact CG-CG 4.44Å; K111-E118 IonicContact NZ-OE1 2.93Å; K111-E118 PolarHBondContact NZ-OE1 3.21Å; K111-E118 IonicContact NZ-OE2 2.75Å; K111-E118 PolarHBondContact NZ-OE2 3.15Å; K111-W119 CarbonylContact C-O 3.58Å; K111-W119 VanDerWaalsContact CA-O 3.3Å; K111-W119 WeakPolarHBondContact CA-O 3.2Å; K111-N146 PolarHBondContact N-O 3.41Å; K111-I147 HydrophobicContact CB-CG1 4.3Å; K111-I147 HydrophobicContact CB-CG2 4.46Å; K111-I147 HydrophobicContact CD-CG1 4.4Å; K111-I147 CarbonylContact O-C 3.56Å; K111-I147 VanDerWaalsContact O-CA 3.31Å; K111-I147 WeakPolarHBondContact O-CA 3.4Å; K111-I148 PolarHBondContact O-N 2.83Å
112	I	97.4	Very high	96.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.6	169.5	-53	-59	0	0	0	107.9	I110 W119 L121 L126 F132 I148 L150 F166	I110-I112 HydrophobicContact CD1-CD1 4Å; I110-I112 HydrophobicContact CG1-CD1 4.1Å; I112-W119 PolarHBondContact N-O 3.37Å; I112-W119 PolarHBondContact O-N 2.88Å; I112-L121 HydrophobicContact CB-CD1 4.38Å; I112-L121 HydrophobicContact CG1-CD1 3.86Å; I112-L126 HydrophobicContact CD1-CD1 4.19Å; I112-L126 HydrophobicContact CG1-CD1 4.2Å; I112-F132 HydrophobicContact CD1-CE1 3.8Å; I112-F132 HydrophobicContact CD1-CZ 4.28Å; I112-F132 HydrophobicContact CG1-CE1 4.4Å; I112-F132 HydrophobicContact CG1-CZ 4.39Å; I112-I148 CarbonylContact C-O 3.59Å; I112-I148 WeakPolarHBondContact CA-O 3Å; I112-I148 HydrophobicContact CD1-CB 3.9Å; I112-I148 HydrophobicContact CD1-CG1 4.47Å; I112-L150 HydrophobicContact CG2-CB 3.88Å; I112-L150 HydrophobicContact CG2-CD2 4.21Å; I112-F166 HydrophobicContact CB-CZ 4.35Å; I112-F166 HydrophobicContact CG2-CZ 3.9Å
113	C	97.6	Very high	96.5	Very high	32 Å²	32	52.9 Å²	52.9	22%	0.216	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.8	178.7	-58.6	0	0	0	0	109.4	E117 I148 E149 L150	C113-E117 WeakPolarHBondContact CA-O 3.31Å; C113-I148 PolarHBondContact N-O 2.93Å; C113-E149 HydrophobicContact CB-CG 4.26Å; C113-E149 WeakPolarHBondContact O-CA 3.3Å; C113-L150 PolarHBondContact O-N 3.44Å
114	A	97.3	Very high	96.4	Very high	7 Å²	7	55.7 Å²	55.7	6%	0.058	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	145.7	178.2	0	0	0	0	0	111	G116 E117 W119 L150 I152 L162	A114-G116 PolarHBondContact O-N 2.69Å; A114-E117 PolarHBondContact N-O 2.77Å; A114-E117 PolarHBondContact O-N 2.77Å; A114-W119 HydrophobicContact CB-CZ3 3.82Å; A114-W119 WeakPolarHBondContact O-CZ3 3.41Å; A114-L150 HydrophobicContact CB-CB 4.19Å; A114-I152 HydrophobicContact CB-CD1 4.3Å; A114-I152 HydrophobicContact CB-CG1 4.1Å; A114-L162 HydrophobicContact CB-CD1 3.88Å
115	L	96	Very high	96.4	Very high	91 Å²	91	54 Å²	54	48%	0.476	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	22.5	177.2	-54.9	178.2	0	0	0	115.2	I152 V159 L162	L115-I152 HydrophobicContact CD2-CB 3.92Å; L115-I152 HydrophobicContact CD2-CG1 4.01Å; L115-I152 HydrophobicContact CD2-CG2 4.17Å; L115-I152 HydrophobicContact CG-CB 4.44Å; L115-I152 HydrophobicContact CG-CG1 4Å; L115-V159 HydrophobicContact CB-CG2 3.93Å; L115-V159 HydrophobicContact CD1-CG2 4.17Å; L115-L162 HydrophobicContact CD1-CD1 3.98Å; L115-L162 HydrophobicContact CG-CD1 4.38Å
116	G	94.3	Very high	96.4	Very high	84 Å²	84	53.4 Å²	53.4	87%	0.866	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-0.3	-176.4	0	0	0	0	0	115.4	A114	A114-G116 PolarHBondContact O-N 2.69Å
117	E	97.1	Very high	96.3	Very high	105 Å²	105	52.1 Å²	52.1	49%	0.491	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	156.9	179.9	-68.9	-69.5	162.1	0	0	111.8	C113 A114 W119 V159	C113-E117 WeakPolarHBondContact CA-O 3.31Å; A114-E117 PolarHBondContact N-O 2.77Å; A114-E117 PolarHBondContact O-N 2.77Å; E117-W119 HydrophobicContact CB-CE3 4.42Å; E117-W119 HydrophobicContact CB-CH2 3.58Å; E117-W119 HydrophobicContact CB-CZ2 4.16Å; E117-W119 HydrophobicContact CB-CZ3 3.71Å; E117-V159 HydrophobicContact CB-CG1 4.46Å; E117-V159 HydrophobicContact CG-CG1 3.81Å; E117-V159 HydrophobicContact CG-CG2 3.84Å
118	E	97.4	Very high	96.3	Very high	93 Å²	93	51.1 Å²	51.1	44%	0.435	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.9	-178.6	-171	-165.1	89.5	0	0	111	K111	K111-E118 HydrophobicContact CB-CG 4.26Å; K111-E118 HydrophobicContact CD-CG 4.32Å; K111-E118 WeakPolarHBondContact CD-OE2 3.37Å; K111-E118 WeakPolarHBondContact CE-OE1 3.14Å; K111-E118 HydrophobicContact CG-CG 4.44Å; K111-E118 IonicContact NZ-OE1 2.93Å; K111-E118 PolarHBondContact NZ-OE1 3.21Å; K111-E118 IonicContact NZ-OE2 2.75Å; K111-E118 PolarHBondContact NZ-OE2 3.15Å
119	W	98.3	Very high	96.3	Very high	16 Å²	16	49.1 Å²	49.1	6%	0.061	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118.1	174.8	-68.1	-91.1	0	0	0	110.8	K111 I112 A114 E117 L121 V159 L162 Q163 F166	K111-W119 CarbonylContact C-O 3.58Å; K111-W119 VanDerWaalsContact CA-O 3.3Å; K111-W119 WeakPolarHBondContact CA-O 3.2Å; I112-W119 PolarHBondContact N-O 3.37Å; I112-W119 PolarHBondContact O-N 2.88Å; A114-W119 HydrophobicContact CB-CZ3 3.82Å; A114-W119 WeakPolarHBondContact O-CZ3 3.41Å; E117-W119 HydrophobicContact CB-CE3 4.42Å; E117-W119 HydrophobicContact CB-CH2 3.58Å; E117-W119 HydrophobicContact CB-CZ2 4.16Å; E117-W119 HydrophobicContact CB-CZ3 3.71Å; W119-L121 HydrophobicContact CB-CD1 3.85Å; W119-L121 HydrophobicContact CB-CD2 4.13Å; W119-L121 HydrophobicContact CB-CG 3.8Å; W119-L121 PolarHBondContact O-N 2.8Å; W119-V159 HydrophobicContact CH2-CG1 4.34Å; W119-V159 HydrophobicContact CZ2-CG1 4.02Å; W119-L162 HydrophobicContact CH2-CB 4.08Å; W119-L162 HydrophobicContact CH2-CD1 3.94Å; W119-L162 HydrophobicContact CZ2-CB 3.9Å; W119-L162 HydrophobicContact CZ3-CD1 4.41Å; W119-Q163 VanDerWaalsContact CD1-OE1 3.29Å; W119-F166 HydrophobicContact CB-CD2 4.4Å; W119-F166 HydrophobicContact CB-CE2 4.49Å; W119-F166 AromaticContact CD1-CD2 3.84Å; W119-F166 AromaticContact CD2-CD2 3.9Å; W119-F166 HydrophobicContact CD2-CD2 3.9Å; W119-F166 AromaticContact CD2-CE2 3.7Å; W119-F166 HydrophobicContact CD2-CE2 3.7Å; W119-F166 AromaticContact CE3-CE2 3.95Å; W119-F166 HydrophobicContact CE3-CE2 3.95Å; W119-F166 AromaticContact CG-CD2 3.79Å; W119-F166 HydrophobicContact CG-CD2 3.79Å; W119-F166 AromaticContact CG-CE2 3.96Å; W119-F166 HydrophobicContact CG-CE2 3.96Å; W119-F166 HydrophobicContact CZ3-CE2 4.48Å; W119-F166 AromaticContact NE1-CD2 3.95Å
120	S	98.1	Very high	96.4	Very high	34 Å²	34	46.8 Å²	46.8	24%	0.238	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	108.7	170.8	-67.8	0	0	0	0	109.7
121	L	97.9	Very high	96.3	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	-179	-167.6	-58.9	179.9	0	0	0	111.9	F102 S108 D109 I110 I112 W119 L126 F166 Y170	F102-L121 HydrophobicContact CD2-CD2 3.62Å; F102-L121 HydrophobicContact CE2-CD2 3.7Å; S108-L121 CarbonylContact C-O 3.59Å; S108-L121 VanDerWaalsContact CA-O 3.25Å; S108-L121 WeakPolarHBondContact CA-O 3.38Å; S108-L121 WeakPolarHBondContact CB-O 3.42Å; D109-L121 PolarHBondContact N-O 3.13Å; D109-L121 VanDerWaalsContact N-O 3.15Å; I110-L121 HydrophobicContact CG2-CB 4.25Å; I110-L121 WeakPolarHBondContact CG2-O 3.38Å; I110-L121 PolarHBondContact N-O 3.38Å; I110-L121 CarbonylContact O-C 3.53Å; I110-L121 PolarHBondContact O-N 2.83Å; I110-L121 VanDerWaalsContact O-O 3.07Å; I112-L121 HydrophobicContact CB-CD1 4.38Å; I112-L121 HydrophobicContact CG1-CD1 3.86Å; W119-L121 HydrophobicContact CB-CD1 3.85Å; W119-L121 HydrophobicContact CB-CD2 4.13Å; W119-L121 HydrophobicContact CB-CG 3.8Å; W119-L121 PolarHBondContact O-N 2.8Å; L121-L126 HydrophobicContact CB-CD1 4.23Å; L121-L126 HydrophobicContact CB-CG 4.4Å; L121-L126 HydrophobicContact CD1-CD1 4.42Å; L121-L126 HydrophobicContact CD1-CD2 3.9Å; L121-F166 HydrophobicContact CD1-CB 4.22Å; L121-F166 HydrophobicContact CD1-CD1 3.66Å; L121-F166 HydrophobicContact CD1-CD2 4.23Å; L121-F166 HydrophobicContact CD1-CE1 4.01Å; L121-F166 HydrophobicContact CD1-CG 3.8Å; L121-F166 HydrophobicContact CD1-CZ 4.46Å; L121-F166 HydrophobicContact CD2-CB 4.41Å; L121-Y170 HydrophobicContact CD2-CE2 4.2Å
122	H	96.8	Very high	96.2	Very high	15 Å²	15	46.6 Å²	46.6	7%	0.069	26%	0.261	C	S	.	.			trans	-125.4	123.4	-174.4	-61.6	81.2	0	0	0	110.2	L101 E106 N107 S108 D109 I124 Y125 L126 Y170	L101-H122 PolarHBondContact O-CE1 3.02Å; L101-H122 VanDerWaalsContact O-CE1 3.29Å; E106-H122 PolarHBondContact O-NE2 3.19Å; N107-H122 PolarHBondContact O-NE2 3.15Å; S108-H122 PolarHBondContact N-NE2 3.15Å; D109-H122 VanDerWaalsContact OD1-CA 3.23Å; D109-H122 WeakPolarHBondContact OD1-CA 3.36Å; H122-I124 HydrophobicContact CB-CG2 4.24Å; H122-I124 PolarHBondContact O-N 3.38Å; H122-Y125 HydrophobicContact CB-CD2 3.77Å; H122-Y125 PolarHBondContact O-N 2.9Å; H122-L126 PolarHBondContact O-N 3.15Å; H122-Y170 HydrophobicContact CB-CE1 4.47Å; H122-Y170 PolarHBondContact N-OH 2.7Å; H122-Y170 AromaticContact ND1-CE1 3.65Å; H122-Y170 AromaticContact ND1-CZ 3.81Å; H122-Y170 PolarHBondContact ND1-OH 3.41Å; H122-Y170 VanDerWaalsContact ND1-OH 3.12Å
123	K	94.2	Very high	96	Very high	40 Å²	40	49 Å²	49	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-54	-40.5	-179.9	-71.2	-178.9	178	-176.7	0	111.8	D109 I110 Y125 L126 C127 F136 S143 M145	D109-K123 PolarHBondContact OD1-N 2.91Å; I110-K123 HydrophobicContact CB-CG 4.01Å; I110-K123 HydrophobicContact CD1-CG 4.25Å; I110-K123 HydrophobicContact CG2-CG 3.8Å; K123-Y125 VanDerWaalsContact C-N 3.32Å; K123-Y125 PolarHBondContact O-N 3.41Å; K123-L126 PolarHBondContact O-N 2.89Å; K123-C127 PolarHBondContact O-N 2.83Å; K123-C127 PolarHBondContact O-SG 2.83Å; K123-F136 HydrophobicContact CB-CE2 4.42Å; K123-F136 HydrophobicContact CG-CD2 4.49Å; K123-F136 HydrophobicContact CG-CE2 4.2Å; K123-F136 HydrophobicContact CG-CZ 4.41Å; K123-S143 PolarHBondContact NZ-O 3.44Å; K123-S143 VanDerWaalsContact NZ-O 3.15Å; K123-M145 WeakPolarHBondContact CE-O 3.39Å; K123-M145 PolarHBondContact NZ-O 3.32Å
124	I	94.6	Very high	95.7	Very high	135 Å²	135	50.8 Å²	50.8	69%	0.692	29%	0.29	S	S	*	.	H	α-helix	trans	-59.6	-36.7	178.1	-168.2	169.8	0	0	0	113.6	H122	H122-I124 HydrophobicContact CB-CG2 4.24Å; H122-I124 PolarHBondContact O-N 3.38Å
125	Y	96.1	Very high	95.4	Very high	50 Å²	50	51.9 Å²	51.9	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-80.9	-37.6	176.7	-76.2	-84.5	0	0	0	111.5	I97 L101 H122 K123 C127 Q128 L169 Y170	I97-Y125 HydrophobicContact CG2-CE1 4.13Å; I97-Y125 WeakPolarHBondContact CG2-OH 3.45Å; L101-Y125 HydrophobicContact CD1-CE2 3.7Å; H122-Y125 HydrophobicContact CB-CD2 3.77Å; H122-Y125 PolarHBondContact O-N 2.9Å; K123-Y125 VanDerWaalsContact C-N 3.32Å; K123-Y125 PolarHBondContact O-N 3.41Å; Y125-C127 VanDerWaalsContact C-N 3.33Å; Y125-C127 PolarHBondContact O-N 3.37Å; Y125-Q128 WeakPolarHBondContact O-CB 3.38Å; Y125-Q128 WeakPolarHBondContact O-CG 3.26Å; Y125-Q128 PolarHBondContact O-N 2.92Å; Y125-Q128 PolarHBondContact O-NE2 2.81Å; Y125-L169 VanDerWaalsContact CD1-O 3.28Å; Y125-L169 WeakPolarHBondContact CD1-O 3.43Å; Y125-Y170 AromaticContact CD1-CD1 3.74Å; Y125-Y170 HydrophobicContact CD1-CD1 3.74Å; Y125-Y170 AromaticContact CD1-CE1 3.99Å; Y125-Y170 HydrophobicContact CD1-CE1 3.99Å; Y125-Y170 HydrophobicContact CD1-CG 4.16Å; Y125-Y170 AromaticContact CD2-CD1 3.88Å; Y125-Y170 HydrophobicContact CD2-CD1 3.88Å; Y125-Y170 AromaticContact CD2-CE1 3.39Å; Y125-Y170 HydrophobicContact CD2-CE1 3.39Å; Y125-Y170 AromaticContact CE1-CD1 3.87Å; Y125-Y170 HydrophobicContact CE1-CD1 3.87Å; Y125-Y170 HydrophobicContact CE1-CE1 4.39Å; Y125-Y170 HydrophobicContact CE1-CG 4.47Å; Y125-Y170 HydrophobicContact CE2-CD1 4.01Å; Y125-Y170 AromaticContact CE2-CE1 3.85Å; Y125-Y170 HydrophobicContact CE2-CE1 3.85Å; Y125-Y170 AromaticContact CG-CD1 3.72Å; Y125-Y170 HydrophobicContact CG-CD1 3.72Å; Y125-Y170 AromaticContact CG-CE1 3.46Å; Y125-Y170 HydrophobicContact CG-CE1 3.46Å; Y125-Y170 VanDerWaalsContact CG-CE1 3.46Å; Y125-Y170 HydrophobicContact CG-CG 4.38Å; Y125-Y170 AromaticContact CG-CZ 3.91Å
126	L	96.1	Very high	95	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-34.7	174.9	-72.3	-177.2	0	0	0	112.7	I110 I112 L121 H122 K123 Q128 S129 F132 F136 F166 L169	I110-L126 HydrophobicContact CG2-CD1 3.8Å; I112-L126 HydrophobicContact CD1-CD1 4.19Å; I112-L126 HydrophobicContact CG1-CD1 4.2Å; L121-L126 HydrophobicContact CB-CD1 4.23Å; L121-L126 HydrophobicContact CB-CG 4.4Å; L121-L126 HydrophobicContact CD1-CD1 4.42Å; L121-L126 HydrophobicContact CD1-CD2 3.9Å; H122-L126 PolarHBondContact O-N 3.15Å; K123-L126 PolarHBondContact O-N 2.89Å; L126-Q128 PolarHBondContact O-N 2.89Å; L126-S129 VanDerWaalsContact O-CB 3.31Å; L126-S129 WeakPolarHBondContact O-CB 3.21Å; L126-S129 PolarHBondContact O-N 3.33Å; L126-F132 HydrophobicContact CB-CB 3.94Å; L126-F132 HydrophobicContact CB-CD2 4.3Å; L126-F132 HydrophobicContact CB-CG 4.1Å; L126-F132 HydrophobicContact CD1-CD1 4.34Å; L126-F132 HydrophobicContact CD1-CG 4.41Å; L126-F132 HydrophobicContact CD2-CD2 3.79Å; L126-F132 HydrophobicContact CD2-CE2 3.89Å; L126-F132 HydrophobicContact CD2-CG 4.28Å; L126-F132 HydrophobicContact CD2-CZ 4.46Å; L126-F132 HydrophobicContact CG-CD2 4.48Å; L126-F132 WeakPolarHBondContact O-CB 3.41Å; L126-F136 HydrophobicContact CB-CE2 3.78Å; L126-F136 HydrophobicContact CD1-CE2 4Å; L126-F136 HydrophobicContact CD1-CZ 4Å; L126-F166 HydrophobicContact CD2-CD1 4.18Å; L126-F166 HydrophobicContact CD2-CE1 4.45Å; L126-L169 HydrophobicContact CD2-CD1 3.78Å
127	C	94.4	Very high	94.5	Very high	58 Å²	58	48.1 Å²	48.1	39%	0.392	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-6.9	176.1	-72.9	0	0	0	0	115.2	K123 Y125 S129 S133	K123-C127 PolarHBondContact O-N 2.83Å; K123-C127 PolarHBondContact O-SG 2.83Å; Y125-C127 VanDerWaalsContact C-N 3.33Å; Y125-C127 PolarHBondContact O-N 3.37Å; C127-S129 VanDerWaalsContact C-N 3.32Å; C127-S133 WeakPolarHBondContact O-CB 3.35Å
128	Q	94.5	Very high	93.2	Very high	123 Å²	123	46 Å²	46	58%	0.575	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-19.5	169.2	-62.2	175.3	98.9	0	0	112.7	Y125 L126 L169	Y125-Q128 WeakPolarHBondContact O-CB 3.38Å; Y125-Q128 WeakPolarHBondContact O-CG 3.26Å; Y125-Q128 PolarHBondContact O-N 2.92Å; Y125-Q128 PolarHBondContact O-NE2 2.81Å; L126-Q128 PolarHBondContact O-N 2.89Å; Q128-L169 HydrophobicContact CB-CD2 3.92Å; Q128-L169 PolarHBondContact NE2-O 2.76Å
129	S	96.8	Very high	91.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.007	29%	0.289	C	S	.	.	S	Bend	trans	-80.4	133.5	171	149.3	0	0	0	0	110	L126 C127 Y131 F132 S133 L191	L126-S129 VanDerWaalsContact O-CB 3.31Å; L126-S129 WeakPolarHBondContact O-CB 3.21Å; L126-S129 PolarHBondContact O-N 3.33Å; C127-S129 VanDerWaalsContact C-N 3.32Å; S129-Y131 PolarHBondContact O-N 3.28Å; S129-Y131 PolarHBondContact OG-N 3.34Å; S129-F132 PolarHBondContact O-N 3.37Å; S129-F132 WeakPolarHBondContact OG-CD2 3.39Å; S129-F132 PolarHBondContact OG-N 3.23Å; S129-F132 VanDerWaalsContact OG-N 3.16Å; S129-S133 WeakPolarHBondContact O-CB 3.46Å; S129-S133 PolarHBondContact O-N 2.59Å; S129-L191 VanDerWaalsContact CB-O 3.3Å; S129-L191 WeakPolarHBondContact CB-O 3.15Å; S129-L191 PolarHBondContact OG-O 3.25Å
130	G	95.5	Very high	90.1	Very high	25 Å²	25	55 Å²	55	26%	0.258	32%	0.316	S	S	.	.	H	α-helix	trans	-59.5	-36.2	175	0	0	0	0	0	112.9	S134 Q192	G130-S134 WeakPolarHBondContact O-CB 3.45Å; G130-S134 PolarHBondContact O-N 3.4Å; G130-S134 PolarHBondContact O-OG 3.43Å; G130-Q192 PolarHBondContact N-O 2.97Å
131	Y	95.1	Very high	88.6	Confident	68 Å²	68	60.7 Å²	60.7	27%	0.267	34%	0.336	S	S	.	.	H	α-helix	trans	-63.1	-56.1	177.5	179	-89.4	0	0	0	111.6	S129 S134 M135 L150 L191	S129-Y131 PolarHBondContact O-N 3.28Å; S129-Y131 PolarHBondContact OG-N 3.34Å; Y131-S134 PolarHBondContact O-N 3.3Å; Y131-M135 HydrophobicContact CD1-CE 4.41Å; Y131-M135 HydrophobicContact CE1-CE 3.44Å; Y131-M135 VanDerWaalsContact CE1-CE 3.44Å; Y131-M135 HydrophobicContact CE1-SD 4.42Å; Y131-M135 WeakPolarHBondContact O-CB 3.47Å; Y131-M135 PolarHBondContact O-N 3.01Å; Y131-M135 WeakPolarHBondContact OH-CE 3.45Å; Y131-L150 HydrophobicContact CE1-CD1 3.77Å; Y131-L150 WeakPolarHBondContact OH-CD1 3.5Å; Y131-L191 HydrophobicContact CD1-CD2 4.27Å
132	F	94.9	Very high	87.4	Confident	1 Å²	1	63.3 Å²	63.3	0%	0.004	35%	0.348	C	S	.	.	H	α-helix	trans	-73.7	-34.7	-178	-70.4	-66.6	0	0	0	113	I112 L126 S129 S134 M135 F136 F166 L191	I112-F132 HydrophobicContact CD1-CE1 3.8Å; I112-F132 HydrophobicContact CD1-CZ 4.28Å; I112-F132 HydrophobicContact CG1-CE1 4.4Å; I112-F132 HydrophobicContact CG1-CZ 4.39Å; L126-F132 HydrophobicContact CB-CB 3.94Å; L126-F132 HydrophobicContact CB-CD2 4.3Å; L126-F132 HydrophobicContact CB-CG 4.1Å; L126-F132 HydrophobicContact CD1-CD1 4.34Å; L126-F132 HydrophobicContact CD1-CG 4.41Å; L126-F132 HydrophobicContact CD2-CD2 3.79Å; L126-F132 HydrophobicContact CD2-CE2 3.89Å; L126-F132 HydrophobicContact CD2-CG 4.28Å; L126-F132 HydrophobicContact CD2-CZ 4.46Å; L126-F132 HydrophobicContact CG-CD2 4.48Å; L126-F132 WeakPolarHBondContact O-CB 3.41Å; S129-F132 PolarHBondContact O-N 3.37Å; S129-F132 WeakPolarHBondContact OG-CD2 3.39Å; S129-F132 PolarHBondContact OG-N 3.23Å; S129-F132 VanDerWaalsContact OG-N 3.16Å; F132-S134 VanDerWaalsContact C-N 3.26Å; F132-S134 PolarHBondContact O-N 3.04Å; F132-M135 HydrophobicContact CD1-SD 4.02Å; F132-M135 HydrophobicContact CE1-SD 4.31Å; F132-M135 PolarHBondContact O-N 3.31Å; F132-F136 HydrophobicContact CB-CD2 4.26Å; F132-F136 HydrophobicContact CB-CE2 3.78Å; F132-F136 HydrophobicContact CB-CZ 4.27Å; F132-F136 HydrophobicContact CD1-CE2 4.2Å; F132-F136 AromaticContact CD1-CZ 3.83Å; F132-F136 HydrophobicContact CD1-CZ 3.83Å; F132-F136 HydrophobicContact CG-CE2 4.33Å; F132-F136 HydrophobicContact CG-CZ 4.42Å; F132-F136 WeakPolarHBondContact O-CD2 3.3Å; F132-F136 WeakPolarHBondContact O-CG 3.31Å; F132-F136 PolarHBondContact O-N 2.89Å; F132-F166 AromaticContact CE2-CE1 3.78Å; F132-F166 HydrophobicContact CE2-CE1 3.78Å; F132-F166 AromaticContact CZ-CE1 3.9Å; F132-F166 HydrophobicContact CZ-CE1 3.9Å; F132-L191 HydrophobicContact CE2-CD1 4.33Å; F132-L191 HydrophobicContact CE2-CD2 3.61Å; F132-L191 HydrophobicContact CE2-CG 4.45Å; F132-L191 HydrophobicContact CZ-CD2 3.98Å
133	S	93.6	Very high	86.1	Confident	51 Å²	51	64.5 Å²	64.5	36%	0.357	36%	0.359	S	S	.	.	H	α-helix	trans	-56.3	-44.6	170.9	-176	0	0	0	0	110.8	C127 S129 S137	C127-S133 WeakPolarHBondContact O-CB 3.35Å; S129-S133 WeakPolarHBondContact O-CB 3.46Å; S129-S133 PolarHBondContact O-N 2.59Å; S133-S137 WeakPolarHBondContact O-CB 3.46Å; S133-S137 PolarHBondContact O-N 2.81Å; S133-S137 PolarHBondContact O-OG 2.8Å
134	S	91.2	Very high	85.2	Confident	68 Å²	68	67 Å²	67	48%	0.476	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-46.6	177.4	-59.4	0	0	0	0	111.5	G130 Y131 F132 F136 S137	G130-S134 WeakPolarHBondContact O-CB 3.45Å; G130-S134 PolarHBondContact O-N 3.4Å; G130-S134 PolarHBondContact O-OG 3.43Å; Y131-S134 PolarHBondContact O-N 3.3Å; F132-S134 VanDerWaalsContact C-N 3.26Å; F132-S134 PolarHBondContact O-N 3.04Å; S134-F136 PolarHBondContact O-N 3.03Å; S134-S137 PolarHBondContact O-N 2.82Å; S134-S137 PolarHBondContact O-OG 3.42Å
135	M	89.9	Confident	84.8	Confident	31 Å²	31	63 Å²	63	15%	0.153	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-38.5	179.7	-179.7	-178.1	-79.4	0	0	113.8	Y131 F132 E142 I148	Y131-M135 HydrophobicContact CD1-CE 4.41Å; Y131-M135 HydrophobicContact CE1-CE 3.44Å; Y131-M135 VanDerWaalsContact CE1-CE 3.44Å; Y131-M135 HydrophobicContact CE1-SD 4.42Å; Y131-M135 WeakPolarHBondContact O-CB 3.47Å; Y131-M135 PolarHBondContact O-N 3.01Å; Y131-M135 WeakPolarHBondContact OH-CE 3.45Å; F132-M135 HydrophobicContact CD1-SD 4.02Å; F132-M135 HydrophobicContact CE1-SD 4.31Å; F132-M135 PolarHBondContact O-N 3.31Å; M135-E142 HydrophobicContact CG-CB 3.81Å; M135-E142 HydrophobicContact CG-CG 4.29Å; M135-E142 HydrophobicContact SD-CB 4.48Å; M135-I148 HydrophobicContact CE-CG2 4.36Å; M135-I148 HydrophobicContact CG-CD1 4.49Å; M135-I148 HydrophobicContact SD-CD1 3.5Å; M135-I148 VanDerWaalsContact SD-CD1 3.5Å; M135-I148 HydrophobicContact SD-CG2 4.14Å
136	F	89.1	Confident	84.4	Confident	30 Å²	30	65.6 Å²	65.6	13%	0.132	38%	0.377	C	S	.	.	H	α-helix	trans	-87.3	-16.4	179.1	-55.6	-33.7	0	0	0	113.3	I110 K123 L126 F132 S134 I148	I110-F136 HydrophobicContact CD1-CE1 3.68Å; I110-F136 HydrophobicContact CD1-CZ 3.49Å; I110-F136 VanDerWaalsContact CD1-CZ 3.49Å; K123-F136 HydrophobicContact CB-CE2 4.42Å; K123-F136 HydrophobicContact CG-CD2 4.49Å; K123-F136 HydrophobicContact CG-CE2 4.2Å; K123-F136 HydrophobicContact CG-CZ 4.41Å; L126-F136 HydrophobicContact CB-CE2 3.78Å; L126-F136 HydrophobicContact CD1-CE2 4Å; L126-F136 HydrophobicContact CD1-CZ 4Å; F132-F136 HydrophobicContact CB-CD2 4.26Å; F132-F136 HydrophobicContact CB-CE2 3.78Å; F132-F136 HydrophobicContact CB-CZ 4.27Å; F132-F136 HydrophobicContact CD1-CE2 4.2Å; F132-F136 AromaticContact CD1-CZ 3.83Å; F132-F136 HydrophobicContact CD1-CZ 3.83Å; F132-F136 HydrophobicContact CG-CE2 4.33Å; F132-F136 HydrophobicContact CG-CZ 4.42Å; F132-F136 WeakPolarHBondContact O-CD2 3.3Å; F132-F136 WeakPolarHBondContact O-CG 3.31Å; F132-F136 PolarHBondContact O-N 2.89Å; S134-F136 PolarHBondContact O-N 3.03Å; F136-I148 HydrophobicContact CE1-CD1 3.71Å; F136-I148 HydrophobicContact CZ-CD1 4.39Å
137	S	82.3	Confident	84.3	Confident	66 Å²	66	70.2 Å²	70.2	46%	0.462	40%	0.401	S	S	.	.	S	Bend	trans	-80.4	126	176.9	71.5	0	0	0	0	112.4	S133 S134 W140	S133-S137 WeakPolarHBondContact O-CB 3.46Å; S133-S137 PolarHBondContact O-N 2.81Å; S133-S137 PolarHBondContact O-OG 2.8Å; S134-S137 PolarHBondContact O-N 2.82Å; S134-S137 PolarHBondContact O-OG 3.42Å; S137-W140 VanDerWaalsContact O-CD1 3.28Å
138	G	70	Confident	84.3	Confident	61 Å²	61	68 Å²	68	63%	0.629	39%	0.385	S	S	*	.	S	Bend	trans	96.6	-150.6	172	0	0	0	0	0	114.7
139	S	65.4	Low	84.3	Confident	132 Å²	132	70.1 Å²	70.1	92%	0.923	40%	0.395	S	S	*	.	S	Bend	trans	-102.2	24.2	-170.1	-50.9	0	0	0	0	114
140	W	66.7	Low	84.2	Confident	165 Å²	165	70.5 Å²	70.5	63%	0.625	40%	0.397	S	S	*	.			trans	-66.9	147.4	175.4	-67.1	90.7	0	0	0	110.8	S137 E142 S143	S137-W140 VanDerWaalsContact O-CD1 3.28Å; W140-E142 WeakPolarHBondContact CB-OE2 3.33Å; W140-E142 PolarHBondContact O-N 3.39Å; W140-S143 WeakPolarHBondContact O-CB 3.28Å; W140-S143 PolarHBondContact O-N 2.76Å; W140-S143 PolarHBondContact O-OG 2.65Å
141	K	65.3	Low	84.2	Confident	154 Å²	154	77.4 Å²	77.4	67%	0.67	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-61.6	-36	-178.2	-169.2	-171.2	173.5	-166.6	0	110.5	S143 S144 M145	K141-S143 VanDerWaalsContact C-N 3.29Å; K141-S143 PolarHBondContact O-N 3.01Å; K141-S144 PolarHBondContact O-N 2.84Å; K141-S144 PolarHBondContact O-OG 3.18Å; K141-M145 HydrophobicContact CB-CE 4.02Å; K141-M145 HydrophobicContact CD-CE 3.52Å; K141-M145 HydrophobicContact CG-CE 3.55Å
142	E	72.5	Confident	84.3	Confident	55 Å²	55	75.8 Å²	75.8	26%	0.257	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-59.9	-30.9	179.8	-64.2	64.6	-140.9	0	0	112.6	M135 W140 S144 M145 I148	M135-E142 HydrophobicContact CG-CB 3.81Å; M135-E142 HydrophobicContact CG-CG 4.29Å; M135-E142 HydrophobicContact SD-CB 4.48Å; W140-E142 WeakPolarHBondContact CB-OE2 3.33Å; W140-E142 PolarHBondContact O-N 3.39Å; E142-S144 PolarHBondContact O-N 3.36Å; E142-M145 HydrophobicContact CG-CE 4.46Å; E142-M145 WeakPolarHBondContact O-CB 3.39Å; E142-M145 PolarHBondContact O-N 3.09Å; E142-I148 HydrophobicContact CB-CD1 4.3Å
143	S	69.9	Low	84.2	Confident	41 Å²	41	80.9 Å²	80.9	29%	0.287	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-55.5	-37.1	176.9	66.5	0	0	0	0	112.5	K123 W140 K141	K123-S143 PolarHBondContact NZ-O 3.44Å; K123-S143 VanDerWaalsContact NZ-O 3.15Å; W140-S143 WeakPolarHBondContact O-CB 3.28Å; W140-S143 PolarHBondContact O-N 2.76Å; W140-S143 PolarHBondContact O-OG 2.65Å; K141-S143 VanDerWaalsContact C-N 3.29Å; K141-S143 PolarHBondContact O-N 3.01Å
144	S	75.5	Confident	84.3	Confident	92 Å²	92	80.4 Å²	80.4	64%	0.643	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-90	-4.5	179.3	70.9	0	0	0	0	114.5	K141 E142	K141-S144 PolarHBondContact O-N 2.84Å; K141-S144 PolarHBondContact O-OG 3.18Å; E142-S144 PolarHBondContact O-N 3.36Å
145	M	85	Confident	84.5	Confident	52 Å²	52	86.5 Å²	86.5	26%	0.256	47%	0.466	S	S	.	.			trans	-83.6	151.5	-179.8	-63.9	-169.3	-163.9	0	0	112.1	K123 K141 E142 I148	K123-M145 WeakPolarHBondContact CE-O 3.39Å; K123-M145 PolarHBondContact NZ-O 3.32Å; K141-M145 HydrophobicContact CB-CE 4.02Å; K141-M145 HydrophobicContact CD-CE 3.52Å; K141-M145 HydrophobicContact CG-CE 3.55Å; E142-M145 HydrophobicContact CG-CE 4.46Å; E142-M145 WeakPolarHBondContact O-CB 3.39Å; E142-M145 PolarHBondContact O-N 3.09Å; M145-I148 HydrophobicContact CB-CG1 4.39Å
146	N	87.9	Confident	84.8	Confident	103 Å²	103	88.9 Å²	88.9	55%	0.551	48%	0.479	S	S	*	.	S	Bend	trans	-113.9	-1.2	173.7	-61.5	-2.5	0	0	0	112.2	I110 K111	I110-N146 CarbonylContact C-O 3.54Å; I110-N146 WeakPolarHBondContact CA-O 3.5Å; K111-N146 PolarHBondContact N-O 3.41Å
147	I	94.5	Very high	85.3	Confident	97 Å²	97	87.9 Å²	87.9	50%	0.497	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	132.5	173.3	-53	-179.6	0	0	0	106.9	K111	K111-I147 HydrophobicContact CB-CG1 4.3Å; K111-I147 HydrophobicContact CB-CG2 4.46Å; K111-I147 HydrophobicContact CD-CG1 4.4Å; K111-I147 CarbonylContact O-C 3.56Å; K111-I147 VanDerWaalsContact O-CA 3.31Å; K111-I147 WeakPolarHBondContact O-CA 3.4Å
148	I	94.3	Very high	86	Confident	11 Å²	11	87.2 Å²	87.2	6%	0.056	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	126.9	178.1	-59.3	-169.9	0	0	0	109.3	I110 K111 I112 C113 M135 F136 E142 M145	I110-I148 HydrophobicContact CD1-CD1 3.76Å; I110-I148 HydrophobicContact CD1-CG1 4.07Å; K111-I148 PolarHBondContact O-N 2.83Å; I112-I148 CarbonylContact C-O 3.59Å; I112-I148 WeakPolarHBondContact CA-O 3Å; I112-I148 HydrophobicContact CD1-CB 3.9Å; I112-I148 HydrophobicContact CD1-CG1 4.47Å; C113-I148 PolarHBondContact N-O 2.93Å; M135-I148 HydrophobicContact CE-CG2 4.36Å; M135-I148 HydrophobicContact CG-CD1 4.49Å; M135-I148 HydrophobicContact SD-CD1 3.5Å; M135-I148 VanDerWaalsContact SD-CD1 3.5Å; M135-I148 HydrophobicContact SD-CG2 4.14Å; F136-I148 HydrophobicContact CE1-CD1 3.71Å; F136-I148 HydrophobicContact CZ-CD1 4.39Å; E142-I148 HydrophobicContact CB-CD1 4.3Å; M145-I148 HydrophobicContact CB-CG1 4.39Å
149	E	94.9	Very high	87.3	Confident	169 Å²	169	87 Å²	87	79%	0.79	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.6	168.8	-65.6	-173.1	-161.7	0	0	109.1	C113	C113-E149 HydrophobicContact CB-CG 4.26Å; C113-E149 WeakPolarHBondContact O-CA 3.3Å
150	L	94.9	Very high	88.8	Confident	8 Å²	8	85.2 Å²	85.2	4%	0.042	43%	0.43	C	S	.	.			trans	-101.1	111.7	-178.7	174.6	68.5	0	0	0	109.4	I112 C113 A114 Y131 I152 F166 L191	I112-L150 HydrophobicContact CG2-CB 3.88Å; I112-L150 HydrophobicContact CG2-CD2 4.21Å; C113-L150 PolarHBondContact O-N 3.44Å; A114-L150 HydrophobicContact CB-CB 4.19Å; Y131-L150 HydrophobicContact CE1-CD1 3.77Å; Y131-L150 WeakPolarHBondContact OH-CD1 3.5Å; L150-I152 HydrophobicContact CD2-CD1 3.88Å; L150-I152 HydrophobicContact CG-CD1 3.84Å; L150-F166 HydrophobicContact CD2-CZ 4.19Å; L150-L191 HydrophobicContact CD2-CD2 4.01Å
151	E	94.9	Very high	90.3	Very high	170 Å²	170	77.4 Å²	77.4	79%	0.794	40%	0.4	S	S	*	.			trans	-69	132.2	174.3	-64.7	-173.5	172	0	0	111.1	P153	E151-P153 VanDerWaalsContact O-CD 3.28Å; E151-P153 WeakPolarHBondContact O-CD 3.3Å
152	I	96.6	Very high	91.9	Very high	35 Å²	35	70 Å²	70	18%	0.179	37%	0.368	C	S	.	.			trans	-114.8	90.2	179.8	-54.3	-58.7	0	0	0	109.1	A114 L115 L150 I157 L162 L190	A114-I152 HydrophobicContact CB-CD1 4.3Å; A114-I152 HydrophobicContact CB-CG1 4.1Å; L115-I152 HydrophobicContact CD2-CB 3.92Å; L115-I152 HydrophobicContact CD2-CG1 4.01Å; L115-I152 HydrophobicContact CD2-CG2 4.17Å; L115-I152 HydrophobicContact CG-CB 4.44Å; L115-I152 HydrophobicContact CG-CG1 4Å; L150-I152 HydrophobicContact CD2-CD1 3.88Å; L150-I152 HydrophobicContact CG-CD1 3.84Å; I152-I157 HydrophobicContact CD1-CG2 4.46Å; I152-I157 HydrophobicContact CG2-CB 3.59Å; I152-I157 HydrophobicContact CG2-CD1 4.18Å; I152-I157 HydrophobicContact CG2-CG1 4.41Å; I152-I157 HydrophobicContact CG2-CG2 3.7Å; I152-L162 HydrophobicContact CD1-CD1 3.98Å; I152-L162 HydrophobicContact CD1-CD2 4.21Å; I152-L162 HydrophobicContact CG1-CD1 4.3Å; I152-L190 HydrophobicContact CD1-CD2 3.57Å
153	P	93.7	Very high	93	Very high	108 Å²	108	70.3 Å²	70.3	70%	0.701	37%	0.369	S	S	*	.			trans	-80.7	-18.3	-178.6	31.3	-35.9	0	0	0	113.8	E151	E151-P153 VanDerWaalsContact O-CD 3.28Å; E151-P153 WeakPolarHBondContact O-CD 3.3Å
154	D	95.9	Very high	94.3	Very high	41 Å²	41	69.5 Å²	69.5	22%	0.219	36%	0.362	C	S	.	.			trans	-91.5	116	179.8	-173.1	-11.6	0	0	0	111.1	N156 I157 Y223	D154-N156 PolarHBondContact O-N 3.08Å; D154-N156 VanDerWaalsContact O-N 3.15Å; D154-N156 WeakPolarHBondContact OD1-CB 3.2Å; D154-N156 PolarHBondContact OD1-N 3.04Å; D154-N156 PolarHBondContact OD1-ND2 3.39Å; D154-I157 HydrophobicContact CB-CD1 3.9Å; D154-I157 HydrophobicContact CB-CG1 4.08Å; D154-I157 WeakPolarHBondContact O-CB 3.26Å; D154-I157 PolarHBondContact O-N 3.47Å; D154-Y223 VanDerWaalsContact OD2-CE1 3.22Å; D154-Y223 WeakPolarHBondContact OD2-CE1 3.42Å; D154-Y223 VanDerWaalsContact OD2-CZ 3.32Å; D154-Y223 PolarHBondContact OD2-OH 3.49Å
155	Q	95.4	Very high	95.4	Very high	196 Å²	196	65.1 Å²	65.1	92%	0.916	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.8	-179.3	-61.2	175.5	25.1	0	0	113.9	I157	Q155-I157 VanDerWaalsContact C-N 3.29Å
156	N	96.5	Very high	96	Very high	80 Å²	80	62.6 Å²	62.6	43%	0.428	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-11.8	173.4	-60.2	-83.1	0	0	0	112.7	D154 A183 A186 Y223	D154-N156 PolarHBondContact O-N 3.08Å; D154-N156 VanDerWaalsContact O-N 3.15Å; D154-N156 WeakPolarHBondContact OD1-CB 3.2Å; D154-N156 PolarHBondContact OD1-N 3.04Å; D154-N156 PolarHBondContact OD1-ND2 3.39Å; N156-A183 VanDerWaalsContact O-CA 3.25Å; N156-A183 WeakPolarHBondContact O-CA 3.04Å; N156-A183 WeakPolarHBondContact O-CB 3.13Å; N156-A186 HydrophobicContact CB-CB 4.01Å; N156-Y223 PolarHBondContact ND2-OH 3.35Å
157	I	98.1	Very high	96.4	Very high	9 Å²	9	57.7 Å²	57.7	5%	0.046	29%	0.293	C	S	.	.			trans	-88.7	125.9	179.2	-59.6	176.1	0	0	0	109.3	I152 D154 Q155 L162 A186 A187 L190	I152-I157 HydrophobicContact CD1-CG2 4.46Å; I152-I157 HydrophobicContact CG2-CB 3.59Å; I152-I157 HydrophobicContact CG2-CD1 4.18Å; I152-I157 HydrophobicContact CG2-CG1 4.41Å; I152-I157 HydrophobicContact CG2-CG2 3.7Å; D154-I157 HydrophobicContact CB-CD1 3.9Å; D154-I157 HydrophobicContact CB-CG1 4.08Å; D154-I157 WeakPolarHBondContact O-CB 3.26Å; D154-I157 PolarHBondContact O-N 3.47Å; Q155-I157 VanDerWaalsContact C-N 3.29Å; I157-L162 HydrophobicContact CG2-CD1 4.17Å; I157-L162 HydrophobicContact CG2-CD2 3.9Å; I157-L162 HydrophobicContact CG2-CG 3.74Å; I157-A186 HydrophobicContact CD1-CB 4.25Å; I157-A186 HydrophobicContact CG1-CB 3.51Å; I157-A187 HydrophobicContact CG1-CB 4.49Å; I157-A187 HydrophobicContact CG2-CB 4.24Å; I157-L190 HydrophobicContact CD1-CB 3.86Å; I157-L190 HydrophobicContact CD1-CD2 3.64Å; I157-L190 HydrophobicContact CD1-CG 4.36Å
158	D	97.5	Very high	96.5	Very high	53 Å²	53	54.2 Å²	54.2	28%	0.283	28%	0.277	S	S	.	.			trans	-124.9	173.7	173.8	64	48.5	0	0	0	111.6	E160 A161 L162 R180	D158-E160 VanDerWaalsContact C-N 3.32Å; D158-E160 PolarHBondContact O-N 3.12Å; D158-E160 PolarHBondContact OD1-N 2.82Å; D158-E160 VanDerWaalsContact OD1-N 3.11Å; D158-A161 WeakPolarHBondContact O-CB 3.32Å; D158-A161 PolarHBondContact O-N 2.86Å; D158-A161 PolarHBondContact OD1-N 3.35Å; D158-L162 PolarHBondContact O-N 2.69Å; D158-R180 IonicContact OD1-CZ 2.73Å; D158-R180 IonicContact OD1-NH2 3.15Å; D158-R180 PolarHBondContact OD1-NH2 2.82Å; D158-R180 IonicContact OD2-CZ 2.62Å; D158-R180 IonicContact OD2-NH1 2.61Å; D158-R180 PolarHBondContact OD2-NH1 3.49Å; D158-R180 IonicContact OD2-NH2 2.68Å; D158-R180 PolarHBondContact OD2-NH2 3.3Å
159	V	97.9	Very high	96.6	Very high	55 Å²	55	54.4 Å²	54.4	33%	0.333	28%	0.278	S	S	.	.	H	α-helix	trans	-56.9	-41.3	-177.7	170.8	0	0	0	0	112.5	L115 E117 W119 L162 Q163	L115-V159 HydrophobicContact CB-CG2 3.93Å; L115-V159 HydrophobicContact CD1-CG2 4.17Å; E117-V159 HydrophobicContact CB-CG1 4.46Å; E117-V159 HydrophobicContact CG-CG1 3.81Å; E117-V159 HydrophobicContact CG-CG2 3.84Å; W119-V159 HydrophobicContact CH2-CG1 4.34Å; W119-V159 HydrophobicContact CZ2-CG1 4.02Å; V159-L162 PolarHBondContact O-N 3.29Å; V159-Q163 WeakPolarHBondContact O-CB 3.37Å; V159-Q163 PolarHBondContact O-N 2.89Å
160	E	96.9	Very high	96.6	Very high	96 Å²	96	46.6 Å²	46.6	45%	0.449	24%	0.242	S	C	.	.	H	α-helix	trans	-72.3	-35	-179.6	-178.2	-165.3	-159.4	0	0	110.8	D158 Q163 V164 R180	D158-E160 VanDerWaalsContact C-N 3.32Å; D158-E160 PolarHBondContact O-N 3.12Å; D158-E160 PolarHBondContact OD1-N 2.82Å; D158-E160 VanDerWaalsContact OD1-N 3.11Å; E160-Q163 WeakPolarHBondContact O-CB 3.42Å; E160-Q163 PolarHBondContact O-N 3.32Å; E160-V164 WeakPolarHBondContact O-CG2 3.41Å; E160-V164 PolarHBondContact O-N 3.4Å; E160-R180 IonicContact OE2-CZ 3.23Å; E160-R180 IonicContact OE2-NE 2.69Å; E160-R180 PolarHBondContact OE2-NE 2.76Å; E160-R180 IonicContact OE2-NH2 2.65Å; E160-R180 PolarHBondContact OE2-NH2 2.83Å
161	A	97.8	Very high	96.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-42.8	172.8	0	0	0	0	0	112.2	D158 V164 A165 A183 I184 A187	D158-A161 WeakPolarHBondContact O-CB 3.32Å; D158-A161 PolarHBondContact O-N 2.86Å; D158-A161 PolarHBondContact OD1-N 3.35Å; A161-V164 PolarHBondContact O-N 2.98Å; A161-A165 WeakPolarHBondContact O-CB 3.43Å; A161-A165 PolarHBondContact O-N 2.9Å; A161-A183 HydrophobicContact CB-CB 3.86Å; A161-A183 WeakPolarHBondContact CB-O 3.08Å; A161-I184 HydrophobicContact CB-CG1 4.47Å; A161-A187 HydrophobicContact CB-CB 4.11Å
162	L	98.1	Very high	95.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.2	-43.4	172.6	-70.9	174.2	0	0	0	111.8	A114 L115 W119 I152 I157 D158 V159 V164 A165 F166 A187 L191	A114-L162 HydrophobicContact CB-CD1 3.88Å; L115-L162 HydrophobicContact CD1-CD1 3.98Å; L115-L162 HydrophobicContact CG-CD1 4.38Å; W119-L162 HydrophobicContact CH2-CB 4.08Å; W119-L162 HydrophobicContact CH2-CD1 3.94Å; W119-L162 HydrophobicContact CZ2-CB 3.9Å; W119-L162 HydrophobicContact CZ3-CD1 4.41Å; I152-L162 HydrophobicContact CD1-CD1 3.98Å; I152-L162 HydrophobicContact CD1-CD2 4.21Å; I152-L162 HydrophobicContact CG1-CD1 4.3Å; I157-L162 HydrophobicContact CG2-CD1 4.17Å; I157-L162 HydrophobicContact CG2-CD2 3.9Å; I157-L162 HydrophobicContact CG2-CG 3.74Å; D158-L162 PolarHBondContact O-N 2.69Å; V159-L162 PolarHBondContact O-N 3.29Å; L162-V164 VanDerWaalsContact C-N 3.29Å; L162-V164 PolarHBondContact O-N 3.44Å; L162-A165 PolarHBondContact O-N 2.89Å; L162-A165 VanDerWaalsContact O-N 3.16Å; L162-F166 HydrophobicContact CB-CD2 4.3Å; L162-F166 HydrophobicContact CB-CE2 4Å; L162-F166 HydrophobicContact CD2-CE2 4.44Å; L162-F166 WeakPolarHBondContact O-CD2 3.34Å; L162-F166 WeakPolarHBondContact O-CG 3.39Å; L162-F166 PolarHBondContact O-N 2.91Å; L162-A187 HydrophobicContact CD2-CB 4.27Å; L162-L191 HydrophobicContact CD2-CD1 4.45Å
163	Q	97.3	Very high	95.1	Very high	61 Å²	61	52.2 Å²	52.2	29%	0.285	27%	0.273	S	S	.	.	H	α-helix	trans	-56.3	-42.6	174.1	-177.4	68.5	11.4	0	0	111.8	F102 W119 V159 E160 G167	F102-Q163 VanDerWaalsContact CE1-NE2 3.32Å; F102-Q163 HydrophobicContact CZ-CG 4.4Å; F102-Q163 VanDerWaalsContact CZ-O 3.25Å; F102-Q163 WeakPolarHBondContact CZ-O 3.35Å; W119-Q163 VanDerWaalsContact CD1-OE1 3.29Å; V159-Q163 WeakPolarHBondContact O-CB 3.37Å; V159-Q163 PolarHBondContact O-N 2.89Å; E160-Q163 WeakPolarHBondContact O-CB 3.42Å; E160-Q163 PolarHBondContact O-N 3.32Å; Q163-G167 PolarHBondContact O-N 3.42Å
164	V	97.1	Very high	94.8	Very high	23 Å²	23	47.5 Å²	47.5	14%	0.139	24%	0.242	C	C	.	.	H	α-helix	trans	-69.2	-41.8	176.4	172.1	0	0	0	0	111.4	E160 A161 L162 G167 S168 V174 I184	E160-V164 WeakPolarHBondContact O-CG2 3.41Å; E160-V164 PolarHBondContact O-N 3.4Å; A161-V164 PolarHBondContact O-N 2.98Å; L162-V164 VanDerWaalsContact C-N 3.29Å; L162-V164 PolarHBondContact O-N 3.44Å; V164-G167 PolarHBondContact O-N 3.05Å; V164-S168 PolarHBondContact O-N 2.88Å; V164-V174 HydrophobicContact CG1-CG1 3.69Å; V164-I184 HydrophobicContact CB-CD1 4.49Å; V164-I184 HydrophobicContact CB-CG1 4.28Å; V164-I184 HydrophobicContact CG1-CD1 4.08Å; V164-I184 HydrophobicContact CG1-CG1 4.13Å; V164-I184 HydrophobicContact CG1-CG2 3.84Å; V164-I184 HydrophobicContact CG2-CD1 4.46Å
165	A	97.6	Very high	94.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-50.1	-179.3	0	0	0	0	0	112.1	A161 L162 G167 S168 A187 L191 L193 L196	A161-A165 WeakPolarHBondContact O-CB 3.43Å; A161-A165 PolarHBondContact O-N 2.9Å; L162-A165 PolarHBondContact O-N 2.89Å; L162-A165 VanDerWaalsContact O-N 3.16Å; A165-G167 VanDerWaalsContact C-N 3.32Å; A165-G167 PolarHBondContact O-N 2.95Å; A165-S168 PolarHBondContact O-N 2.93Å; A165-S168 PolarHBondContact O-OG 2.53Å; A165-A187 HydrophobicContact CB-CB 3.96Å; A165-L191 HydrophobicContact CB-CD1 4.03Å; A165-L193 HydrophobicContact CB-CD1 3.85Å; A165-L196 HydrophobicContact CB-CD2 4.11Å
166	F	97.9	Very high	94.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-42.2	172.4	-63.8	-50.7	0	0	0	111.2	F102 I112 W119 L121 L126 F132 L150 L162 S168 L169 Y170 L191	F102-F166 HydrophobicContact CE2-CB 3.6Å; F102-F166 HydrophobicContact CZ-CB 4.06Å; I112-F166 HydrophobicContact CB-CZ 4.35Å; I112-F166 HydrophobicContact CG2-CZ 3.9Å; W119-F166 HydrophobicContact CB-CD2 4.4Å; W119-F166 HydrophobicContact CB-CE2 4.49Å; W119-F166 AromaticContact CD1-CD2 3.84Å; W119-F166 AromaticContact CD2-CD2 3.9Å; W119-F166 HydrophobicContact CD2-CD2 3.9Å; W119-F166 AromaticContact CD2-CE2 3.7Å; W119-F166 HydrophobicContact CD2-CE2 3.7Å; W119-F166 AromaticContact CE3-CE2 3.95Å; W119-F166 HydrophobicContact CE3-CE2 3.95Å; W119-F166 AromaticContact CG-CD2 3.79Å; W119-F166 HydrophobicContact CG-CD2 3.79Å; W119-F166 AromaticContact CG-CE2 3.96Å; W119-F166 HydrophobicContact CG-CE2 3.96Å; W119-F166 HydrophobicContact CZ3-CE2 4.48Å; W119-F166 AromaticContact NE1-CD2 3.95Å; L121-F166 HydrophobicContact CD1-CB 4.22Å; L121-F166 HydrophobicContact CD1-CD1 3.66Å; L121-F166 HydrophobicContact CD1-CD2 4.23Å; L121-F166 HydrophobicContact CD1-CE1 4.01Å; L121-F166 HydrophobicContact CD1-CG 3.8Å; L121-F166 HydrophobicContact CD1-CZ 4.46Å; L121-F166 HydrophobicContact CD2-CB 4.41Å; L126-F166 HydrophobicContact CD2-CD1 4.18Å; L126-F166 HydrophobicContact CD2-CE1 4.45Å; F132-F166 AromaticContact CE2-CE1 3.78Å; F132-F166 HydrophobicContact CE2-CE1 3.78Å; F132-F166 AromaticContact CZ-CE1 3.9Å; F132-F166 HydrophobicContact CZ-CE1 3.9Å; L150-F166 HydrophobicContact CD2-CZ 4.19Å; L162-F166 HydrophobicContact CB-CD2 4.3Å; L162-F166 HydrophobicContact CB-CE2 4Å; L162-F166 HydrophobicContact CD2-CE2 4.44Å; L162-F166 WeakPolarHBondContact O-CD2 3.34Å; L162-F166 WeakPolarHBondContact O-CG 3.39Å; L162-F166 PolarHBondContact O-N 2.91Å; F166-S168 VanDerWaalsContact C-N 3.29Å; F166-S168 PolarHBondContact O-N 3.34Å; F166-L169 WeakPolarHBondContact O-CB 3.43Å; F166-L169 PolarHBondContact O-N 2.86Å; F166-L169 VanDerWaalsContact O-N 3.15Å; F166-Y170 WeakPolarHBondContact O-CD2 3.25Å; F166-L191 HydrophobicContact CD1-CD1 4.04Å; F166-L191 HydrophobicContact CE1-CD1 3.71Å; F166-L191 HydrophobicContact CZ-CD1 4.26Å
167	G	96.5	Very high	94.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-31.9	178.6	0	0	0	0	0	114.2	Y98 F102 Q163 V164 A165 L169 Y170	Y98-G167 WeakPolarHBondContact CE2-O 3.48Å; F102-G167 VanDerWaalsContact CZ-CA 3.48Å; Q163-G167 PolarHBondContact O-N 3.42Å; V164-G167 PolarHBondContact O-N 3.05Å; A165-G167 VanDerWaalsContact C-N 3.32Å; A165-G167 PolarHBondContact O-N 2.95Å; G167-L169 PolarHBondContact O-N 2.98Å; G167-Y170 PolarHBondContact O-N 2.75Å; G167-Y170 VanDerWaalsContact O-N 3.12Å
168	S	96.3	Very high	93.8	Very high	23 Å²	23	48 Å²	48	16%	0.161	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-20.4	176.3	75.7	0	0	0	0	113.9	V164 A165 F166 Y170	V164-S168 PolarHBondContact O-N 2.88Å; A165-S168 PolarHBondContact O-N 2.93Å; A165-S168 PolarHBondContact O-OG 2.53Å; F166-S168 VanDerWaalsContact C-N 3.29Å; F166-S168 PolarHBondContact O-N 3.34Å; S168-Y170 PolarHBondContact O-N 3.23Å
169	L	96.4	Very high	93.6	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.079	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-20	177	-62.9	176.3	0	0	0	112.5	Y125 L126 Q128 F166 G167 L193	Y125-L169 VanDerWaalsContact CD1-O 3.28Å; Y125-L169 WeakPolarHBondContact CD1-O 3.43Å; L126-L169 HydrophobicContact CD2-CD1 3.78Å; Q128-L169 HydrophobicContact CB-CD2 3.92Å; Q128-L169 PolarHBondContact NE2-O 2.76Å; F166-L169 WeakPolarHBondContact O-CB 3.43Å; F166-L169 PolarHBondContact O-N 2.86Å; F166-L169 VanDerWaalsContact O-N 3.15Å; G167-L169 PolarHBondContact O-N 2.98Å; L169-L193 HydrophobicContact CD2-CD2 3.49Å; L169-L193 VanDerWaalsContact CD2-CD2 3.49Å; L169-L193 HydrophobicContact CG-CD2 4.28Å
170	Y	95.6	Very high	93.5	Very high	6 Å²	6	50.4 Å²	50.4	2%	0.024	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	2.8	-173.3	-64.2	-97.2	0	0	0	113.4	I97 L101 F102 L121 H122 Y125 F166 G167 S168	I97-Y170 HydrophobicContact CG2-CD1 4.07Å; I97-Y170 WeakPolarHBondContact CG2-O 3.14Å; L101-Y170 HydrophobicContact CB-CD1 4.09Å; L101-Y170 HydrophobicContact CB-CE1 3.97Å; F102-Y170 HydrophobicContact CB-CD1 4Å; F102-Y170 HydrophobicContact CB-CD2 3.69Å; F102-Y170 HydrophobicContact CB-CE1 4.31Å; F102-Y170 HydrophobicContact CB-CE2 4.04Å; F102-Y170 HydrophobicContact CB-CG 3.67Å; F102-Y170 AromaticContact CD2-CD2 3.8Å; F102-Y170 HydrophobicContact CD2-CD2 3.8Å; F102-Y170 AromaticContact CD2-CE2 3.66Å; F102-Y170 HydrophobicContact CD2-CE2 3.66Å; F102-Y170 AromaticContact CG-CD2 3.88Å; F102-Y170 HydrophobicContact CG-CD2 3.88Å; F102-Y170 HydrophobicContact CG-CE2 4.16Å; F102-Y170 HydrophobicContact CG-CG 4.32Å; L121-Y170 HydrophobicContact CD2-CE2 4.2Å; H122-Y170 HydrophobicContact CB-CE1 4.47Å; H122-Y170 PolarHBondContact N-OH 2.7Å; H122-Y170 AromaticContact ND1-CE1 3.65Å; H122-Y170 AromaticContact ND1-CZ 3.81Å; H122-Y170 PolarHBondContact ND1-OH 3.41Å; H122-Y170 VanDerWaalsContact ND1-OH 3.12Å; Y125-Y170 AromaticContact CD1-CD1 3.74Å; Y125-Y170 HydrophobicContact CD1-CD1 3.74Å; Y125-Y170 AromaticContact CD1-CE1 3.99Å; Y125-Y170 HydrophobicContact CD1-CE1 3.99Å; Y125-Y170 HydrophobicContact CD1-CG 4.16Å; Y125-Y170 AromaticContact CD2-CD1 3.88Å; Y125-Y170 HydrophobicContact CD2-CD1 3.88Å; Y125-Y170 AromaticContact CD2-CE1 3.39Å; Y125-Y170 HydrophobicContact CD2-CE1 3.39Å; Y125-Y170 AromaticContact CE1-CD1 3.87Å; Y125-Y170 HydrophobicContact CE1-CD1 3.87Å; Y125-Y170 HydrophobicContact CE1-CE1 4.39Å; Y125-Y170 HydrophobicContact CE1-CG 4.47Å; Y125-Y170 HydrophobicContact CE2-CD1 4.01Å; Y125-Y170 AromaticContact CE2-CE1 3.85Å; Y125-Y170 HydrophobicContact CE2-CE1 3.85Å; Y125-Y170 AromaticContact CG-CD1 3.72Å; Y125-Y170 HydrophobicContact CG-CD1 3.72Å; Y125-Y170 AromaticContact CG-CE1 3.46Å; Y125-Y170 HydrophobicContact CG-CE1 3.46Å; Y125-Y170 VanDerWaalsContact CG-CE1 3.46Å; Y125-Y170 HydrophobicContact CG-CG 4.38Å; Y125-Y170 AromaticContact CG-CZ 3.91Å; F166-Y170 WeakPolarHBondContact O-CD2 3.25Å; G167-Y170 PolarHBondContact O-N 2.75Å; G167-Y170 VanDerWaalsContact O-N 3.12Å; S168-Y170 PolarHBondContact O-N 3.23Å
171	R	91.3	Very high	93.6	Very high	62 Å²	62	45.8 Å²	45.8	23%	0.234	24%	0.241	C	C	.	.			trans	-156.6	147.8	178.1	67.2	178.7	-170.1	-159.5	0.9	112.1	Y98 D173	Y98-R171 HydrophobicContact CD2-CB 4.16Å; Y98-R171 HydrophobicContact CD2-CG 3.84Å; Y98-R171 HydrophobicContact CE2-CG 4.18Å; Y98-R171 PolarHBondContact OH-NH1 3.01Å; R171-D173 WeakPolarHBondContact CD-O 3.37Å; R171-D173 WeakPolarHBondContact CG-O 2.86Å; R171-D173 PolarHBondContact NE-O 2.71Å
172	D	81.1	Confident	93.6	Very high	138 Å²	138	47.3 Å²	47.3	74%	0.738	25%	0.25	S	S	*	.	S	Bend	trans	-78.5	-28.3	-177.8	-42.6	-77.5	0	0	0	113.6
173	D	81.1	Confident	93.6	Very high	130 Å²	130	47.7 Å²	47.7	70%	0.695	25%	0.254	S	S	*	.			trans	-106.6	121.3	-176.9	-176.2	11.1	0	0	0	111.2	R171	R171-D173 WeakPolarHBondContact CD-O 3.37Å; R171-D173 WeakPolarHBondContact CG-O 2.86Å; R171-D173 PolarHBondContact NE-O 2.71Å
174	V	88.2	Confident	93.6	Very high	10 Å²	10	45 Å²	45	6%	0.061	24%	0.241	C	C	.	.			trans	-123.4	110.1	179.5	-178.8	0	0	0	0	108.7	V164 I176 L196	V164-V174 HydrophobicContact CG1-CG1 3.69Å; V174-I176 HydrophobicContact CG1-CG1 3.93Å; V174-I176 PolarHBondContact O-N 3.35Å; V174-L196 HydrophobicContact CB-CD1 4.45Å; V174-L196 HydrophobicContact CG1-CD1 4.1Å
175	L	88.9	Confident	93.7	Very high	146 Å²	146	44 Å²	44	76%	0.764	24%	0.235	S	C	*	.			trans	-71.8	96.1	173.5	-177.5	64.2	0	0	0	110.8
176	I	93.6	Very high	93.7	Very high	13 Å²	13	44 Å²	44	7%	0.067	24%	0.235	C	C	.	.			trans	-86.6	113.4	178.2	-57.9	171.2	0	0	0	109.7	V174 V181 I184 L196 Q199 T203	V174-I176 HydrophobicContact CG1-CG1 3.93Å; V174-I176 PolarHBondContact O-N 3.35Å; I176-V181 HydrophobicContact CG2-CB 3.8Å; I176-V181 HydrophobicContact CG2-CG2 3.73Å; I176-I184 HydrophobicContact CG2-CD1 4.07Å; I176-L196 HydrophobicContact CD1-CD1 3.9Å; I176-L196 HydrophobicContact CG1-CD1 4.46Å; I176-Q199 HydrophobicContact CD1-CB 3.61Å; I176-T203 HydrophobicContact CB-CG2 4.34Å; I176-T203 HydrophobicContact CG2-CG2 4.04Å
177	K	91.4	Very high	93.8	Very high	118 Å²	118	44 Å²	44	51%	0.513	24%	0.235	S	C	.	.			trans	-74.6	132.3	174.1	-68.5	175.9	-177.4	169	0	110.1	S179 R180 V181	K177-S179 PolarHBondContact O-N 3.12Å; K177-R180 HydrophobicContact CB-CB 4.44Å; K177-R180 HydrophobicContact CB-CG 4.28Å; K177-R180 PolarHBondContact O-N 2.57Å; K177-V181 PolarHBondContact O-N 3.17Å
178	P	91.4	Very high	93.8	Very high	59 Å²	59	44 Å²	44	38%	0.383	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.5	179.4	-28.3	35.8	0	0	0	115.3	R180 V181 T203 T207 Y216	P178-R180 VanDerWaalsContact C-N 3.31Å; P178-V181 WeakPolarHBondContact O-CG1 3.28Å; P178-T203 HydrophobicContact CG-CG2 4.37Å; P178-T207 HydrophobicContact CB-CG2 4.12Å; P178-T207 HydrophobicContact CG-CG2 3.61Å; P178-Y216 PolarHBondContact O-OH 3.01Å
179	S	94.1	Very high	93.9	Very high	103 Å²	103	44.6 Å²	44.6	72%	0.72	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-14	174.1	52.5	0	0	0	0	114.4	K177	K177-S179 PolarHBondContact O-N 3.12Å
180	R	95.4	Very high	94	Very high	55 Å²	55	46 Å²	46	21%	0.208	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-10.7	-176.6	-55.2	-62.1	-75.3	121.8	9	113.2	D158 E160 K177 P178 V182 A183 I184	D158-R180 IonicContact OD1-CZ 2.73Å; D158-R180 IonicContact OD1-NH2 3.15Å; D158-R180 PolarHBondContact OD1-NH2 2.82Å; D158-R180 IonicContact OD2-CZ 2.62Å; D158-R180 IonicContact OD2-NH1 2.61Å; D158-R180 PolarHBondContact OD2-NH1 3.49Å; D158-R180 IonicContact OD2-NH2 2.68Å; D158-R180 PolarHBondContact OD2-NH2 3.3Å; E160-R180 IonicContact OE2-CZ 3.23Å; E160-R180 IonicContact OE2-NE 2.69Å; E160-R180 PolarHBondContact OE2-NE 2.76Å; E160-R180 IonicContact OE2-NH2 2.65Å; E160-R180 PolarHBondContact OE2-NH2 2.83Å; K177-R180 HydrophobicContact CB-CB 4.44Å; K177-R180 HydrophobicContact CB-CG 4.28Å; K177-R180 PolarHBondContact O-N 2.57Å; P178-R180 VanDerWaalsContact C-N 3.31Å; R180-V182 PolarHBondContact O-N 2.76Å; R180-V182 VanDerWaalsContact O-N 3.1Å; R180-A183 PolarHBondContact O-N 3.36Å; R180-I184 HydrophobicContact CB-CD1 3.82Å; R180-I184 HydrophobicContact CB-CG1 4.43Å; R180-I184 WeakPolarHBondContact O-CG1 3.04Å; R180-I184 PolarHBondContact O-N 2.85Å
181	V	97.8	Very high	94.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-53.2	-34.3	-175.7	70.2	0	0	0	0	114.1	I176 K177 P178 L185 C200 T203 M204 Y216	I176-V181 HydrophobicContact CG2-CB 3.8Å; I176-V181 HydrophobicContact CG2-CG2 3.73Å; K177-V181 PolarHBondContact O-N 3.17Å; P178-V181 WeakPolarHBondContact O-CG1 3.28Å; V181-L185 WeakPolarHBondContact O-CB 3.49Å; V181-L185 PolarHBondContact O-N 3.44Å; V181-C200 HydrophobicContact CG2-CB 3.78Å; V181-C200 WeakPolarHBondContact CG2-O 3.39Å; V181-T203 HydrophobicContact CG2-CG2 4.26Å; V181-M204 HydrophobicContact CB-CG 4.38Å; V181-M204 HydrophobicContact CG1-CG 3.74Å; V181-M204 HydrophobicContact CG2-CG 3.66Å; V181-M204 HydrophobicContact CG2-SD 4.32Å; V181-Y216 HydrophobicContact CG1-CE1 3.63Å; V181-Y216 WeakPolarHBondContact CG1-OH 3.14Å
182	V	97.9	Very high	94.4	Very high	31 Å²	31	47.3 Å²	47.3	19%	0.188	26%	0.255	C	S	.	.	H	α-helix	trans	-68.8	-44.2	178.6	176.6	0	0	0	0	111.7	R180 L185 A186 Y216 S219 Y223	R180-V182 PolarHBondContact O-N 2.76Å; R180-V182 VanDerWaalsContact O-N 3.1Å; V182-L185 PolarHBondContact O-N 3.24Å; V182-A186 WeakPolarHBondContact O-CB 3.31Å; V182-A186 PolarHBondContact O-N 3.34Å; V182-Y216 HydrophobicContact CG2-CD1 4.14Å; V182-Y216 HydrophobicContact CG2-CE1 4.16Å; V182-S219 VanDerWaalsContact CG1-OG 3.27Å; V182-S219 WeakPolarHBondContact CG1-OG 3.4Å; V182-Y223 HydrophobicContact CG1-CE2 4.4Å
183	A	98.2	Very high	95.2	Very high	8 Å²	8	41.2 Å²	41.2	7%	0.066	22%	0.223	C	C	.	.	H	α-helix	trans	-68	-42.3	177.9	0	0	0	0	0	111.4	N156 A161 R180 L185 A186 A187	N156-A183 VanDerWaalsContact O-CA 3.25Å; N156-A183 WeakPolarHBondContact O-CA 3.04Å; N156-A183 WeakPolarHBondContact O-CB 3.13Å; A161-A183 HydrophobicContact CB-CB 3.86Å; A161-A183 WeakPolarHBondContact CB-O 3.08Å; R180-A183 PolarHBondContact O-N 3.36Å; A183-L185 VanDerWaalsContact C-N 3.34Å; A183-L185 PolarHBondContact O-N 2.89Å; A183-A186 WeakPolarHBondContact O-CB 3.47Å; A183-A186 PolarHBondContact O-N 3.09Å; A183-A187 PolarHBondContact O-N 3.34Å
184	I	98.4	Very high	95.9	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-40.8	175.6	-61.9	163	0	0	0	110.6	A161 V164 I176 R180 A187 A188 L196	A161-I184 HydrophobicContact CB-CG1 4.47Å; V164-I184 HydrophobicContact CB-CD1 4.49Å; V164-I184 HydrophobicContact CB-CG1 4.28Å; V164-I184 HydrophobicContact CG1-CD1 4.08Å; V164-I184 HydrophobicContact CG1-CG1 4.13Å; V164-I184 HydrophobicContact CG1-CG2 3.84Å; V164-I184 HydrophobicContact CG2-CD1 4.46Å; I176-I184 HydrophobicContact CG2-CD1 4.07Å; R180-I184 HydrophobicContact CB-CD1 3.82Å; R180-I184 HydrophobicContact CB-CG1 4.43Å; R180-I184 WeakPolarHBondContact O-CG1 3.04Å; R180-I184 PolarHBondContact O-N 2.85Å; I184-A187 PolarHBondContact O-N 2.97Å; I184-A188 VanDerWaalsContact O-CB 3.25Å; I184-A188 WeakPolarHBondContact O-CB 3.48Å; I184-A188 PolarHBondContact O-N 3.18Å; I184-L196 HydrophobicContact CG2-CD1 4.07Å; I184-L196 HydrophobicContact CG2-CD2 3.99Å; I184-L196 HydrophobicContact CG2-CG 4.17Å
185	L	98.5	Very high	96.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-44.2	174	175.6	61	0	0	0	111.8	V181 V182 A183 A187 A188 C189 I197 C200 M204 Y223 L225	V181-L185 WeakPolarHBondContact O-CB 3.49Å; V181-L185 PolarHBondContact O-N 3.44Å; V182-L185 PolarHBondContact O-N 3.24Å; A183-L185 VanDerWaalsContact C-N 3.34Å; A183-L185 PolarHBondContact O-N 2.89Å; L185-A187 PolarHBondContact O-N 3.32Å; L185-A188 PolarHBondContact O-N 3.19Å; L185-C189 WeakPolarHBondContact O-CB 3.23Å; L185-C189 PolarHBondContact O-N 2.98Å; L185-C189 PolarHBondContact O-SG 2.93Å; L185-C189 VanDerWaalsContact O-SG 3.35Å; L185-I197 HydrophobicContact CD1-CB 4.36Å; L185-I197 HydrophobicContact CD1-CG1 4.36Å; L185-I197 HydrophobicContact CD1-CG2 3.93Å; L185-C200 HydrophobicContact CB-CB 4.02Å; L185-C200 HydrophobicContact CD1-CB 4.02Å; L185-C200 HydrophobicContact CG-CB 4.5Å; L185-M204 HydrophobicContact CD2-SD 3.81Å; L185-Y223 HydrophobicContact CD2-CD2 3.67Å; L185-Y223 HydrophobicContact CD2-CG 4.12Å; L185-Y223 HydrophobicContact CG-CD2 3.89Å; L185-Y223 HydrophobicContact CG-CG 4.06Å; L185-L225 HydrophobicContact CD1-CD1 3.95Å; L185-L225 HydrophobicContact CD1-CD2 3.98Å; L185-L225 HydrophobicContact CD2-CD1 4.16Å; L185-L225 HydrophobicContact CD2-CD2 3.88Å
186	A	98.4	Very high	96.6	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-47.9	176.5	0	0	0	0	0	111.6	N156 I157 V182 A183 C189 L190 Y223	N156-A186 HydrophobicContact CB-CB 4.01Å; I157-A186 HydrophobicContact CD1-CB 4.25Å; I157-A186 HydrophobicContact CG1-CB 3.51Å; V182-A186 WeakPolarHBondContact O-CB 3.31Å; V182-A186 PolarHBondContact O-N 3.34Å; A183-A186 WeakPolarHBondContact O-CB 3.47Å; A183-A186 PolarHBondContact O-N 3.09Å; A186-C189 PolarHBondContact O-N 2.82Å; A186-L190 PolarHBondContact O-N 2.87Å; A186-Y223 HydrophobicContact CB-CE1 3.87Å; A186-Y223 HydrophobicContact CB-CE2 4.27Å; A186-Y223 VanDerWaalsContact CB-OH 3.26Å; A186-Y223 WeakPolarHBondContact CB-OH 3.46Å
187	A	98.4	Very high	96.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.8	-42.2	175.6	0	0	0	0	0	112.1	I157 A161 L162 A165 A183 I184 L185 C189 L190 L191	I157-A187 HydrophobicContact CG1-CB 4.49Å; I157-A187 HydrophobicContact CG2-CB 4.24Å; A161-A187 HydrophobicContact CB-CB 4.11Å; L162-A187 HydrophobicContact CD2-CB 4.27Å; A165-A187 HydrophobicContact CB-CB 3.96Å; A183-A187 PolarHBondContact O-N 3.34Å; I184-A187 PolarHBondContact O-N 2.97Å; L185-A187 PolarHBondContact O-N 3.32Å; A187-C189 PolarHBondContact O-N 3.33Å; A187-L190 PolarHBondContact O-N 3.3Å; A187-L191 WeakPolarHBondContact O-CB 3.16Å; A187-L191 WeakPolarHBondContact O-CG 3.17Å; A187-L191 PolarHBondContact O-N 2.89Å
188	A	98.2	Very high	97.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-38.5	177.3	0	0	0	0	0	112.5	I184 L185 Q192 L193 L196 I197	I184-A188 VanDerWaalsContact O-CB 3.25Å; I184-A188 WeakPolarHBondContact O-CB 3.48Å; I184-A188 PolarHBondContact O-N 3.18Å; L185-A188 PolarHBondContact O-N 3.19Å; A188-Q192 WeakPolarHBondContact O-CA 3.22Å; A188-Q192 PolarHBondContact O-N 2.95Å; A188-L193 HydrophobicContact CB-CB 4.22Å; A188-L193 PolarHBondContact O-N 2.81Å; A188-L196 HydrophobicContact CB-CB 4.05Å; A188-L196 HydrophobicContact CB-CD2 3.77Å; A188-L196 HydrophobicContact CB-CG 3.82Å; A188-I197 HydrophobicContact CB-CG1 3.7Å
189	C	98.2	Very high	97.3	Very high	36 Å²	36	37.8 Å²	37.8	24%	0.243	21%	0.211	C	C	.	.	H	α-helix	trans	-68.5	-45.4	174.9	-72.7	0	0	0	0	112.3	L185 A186 A187 L191 Q192 Y223	L185-C189 WeakPolarHBondContact O-CB 3.23Å; L185-C189 PolarHBondContact O-N 2.98Å; L185-C189 PolarHBondContact O-SG 2.93Å; L185-C189 VanDerWaalsContact O-SG 3.35Å; A186-C189 PolarHBondContact O-N 2.82Å; A187-C189 PolarHBondContact O-N 3.33Å; C189-L191 VanDerWaalsContact C-N 3.31Å; C189-L191 PolarHBondContact O-N 3.08Å; C189-Q192 PolarHBondContact O-N 2.87Å; C189-Y223 HydrophobicContact CB-CD1 4.13Å
190	L	98.1	Very high	97.5	Very high	44 Å²	44	32.9 Å²	32.9	23%	0.23	18%	0.177	C	C	.	.	H	α-helix	trans	-57.2	-46	175.3	177.3	65.2	0	0	0	111.3	I152 I157 A186 A187 Q192	I152-L190 HydrophobicContact CD1-CD2 3.57Å; I157-L190 HydrophobicContact CD1-CB 3.86Å; I157-L190 HydrophobicContact CD1-CD2 3.64Å; I157-L190 HydrophobicContact CD1-CG 4.36Å; A186-L190 PolarHBondContact O-N 2.87Å; A187-L190 PolarHBondContact O-N 3.3Å; L190-Q192 VanDerWaalsContact C-N 3.31Å; L190-Q192 PolarHBondContact O-N 2.93Å
191	L	97.8	Very high	97.6	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3.3	-178.7	-60.1	-174.7	0	0	0	113.9	S129 Y131 F132 L150 L162 A165 F166 A187 C189 L193	S129-L191 VanDerWaalsContact CB-O 3.3Å; S129-L191 WeakPolarHBondContact CB-O 3.15Å; S129-L191 PolarHBondContact OG-O 3.25Å; Y131-L191 HydrophobicContact CD1-CD2 4.27Å; F132-L191 HydrophobicContact CE2-CD1 4.33Å; F132-L191 HydrophobicContact CE2-CD2 3.61Å; F132-L191 HydrophobicContact CE2-CG 4.45Å; F132-L191 HydrophobicContact CZ-CD2 3.98Å; L150-L191 HydrophobicContact CD2-CD2 4.01Å; L162-L191 HydrophobicContact CD2-CD1 4.45Å; A165-L191 HydrophobicContact CB-CD1 4.03Å; F166-L191 HydrophobicContact CD1-CD1 4.04Å; F166-L191 HydrophobicContact CE1-CD1 3.71Å; F166-L191 HydrophobicContact CZ-CD1 4.26Å; A187-L191 WeakPolarHBondContact O-CB 3.16Å; A187-L191 WeakPolarHBondContact O-CG 3.17Å; A187-L191 PolarHBondContact O-N 2.89Å; C189-L191 VanDerWaalsContact C-N 3.31Å; C189-L191 PolarHBondContact O-N 3.08Å; L191-L193 HydrophobicContact CB-CD1 3.98Å; L191-L193 HydrophobicContact CB-CG 3.89Å; L191-L193 HydrophobicContact CD1-CD1 4.33Å; L191-L193 PolarHBondContact O-N 2.93Å
192	Q	97.8	Very high	97.6	Very high	95 Å²	95	35 Å²	35	44%	0.444	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	53.7	-179.4	-55.9	177.9	1.4	0	0	112.7	G130 A188 C189 L190	G130-Q192 PolarHBondContact N-O 2.97Å; A188-Q192 WeakPolarHBondContact O-CA 3.22Å; A188-Q192 PolarHBondContact O-N 2.95Å; C189-Q192 PolarHBondContact O-N 2.87Å; L190-Q192 VanDerWaalsContact C-N 3.31Å; L190-Q192 PolarHBondContact O-N 2.93Å
193	L	97.4	Very high	97.5	Very high	10 Å²	10	34.7 Å²	34.7	5%	0.052	19%	0.188	C	C	.	.			trans	-100.7	72.7	-179.5	-65.3	175.3	0	0	0	110.7	A165 L169 A188 L191 G195 L196 I197	A165-L193 HydrophobicContact CB-CD1 3.85Å; L169-L193 HydrophobicContact CD2-CD2 3.49Å; L169-L193 VanDerWaalsContact CD2-CD2 3.49Å; L169-L193 HydrophobicContact CG-CD2 4.28Å; A188-L193 HydrophobicContact CB-CB 4.22Å; A188-L193 PolarHBondContact O-N 2.81Å; L191-L193 HydrophobicContact CB-CD1 3.98Å; L191-L193 HydrophobicContact CB-CG 3.89Å; L191-L193 HydrophobicContact CD1-CD1 4.33Å; L191-L193 PolarHBondContact O-N 2.93Å; L193-G195 VanDerWaalsContact C-N 3.28Å; L193-G195 PolarHBondContact O-N 2.82Å; L193-G195 VanDerWaalsContact O-N 3.12Å; L193-L196 HydrophobicContact CB-CB 4.01Å; L193-L196 HydrophobicContact CD1-CD2 4.08Å; L193-L196 PolarHBondContact O-N 3.44Å; L193-I197 WeakPolarHBondContact O-CG1 3.45Å; L193-I197 PolarHBondContact O-N 2.81Å
194	D	95.9	Very high	97.5	Very high	116 Å²	116	34.3 Å²	34.3	62%	0.62	19%	0.185	S	C	*	.	H	α-helix	trans	-51.4	-40.6	-171.4	-70.4	-38.8	0	0	0	114.5	L196 I197 Q198	D194-L196 PolarHBondContact O-N 3.01Å; D194-I197 PolarHBondContact O-N 2.87Å; D194-Q198 VanDerWaalsContact O-CG 3.32Å; D194-Q198 WeakPolarHBondContact O-CG 3.19Å; D194-Q198 PolarHBondContact O-N 3.24Å
195	G	94.8	Very high	97.5	Very high	45 Å²	45	36.3 Å²	36.3	46%	0.464	19%	0.193	S	C	.	.	H	α-helix	trans	-62.6	-40.8	176.6	0	0	0	0	0	113.1	L193 Q198 Q199	L193-G195 VanDerWaalsContact C-N 3.28Å; L193-G195 PolarHBondContact O-N 2.82Å; L193-G195 VanDerWaalsContact O-N 3.12Å; G195-Q198 PolarHBondContact O-N 3.03Å; G195-Q199 WeakPolarHBondContact O-CG 3.36Å; G195-Q199 PolarHBondContact O-N 3.08Å
196	L	97.1	Very high	97.4	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-73	-36.8	177.1	-175.6	61	0	0	0	111.5	A165 V174 I176 I184 A188 L193 D194 Q198 Q199 C200	A165-L196 HydrophobicContact CB-CD2 4.11Å; V174-L196 HydrophobicContact CB-CD1 4.45Å; V174-L196 HydrophobicContact CG1-CD1 4.1Å; I176-L196 HydrophobicContact CD1-CD1 3.9Å; I176-L196 HydrophobicContact CG1-CD1 4.46Å; I184-L196 HydrophobicContact CG2-CD1 4.07Å; I184-L196 HydrophobicContact CG2-CD2 3.99Å; I184-L196 HydrophobicContact CG2-CG 4.17Å; A188-L196 HydrophobicContact CB-CB 4.05Å; A188-L196 HydrophobicContact CB-CD2 3.77Å; A188-L196 HydrophobicContact CB-CG 3.82Å; L193-L196 HydrophobicContact CB-CB 4.01Å; L193-L196 HydrophobicContact CD1-CD2 4.08Å; L193-L196 PolarHBondContact O-N 3.44Å; D194-L196 PolarHBondContact O-N 3.01Å; L196-Q198 VanDerWaalsContact C-N 3.31Å; L196-Q198 PolarHBondContact O-N 3.45Å; L196-Q199 PolarHBondContact O-N 2.81Å; L196-C200 WeakPolarHBondContact O-CB 3.4Å; L196-C200 PolarHBondContact O-N 3.34Å; L196-C200 PolarHBondContact O-SG 3.26Å
197	I	98	Very high	97.3	Very high	31 Å²	31	44.2 Å²	44.2	16%	0.159	23%	0.233	C	C	.	.	H	α-helix	trans	-58.3	-44.2	172.2	-64.2	170.5	0	0	0	110.3	L185 A188 L193 D194 C200 G201 L225	L185-I197 HydrophobicContact CD1-CB 4.36Å; L185-I197 HydrophobicContact CD1-CG1 4.36Å; L185-I197 HydrophobicContact CD1-CG2 3.93Å; A188-I197 HydrophobicContact CB-CG1 3.7Å; L193-I197 WeakPolarHBondContact O-CG1 3.45Å; L193-I197 PolarHBondContact O-N 2.81Å; D194-I197 PolarHBondContact O-N 2.87Å; I197-C200 PolarHBondContact O-N 3.33Å; I197-G201 PolarHBondContact O-N 2.87Å; I197-L225 HydrophobicContact CG2-CD1 4.13Å
198	Q	96.4	Very high	97.2	Very high	134 Å²	134	44.7 Å²	44.7	63%	0.626	24%	0.236	S	C	*	.	H	α-helix	trans	-64	-47.1	176.3	-71.7	175.3	20.7	0	0	112	D194 G195 L196 C200 G201 E202	D194-Q198 VanDerWaalsContact O-CG 3.32Å; D194-Q198 WeakPolarHBondContact O-CG 3.19Å; D194-Q198 PolarHBondContact O-N 3.24Å; G195-Q198 PolarHBondContact O-N 3.03Å; L196-Q198 VanDerWaalsContact C-N 3.31Å; L196-Q198 PolarHBondContact O-N 3.45Å; Q198-C200 VanDerWaalsContact C-N 3.35Å; Q198-C200 PolarHBondContact O-N 3.09Å; Q198-G201 WeakPolarHBondContact O-CA 3.4Å; Q198-G201 PolarHBondContact O-N 3.07Å; Q198-E202 PolarHBondContact O-N 3.4Å
199	Q	96.3	Very high	97.1	Very high	71 Å²	71	46.8 Å²	46.8	33%	0.332	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-40.2	176.7	-71	179.2	3.5	0	0	112.6	I176 G195 L196 G201 E202 T203	I176-Q199 HydrophobicContact CD1-CB 3.61Å; G195-Q199 WeakPolarHBondContact O-CG 3.36Å; G195-Q199 PolarHBondContact O-N 3.08Å; L196-Q199 PolarHBondContact O-N 2.81Å; Q199-G201 VanDerWaalsContact C-N 3.34Å; Q199-E202 PolarHBondContact O-N 3.38Å; Q199-T203 WeakPolarHBondContact O-CB 3.48Å; Q199-T203 PolarHBondContact O-N 3.3Å; Q199-T203 PolarHBondContact O-OG1 3.1Å
200	C	98.2	Very high	97	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-45.5	170.2	-78.6	0	0	0	0	111.3	V181 L185 L196 I197 Q198 T203 M204	V181-C200 HydrophobicContact CG2-CB 3.78Å; V181-C200 WeakPolarHBondContact CG2-O 3.39Å; L185-C200 HydrophobicContact CB-CB 4.02Å; L185-C200 HydrophobicContact CD1-CB 4.02Å; L185-C200 HydrophobicContact CG-CB 4.5Å; L196-C200 WeakPolarHBondContact O-CB 3.4Å; L196-C200 PolarHBondContact O-N 3.34Å; L196-C200 PolarHBondContact O-SG 3.26Å; I197-C200 PolarHBondContact O-N 3.33Å; Q198-C200 VanDerWaalsContact C-N 3.35Å; Q198-C200 PolarHBondContact O-N 3.09Å; C200-T203 PolarHBondContact O-N 3.39Å; C200-M204 WeakPolarHBondContact O-CB 3.44Å; C200-M204 VanDerWaalsContact O-CG 3.26Å; C200-M204 WeakPolarHBondContact O-CG 3.2Å; C200-M204 PolarHBondContact O-N 2.72Å
201	G	98.1	Very high	96.8	Very high	4 Å²	4	53.6 Å²	53.6	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-41.1	178.5	0	0	0	0	0	114.2	I197 Q198 Q199 K205	I197-G201 PolarHBondContact O-N 2.87Å; Q198-G201 WeakPolarHBondContact O-CA 3.4Å; Q198-G201 PolarHBondContact O-N 3.07Å; Q199-G201 VanDerWaalsContact C-N 3.34Å; G201-K205 WeakPolarHBondContact O-CE 3.38Å; G201-K205 WeakPolarHBondContact O-CG 3.34Å; G201-K205 PolarHBondContact O-N 3.43Å; G201-K205 VanDerWaalsContact O-N 3.1Å
202	E	97.1	Very high	96.7	Very high	95 Å²	95	54.7 Å²	54.7	44%	0.444	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-49.5	172.1	-61.9	-46.1	134.9	0	0	111.2	Q198 Q199 M204 K205 E206	Q198-E202 PolarHBondContact O-N 3.4Å; Q199-E202 PolarHBondContact O-N 3.38Å; E202-M204 VanDerWaalsContact C-N 3.29Å; E202-M204 PolarHBondContact O-N 3.39Å; E202-K205 WeakPolarHBondContact O-CB 3.41Å; E202-K205 PolarHBondContact O-N 2.71Å; E202-K205 IonicContact OE1-NZ 3.43Å; E202-K205 PolarHBondContact OE1-NZ 3.41Å; E202-K205 WeakPolarHBondContact OE2-CE 3.47Å; E202-K205 IonicContact OE2-NZ 3.6Å; E202-K205 PolarHBondContact OE2-NZ 2.93Å; E202-E206 WeakPolarHBondContact O-CG 3.36Å; E202-E206 PolarHBondContact O-N 3.38Å
203	T	97.1	Very high	96.7	Very high	25 Å²	25	50.2 Å²	50.2	15%	0.153	26%	0.26	C	S	.	.	H	α-helix	trans	-54.2	-45.3	177.7	-56.2	0	0	0	0	111.5	I176 P178 V181 Q199 C200 E206 T207	I176-T203 HydrophobicContact CB-CG2 4.34Å; I176-T203 HydrophobicContact CG2-CG2 4.04Å; P178-T203 HydrophobicContact CG-CG2 4.37Å; V181-T203 HydrophobicContact CG2-CG2 4.26Å; Q199-T203 WeakPolarHBondContact O-CB 3.48Å; Q199-T203 PolarHBondContact O-N 3.3Å; Q199-T203 PolarHBondContact O-OG1 3.1Å; C200-T203 PolarHBondContact O-N 3.39Å; T203-E206 PolarHBondContact O-N 3.34Å; T203-T207 WeakPolarHBondContact O-CB 3.47Å; T203-T207 WeakPolarHBondContact O-CG2 3.34Å; T203-T207 PolarHBondContact O-N 3.19Å; T203-T207 PolarHBondContact O-OG1 3.46Å
204	M	98.2	Very high	96.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-45	176.2	-71.7	172.7	85.4	0	0	111.9	V181 L185 C200 E202 E206 T207 I208 Y216 V228	V181-M204 HydrophobicContact CB-CG 4.38Å; V181-M204 HydrophobicContact CG1-CG 3.74Å; V181-M204 HydrophobicContact CG2-CG 3.66Å; V181-M204 HydrophobicContact CG2-SD 4.32Å; L185-M204 HydrophobicContact CD2-SD 3.81Å; C200-M204 WeakPolarHBondContact O-CB 3.44Å; C200-M204 VanDerWaalsContact O-CG 3.26Å; C200-M204 WeakPolarHBondContact O-CG 3.2Å; C200-M204 PolarHBondContact O-N 2.72Å; E202-M204 VanDerWaalsContact C-N 3.29Å; E202-M204 PolarHBondContact O-N 3.39Å; M204-E206 PolarHBondContact O-N 2.83Å; M204-T207 PolarHBondContact O-N 2.98Å; M204-I208 WeakPolarHBondContact O-CG1 3.17Å; M204-I208 PolarHBondContact O-N 2.94Å; M204-Y216 HydrophobicContact CB-CD2 3.87Å; M204-Y216 HydrophobicContact CB-CE2 4.01Å; M204-Y216 HydrophobicContact CB-CG 4.35Å; M204-Y216 HydrophobicContact CE-CD1 3.65Å; M204-Y216 HydrophobicContact CE-CD2 4.36Å; M204-Y216 HydrophobicContact CE-CE1 4.42Å; M204-Y216 HydrophobicContact CE-CG 3.62Å; M204-Y216 HydrophobicContact CG-CD1 4.34Å; M204-Y216 HydrophobicContact CG-CD2 4.14Å; M204-Y216 HydrophobicContact CG-CE1 4.33Å; M204-Y216 HydrophobicContact CG-CE2 4.13Å; M204-Y216 HydrophobicContact CG-CG 4.26Å; M204-Y216 WeakPolarHBondContact O-CD2 3.32Å; M204-Y216 WeakPolarHBondContact O-CE2 3.44Å; M204-V228 HydrophobicContact CB-CG1 3.79Å; M204-V228 HydrophobicContact CB-CG2 4.32Å; M204-V228 HydrophobicContact CE-CG1 4Å; M204-V228 HydrophobicContact SD-CG1 4.3Å
205	K	97.6	Very high	96.7	Very high	48 Å²	48	46.6 Å²	46.6	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-64.7	-36.7	178.9	-80.4	180	-76.5	155.9	0	113.3	G201 E202 T207 V228 K231	G201-K205 WeakPolarHBondContact O-CE 3.38Å; G201-K205 WeakPolarHBondContact O-CG 3.34Å; G201-K205 PolarHBondContact O-N 3.43Å; G201-K205 VanDerWaalsContact O-N 3.1Å; E202-K205 WeakPolarHBondContact O-CB 3.41Å; E202-K205 PolarHBondContact O-N 2.71Å; E202-K205 IonicContact OE1-NZ 3.43Å; E202-K205 PolarHBondContact OE1-NZ 3.41Å; E202-K205 WeakPolarHBondContact OE2-CE 3.47Å; E202-K205 IonicContact OE2-NZ 3.6Å; E202-K205 PolarHBondContact OE2-NZ 2.93Å; K205-T207 VanDerWaalsContact C-N 3.35Å; K205-V228 HydrophobicContact CG-CG2 4.15Å; K205-K231 HydrophobicContact CD-CG 3.98Å; K205-K231 HydrophobicContact CG-CB 4.09Å; K205-K231 HydrophobicContact CG-CG 3.97Å
206	E	95.6	Very high	96.9	Very high	128 Å²	128	44.8 Å²	44.8	60%	0.598	23%	0.23	S	C	*	.	H	α-helix	trans	-73.3	-29.7	-179.1	-71.3	-171.9	161.6	0	0	113	E202 T203 M204 K466	E202-E206 WeakPolarHBondContact O-CG 3.36Å; E202-E206 PolarHBondContact O-N 3.38Å; T203-E206 PolarHBondContact O-N 3.34Å; M204-E206 PolarHBondContact O-N 2.83Å; E206-K466 PolarHBondContact O-NZ 2.92Å; E206-K466 VanDerWaalsContact O-NZ 3.1Å
207	T	96.2	Very high	97	Very high	40 Å²	40	45.7 Å²	45.7	25%	0.245	23%	0.233	C	C	.	.	S	Bend	trans	-108.9	14.2	-171.5	63.5	0	0	0	0	114.9	P178 T203 M204 K205 N209 T212 Y216	P178-T207 HydrophobicContact CB-CG2 4.12Å; P178-T207 HydrophobicContact CG-CG2 3.61Å; T203-T207 WeakPolarHBondContact O-CB 3.47Å; T203-T207 WeakPolarHBondContact O-CG2 3.34Å; T203-T207 PolarHBondContact O-N 3.19Å; T203-T207 PolarHBondContact O-OG1 3.46Å; M204-T207 PolarHBondContact O-N 2.98Å; K205-T207 VanDerWaalsContact C-N 3.35Å; T207-N209 PolarHBondContact O-N 3.37Å; T207-N209 PolarHBondContact O-ND2 3.3Å; T207-T212 PolarHBondContact O-OG1 3.09Å; T207-Y216 PolarHBondContact OG1-OH 3.43Å
208	I	97.3	Very high	96.9	Very high	10 Å²	10	48.4 Å²	48.4	5%	0.051	25%	0.251	C	S	.	.			trans	-59.4	120.9	171.4	-51.6	-176.7	0	0	0	110.2	M204 V213 Y216 K231 W235	M204-I208 WeakPolarHBondContact O-CG1 3.17Å; M204-I208 PolarHBondContact O-N 2.94Å; I208-V213 HydrophobicContact CG2-CB 3.79Å; I208-V213 HydrophobicContact CG2-CG2 3.68Å; I208-Y216 HydrophobicContact CG1-CD2 4.41Å; I208-K231 HydrophobicContact CD1-CB 3.61Å; I208-W235 HydrophobicContact CG2-CB 3.78Å; I208-W235 HydrophobicContact CG2-CD2 4.17Å; I208-W235 HydrophobicContact CG2-CG 3.62Å
209	N	95.9	Very high	97	Very high	43 Å²	43	42.7 Å²	42.7	23%	0.23	23%	0.226	C	C	.	.			trans	-150.5	179.1	174.1	68.6	81	0	0	0	110	T207 K211 T212 V213	T207-N209 PolarHBondContact O-N 3.37Å; T207-N209 PolarHBondContact O-ND2 3.3Å; N209-K211 PolarHBondContact O-N 3.02Å; N209-K211 WeakPolarHBondContact OD1-CB 3.45Å; N209-K211 PolarHBondContact OD1-N 2.94Å; N209-T212 PolarHBondContact N-OG1 3.34Å; N209-T212 PolarHBondContact ND2-OG1 3.17Å; N209-T212 VanDerWaalsContact ND2-OG1 3.16Å; N209-T212 PolarHBondContact O-N 3.07Å; N209-T212 PolarHBondContact O-OG1 3.35Å; N209-V213 WeakPolarHBondContact O-CB 3.16Å; N209-V213 PolarHBondContact O-N 3.13Å
210	V	95.6	Very high	97.1	Very high	46 Å²	46	39.3 Å²	39.3	28%	0.279	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-28.5	-177.1	69.9	0	0	0	0	114.9	W235 N245 L248	V210-W235 HydrophobicContact CB-CH2 3.84Å; V210-W235 HydrophobicContact CB-CZ2 4.31Å; V210-W235 HydrophobicContact CG2-CH2 4.33Å; V210-N245 HydrophobicContact CG2-CB 3.94Å; V210-L248 HydrophobicContact CG2-CB 4.1Å; V210-L248 HydrophobicContact CG2-CD2 4.31Å
211	K	94	Very high	97	Very high	177 Å²	177	41.3 Å²	41.3	77%	0.77	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-19.2	179.7	-57.1	-176.9	178.6	-178	0	114.2	N209	N209-K211 PolarHBondContact O-N 3.02Å; N209-K211 WeakPolarHBondContact OD1-CB 3.45Å; N209-K211 PolarHBondContact OD1-N 2.94Å
212	T	96.4	Very high	97	Very high	25 Å²	25	45.6 Å²	45.6	15%	0.153	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-24.3	-173.5	56.1	0	0	0	0	112.7	T207 N209 C214 G215 Y216	T207-T212 PolarHBondContact O-OG1 3.09Å; N209-T212 PolarHBondContact N-OG1 3.34Å; N209-T212 PolarHBondContact ND2-OG1 3.17Å; N209-T212 VanDerWaalsContact ND2-OG1 3.16Å; N209-T212 PolarHBondContact O-N 3.07Å; N209-T212 PolarHBondContact O-OG1 3.35Å; T212-C214 PolarHBondContact O-N 2.98Å; T212-G215 PolarHBondContact O-N 2.85Å; T212-Y216 HydrophobicContact CG2-CE1 4.33Å; T212-Y216 HydrophobicContact CG2-CE2 4.17Å; T212-Y216 VanDerWaalsContact O-CB 3.29Å; T212-Y216 WeakPolarHBondContact O-CB 3.45Å; T212-Y216 PolarHBondContact O-N 3.03Å
213	V	97.7	Very high	97	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-40.1	-167.4	66.6	0	0	0	0	114.5	I208 N209 Y217 C232 W235 L236 L248	I208-V213 HydrophobicContact CG2-CB 3.79Å; I208-V213 HydrophobicContact CG2-CG2 3.68Å; N209-V213 WeakPolarHBondContact O-CB 3.16Å; N209-V213 PolarHBondContact O-N 3.13Å; V213-Y217 VanDerWaalsContact O-CB 3.24Å; V213-Y217 WeakPolarHBondContact O-CB 3.37Å; V213-Y217 PolarHBondContact O-N 3.18Å; V213-C232 HydrophobicContact CG2-CB 3.83Å; V213-W235 HydrophobicContact CB-CE3 4.06Å; V213-W235 HydrophobicContact CB-CZ3 4.42Å; V213-W235 HydrophobicContact CG1-CE3 3.91Å; V213-W235 HydrophobicContact CG1-CZ3 3.81Å; V213-W235 HydrophobicContact CG2-CB 4.43Å; V213-W235 HydrophobicContact CG2-CD2 4.34Å; V213-W235 HydrophobicContact CG2-CE3 3.86Å; V213-L236 HydrophobicContact CG1-CD2 3.9Å; V213-L236 HydrophobicContact CG2-CD1 4.19Å; V213-L236 HydrophobicContact CG2-CD2 4.09Å; V213-L236 HydrophobicContact CG2-CG 3.76Å; V213-L248 HydrophobicContact CG1-CD1 3.79Å
214	C	97.3	Very high	97	Very high	13 Å²	13	44.2 Å²	44.2	9%	0.088	26%	0.261	C	S	.	.	H	α-helix	trans	-74	-44.1	179.7	-63.5	0	0	0	0	111.9	T212 Y217 T218 E251	T212-C214 PolarHBondContact O-N 2.98Å; C214-Y217 PolarHBondContact O-N 3.48Å; C214-T218 WeakPolarHBondContact O-CB 3.27Å; C214-T218 PolarHBondContact O-N 3.42Å; C214-T218 PolarHBondContact O-OG1 3.35Å; C214-E251 HydrophobicContact CB-CB 3.86Å; C214-E251 VanDerWaalsContact CB-OE2 3.24Å; C214-E251 WeakPolarHBondContact CB-OE2 3.4Å
215	G	96.5	Very high	97	Very high	37 Å²	37	45 Å²	45	38%	0.381	27%	0.265	S	S	.	.	H	α-helix	trans	-58.7	-50	173.3	0	0	0	0	0	111.2	T212 Y217 T218 S219	T212-G215 PolarHBondContact O-N 2.85Å; G215-Y217 PolarHBondContact O-N 2.96Å; G215-T218 PolarHBondContact O-N 3.25Å; G215-S219 WeakPolarHBondContact O-CB 3.29Å; G215-S219 PolarHBondContact O-N 2.96Å; G215-S219 PolarHBondContact O-OG 2.67Å
216	Y	98.3	Very high	97	Very high	8 Å²	8	48 Å²	48	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-38.9	178.4	-71.8	2.3	0	0	0	112.8	P178 V181 V182 M204 T207 I208 T212 T218 A220	P178-Y216 PolarHBondContact O-OH 3.01Å; V181-Y216 HydrophobicContact CG1-CE1 3.63Å; V181-Y216 WeakPolarHBondContact CG1-OH 3.14Å; V182-Y216 HydrophobicContact CG2-CD1 4.14Å; V182-Y216 HydrophobicContact CG2-CE1 4.16Å; M204-Y216 HydrophobicContact CB-CD2 3.87Å; M204-Y216 HydrophobicContact CB-CE2 4.01Å; M204-Y216 HydrophobicContact CB-CG 4.35Å; M204-Y216 HydrophobicContact CE-CD1 3.65Å; M204-Y216 HydrophobicContact CE-CD2 4.36Å; M204-Y216 HydrophobicContact CE-CE1 4.42Å; M204-Y216 HydrophobicContact CE-CG 3.62Å; M204-Y216 HydrophobicContact CG-CD1 4.34Å; M204-Y216 HydrophobicContact CG-CD2 4.14Å; M204-Y216 HydrophobicContact CG-CE1 4.33Å; M204-Y216 HydrophobicContact CG-CE2 4.13Å; M204-Y216 HydrophobicContact CG-CG 4.26Å; M204-Y216 WeakPolarHBondContact O-CD2 3.32Å; M204-Y216 WeakPolarHBondContact O-CE2 3.44Å; T207-Y216 PolarHBondContact OG1-OH 3.43Å; I208-Y216 HydrophobicContact CG1-CD2 4.41Å; T212-Y216 HydrophobicContact CG2-CE1 4.33Å; T212-Y216 HydrophobicContact CG2-CE2 4.17Å; T212-Y216 VanDerWaalsContact O-CB 3.29Å; T212-Y216 WeakPolarHBondContact O-CB 3.45Å; T212-Y216 PolarHBondContact O-N 3.03Å; Y216-T218 VanDerWaalsContact C-N 3.32Å; Y216-T218 PolarHBondContact O-N 2.59Å; Y216-A220 WeakPolarHBondContact O-CB 3.48Å; Y216-A220 PolarHBondContact O-N 2.9Å
217	Y	98.4	Very high	97.1	Very high	25 Å²	25	45.1 Å²	45.1	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-41.8	173.8	176.4	-91	0	0	0	111.8	V213 C214 G215 G221 K229 C232 L233 V256	V213-Y217 VanDerWaalsContact O-CB 3.24Å; V213-Y217 WeakPolarHBondContact O-CB 3.37Å; V213-Y217 PolarHBondContact O-N 3.18Å; C214-Y217 PolarHBondContact O-N 3.48Å; G215-Y217 PolarHBondContact O-N 2.96Å; Y217-G221 PolarHBondContact O-N 2.85Å; Y217-G221 VanDerWaalsContact O-N 3.15Å; Y217-K229 HydrophobicContact CD2-CG 3.7Å; Y217-K229 HydrophobicContact CE2-CD 4.37Å; Y217-K229 HydrophobicContact CE2-CG 3.46Å; Y217-K229 VanDerWaalsContact CE2-CG 3.46Å; Y217-C232 HydrophobicContact CD2-CB 4.12Å; Y217-C232 HydrophobicContact CG-CB 4.47Å; Y217-L233 HydrophobicContact CD2-CD2 4.4Å; Y217-L233 HydrophobicContact CD2-CG 4.06Å; Y217-L233 HydrophobicContact CE2-CD1 3.88Å; Y217-L233 HydrophobicContact CE2-CD2 3.88Å; Y217-L233 HydrophobicContact CE2-CG 3.64Å; Y217-V256 HydrophobicContact CD1-CG2 3.83Å; Y217-V256 HydrophobicContact CE1-CG2 3.35Å
218	T	97.3	Very high	97.2	Very high	87 Å²	87	43.2 Å²	43.2	53%	0.534	27%	0.266	S	S	.	.	H	α-helix	trans	-68.4	-53.2	179.2	-55.2	0	0	0	0	110.8	C214 G215 Y216 A220 G221 T222	C214-T218 WeakPolarHBondContact O-CB 3.27Å; C214-T218 PolarHBondContact O-N 3.42Å; C214-T218 PolarHBondContact O-OG1 3.35Å; G215-T218 PolarHBondContact O-N 3.25Å; Y216-T218 VanDerWaalsContact C-N 3.32Å; Y216-T218 PolarHBondContact O-N 2.59Å; T218-A220 VanDerWaalsContact C-N 3.32Å; T218-A220 PolarHBondContact O-N 2.77Å; T218-G221 WeakPolarHBondContact O-CA 3.28Å; T218-G221 PolarHBondContact O-N 3.05Å; T218-T222 PolarHBondContact O-N 2.8Å; T218-T222 PolarHBondContact O-OG1 2.83Å
219	S	97.6	Very high	97.3	Very high	14 Å²	14	45.6 Å²	45.6	10%	0.098	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-40.8	177.7	-54	0	0	0	0	112.2	V182 G215 G221 T222 Y223	V182-S219 VanDerWaalsContact CG1-OG 3.27Å; V182-S219 WeakPolarHBondContact CG1-OG 3.4Å; G215-S219 WeakPolarHBondContact O-CB 3.29Å; G215-S219 PolarHBondContact O-N 2.96Å; G215-S219 PolarHBondContact O-OG 2.67Å; S219-G221 PolarHBondContact O-N 3.34Å; S219-T222 PolarHBondContact O-N 2.86Å; S219-T222 VanDerWaalsContact O-N 3.14Å; S219-Y223 WeakPolarHBondContact O-CD2 3.22Å; S219-Y223 PolarHBondContact O-N 2.81Å
220	A	98	Very high	97.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-30.1	174.6	0	0	0	0	0	112.6	Y216 T218 G224 L225 V228 K229	Y216-A220 WeakPolarHBondContact O-CB 3.48Å; Y216-A220 PolarHBondContact O-N 2.9Å; T218-A220 VanDerWaalsContact C-N 3.32Å; T218-A220 PolarHBondContact O-N 2.77Å; A220-G224 CarbonylContact O-C 3.52Å; A220-G224 PolarHBondContact O-N 2.76Å; A220-G224 VanDerWaalsContact O-N 3.15Å; A220-L225 HydrophobicContact CB-CB 4.08Å; A220-L225 PolarHBondContact O-N 3.43Å; A220-V228 HydrophobicContact CB-CB 3.86Å; A220-V228 HydrophobicContact CB-CG1 3.95Å; A220-K229 HydrophobicContact CB-CB 3.95Å
221	G	96.9	Very high	97.5	Very high	42 Å²	42	52.2 Å²	52.2	43%	0.433	30%	0.299	S	S	.	.	H	α-helix	trans	-69.3	-42.8	169.6	0	0	0	0	0	113.2	Y217 T218 S219	Y217-G221 PolarHBondContact O-N 2.85Å; Y217-G221 VanDerWaalsContact O-N 3.15Å; T218-G221 WeakPolarHBondContact O-CA 3.28Å; T218-G221 PolarHBondContact O-N 3.05Å; S219-G221 PolarHBondContact O-N 3.34Å
222	T	97.1	Very high	97.7	Very high	94 Å²	94	43.8 Å²	43.8	58%	0.577	26%	0.262	S	S	*	.	H	α-helix	trans	-65	-44.5	178.1	-54.1	0	0	0	0	112.5	T218 S219	T218-T222 PolarHBondContact O-N 2.8Å; T218-T222 PolarHBondContact O-OG1 2.83Å; S219-T222 PolarHBondContact O-N 2.86Å; S219-T222 VanDerWaalsContact O-N 3.14Å
223	Y	97.9	Very high	97.8	Very high	36 Å²	36	44.2 Å²	44.2	14%	0.141	26%	0.264	C	S	.	.	H	α-helix	trans	-98.6	2	-172.2	-58.5	-59.8	0	0	0	114.4	D154 N156 V182 L185 A186 C189 S219 L225	D154-Y223 VanDerWaalsContact OD2-CE1 3.22Å; D154-Y223 WeakPolarHBondContact OD2-CE1 3.42Å; D154-Y223 VanDerWaalsContact OD2-CZ 3.32Å; D154-Y223 PolarHBondContact OD2-OH 3.49Å; N156-Y223 PolarHBondContact ND2-OH 3.35Å; V182-Y223 HydrophobicContact CG1-CE2 4.4Å; L185-Y223 HydrophobicContact CD2-CD2 3.67Å; L185-Y223 HydrophobicContact CD2-CG 4.12Å; L185-Y223 HydrophobicContact CG-CD2 3.89Å; L185-Y223 HydrophobicContact CG-CG 4.06Å; A186-Y223 HydrophobicContact CB-CE1 3.87Å; A186-Y223 HydrophobicContact CB-CE2 4.27Å; A186-Y223 VanDerWaalsContact CB-OH 3.26Å; A186-Y223 WeakPolarHBondContact CB-OH 3.46Å; C189-Y223 HydrophobicContact CB-CD1 4.13Å; S219-Y223 WeakPolarHBondContact O-CD2 3.22Å; S219-Y223 PolarHBondContact O-N 2.81Å; Y223-L225 VanDerWaalsContact O-CD1 3.28Å; Y223-L225 WeakPolarHBondContact O-CD1 3.3Å
224	G	97	Very high	97.8	Very high	55 Å²	55	47.4 Å²	47.4	57%	0.567	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	20	174.2	0	0	0	0	0	116.2	A220 D226	A220-G224 CarbonylContact O-C 3.52Å; A220-G224 PolarHBondContact O-N 2.76Å; A220-G224 VanDerWaalsContact O-N 3.15Å; G224-D226 PolarHBondContact O-N 3.47Å; G224-D226 VanDerWaalsContact O-N 3.12Å
225	L	98.2	Very high	97.8	Very high	17 Å²	17	47.6 Å²	47.6	9%	0.089	28%	0.277	C	S	.	.			trans	-88.5	67.5	-177.7	-78.4	70.3	0	0	0	111.6	L185 I197 A220 Y223 S227 V228 K229	L185-L225 HydrophobicContact CD1-CD1 3.95Å; L185-L225 HydrophobicContact CD1-CD2 3.98Å; L185-L225 HydrophobicContact CD2-CD1 4.16Å; L185-L225 HydrophobicContact CD2-CD2 3.88Å; I197-L225 HydrophobicContact CG2-CD1 4.13Å; A220-L225 HydrophobicContact CB-CB 4.08Å; A220-L225 PolarHBondContact O-N 3.43Å; Y223-L225 VanDerWaalsContact O-CD1 3.28Å; Y223-L225 WeakPolarHBondContact O-CD1 3.3Å; L225-S227 PolarHBondContact O-N 3.19Å; L225-S227 VanDerWaalsContact O-N 3.08Å; L225-V228 HydrophobicContact CB-CB 4.09Å; L225-V228 HydrophobicContact CB-CG2 3.84Å; L225-V228 HydrophobicContact CD2-CG2 3.88Å; L225-V228 HydrophobicContact CG-CG2 4.44Å; L225-V228 WeakPolarHBondContact O-CB 3.44Å; L225-V228 PolarHBondContact O-N 2.99Å; L225-K229 PolarHBondContact O-N 3.08Å
226	D	97.8	Very high	97.9	Very high	111 Å²	111	45.9 Å²	45.9	59%	0.594	26%	0.259	S	S	*	.	H	α-helix	trans	-56.2	-29.9	-176.5	-83.8	-35.9	0	0	0	114.2	G224 K229 K230	G224-D226 PolarHBondContact O-N 3.47Å; G224-D226 VanDerWaalsContact O-N 3.12Å; D226-K229 PolarHBondContact O-N 3.36Å; D226-K229 IonicContact OD1-NZ 2.76Å; D226-K230 VanDerWaalsContact O-CB 3.31Å; D226-K230 WeakPolarHBondContact O-CB 3.44Å; D226-K230 PolarHBondContact O-N 2.93Å
227	S	98.1	Very high	97.9	Very high	67 Å²	67	46.6 Å²	46.6	47%	0.469	26%	0.264	S	S	.	.	H	α-helix	trans	-66.4	-38.6	175.8	66.4	0	0	0	0	112.7	L225 K231	L225-S227 PolarHBondContact O-N 3.19Å; L225-S227 VanDerWaalsContact O-N 3.08Å; S227-K231 WeakPolarHBondContact O-CG 3.23Å; S227-K231 PolarHBondContact O-N 2.8Å
228	V	98.5	Very high	97.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.2	-48.6	173.5	-179	0	0	0	0	109.6	M204 K205 A220 L225 K230 K231 C232	M204-V228 HydrophobicContact CB-CG1 3.79Å; M204-V228 HydrophobicContact CB-CG2 4.32Å; M204-V228 HydrophobicContact CE-CG1 4Å; M204-V228 HydrophobicContact SD-CG1 4.3Å; K205-V228 HydrophobicContact CG-CG2 4.15Å; A220-V228 HydrophobicContact CB-CB 3.86Å; A220-V228 HydrophobicContact CB-CG1 3.95Å; L225-V228 HydrophobicContact CB-CB 4.09Å; L225-V228 HydrophobicContact CB-CG2 3.84Å; L225-V228 HydrophobicContact CD2-CG2 3.88Å; L225-V228 HydrophobicContact CG-CG2 4.44Å; L225-V228 WeakPolarHBondContact O-CB 3.44Å; L225-V228 PolarHBondContact O-N 2.99Å; V228-K230 VanDerWaalsContact C-N 3.3Å; V228-K230 PolarHBondContact O-N 3.34Å; V228-K231 CarbonylContact O-C 3.55Å; V228-K231 WeakPolarHBondContact O-CA 3.47Å; V228-K231 WeakPolarHBondContact O-CB 3.41Å; V228-K231 PolarHBondContact O-N 3.18Å; V228-C232 PolarHBondContact O-N 2.9Å; V228-C232 PolarHBondContact O-SG 3.14Å; V228-C232 VanDerWaalsContact O-SG 3.4Å
229	K	98.1	Very high	97.8	Very high	60 Å²	60	42.8 Å²	42.8	26%	0.261	24%	0.242	S	C	.	.	H	α-helix	trans	-55.1	-44	178.6	-172.3	-179.5	177	-176.9	0	112.3	Y217 A220 L225 D226 C232 L233	Y217-K229 HydrophobicContact CD2-CG 3.7Å; Y217-K229 HydrophobicContact CE2-CD 4.37Å; Y217-K229 HydrophobicContact CE2-CG 3.46Å; Y217-K229 VanDerWaalsContact CE2-CG 3.46Å; A220-K229 HydrophobicContact CB-CB 3.95Å; L225-K229 PolarHBondContact O-N 3.08Å; D226-K229 PolarHBondContact O-N 3.36Å; D226-K229 IonicContact OD1-NZ 2.76Å; K229-C232 PolarHBondContact O-N 2.93Å; K229-L233 PolarHBondContact O-N 2.8Å; K229-L233 VanDerWaalsContact O-N 3.08Å
230	K	98.2	Very high	97.8	Very high	133 Å²	133	42.2 Å²	42.2	58%	0.578	24%	0.237	S	C	*	.	H	α-helix	trans	-61.8	-43.5	173	-178	177.2	176.9	-179.9	0	111.9	D226 V228 L233 E234	D226-K230 VanDerWaalsContact O-CB 3.31Å; D226-K230 WeakPolarHBondContact O-CB 3.44Å; D226-K230 PolarHBondContact O-N 2.93Å; V228-K230 VanDerWaalsContact C-N 3.3Å; V228-K230 PolarHBondContact O-N 3.34Å; K230-L233 PolarHBondContact O-N 3.42Å; K230-E234 WeakPolarHBondContact CE-OE1 3.43Å; K230-E234 WeakPolarHBondContact O-CG 3.2Å; K230-E234 PolarHBondContact O-N 3.05Å
231	K	98.1	Very high	97.7	Very high	96 Å²	96	42.9 Å²	42.9	42%	0.417	24%	0.241	S	C	.	.	H	α-helix	trans	-66.1	-35.6	177.5	-75.7	-75.4	168.2	-157.4	0	113	K205 I208 S227 V228 E234 W235	K205-K231 HydrophobicContact CD-CG 3.98Å; K205-K231 HydrophobicContact CG-CB 4.09Å; K205-K231 HydrophobicContact CG-CG 3.97Å; I208-K231 HydrophobicContact CD1-CB 3.61Å; S227-K231 WeakPolarHBondContact O-CG 3.23Å; S227-K231 PolarHBondContact O-N 2.8Å; V228-K231 CarbonylContact O-C 3.55Å; V228-K231 WeakPolarHBondContact O-CA 3.47Å; V228-K231 WeakPolarHBondContact O-CB 3.41Å; V228-K231 PolarHBondContact O-N 3.18Å; K231-E234 WeakPolarHBondContact CD-OE2 3.14Å; K231-E234 WeakPolarHBondContact CE-OE2 3.46Å; K231-E234 IonicContact NZ-OE2 2.71Å; K231-E234 PolarHBondContact NZ-OE2 3.44Å; K231-E234 PolarHBondContact O-N 2.94Å; K231-W235 WeakPolarHBondContact O-CB 3.47Å; K231-W235 PolarHBondContact O-N 3.49Å
232	C	98.5	Very high	97.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-45.2	171	-65.5	0	0	0	0	111.7	V213 Y217 V228 K229 W235 L236	V213-C232 HydrophobicContact CG2-CB 3.83Å; Y217-C232 HydrophobicContact CD2-CB 4.12Å; Y217-C232 HydrophobicContact CG-CB 4.47Å; V228-C232 PolarHBondContact O-N 2.9Å; V228-C232 PolarHBondContact O-SG 3.14Å; V228-C232 VanDerWaalsContact O-SG 3.4Å; K229-C232 PolarHBondContact O-N 2.93Å; C232-W235 PolarHBondContact O-N 2.99Å; C232-L236 VanDerWaalsContact O-CG 3.31Å; C232-L236 WeakPolarHBondContact O-CG 3.43Å; C232-L236 PolarHBondContact O-N 2.97Å
233	L	98.4	Very high	97.2	Very high	34 Å²	34	40.3 Å²	40.3	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-42.8	174.6	-74.6	170.4	0	0	0	112.5	Y217 K229 K230 W235 L236 L237 V256 L260	Y217-L233 HydrophobicContact CD2-CD2 4.4Å; Y217-L233 HydrophobicContact CD2-CG 4.06Å; Y217-L233 HydrophobicContact CE2-CD1 3.88Å; Y217-L233 HydrophobicContact CE2-CD2 3.88Å; Y217-L233 HydrophobicContact CE2-CG 3.64Å; K229-L233 PolarHBondContact O-N 2.8Å; K229-L233 VanDerWaalsContact O-N 3.08Å; K230-L233 PolarHBondContact O-N 3.42Å; L233-W235 VanDerWaalsContact C-N 3.32Å; L233-W235 PolarHBondContact O-N 3.39Å; L233-L236 PolarHBondContact O-N 2.66Å; L233-L237 WeakPolarHBondContact O-CB 3.4Å; L233-L237 VanDerWaalsContact O-CG 3.24Å; L233-L237 WeakPolarHBondContact O-CG 3.19Å; L233-L237 PolarHBondContact O-N 3.24Å; L233-V256 HydrophobicContact CD2-CG1 4.34Å; L233-L260 HydrophobicContact CD2-CD2 4.29Å
234	E	97.7	Very high	96.9	Very high	66 Å²	66	40.9 Å²	40.9	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-59.5	-41.7	174.5	-74.5	174.1	-167	0	0	111.8	K230 K231 N238	K230-E234 WeakPolarHBondContact CE-OE1 3.43Å; K230-E234 WeakPolarHBondContact O-CG 3.2Å; K230-E234 PolarHBondContact O-N 3.05Å; K231-E234 WeakPolarHBondContact CD-OE2 3.14Å; K231-E234 WeakPolarHBondContact CE-OE2 3.46Å; K231-E234 IonicContact NZ-OE2 2.71Å; K231-E234 PolarHBondContact NZ-OE2 3.44Å; K231-E234 PolarHBondContact O-N 2.94Å; E234-N238 PolarHBondContact O-N 3.27Å; E234-N238 PolarHBondContact O-ND2 3Å
235	W	98.2	Very high	96.7	Very high	18 Å²	18	41 Å²	41	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-46.5	174.4	-171.3	102.8	0	0	0	111.2	I208 V210 V213 K231 C232 L233 N238 N239 L248 S464 G465	I208-W235 HydrophobicContact CG2-CB 3.78Å; I208-W235 HydrophobicContact CG2-CD2 4.17Å; I208-W235 HydrophobicContact CG2-CG 3.62Å; V210-W235 HydrophobicContact CB-CH2 3.84Å; V210-W235 HydrophobicContact CB-CZ2 4.31Å; V210-W235 HydrophobicContact CG2-CH2 4.33Å; V213-W235 HydrophobicContact CB-CE3 4.06Å; V213-W235 HydrophobicContact CB-CZ3 4.42Å; V213-W235 HydrophobicContact CG1-CE3 3.91Å; V213-W235 HydrophobicContact CG1-CZ3 3.81Å; V213-W235 HydrophobicContact CG2-CB 4.43Å; V213-W235 HydrophobicContact CG2-CD2 4.34Å; V213-W235 HydrophobicContact CG2-CE3 3.86Å; K231-W235 WeakPolarHBondContact O-CB 3.47Å; K231-W235 PolarHBondContact O-N 3.49Å; C232-W235 PolarHBondContact O-N 2.99Å; L233-W235 VanDerWaalsContact C-N 3.32Å; L233-W235 PolarHBondContact O-N 3.39Å; W235-N238 PolarHBondContact O-N 3.43Å; W235-N239 HydrophobicContact CD2-CB 4.13Å; W235-N239 HydrophobicContact CE3-CB 3.84Å; W235-N239 HydrophobicContact CH2-CB 3.61Å; W235-N239 HydrophobicContact CZ2-CB 3.94Å; W235-N239 HydrophobicContact CZ3-CB 3.57Å; W235-N239 WeakPolarHBondContact O-CB 3.24Å; W235-N239 PolarHBondContact O-N 3.24Å; W235-N239 PolarHBondContact O-ND2 3.3Å; W235-L248 HydrophobicContact CZ3-CD2 4.17Å; W235-S464 VanDerWaalsContact CZ2-O 3.27Å; W235-S464 WeakPolarHBondContact CZ2-O 3.4Å; W235-S464 PolarHBondContact NE1-O 2.79Å; W235-G465 PolarHBondContact NE1-O 3.21Å
236	L	98.4	Very high	96.6	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-43.1	179.9	-73	169.2	0	0	0	112.7	V213 C232 L233 N238 N239 L240 L248 L252 V256 L260	V213-L236 HydrophobicContact CG1-CD2 3.9Å; V213-L236 HydrophobicContact CG2-CD1 4.19Å; V213-L236 HydrophobicContact CG2-CD2 4.09Å; V213-L236 HydrophobicContact CG2-CG 3.76Å; C232-L236 VanDerWaalsContact O-CG 3.31Å; C232-L236 WeakPolarHBondContact O-CG 3.43Å; C232-L236 PolarHBondContact O-N 2.97Å; L233-L236 PolarHBondContact O-N 2.66Å; L236-N238 PolarHBondContact O-N 3.16Å; L236-N239 PolarHBondContact O-N 3.49Å; L236-L240 VanDerWaalsContact O-CB 3.27Å; L236-L240 WeakPolarHBondContact O-CB 3.45Å; L236-L240 PolarHBondContact O-N 2.82Å; L236-L248 HydrophobicContact CD2-CD1 3.93Å; L236-L248 HydrophobicContact CD2-CD2 4.48Å; L236-L252 HydrophobicContact CD1-CD2 4.05Å; L236-L252 HydrophobicContact CD2-CD2 4.03Å; L236-V256 HydrophobicContact CD1-CG1 3.79Å; L236-L260 HydrophobicContact CB-CD1 3.89Å; L236-L260 HydrophobicContact CB-CD2 3.58Å; L236-L260 HydrophobicContact CB-CG 4.4Å; L236-L260 HydrophobicContact CD1-CD1 4.34Å
237	L	98.1	Very high	96.5	Very high	23 Å²	23	40 Å²	40	12%	0.12	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-33.9	177.2	-73.6	168.8	0	0	0	112.6	L233 L260 S263 N265 L266 F267	L233-L237 WeakPolarHBondContact O-CB 3.4Å; L233-L237 VanDerWaalsContact O-CG 3.24Å; L233-L237 WeakPolarHBondContact O-CG 3.19Å; L233-L237 PolarHBondContact O-N 3.24Å; L237-L260 HydrophobicContact CD2-CB 4.49Å; L237-L260 HydrophobicContact CD2-CD2 3.69Å; L237-L260 HydrophobicContact CG-CD2 3.75Å; L237-S263 WeakPolarHBondContact CD2-OG 3.44Å; L237-N265 HydrophobicContact CD1-CB 4.25Å; L237-L266 HydrophobicContact CD2-CB 4.24Å; L237-L266 HydrophobicContact CD2-CD1 4.34Å; L237-F267 WeakPolarHBondContact O-CB 3.01Å; L237-F267 PolarHBondContact O-N 3Å
238	N	96.8	Very high	96.4	Very high	31 Å²	31	37 Å²	37	17%	0.166	17%	0.174	C	C	.	.	H	α-helix	trans	-80.7	-33.9	177.3	-74.5	-34.4	0	0	0	113.3	E234 W235 L236 T242 F461	E234-N238 PolarHBondContact O-N 3.27Å; E234-N238 PolarHBondContact O-ND2 3Å; W235-N238 PolarHBondContact O-N 3.43Å; L236-N238 PolarHBondContact O-N 3.16Å; N238-T242 VanDerWaalsContact O-CG2 3.29Å; N238-T242 WeakPolarHBondContact O-CG2 3.5Å; N238-T242 PolarHBondContact O-OG1 2.89Å; N238-F461 HydrophobicContact CB-CE1 3.62Å; N238-F461 HydrophobicContact CB-CZ 3.73Å
239	N	96.6	Very high	96.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-103.9	-25.9	-167.4	-72.7	-75.7	0	0	0	115.5	W235 L236 M241 T242 H243 G465	W235-N239 HydrophobicContact CD2-CB 4.13Å; W235-N239 HydrophobicContact CE3-CB 3.84Å; W235-N239 HydrophobicContact CH2-CB 3.61Å; W235-N239 HydrophobicContact CZ2-CB 3.94Å; W235-N239 HydrophobicContact CZ3-CB 3.57Å; W235-N239 WeakPolarHBondContact O-CB 3.24Å; W235-N239 PolarHBondContact O-N 3.24Å; W235-N239 PolarHBondContact O-ND2 3.3Å; L236-N239 PolarHBondContact O-N 3.49Å; N239-M241 PolarHBondContact O-N 3.28Å; N239-M241 VanDerWaalsContact O-N 3.11Å; N239-T242 WeakPolarHBondContact CA-OG1 3.31Å; N239-T242 PolarHBondContact O-N 3.5Å; N239-H243 CarbonylContact O-C 3.56Å; N239-H243 PolarHBondContact O-N 3.16Å; N239-H243 PolarHBondContact OD1-ND1 3.01Å; N239-G465 PolarHBondContact ND2-O 3.5Å; N239-G465 VanDerWaalsContact OD1-CA 3.22Å; N239-G465 WeakPolarHBondContact OD1-CA 3.13Å; N239-G465 PolarHBondContact OD1-O 2.84Å
240	L	96.9	Very high	96.3	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.8	-175	-175.7	70.9	0	0	0	113.1	L236 Q244 F249 L252 M257 L260 I261 L266	L236-L240 VanDerWaalsContact O-CB 3.27Å; L236-L240 WeakPolarHBondContact O-CB 3.45Å; L236-L240 PolarHBondContact O-N 2.82Å; L240-Q244 WeakPolarHBondContact O-CG 3.41Å; L240-F249 HydrophobicContact CD1-CD1 4.15Å; L240-F249 HydrophobicContact CD1-CE1 3.69Å; L240-F249 HydrophobicContact CG-CE1 4.4Å; L240-L252 HydrophobicContact CD1-CD1 3.5Å; L240-L252 VanDerWaalsContact CD1-CD1 3.5Å; L240-M257 HydrophobicContact CD1-CE 4.21Å; L240-M257 HydrophobicContact CD2-CE 4.44Å; L240-M257 HydrophobicContact CD2-SD 3.87Å; L240-L260 HydrophobicContact CD1-CD1 4.47Å; L240-L260 HydrophobicContact CD2-CB 4.17Å; L240-L260 HydrophobicContact CD2-CD1 3.96Å; L240-I261 HydrophobicContact CD2-CD1 4.11Å; L240-L266 HydrophobicContact CB-CD1 4.37Å; L240-L266 HydrophobicContact CD2-CD1 4.16Å
241	M	95.7	Very high	96.2	Very high	14 Å²	14	34.7 Å²	34.7	7%	0.069	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-18.6	-176.3	-61.5	-57	-67.4	0	0	113.9	N239 L266 F267 M269 D274 I275 A278	N239-M241 PolarHBondContact O-N 3.28Å; N239-M241 VanDerWaalsContact O-N 3.11Å; M241-L266 HydrophobicContact CG-CD1 4.22Å; M241-L266 HydrophobicContact CG-CD2 4.4Å; M241-L266 HydrophobicContact CG-CG 4.33Å; M241-F267 WeakPolarHBondContact CB-O 3.5Å; M241-M269 WeakPolarHBondContact O-CG 3.37Å; M241-D274 HydrophobicContact CE-CB 3.69Å; M241-I275 HydrophobicContact CE-CG1 4.36Å; M241-A278 HydrophobicContact CE-CB 4Å; M241-A278 HydrophobicContact SD-CB 3.76Å
242	T	92.6	Very high	96.2	Very high	17 Å²	17	30.2 Å²	30.2	10%	0.104	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-30.5	-178.3	59.9	0	0	0	0	112.6	N238 N239 F267 M269 F461 Y501	N238-T242 VanDerWaalsContact O-CG2 3.29Å; N238-T242 WeakPolarHBondContact O-CG2 3.5Å; N238-T242 PolarHBondContact O-OG1 2.89Å; N239-T242 WeakPolarHBondContact CA-OG1 3.31Å; N239-T242 PolarHBondContact O-N 3.5Å; T242-F267 HydrophobicContact CG2-CD1 4.14Å; T242-M269 HydrophobicContact CG2-CE 3.81Å; T242-M269 HydrophobicContact CG2-CG 4.12Å; T242-M269 HydrophobicContact CG2-SD 3.93Å; T242-F461 HydrophobicContact CG2-CE2 4.4Å; T242-Y501 HydrophobicContact CG2-CD1 3.71Å; T242-Y501 HydrophobicContact CG2-CE1 3.99Å; T242-Y501 HydrophobicContact CG2-CG 4.34Å
243	H	91.3	Very high	96.1	Very high	65 Å²	65	33 Å²	33	30%	0.301	17%	0.166	S	C	.	.	S	Bend	trans	-134.2	56	-176.9	-57.3	117.5	0	0	0	111	N239 N245 F461 Y501	N239-H243 CarbonylContact O-C 3.56Å; N239-H243 PolarHBondContact O-N 3.16Å; N239-H243 PolarHBondContact OD1-ND1 3.01Å; H243-N245 PolarHBondContact O-N 3.13Å; H243-F461 AromaticContact CE1-CD2 3.87Å; H243-Y501 AromaticContact NE2-CZ 3.69Å; H243-Y501 PolarHBondContact NE2-OH 2.91Å
244	Q	91.6	Very high	96.1	Very high	48 Å²	48	33.9 Å²	33.9	22%	0.224	17%	0.17	C	C	.	.			trans	-52.1	133.5	178.8	-77.1	-172.9	0.7	0	0	112	L240 F249 L295	L240-Q244 WeakPolarHBondContact O-CG 3.41Å; Q244-F249 HydrophobicContact CB-CE2 4.22Å; Q244-F249 HydrophobicContact CB-CZ 4.47Å; Q244-F249 HydrophobicContact CG-CE2 4.12Å; Q244-F249 HydrophobicContact CG-CZ 3.91Å; Q244-L295 HydrophobicContact CB-CD1 4.13Å; Q244-L295 HydrophobicContact CB-CD2 3.97Å; Q244-L295 WeakPolarHBondContact O-CD2 3.44Å
245	N	93.9	Very high	96.1	Very high	58 Å²	58	35 Å²	35	31%	0.31	18%	0.179	S	C	.	.			trans	-141.7	138.9	-178.3	-179.2	-65.7	0	0	0	109.6	V210 H243 E247 L248 F249	V210-N245 HydrophobicContact CG2-CB 3.94Å; H243-N245 PolarHBondContact O-N 3.13Å; N245-E247 PolarHBondContact OD1-N 3.35Å; N245-L248 HydrophobicContact CB-CB 3.89Å; N245-L248 PolarHBondContact OD1-N 3.45Å; N245-L248 VanDerWaalsContact OD1-N 3.16Å; N245-F249 VanDerWaalsContact O-CD2 3.29Å; N245-F249 WeakPolarHBondContact O-CD2 3.45Å; N245-F249 PolarHBondContact O-N 3.15Å; N245-F249 VanDerWaalsContact O-N 3.17Å
246	V	95.9	Very high	96.1	Very high	14 Å²	14	34.5 Å²	34.5	9%	0.085	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-48	-176.3	174.1	0	0	0	0	111.7	F249 K250 L285 W291 L295 L298	V246-F249 PolarHBondContact O-N 2.92Å; V246-K250 PolarHBondContact O-N 3.26Å; V246-K250 VanDerWaalsContact O-N 3.1Å; V246-L285 HydrophobicContact CG1-CD1 4.22Å; V246-L285 HydrophobicContact CG1-CD2 4.12Å; V246-W291 HydrophobicContact CG1-CE3 4.09Å; V246-W291 HydrophobicContact CG1-CZ3 3.7Å; V246-W291 HydrophobicContact CG2-CZ3 3.97Å; V246-L295 HydrophobicContact CG2-CB 4.37Å; V246-L295 HydrophobicContact CG2-CD1 4.38Å; V246-L298 HydrophobicContact CG2-CD2 4.45Å
247	E	95.2	Very high	96.1	Very high	93 Å²	93	34.5 Å²	34.5	44%	0.435	18%	0.177	S	C	.	.	H	α-helix	trans	-69.2	-38.1	-177.1	-54	-49.5	124.1	0	0	110.5	N245 F249 K250 E251	N245-E247 PolarHBondContact OD1-N 3.35Å; E247-F249 VanDerWaalsContact C-N 3.3Å; E247-F249 PolarHBondContact O-N 3.12Å; E247-K250 WeakPolarHBondContact O-CB 3.39Å; E247-K250 PolarHBondContact O-N 3.11Å; E247-K250 IonicContact OE1-NZ 2.74Å; E247-K250 PolarHBondContact OE1-NZ 3.23Å; E247-K250 WeakPolarHBondContact OE2-CD 3.48Å; E247-K250 IonicContact OE2-NZ 2.65Å; E247-K250 PolarHBondContact OE2-NZ 2.86Å; E247-K250 VanDerWaalsContact OE2-NZ 3.15Å; E247-E251 PolarHBondContact O-N 3.41Å
248	L	96.1	Very high	96.1	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-56.4	-43	170.5	-177.1	64.7	0	0	0	112	V210 V213 W235 L236 N245 K250 E251 L252	V210-L248 HydrophobicContact CG2-CB 4.1Å; V210-L248 HydrophobicContact CG2-CD2 4.31Å; V213-L248 HydrophobicContact CG1-CD1 3.79Å; W235-L248 HydrophobicContact CZ3-CD2 4.17Å; L236-L248 HydrophobicContact CD2-CD1 3.93Å; L236-L248 HydrophobicContact CD2-CD2 4.48Å; N245-L248 HydrophobicContact CB-CB 3.89Å; N245-L248 PolarHBondContact OD1-N 3.45Å; N245-L248 VanDerWaalsContact OD1-N 3.16Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.89Å; L248-E251 PolarHBondContact O-N 3.22Å; L248-L252 HydrophobicContact CD1-CD1 4.43Å; L248-L252 HydrophobicContact CD1-CG 4.45Å; L248-L252 HydrophobicContact CG-CD1 4.07Å; L248-L252 WeakPolarHBondContact O-CD1 3.32Å; L248-L252 WeakPolarHBondContact O-CG 3.24Å; L248-L252 PolarHBondContact O-N 3.1Å
249	F	97.1	Very high	96.2	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-66.1	-33.1	175.7	-77.2	-48	0	0	0	113	L240 Q244 N245 V246 E247 M257 A278 W282 L285 Q286 L298	L240-F249 HydrophobicContact CD1-CD1 4.15Å; L240-F249 HydrophobicContact CD1-CE1 3.69Å; L240-F249 HydrophobicContact CG-CE1 4.4Å; Q244-F249 HydrophobicContact CB-CE2 4.22Å; Q244-F249 HydrophobicContact CB-CZ 4.47Å; Q244-F249 HydrophobicContact CG-CE2 4.12Å; Q244-F249 HydrophobicContact CG-CZ 3.91Å; N245-F249 VanDerWaalsContact O-CD2 3.29Å; N245-F249 WeakPolarHBondContact O-CD2 3.45Å; N245-F249 PolarHBondContact O-N 3.15Å; N245-F249 VanDerWaalsContact O-N 3.17Å; V246-F249 PolarHBondContact O-N 2.92Å; E247-F249 VanDerWaalsContact C-N 3.3Å; E247-F249 PolarHBondContact O-N 3.12Å; F249-M257 HydrophobicContact CD1-CE 4.11Å; F249-M257 HydrophobicContact CE1-CE 4.33Å; F249-A278 HydrophobicContact CZ-CB 4.33Å; F249-W282 HydrophobicContact CD1-CB 4.01Å; F249-W282 HydrophobicContact CD1-CG 4.48Å; F249-W282 HydrophobicContact CE1-CB 4.46Å; F249-W282 HydrophobicContact CG-CB 4.47Å; F249-W282 PolarHBondContact O-NE1 3.11Å; F249-L285 HydrophobicContact CB-CD1 3.53Å; F249-L285 HydrophobicContact CD2-CD1 4.17Å; F249-L285 HydrophobicContact CG-CD1 4.28Å; F249-Q286 PolarHBondContact O-NE2 3.41Å; F249-L298 HydrophobicContact CD2-CD2 4.5Å
250	K	96.9	Very high	96.3	Very high	46 Å²	46	39.4 Å²	39.4	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-41	175.3	-69.6	171.9	179.9	166.1	0	112.1	V246 E247 L248 L252 L285 Q286 W291	V246-K250 PolarHBondContact O-N 3.26Å; V246-K250 VanDerWaalsContact O-N 3.1Å; E247-K250 WeakPolarHBondContact O-CB 3.39Å; E247-K250 PolarHBondContact O-N 3.11Å; E247-K250 IonicContact OE1-NZ 2.74Å; E247-K250 PolarHBondContact OE1-NZ 3.23Å; E247-K250 WeakPolarHBondContact OE2-CD 3.48Å; E247-K250 IonicContact OE2-NZ 2.65Å; E247-K250 PolarHBondContact OE2-NZ 2.86Å; E247-K250 VanDerWaalsContact OE2-NZ 3.15Å; L248-K250 VanDerWaalsContact C-N 3.34Å; L248-K250 PolarHBondContact O-N 2.89Å; K250-L252 VanDerWaalsContact C-N 3.33Å; K250-L252 PolarHBondContact O-N 3.43Å; K250-L285 HydrophobicContact CG-CB 4.21Å; K250-L285 HydrophobicContact CG-CD2 4.47Å; K250-Q286 PolarHBondContact O-NE2 3.47Å; K250-W291 WeakPolarHBondContact CE-O 3.44Å; K250-W291 PolarHBondContact NZ-O 3.24Å
251	E	96.8	Very high	96.3	Very high	96 Å²	96	39.4 Å²	39.4	45%	0.449	20%	0.197	S	C	.	.	H	α-helix	trans	-73.6	-21.1	-178.8	-68.4	176.3	-159.1	0	0	113.9	C214 E247 L248 S253	C214-E251 HydrophobicContact CB-CB 3.86Å; C214-E251 VanDerWaalsContact CB-OE2 3.24Å; C214-E251 WeakPolarHBondContact CB-OE2 3.4Å; E247-E251 PolarHBondContact O-N 3.41Å; L248-E251 PolarHBondContact O-N 3.22Å; E251-S253 PolarHBondContact O-N 3.26Å; E251-S253 VanDerWaalsContact O-N 3.14Å
252	L	97.8	Very high	96.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	21%	0.211	C	C	.	.			trans	-75.1	103.7	-177	-79.6	169.2	0	0	0	112.9	L236 L240 L248 K250 V256 M257 L260 W282	L236-L252 HydrophobicContact CD1-CD2 4.05Å; L236-L252 HydrophobicContact CD2-CD2 4.03Å; L240-L252 HydrophobicContact CD1-CD1 3.5Å; L240-L252 VanDerWaalsContact CD1-CD1 3.5Å; L248-L252 HydrophobicContact CD1-CD1 4.43Å; L248-L252 HydrophobicContact CD1-CG 4.45Å; L248-L252 HydrophobicContact CG-CD1 4.07Å; L248-L252 WeakPolarHBondContact O-CD1 3.32Å; L248-L252 WeakPolarHBondContact O-CG 3.24Å; L248-L252 PolarHBondContact O-N 3.1Å; K250-L252 VanDerWaalsContact C-N 3.33Å; K250-L252 PolarHBondContact O-N 3.43Å; L252-V256 HydrophobicContact CD2-CB 4.17Å; L252-V256 HydrophobicContact CD2-CG1 3.52Å; L252-M257 HydrophobicContact CB-CE 4.22Å; L252-M257 HydrophobicContact CD1-CE 3.85Å; L252-L260 HydrophobicContact CD1-CD1 4.5Å; L252-L260 HydrophobicContact CD2-CD1 4.17Å; L252-W282 PolarHBondContact O-NE1 3.3Å
253	S	97.1	Very high	96.6	Very high	59 Å²	59	40.6 Å²	40.6	41%	0.413	21%	0.213	S	C	.	.			trans	-60.5	155.4	172.6	72.3	0	0	0	0	113.6	E251 N255 V256 M257	E251-S253 PolarHBondContact O-N 3.26Å; E251-S253 VanDerWaalsContact O-N 3.14Å; S253-N255 VanDerWaalsContact C-N 3.26Å; S253-N255 PolarHBondContact O-N 3.49Å; S253-V256 PolarHBondContact O-N 3.16Å; S253-V256 VanDerWaalsContact O-N 3.08Å; S253-V256 WeakPolarHBondContact OG-CG2 3.27Å; S253-M257 PolarHBondContact O-N 2.93Å
254	I	98.1	Very high	96.8	Very high	52 Å²	52	37.8 Å²	37.8	27%	0.267	20%	0.201	S	C	.	.	H	α-helix	trans	-51.6	-42.7	178.2	-58.7	178.9	0	0	0	112	M257 K258 W282 P326 F327 V330	I254-M257 PolarHBondContact O-N 2.62Å; I254-K258 VanDerWaalsContact O-CB 3.3Å; I254-K258 WeakPolarHBondContact O-CB 3.49Å; I254-K258 PolarHBondContact O-N 2.73Å; I254-W282 HydrophobicContact CB-CH2 4.36Å; I254-W282 HydrophobicContact CG1-CH2 4.04Å; I254-W282 HydrophobicContact CG1-CZ2 4.13Å; I254-P326 HydrophobicContact CD1-CB 3.61Å; I254-F327 HydrophobicContact CD1-CE1 4.48Å; I254-F327 HydrophobicContact CG1-CE1 4.49Å; I254-V330 HydrophobicContact CG2-CG2 3.72Å
255	N	97.4	Very high	97	Very high	91 Å²	91	38.1 Å²	38.1	49%	0.487	20%	0.204	S	C	.	.	H	α-helix	trans	-67.6	-39.2	-179.4	-175.8	30.7	0	0	0	112.5	S253 Q259	S253-N255 VanDerWaalsContact C-N 3.26Å; S253-N255 PolarHBondContact O-N 3.49Å; N255-Q259 WeakPolarHBondContact O-CG 3.28Å; N255-Q259 PolarHBondContact O-N 2.93Å; N255-Q259 PolarHBondContact O-NE2 2.79Å; N255-Q259 PolarHBondContact OD1-NE2 2.68Å
256	V	98.1	Very high	97.2	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-68.4	-47.4	175.8	179.7	0	0	0	0	109.6	Y217 L233 L236 L252 S253 K258 Q259 L260	Y217-V256 HydrophobicContact CD1-CG2 3.83Å; Y217-V256 HydrophobicContact CE1-CG2 3.35Å; L233-V256 HydrophobicContact CD2-CG1 4.34Å; L236-V256 HydrophobicContact CD1-CG1 3.79Å; L252-V256 HydrophobicContact CD2-CB 4.17Å; L252-V256 HydrophobicContact CD2-CG1 3.52Å; S253-V256 PolarHBondContact O-N 3.16Å; S253-V256 VanDerWaalsContact O-N 3.08Å; S253-V256 WeakPolarHBondContact OG-CG2 3.27Å; V256-K258 VanDerWaalsContact C-N 3.29Å; V256-K258 PolarHBondContact O-N 3.18Å; V256-Q259 WeakPolarHBondContact O-CB 3.44Å; V256-Q259 PolarHBondContact O-N 2.87Å; V256-L260 HydrophobicContact CG1-CD1 4.03Å; V256-L260 HydrophobicContact CG1-CG 4.24Å; V256-L260 WeakPolarHBondContact O-CG 3.11Å; V256-L260 PolarHBondContact O-N 3.15Å
257	M	98.6	Very high	97.2	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-58.8	-40.6	177.9	-169	60.7	78.2	0	0	112.2	L240 F249 L252 S253 I254 Q259 L260 I261 L279 W282 V330	L240-M257 HydrophobicContact CD1-CE 4.21Å; L240-M257 HydrophobicContact CD2-CE 4.44Å; L240-M257 HydrophobicContact CD2-SD 3.87Å; F249-M257 HydrophobicContact CD1-CE 4.11Å; F249-M257 HydrophobicContact CE1-CE 4.33Å; L252-M257 HydrophobicContact CB-CE 4.22Å; L252-M257 HydrophobicContact CD1-CE 3.85Å; S253-M257 PolarHBondContact O-N 2.93Å; I254-M257 PolarHBondContact O-N 2.62Å; M257-Q259 PolarHBondContact O-N 3.5Å; M257-L260 PolarHBondContact O-N 3.42Å; M257-I261 HydrophobicContact CG-CG1 4.28Å; M257-I261 WeakPolarHBondContact O-CG1 3.39Å; M257-I261 PolarHBondContact O-N 3.06Å; M257-I261 HydrophobicContact SD-CD1 4.07Å; M257-I261 HydrophobicContact SD-CG1 4.06Å; M257-L279 HydrophobicContact CG-CD2 3.59Å; M257-L279 HydrophobicContact SD-CD2 3.97Å; M257-W282 HydrophobicContact CB-CD2 4.41Å; M257-W282 HydrophobicContact CB-CH2 3.88Å; M257-W282 HydrophobicContact CB-CZ2 3.67Å; M257-W282 HydrophobicContact CB-CZ3 4.31Å; M257-W282 HydrophobicContact CE-CB 4.05Å; M257-W282 VanDerWaalsContact CE-CD1 3.44Å; M257-W282 HydrophobicContact CE-CD2 3.75Å; M257-W282 HydrophobicContact CE-CG 3.47Å; M257-W282 VanDerWaalsContact CE-CG 3.47Å; M257-W282 HydrophobicContact CG-CD2 3.9Å; M257-W282 HydrophobicContact CG-CE3 3.88Å; M257-W282 HydrophobicContact CG-CH2 4.01Å; M257-W282 HydrophobicContact CG-CZ2 4.03Å; M257-W282 HydrophobicContact CG-CZ3 3.92Å; M257-V330 HydrophobicContact CB-CG1 4.28Å; M257-V330 HydrophobicContact CG-CG1 3.68Å
258	K	98.4	Very high	97.2	Very high	84 Å²	84	30.4 Å²	30.4	37%	0.365	17%	0.165	S	C	.	.	H	α-helix	trans	-54.6	-48.6	172.3	-174.6	-174.9	176.4	-169.1	0	112	I254 V256 G262 V330	I254-K258 VanDerWaalsContact O-CB 3.3Å; I254-K258 WeakPolarHBondContact O-CB 3.49Å; I254-K258 PolarHBondContact O-N 2.73Å; V256-K258 VanDerWaalsContact C-N 3.29Å; V256-K258 PolarHBondContact O-N 3.18Å; K258-G262 PolarHBondContact O-N 2.99Å; K258-V330 HydrophobicContact CB-CG2 4.06Å
259	Q	97.9	Very high	96.9	Very high	73 Å²	73	31.4 Å²	31.4	34%	0.341	17%	0.17	S	C	.	.	H	α-helix	trans	-64.8	-39.7	178.6	-70.2	173	53	0	0	112.2	N255 V256 M257 S263	N255-Q259 WeakPolarHBondContact O-CG 3.28Å; N255-Q259 PolarHBondContact O-N 2.93Å; N255-Q259 PolarHBondContact O-NE2 2.79Å; N255-Q259 PolarHBondContact OD1-NE2 2.68Å; V256-Q259 WeakPolarHBondContact O-CB 3.44Å; V256-Q259 PolarHBondContact O-N 2.87Å; M257-Q259 PolarHBondContact O-N 3.5Å; Q259-S263 WeakPolarHBondContact O-CB 3.25Å; Q259-S263 PolarHBondContact O-N 3.33Å
260	L	98.4	Very high	96.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-65.9	-47.2	178.6	-62.6	177.3	0	0	0	111.8	L233 L236 L237 L240 L252 V256 M257 S263	L233-L260 HydrophobicContact CD2-CD2 4.29Å; L236-L260 HydrophobicContact CB-CD1 3.89Å; L236-L260 HydrophobicContact CB-CD2 3.58Å; L236-L260 HydrophobicContact CB-CG 4.4Å; L236-L260 HydrophobicContact CD1-CD1 4.34Å; L237-L260 HydrophobicContact CD2-CB 4.49Å; L237-L260 HydrophobicContact CD2-CD2 3.69Å; L237-L260 HydrophobicContact CG-CD2 3.75Å; L240-L260 HydrophobicContact CD1-CD1 4.47Å; L240-L260 HydrophobicContact CD2-CB 4.17Å; L240-L260 HydrophobicContact CD2-CD1 3.96Å; L252-L260 HydrophobicContact CD1-CD1 4.5Å; L252-L260 HydrophobicContact CD2-CD1 4.17Å; V256-L260 HydrophobicContact CG1-CD1 4.03Å; V256-L260 HydrophobicContact CG1-CG 4.24Å; V256-L260 WeakPolarHBondContact O-CG 3.11Å; V256-L260 PolarHBondContact O-N 3.15Å; M257-L260 PolarHBondContact O-N 3.42Å; L260-S263 WeakPolarHBondContact O-CB 3.3Å; L260-S263 PolarHBondContact O-N 2.82Å
261	I	98.1	Very high	96.4	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-75.5	-30.2	-179.5	-55.5	-39.2	0	0	0	112.3	L240 M257 S263 L266 I275 L279 V330 H333 R396	L240-I261 HydrophobicContact CD2-CD1 4.11Å; M257-I261 HydrophobicContact CG-CG1 4.28Å; M257-I261 WeakPolarHBondContact O-CG1 3.39Å; M257-I261 PolarHBondContact O-N 3.06Å; M257-I261 HydrophobicContact SD-CD1 4.07Å; M257-I261 HydrophobicContact SD-CG1 4.06Å; I261-S263 PolarHBondContact O-N 2.88Å; I261-L266 HydrophobicContact CD1-CD2 3.75Å; I261-I275 HydrophobicContact CD1-CG2 3.68Å; I261-I275 HydrophobicContact CG1-CG2 4.29Å; I261-I275 HydrophobicContact CG2-CG2 3.94Å; I261-L279 HydrophobicContact CD1-CD2 4.46Å; I261-L279 HydrophobicContact CG1-CD1 4.25Å; I261-L279 HydrophobicContact CG1-CD2 3.82Å; I261-L279 HydrophobicContact CG1-CG 4.19Å; I261-L279 HydrophobicContact CG2-CD1 4.36Å; I261-V330 HydrophobicContact CG1-CG1 4.27Å; I261-H333 HydrophobicContact CB-CB 4.32Å; I261-H333 HydrophobicContact CG2-CB 3.87Å; I261-R396 PolarHBondContact O-NH1 2.61Å; I261-R396 PolarHBondContact O-NH2 3.24Å
262	G	96.9	Very high	96.3	Very high	34 Å²	34	31.7 Å²	31.7	35%	0.351	17%	0.174	S	C	.	.	H	α-helix	trans	-67.6	-22.5	171.7	0	0	0	0	0	114	K258 H333	K258-G262 PolarHBondContact O-N 2.99Å; G262-H333 VanDerWaalsContact CA-CD2 3.45Å; G262-H333 WeakPolarHBondContact CA-CD2 3.42Å
263	S	97.4	Very high	96.2	Very high	22 Å²	22	32.4 Å²	32.4	15%	0.154	18%	0.178	C	C	.	.			trans	-74.7	129.1	-173.8	-171.8	0	0	0	0	113.5	L237 Q259 L260 I261 N265 L266 R396	L237-S263 WeakPolarHBondContact CD2-OG 3.44Å; Q259-S263 WeakPolarHBondContact O-CB 3.25Å; Q259-S263 PolarHBondContact O-N 3.33Å; L260-S263 WeakPolarHBondContact O-CB 3.3Å; L260-S263 PolarHBondContact O-N 2.82Å; I261-S263 PolarHBondContact O-N 2.88Å; S263-N265 PolarHBondContact O-N 2.65Å; S263-N265 WeakPolarHBondContact OG-CB 3.29Å; S263-N265 PolarHBondContact OG-N 2.61Å; S263-N265 VanDerWaalsContact OG-N 3.1Å; S263-L266 PolarHBondContact O-N 2.84Å; S263-R396 PolarHBondContact O-NH1 2.89Å
264	S	95.1	Very high	96.1	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.042	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25	164.7	61.7	0	0	0	0	112.6	E391 R457 N505	S264-E391 WeakPolarHBondContact CB-O 3.43Å; S264-E391 WeakPolarHBondContact OG-CG 3.25Å; S264-E391 PolarHBondContact OG-OE2 2.81Å; S264-R457 PolarHBondContact O-NH2 2.87Å; S264-N505 PolarHBondContact O-ND2 2.84Å; S264-N505 PolarHBondContact O-OD1 2.99Å
265	N	96.1	Very high	96.1	Very high	55 Å²	55	28.9 Å²	28.9	29%	0.294	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-1.1	-177.9	-63.6	-67.2	0	0	0	114	L237 S263 F267 R455 R457	L237-N265 HydrophobicContact CD1-CB 4.25Å; S263-N265 PolarHBondContact O-N 2.65Å; S263-N265 WeakPolarHBondContact OG-CB 3.29Å; S263-N265 PolarHBondContact OG-N 2.61Å; S263-N265 VanDerWaalsContact OG-N 3.1Å; N265-F267 PolarHBondContact O-N 2.69Å; N265-R455 PolarHBondContact OD1-NH1 3.06Å; N265-R455 PolarHBondContact OD1-NH2 2.91Å; N265-R457 PolarHBondContact O-NH1 3.11Å
266	L	97.6	Very high	96.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.			trans	-56.6	136.7	171.7	-175	65	0	0	0	110.3	L237 L240 M241 I261 S263 V268 I275 R457	L237-L266 HydrophobicContact CD2-CB 4.24Å; L237-L266 HydrophobicContact CD2-CD1 4.34Å; L240-L266 HydrophobicContact CB-CD1 4.37Å; L240-L266 HydrophobicContact CD2-CD1 4.16Å; M241-L266 HydrophobicContact CG-CD1 4.22Å; M241-L266 HydrophobicContact CG-CD2 4.4Å; M241-L266 HydrophobicContact CG-CG 4.33Å; I261-L266 HydrophobicContact CD1-CD2 3.75Å; S263-L266 PolarHBondContact O-N 2.84Å; L266-V268 HydrophobicContact CB-CG2 4.45Å; L266-V268 HydrophobicContact CD2-CG2 4.07Å; L266-V268 HydrophobicContact CG-CG2 4.04Å; L266-V268 PolarHBondContact O-N 2.98Å; L266-I275 HydrophobicContact CD2-CD1 4.33Å; L266-I275 HydrophobicContact CD2-CG2 4.47Å; L266-R457 PolarHBondContact O-NH2 2.99Å; L266-R457 VanDerWaalsContact O-NH2 3.09Å
267	F	96	Very high	96.1	Very high	3 Å²	3	25.8 Å²	25.8	1%	0.013	14%	0.139	C	C	.	.			trans	-96.4	78.8	-172.4	-144	-70.4	0	0	0	111.2	L237 M241 T242 N265 M269 R457 A459 Y501 C503	L237-F267 WeakPolarHBondContact O-CB 3.01Å; L237-F267 PolarHBondContact O-N 3Å; M241-F267 WeakPolarHBondContact CB-O 3.5Å; T242-F267 HydrophobicContact CG2-CD1 4.14Å; N265-F267 PolarHBondContact O-N 2.69Å; F267-M269 HydrophobicContact CD1-CE 3.6Å; F267-M269 HydrophobicContact CE1-CE 3.89Å; F267-R457 HydrophobicContact CE2-CB 4.19Å; F267-R457 HydrophobicContact CZ-CB 4.48Å; F267-A459 HydrophobicContact CE2-CB 3.7Å; F267-A459 HydrophobicContact CZ-CB 3.73Å; F267-Y501 WeakPolarHBondContact CZ-O 3.13Å; F267-C503 HydrophobicContact CD1-CB 3.49Å; F267-C503 VanDerWaalsContact CD1-CB 3.49Å; F267-C503 HydrophobicContact CD2-CB 4.25Å; F267-C503 HydrophobicContact CE1-CB 3.36Å; F267-C503 HydrophobicContact CE2-CB 4.16Å; F267-C503 HydrophobicContact CG-CB 3.93Å; F267-C503 HydrophobicContact CZ-CB 3.71Å
268	V	95.2	Very high	96.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.			trans	-78.5	146	-171	-178.8	0	0	0	0	111.7	L266 I275 R396 G398 C503	L266-V268 HydrophobicContact CB-CG2 4.45Å; L266-V268 HydrophobicContact CD2-CG2 4.07Å; L266-V268 HydrophobicContact CG-CG2 4.04Å; L266-V268 PolarHBondContact O-N 2.98Å; V268-I275 HydrophobicContact CG1-CD1 4.14Å; V268-I275 HydrophobicContact CG1-CG1 4.11Å; V268-I275 HydrophobicContact CG2-CD1 3.58Å; V268-I275 HydrophobicContact CG2-CG1 4.08Å; V268-R396 HydrophobicContact CB-CB 4.08Å; V268-R396 HydrophobicContact CG1-CB 4.34Å; V268-R396 HydrophobicContact CG2-CB 3.77Å; V268-G398 WeakPolarHBondContact O-CA 3.32Å; V268-C503 PolarHBondContact N-SG 3.39Å
269	M	89.3	Confident	96.1	Very high	24 Å²	24	21.9 Å²	21.9	12%	0.118	12%	0.123	C	C	.	.	S	Bend	trans	-105.5	-30.6	-164.9	-79.4	-63.7	95.2	0	0	117.6	M241 T242 F267 G398 R399 K400 Y501	M241-M269 WeakPolarHBondContact O-CG 3.37Å; T242-M269 HydrophobicContact CG2-CE 3.81Å; T242-M269 HydrophobicContact CG2-CG 4.12Å; T242-M269 HydrophobicContact CG2-SD 3.93Å; F267-M269 HydrophobicContact CD1-CE 3.6Å; F267-M269 HydrophobicContact CE1-CE 3.89Å; M269-G398 CarbonylContact O-C 3.51Å; M269-R399 PolarHBondContact O-N 3.18Å; M269-K400 HydrophobicContact SD-CB 4.37Å; M269-Y501 HydrophobicContact CE-CD1 4.04Å; M269-Y501 HydrophobicContact SD-CD1 3.62Å; M269-Y501 HydrophobicContact SD-CE1 4.17Å
270	Q	90.3	Very high	96.1	Very high	117 Å²	117	18.7 Å²	18.7	55%	0.547	11%	0.108	S	C	.	.	S	Bend	trans	-127.5	-68.1	168.5	-42.2	-173.3	22.1	0	0	109.5	D274 C397 G398	Q270-D274 VanDerWaalsContact CA-OD2 3.27Å; Q270-D274 WeakPolarHBondContact CA-OD2 3.46Å; Q270-D274 WeakPolarHBondContact CB-OD2 3.2Å; Q270-D274 WeakPolarHBondContact CG-OD2 3.18Å; Q270-D274 PolarHBondContact N-OD2 3.2Å; Q270-C397 WeakPolarHBondContact O-CA 3.27Å; Q270-C397 WeakPolarHBondContact O-CB 3.39Å; Q270-G398 PolarHBondContact O-N 3.33Å
271	V	93.7	Very high	96.1	Very high	32 Å²	32	19.8 Å²	19.8	19%	0.194	11%	0.113	C	C	.	.			trans	-153	172.1	-173.3	-69.3	0	0	0	0	111.9	M273 D274 R396	V271-M273 HydrophobicContact CG2-CB 4Å; V271-M273 PolarHBondContact O-N 3.46Å; V271-M273 VanDerWaalsContact O-N 3.14Å; V271-D274 PolarHBondContact N-OD2 3.08Å; V271-D274 VanDerWaalsContact N-OD2 3.08Å; V271-D274 VanDerWaalsContact O-CB 3.32Å; V271-D274 WeakPolarHBondContact O-CB 3.37Å; V271-D274 PolarHBondContact O-N 2.9Å; V271-R396 CarbonylContact C-O 3.58Å
272	E	94.8	Very high	96.1	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-56	-28.7	178.6	-166.6	71.9	-164.3	0	0	113.6	D274 I275 Y276 R335 I339 R396	E272-D274 PolarHBondContact O-N 2.86Å; E272-I275 VanDerWaalsContact O-CB 3.28Å; E272-I275 WeakPolarHBondContact O-CB 3.43Å; E272-I275 PolarHBondContact O-N 2.88Å; E272-I275 WeakPolarHBondContact OE2-CD1 3.25Å; E272-Y276 PolarHBondContact O-N 2.93Å; E272-R335 HydrophobicContact CG-CB 4.08Å; E272-R335 WeakPolarHBondContact OE1-CB 3.24Å; E272-R335 PolarHBondContact OE1-N 2.88Å; E272-I339 HydrophobicContact CB-CG1 3.98Å; E272-I339 HydrophobicContact CG-CD1 4.11Å; E272-I339 HydrophobicContact CG-CG1 3.78Å; E272-R396 PolarHBondContact N-O 3.28Å; E272-R396 IonicContact OE1-CZ 2.75Å; E272-R396 IonicContact OE1-NE 3.92Å; E272-R396 IonicContact OE1-NH2 3.65Å; E272-R396 PolarHBondContact OE1-NH2 3.29Å; E272-R396 IonicContact OE2-CZ 3.4Å; E272-R396 IonicContact OE2-NE 2.69Å; E272-R396 PolarHBondContact OE2-NE 2.6Å; E272-R396 IonicContact OE2-NH2 3.23Å; E272-R396 PolarHBondContact OE2-NH2 2.78Å
273	M	95.7	Very high	96.2	Very high	18 Å²	18	18.1 Å²	18.1	9%	0.089	10%	0.095	C	C	.	.	H	α-helix	trans	-62.5	-27.3	175	-172.3	57.8	179.3	0	0	113.4	V271 I275 Y276 T277 I339 I348	V271-M273 HydrophobicContact CG2-CB 4Å; V271-M273 PolarHBondContact O-N 3.46Å; V271-M273 VanDerWaalsContact O-N 3.14Å; M273-I275 PolarHBondContact O-N 3.31Å; M273-Y276 HydrophobicContact CE-CD1 3.66Å; M273-Y276 HydrophobicContact CE-CE1 3.97Å; M273-Y276 PolarHBondContact O-N 2.94Å; M273-Y276 HydrophobicContact SD-CD1 3.63Å; M273-Y276 HydrophobicContact SD-CE1 4.45Å; M273-Y276 HydrophobicContact SD-CG 4.23Å; M273-T277 WeakPolarHBondContact O-CB 3.4Å; M273-T277 PolarHBondContact O-N 3.4Å; M273-T277 PolarHBondContact O-OG1 2.97Å; M273-I339 HydrophobicContact SD-CG2 3.7Å; M273-I348 HydrophobicContact CE-CB 3.74Å; M273-I348 HydrophobicContact CE-CD1 4.16Å; M273-I348 HydrophobicContact CE-CG2 3.43Å; M273-I348 VanDerWaalsContact CE-CG2 3.43Å
274	D	95.9	Very high	96.2	Very high	37 Å²	37	17.3 Å²	17.3	20%	0.198	9%	0.089	C	C	.	.	H	α-helix	trans	-63.2	-34.7	172.1	-64.9	-38.1	0	0	0	111.2	M241 Q270 V271 E272 T277 A278	M241-D274 HydrophobicContact CE-CB 3.69Å; Q270-D274 VanDerWaalsContact CA-OD2 3.27Å; Q270-D274 WeakPolarHBondContact CA-OD2 3.46Å; Q270-D274 WeakPolarHBondContact CB-OD2 3.2Å; Q270-D274 WeakPolarHBondContact CG-OD2 3.18Å; Q270-D274 PolarHBondContact N-OD2 3.2Å; V271-D274 PolarHBondContact N-OD2 3.08Å; V271-D274 VanDerWaalsContact N-OD2 3.08Å; V271-D274 VanDerWaalsContact O-CB 3.32Å; V271-D274 WeakPolarHBondContact O-CB 3.37Å; V271-D274 PolarHBondContact O-N 2.9Å; E272-D274 PolarHBondContact O-N 2.86Å; D274-T277 PolarHBondContact O-N 3.26Å; D274-A278 WeakPolarHBondContact O-CB 3.3Å; D274-A278 PolarHBondContact O-N 3.3Å
275	I	97.8	Very high	96.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-73.6	-43.6	-177.1	-47.1	178.5	0	0	0	109.7	M241 I261 L266 V268 E272 M273 T277 A278 L279 L334 R396	M241-I275 HydrophobicContact CE-CG1 4.36Å; I261-I275 HydrophobicContact CD1-CG2 3.68Å; I261-I275 HydrophobicContact CG1-CG2 4.29Å; I261-I275 HydrophobicContact CG2-CG2 3.94Å; L266-I275 HydrophobicContact CD2-CD1 4.33Å; L266-I275 HydrophobicContact CD2-CG2 4.47Å; V268-I275 HydrophobicContact CG1-CD1 4.14Å; V268-I275 HydrophobicContact CG1-CG1 4.11Å; V268-I275 HydrophobicContact CG2-CD1 3.58Å; V268-I275 HydrophobicContact CG2-CG1 4.08Å; E272-I275 VanDerWaalsContact O-CB 3.28Å; E272-I275 WeakPolarHBondContact O-CB 3.43Å; E272-I275 PolarHBondContact O-N 2.88Å; E272-I275 WeakPolarHBondContact OE2-CD1 3.25Å; M273-I275 PolarHBondContact O-N 3.31Å; I275-T277 VanDerWaalsContact C-N 3.31Å; I275-T277 PolarHBondContact O-N 3.4Å; I275-A278 PolarHBondContact O-N 3.33Å; I275-L279 WeakPolarHBondContact O-CB 3.46Å; I275-L279 WeakPolarHBondContact O-CG 3.5Å; I275-L279 PolarHBondContact O-N 3.26Å; I275-L334 HydrophobicContact CB-CD2 4.13Å; I275-L334 HydrophobicContact CG2-CD2 3.95Å; I275-R396 HydrophobicContact CD1-CB 4.48Å
276	Y	98.2	Very high	96.5	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-55.8	-47.9	169.3	169.6	-99.8	0	0	0	111	E272 M273 A278 L279 K280 F331 L334 I349 D352 V355	E272-Y276 PolarHBondContact O-N 2.93Å; M273-Y276 HydrophobicContact CE-CD1 3.66Å; M273-Y276 HydrophobicContact CE-CE1 3.97Å; M273-Y276 PolarHBondContact O-N 2.94Å; M273-Y276 HydrophobicContact SD-CD1 3.63Å; M273-Y276 HydrophobicContact SD-CE1 4.45Å; M273-Y276 HydrophobicContact SD-CG 4.23Å; Y276-A278 VanDerWaalsContact C-N 3.34Å; Y276-A278 PolarHBondContact O-N 3.41Å; Y276-L279 PolarHBondContact O-N 3.21Å; Y276-K280 WeakPolarHBondContact O-CB 3.32Å; Y276-K280 PolarHBondContact O-N 2.85Å; Y276-F331 HydrophobicContact CD2-CE1 4.25Å; Y276-F331 HydrophobicContact CE2-CE1 4.23Å; Y276-L334 HydrophobicContact CD2-CD1 3.87Å; Y276-I349 HydrophobicContact CD2-CD1 3.97Å; Y276-I349 HydrophobicContact CD2-CG1 4.37Å; Y276-I349 HydrophobicContact CE2-CD1 4Å; Y276-I349 HydrophobicContact CE2-CG1 3.92Å; Y276-I349 HydrophobicContact CG-CD1 4.47Å; Y276-D352 WeakPolarHBondContact CE1-OD2 3.42Å; Y276-D352 WeakPolarHBondContact OH-CB 3.48Å; Y276-D352 VanDerWaalsContact OH-CG 3.28Å; Y276-D352 PolarHBondContact OH-OD2 2.98Å; Y276-V355 HydrophobicContact CE2-CG2 4.18Å
277	T	97.8	Very high	96.5	Very high	29 Å²	29	19.7 Å²	19.7	18%	0.178	10%	0.099	C	C	.	.	H	α-helix	trans	-62.3	-39.5	178.1	-55.1	0	0	0	0	112.1	M273 D274 I275 K280 K281 L299	M273-T277 WeakPolarHBondContact O-CB 3.4Å; M273-T277 PolarHBondContact O-N 3.4Å; M273-T277 PolarHBondContact O-OG1 2.97Å; D274-T277 PolarHBondContact O-N 3.26Å; I275-T277 VanDerWaalsContact C-N 3.31Å; I275-T277 PolarHBondContact O-N 3.4Å; T277-K280 PolarHBondContact O-N 2.71Å; T277-K281 VanDerWaalsContact O-CG 3.27Å; T277-K281 WeakPolarHBondContact O-CG 3.43Å; T277-K281 PolarHBondContact O-N 3.45Å; T277-K281 VanDerWaalsContact O-N 3.13Å; T277-L299 HydrophobicContact CG2-CD1 3.76Å; T277-L299 HydrophobicContact CG2-CD2 4.04Å
278	A	98.2	Very high	96.5	Very high	4 Å²	4	21 Å²	21	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-66.8	-41.9	175.4	0	0	0	0	0	112.1	M241 F249 D274 I275 Y276 K281 W282	M241-A278 HydrophobicContact CE-CB 4Å; M241-A278 HydrophobicContact SD-CB 3.76Å; F249-A278 HydrophobicContact CZ-CB 4.33Å; D274-A278 WeakPolarHBondContact O-CB 3.3Å; D274-A278 PolarHBondContact O-N 3.3Å; I275-A278 PolarHBondContact O-N 3.33Å; Y276-A278 VanDerWaalsContact C-N 3.34Å; Y276-A278 PolarHBondContact O-N 3.41Å; A278-K281 PolarHBondContact O-N 2.96Å; A278-W282 WeakPolarHBondContact O-CB 3.31Å; A278-W282 PolarHBondContact O-N 3.03Å
279	L	98.6	Very high	96.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-38.7	174.6	-76.6	-174	0	0	0	112.7	M257 I261 I275 Y276 W282 M283 V330 F331 L334	M257-L279 HydrophobicContact CG-CD2 3.59Å; M257-L279 HydrophobicContact SD-CD2 3.97Å; I261-L279 HydrophobicContact CD1-CD2 4.46Å; I261-L279 HydrophobicContact CG1-CD1 4.25Å; I261-L279 HydrophobicContact CG1-CD2 3.82Å; I261-L279 HydrophobicContact CG1-CG 4.19Å; I261-L279 HydrophobicContact CG2-CD1 4.36Å; I275-L279 WeakPolarHBondContact O-CB 3.46Å; I275-L279 WeakPolarHBondContact O-CG 3.5Å; I275-L279 PolarHBondContact O-N 3.26Å; Y276-L279 PolarHBondContact O-N 3.21Å; L279-W282 HydrophobicContact CD2-CE3 3.76Å; L279-W282 HydrophobicContact CD2-CZ3 4.16Å; L279-W282 PolarHBondContact O-N 3.26Å; L279-M283 VanDerWaalsContact O-CB 3.24Å; L279-M283 WeakPolarHBondContact O-CB 3.18Å; L279-M283 PolarHBondContact O-N 3.28Å; L279-V330 HydrophobicContact CD1-CG1 3.99Å; L279-V330 HydrophobicContact CD2-CG1 3.49Å; L279-V330 VanDerWaalsContact CD2-CG1 3.49Å; L279-V330 HydrophobicContact CG-CG1 4.41Å; L279-F331 HydrophobicContact CB-CE1 3.96Å; L279-F331 HydrophobicContact CB-CE2 4Å; L279-F331 HydrophobicContact CB-CZ 3.62Å; L279-F331 HydrophobicContact CD1-CD1 4.25Å; L279-F331 HydrophobicContact CD1-CD2 4.24Å; L279-F331 HydrophobicContact CD1-CE1 4.38Å; L279-F331 HydrophobicContact CD1-CE2 4.38Å; L279-F331 HydrophobicContact CD1-CG 4.18Å; L279-F331 HydrophobicContact CD1-CZ 4.45Å; L279-L334 HydrophobicContact CD1-CD1 4.22Å; L279-L334 HydrophobicContact CD1-CD2 3.97Å; L279-L334 HydrophobicContact CD1-CG 3.98Å
280	K	97.6	Very high	96.8	Very high	5 Å²	5	28.9 Å²	28.9	2%	0.022	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-49.9	174.7	-164.4	-172.2	-176.3	178.8	0	111.2	Y276 T277 F284 T302 D303 F306 D352 I354	Y276-K280 WeakPolarHBondContact O-CB 3.32Å; Y276-K280 PolarHBondContact O-N 2.85Å; T277-K280 PolarHBondContact O-N 2.71Å; K280-F284 PolarHBondContact O-N 3.47Å; K280-T302 HydrophobicContact CB-CG2 4.38Å; K280-T302 HydrophobicContact CD-CG2 4.02Å; K280-T302 HydrophobicContact CG-CG2 3.63Å; K280-D303 VanDerWaalsContact CE-OD1 3.32Å; K280-D303 WeakPolarHBondContact CE-OD1 3.11Å; K280-D303 IonicContact NZ-OD1 3.88Å; K280-D303 PolarHBondContact NZ-OD1 3.12Å; K280-F306 HydrophobicContact CG-CD2 3.97Å; K280-F306 HydrophobicContact CG-CE2 3.78Å; K280-D352 WeakPolarHBondContact CE-OD2 3.28Å; K280-D352 IonicContact NZ-OD1 2.74Å; K280-D352 PolarHBondContact NZ-OD1 3.08Å; K280-D352 IonicContact NZ-OD2 2.74Å; K280-D352 PolarHBondContact NZ-OD2 3.18Å; K280-I354 HydrophobicContact CD-CD1 4.02Å; K280-I354 HydrophobicContact CG-CD1 3.63Å
281	K	98.3	Very high	97.2	Very high	25 Å²	25	24.8 Å²	24.8	11%	0.109	14%	0.142	C	C	.	.	H	α-helix	trans	-60.5	-46.2	175.3	-69.9	168.8	173.2	173.8	0	112.4	T277 A278 F284 L285 L298 L299	T277-K281 VanDerWaalsContact O-CG 3.27Å; T277-K281 WeakPolarHBondContact O-CG 3.43Å; T277-K281 PolarHBondContact O-N 3.45Å; T277-K281 VanDerWaalsContact O-N 3.13Å; A278-K281 PolarHBondContact O-N 2.96Å; K281-F284 PolarHBondContact O-N 2.87Å; K281-L285 WeakPolarHBondContact O-CG 3.43Å; K281-L285 PolarHBondContact O-N 3.15Å; K281-L298 HydrophobicContact CB-CD2 3.91Å; K281-L298 HydrophobicContact CB-CG 4.09Å; K281-L298 HydrophobicContact CD-CD2 4.09Å; K281-L298 HydrophobicContact CD-CG 4.33Å; K281-L298 HydrophobicContact CG-CD2 4.11Å; K281-L298 HydrophobicContact CG-CG 3.98Å; K281-L299 HydrophobicContact CG-CD1 4.47Å
282	W	98.6	Very high	97.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-48.9	178.8	166.5	73.1	0	0	0	111.6	F249 L252 I254 M257 A278 L279 F284 L285 Q286 F327 V330	F249-W282 HydrophobicContact CD1-CB 4.01Å; F249-W282 HydrophobicContact CD1-CG 4.48Å; F249-W282 HydrophobicContact CE1-CB 4.46Å; F249-W282 HydrophobicContact CG-CB 4.47Å; F249-W282 PolarHBondContact O-NE1 3.11Å; L252-W282 PolarHBondContact O-NE1 3.3Å; I254-W282 HydrophobicContact CB-CH2 4.36Å; I254-W282 HydrophobicContact CG1-CH2 4.04Å; I254-W282 HydrophobicContact CG1-CZ2 4.13Å; M257-W282 HydrophobicContact CB-CD2 4.41Å; M257-W282 HydrophobicContact CB-CH2 3.88Å; M257-W282 HydrophobicContact CB-CZ2 3.67Å; M257-W282 HydrophobicContact CB-CZ3 4.31Å; M257-W282 HydrophobicContact CE-CB 4.05Å; M257-W282 VanDerWaalsContact CE-CD1 3.44Å; M257-W282 HydrophobicContact CE-CD2 3.75Å; M257-W282 HydrophobicContact CE-CG 3.47Å; M257-W282 VanDerWaalsContact CE-CG 3.47Å; M257-W282 HydrophobicContact CG-CD2 3.9Å; M257-W282 HydrophobicContact CG-CE3 3.88Å; M257-W282 HydrophobicContact CG-CH2 4.01Å; M257-W282 HydrophobicContact CG-CZ2 4.03Å; M257-W282 HydrophobicContact CG-CZ3 3.92Å; A278-W282 WeakPolarHBondContact O-CB 3.31Å; A278-W282 PolarHBondContact O-N 3.03Å; L279-W282 HydrophobicContact CD2-CE3 3.76Å; L279-W282 HydrophobicContact CD2-CZ3 4.16Å; L279-W282 PolarHBondContact O-N 3.26Å; W282-F284 VanDerWaalsContact C-N 3.31Å; W282-F284 PolarHBondContact O-N 3.08Å; W282-L285 PolarHBondContact O-N 2.88Å; W282-Q286 HydrophobicContact CD2-CG 4.29Å; W282-Q286 HydrophobicContact CG-CG 4.46Å; W282-Q286 HydrophobicContact CZ2-CG 4.09Å; W282-Q286 WeakPolarHBondContact O-CG 3.45Å; W282-Q286 PolarHBondContact O-N 2.89Å; W282-F327 HydrophobicContact CE3-CD1 4.35Å; W282-F327 AromaticContact CH2-CD1 3.59Å; W282-F327 HydrophobicContact CH2-CD1 3.59Å; W282-F327 AromaticContact CH2-CE1 3.92Å; W282-F327 HydrophobicContact CH2-CE1 3.92Å; W282-F327 HydrophobicContact CZ2-CD1 4.47Å; W282-F327 HydrophobicContact CZ2-CE1 4.37Å; W282-F327 AromaticContact CZ3-CD1 3.54Å; W282-F327 HydrophobicContact CZ3-CD1 3.54Å; W282-F327 HydrophobicContact CZ3-CE1 4.1Å; W282-V330 HydrophobicContact CH2-CB 4.49Å; W282-V330 HydrophobicContact CH2-CG2 3.84Å; W282-V330 HydrophobicContact CZ3-CB 4.19Å; W282-V330 HydrophobicContact CZ3-CG1 4.04Å; W282-V330 HydrophobicContact CZ3-CG2 4.04Å
283	M	98.5	Very high	97.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-59.2	-42.1	178	-177.3	162.7	69.2	0	0	111.6	L279 L285 Q286 L287 F306 F318 L319 F327 F331 I354	L279-M283 VanDerWaalsContact O-CB 3.24Å; L279-M283 WeakPolarHBondContact O-CB 3.18Å; L279-M283 PolarHBondContact O-N 3.28Å; M283-L285 PolarHBondContact O-N 3.27Å; M283-Q286 PolarHBondContact O-N 2.81Å; M283-L287 HydrophobicContact CG-CD1 3.75Å; M283-L287 WeakPolarHBondContact O-CB 3.32Å; M283-L287 WeakPolarHBondContact O-CD1 3.4Å; M283-L287 VanDerWaalsContact O-CG 3.27Å; M283-L287 WeakPolarHBondContact O-CG 3.46Å; M283-L287 PolarHBondContact O-N 3.41Å; M283-F306 HydrophobicContact CE-CE1 3.77Å; M283-F306 HydrophobicContact CE-CE2 4.46Å; M283-F306 HydrophobicContact CE-CZ 3.46Å; M283-F306 VanDerWaalsContact CE-CZ 3.46Å; M283-F306 HydrophobicContact CG-CZ 4.31Å; M283-F318 HydrophobicContact CE-CD1 3.71Å; M283-F318 HydrophobicContact CE-CE1 3.96Å; M283-F318 HydrophobicContact CG-CE1 4.38Å; M283-F318 HydrophobicContact SD-CD1 4.03Å; M283-F318 HydrophobicContact SD-CE1 3.81Å; M283-L319 HydrophobicContact CE-CD2 4.5Å; M283-L319 HydrophobicContact SD-CD2 4.06Å; M283-F327 HydrophobicContact CB-CD1 4.28Å; M283-F327 HydrophobicContact CB-CE1 4.38Å; M283-F327 HydrophobicContact CG-CB 4.45Å; M283-F327 HydrophobicContact CG-CD1 3.86Å; M283-F327 HydrophobicContact CG-CD2 3.81Å; M283-F327 HydrophobicContact CG-CE1 3.99Å; M283-F327 HydrophobicContact CG-CE2 3.95Å; M283-F327 HydrophobicContact CG-CG 3.77Å; M283-F327 HydrophobicContact CG-CZ 4.03Å; M283-F327 HydrophobicContact SD-CB 3.57Å; M283-F327 VanDerWaalsContact SD-CB 3.57Å; M283-F327 HydrophobicContact SD-CD1 4.1Å; M283-F327 HydrophobicContact SD-CD2 3.65Å; M283-F327 HydrophobicContact SD-CE2 4.37Å; M283-F327 HydrophobicContact SD-CG 3.49Å; M283-F327 WeakPolarHBondContact SD-CG 3.48Å; M283-F331 HydrophobicContact CB-CE2 4.41Å; M283-F331 HydrophobicContact CE-CE1 4.48Å; M283-F331 HydrophobicContact CE-CE2 3.86Å; M283-F331 HydrophobicContact CE-CZ 3.59Å; M283-F331 HydrophobicContact SD-CE2 3.62Å; M283-F331 HydrophobicContact SD-CZ 4.01Å; M283-I354 HydrophobicContact CE-CD1 4.41Å; M283-I354 HydrophobicContact CE-CG2 3.63Å
284	F	98.3	Very high	97.2	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-44.6	171.5	166.8	-101	0	0	0	112.7	K280 K281 W282 Q286 L287 V288 W291 L298 E301 T302 W305 F306	K280-F284 PolarHBondContact O-N 3.47Å; K281-F284 PolarHBondContact O-N 2.87Å; W282-F284 VanDerWaalsContact C-N 3.31Å; W282-F284 PolarHBondContact O-N 3.08Å; F284-Q286 VanDerWaalsContact C-N 3.33Å; F284-Q286 PolarHBondContact O-N 2.87Å; F284-L287 PolarHBondContact O-N 2.94Å; F284-V288 HydrophobicContact CD2-CB 4.43Å; F284-V288 HydrophobicContact CD2-CG2 3.92Å; F284-V288 HydrophobicContact CE2-CB 4.04Å; F284-V288 HydrophobicContact CE2-CG2 3.69Å; F284-V288 HydrophobicContact CZ-CB 4.27Å; F284-V288 HydrophobicContact CZ-CG2 4.4Å; F284-V288 WeakPolarHBondContact O-CB 3.38Å; F284-V288 PolarHBondContact O-N 3.08Å; F284-W291 HydrophobicContact CE1-CB 4.24Å; F284-W291 AromaticContact CE1-CD1 3.79Å; F284-W291 AromaticContact CE1-CD2 3.98Å; F284-W291 HydrophobicContact CE1-CD2 3.98Å; F284-W291 AromaticContact CE1-CG 3.75Å; F284-W291 HydrophobicContact CE1-CG 3.75Å; F284-W291 HydrophobicContact CZ-CB 4.33Å; F284-W291 AromaticContact CZ-CD1 3.61Å; F284-W291 AromaticContact CZ-CG 3.93Å; F284-W291 HydrophobicContact CZ-CG 3.93Å; F284-L298 HydrophobicContact CD1-CD1 3.79Å; F284-L298 HydrophobicContact CE1-CD1 3.94Å; F284-E301 HydrophobicContact CZ-CB 4.38Å; F284-T302 HydrophobicContact CB-CG2 3.88Å; F284-T302 WeakPolarHBondContact CD1-OG1 3.4Å; F284-T302 HydrophobicContact CG-CG2 4.34Å; F284-W305 HydrophobicContact CD2-CB 3.75Å; F284-W305 AromaticContact CD2-CD2 3.9Å; F284-W305 HydrophobicContact CD2-CD2 3.9Å; F284-W305 HydrophobicContact CD2-CE3 4.21Å; F284-W305 AromaticContact CD2-CG 3.69Å; F284-W305 HydrophobicContact CD2-CG 3.69Å; F284-W305 HydrophobicContact CE2-CB 3.61Å; F284-W305 AromaticContact CE2-CD1 3.81Å; F284-W305 HydrophobicContact CE2-CD2 4.25Å; F284-W305 AromaticContact CE2-CG 3.61Å; F284-W305 HydrophobicContact CE2-CG 3.61Å; F284-F306 HydrophobicContact CB-CE2 4.17Å
285	L	98.3	Very high	97.1	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-31	177.6	-71.3	171.4	0	0	0	113.6	V246 F249 K250 K281 W282 M283 V288 P289 W291 L298	V246-L285 HydrophobicContact CG1-CD1 4.22Å; V246-L285 HydrophobicContact CG1-CD2 4.12Å; F249-L285 HydrophobicContact CB-CD1 3.53Å; F249-L285 HydrophobicContact CD2-CD1 4.17Å; F249-L285 HydrophobicContact CG-CD1 4.28Å; K250-L285 HydrophobicContact CG-CB 4.21Å; K250-L285 HydrophobicContact CG-CD2 4.47Å; K281-L285 WeakPolarHBondContact O-CG 3.43Å; K281-L285 PolarHBondContact O-N 3.15Å; W282-L285 PolarHBondContact O-N 2.88Å; M283-L285 PolarHBondContact O-N 3.27Å; L285-V288 CarbonylContact O-C 3.37Å; L285-P289 WeakPolarHBondContact O-CA 3.45Å; L285-W291 HydrophobicContact CD2-CB 4.47Å; L285-W291 HydrophobicContact CD2-CD2 4.2Å; L285-W291 HydrophobicContact CD2-CE3 3.47Å; L285-W291 VanDerWaalsContact CD2-CE3 3.47Å; L285-W291 HydrophobicContact CD2-CZ3 4.05Å; L285-L298 HydrophobicContact CD1-CD1 4.06Å; L285-L298 HydrophobicContact CD1-CD2 3.91Å; L285-L298 HydrophobicContact CD2-CD1 3.87Å; L285-L298 HydrophobicContact CG-CD1 3.89Å
286	Q	98.1	Very high	96.9	Very high	61 Å²	61	43.5 Å²	43.5	29%	0.285	24%	0.241	S	C	.	.	H	α-helix	trans	-71.6	-34.1	173.3	-65.1	-65.8	-54.1	0	0	111.9	F249 K250 W282 M283 F284 F327	F249-Q286 PolarHBondContact O-NE2 3.41Å; K250-Q286 PolarHBondContact O-NE2 3.47Å; W282-Q286 HydrophobicContact CD2-CG 4.29Å; W282-Q286 HydrophobicContact CG-CG 4.46Å; W282-Q286 HydrophobicContact CZ2-CG 4.09Å; W282-Q286 WeakPolarHBondContact O-CG 3.45Å; W282-Q286 PolarHBondContact O-N 2.89Å; M283-Q286 PolarHBondContact O-N 2.81Å; F284-Q286 VanDerWaalsContact C-N 3.33Å; F284-Q286 PolarHBondContact O-N 2.87Å; Q286-F327 HydrophobicContact CB-CE1 3.85Å; Q286-F327 HydrophobicContact CB-CZ 3.83Å; Q286-F327 HydrophobicContact CG-CE1 4.13Å
287	L	97	Very high	96.8	Very high	49 Å²	49	48 Å²	48	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-84.1	-25.9	179	-68.8	162.7	0	0	0	113.2	M283 F284 P289 W305 F318 Q323 F327	M283-L287 HydrophobicContact CG-CD1 3.75Å; M283-L287 WeakPolarHBondContact O-CB 3.32Å; M283-L287 WeakPolarHBondContact O-CD1 3.4Å; M283-L287 VanDerWaalsContact O-CG 3.27Å; M283-L287 WeakPolarHBondContact O-CG 3.46Å; M283-L287 PolarHBondContact O-N 3.41Å; F284-L287 PolarHBondContact O-N 2.94Å; L287-P289 VanDerWaalsContact C-CD 3.46Å; L287-W305 HydrophobicContact CB-CH2 4.23Å; L287-W305 HydrophobicContact CB-CZ2 4.42Å; L287-W305 HydrophobicContact CD1-CH2 3.74Å; L287-W305 HydrophobicContact CD1-CZ3 3.95Å; L287-F318 HydrophobicContact CD1-CE1 3.84Å; L287-F318 HydrophobicContact CD1-CZ 3.53Å; L287-Q323 HydrophobicContact CD2-CB 4.29Å; L287-F327 HydrophobicContact CD1-CE2 4.26Å; L287-F327 HydrophobicContact CD2-CE2 4.03Å; L287-F327 HydrophobicContact CD2-CZ 4.4Å; L287-F327 HydrophobicContact CG-CE2 4.1Å; L287-F327 HydrophobicContact CG-CZ 4.18Å
288	V	97.1	Very high	96.8	Very high	31 Å²	31	46.7 Å²	46.7	19%	0.188	25%	0.254	C	S	.	.			trans	-127.9	66	-179.2	-165.5	0	0	0	0	109.9	F284 L285 S290 W291 W305	F284-V288 HydrophobicContact CD2-CB 4.43Å; F284-V288 HydrophobicContact CD2-CG2 3.92Å; F284-V288 HydrophobicContact CE2-CB 4.04Å; F284-V288 HydrophobicContact CE2-CG2 3.69Å; F284-V288 HydrophobicContact CZ-CB 4.27Å; F284-V288 HydrophobicContact CZ-CG2 4.4Å; F284-V288 WeakPolarHBondContact O-CB 3.38Å; F284-V288 PolarHBondContact O-N 3.08Å; L285-V288 CarbonylContact O-C 3.37Å; V288-S290 PolarHBondContact O-N 3.39Å; V288-S290 VanDerWaalsContact O-N 3.14Å; V288-W291 HydrophobicContact CG1-CB 4.14Å; V288-W291 WeakPolarHBondContact O-CB 3.47Å; V288-W291 PolarHBondContact O-N 2.84Å; V288-W305 HydrophobicContact CG2-CZ2 4.34Å
289	P	95	Very high	96.8	Very high	88 Å²	88	49.3 Å²	49.3	57%	0.571	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22	-174.1	25.8	-35.7	0	0	0	113.8	L285 L287 W291	L285-P289 WeakPolarHBondContact O-CA 3.45Å; L287-P289 VanDerWaalsContact C-CD 3.46Å; P289-W291 PolarHBondContact O-N 3.21Å
290	S	96.4	Very high	96.7	Very high	100 Å²	100	53.3 Å²	53.3	70%	0.699	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.9	175.2	54.2	0	0	0	0	114.3	V288 N292	V288-S290 PolarHBondContact O-N 3.39Å; V288-S290 VanDerWaalsContact O-N 3.14Å; S290-N292 PolarHBondContact O-N 3.49Å
291	W	97.4	Very high	96.7	Very high	31 Å²	31	57.1 Å²	57.1	12%	0.117	31%	0.31	C	S	.	.			trans	-68.7	131.2	178.5	-172.8	94.8	0	0	0	111.5	V246 K250 F284 L285 V288 P289 G293 S294 Q297 L298 E301	V246-W291 HydrophobicContact CG1-CE3 4.09Å; V246-W291 HydrophobicContact CG1-CZ3 3.7Å; V246-W291 HydrophobicContact CG2-CZ3 3.97Å; K250-W291 WeakPolarHBondContact CE-O 3.44Å; K250-W291 PolarHBondContact NZ-O 3.24Å; F284-W291 HydrophobicContact CE1-CB 4.24Å; F284-W291 AromaticContact CE1-CD1 3.79Å; F284-W291 AromaticContact CE1-CD2 3.98Å; F284-W291 HydrophobicContact CE1-CD2 3.98Å; F284-W291 AromaticContact CE1-CG 3.75Å; F284-W291 HydrophobicContact CE1-CG 3.75Å; F284-W291 HydrophobicContact CZ-CB 4.33Å; F284-W291 AromaticContact CZ-CD1 3.61Å; F284-W291 AromaticContact CZ-CG 3.93Å; F284-W291 HydrophobicContact CZ-CG 3.93Å; L285-W291 HydrophobicContact CD2-CB 4.47Å; L285-W291 HydrophobicContact CD2-CD2 4.2Å; L285-W291 HydrophobicContact CD2-CE3 3.47Å; L285-W291 VanDerWaalsContact CD2-CE3 3.47Å; L285-W291 HydrophobicContact CD2-CZ3 4.05Å; V288-W291 HydrophobicContact CG1-CB 4.14Å; V288-W291 WeakPolarHBondContact O-CB 3.47Å; V288-W291 PolarHBondContact O-N 2.84Å; P289-W291 PolarHBondContact O-N 3.21Å; W291-G293 VanDerWaalsContact CH2-CA 3.45Å; W291-G293 WeakPolarHBondContact CH2-O 3.5Å; W291-G293 WeakPolarHBondContact CZ3-O 3.38Å; W291-S294 WeakPolarHBondContact CH2-O 3.33Å; W291-Q297 HydrophobicContact CZ2-CB 4.38Å; W291-L298 HydrophobicContact CD2-CD1 4.45Å; W291-L298 HydrophobicContact CE3-CD1 4.12Å; W291-L298 HydrophobicContact CH2-CB 3.64Å; W291-L298 HydrophobicContact CH2-CD1 3.7Å; W291-L298 HydrophobicContact CH2-CG 4.19Å; W291-L298 HydrophobicContact CZ2-CB 4.15Å; W291-L298 HydrophobicContact CZ2-CD1 4.06Å; W291-L298 HydrophobicContact CZ3-CB 4.35Å; W291-L298 HydrophobicContact CZ3-CD1 3.74Å; W291-L298 HydrophobicContact CZ3-CG 4.49Å; W291-E301 HydrophobicContact CZ2-CB 4.49Å; W291-E301 HydrophobicContact CZ2-CG 4.34Å
292	N	94.6	Very high	96.7	Very high	143 Å²	143	55.9 Å²	55.9	77%	0.765	31%	0.305	S	S	*	.			trans	-135.2	23	-171.1	64	-4.4	0	0	0	113.6	S290	S290-N292 PolarHBondContact O-N 3.49Å
293	G	95.1	Very high	96.6	Very high	23 Å²	23	58.8 Å²	58.8	24%	0.237	32%	0.32	C	S	.	.			trans	-75.8	178	178.7	0	0	0	0	0	114	W291	W291-G293 VanDerWaalsContact CH2-CA 3.45Å; W291-G293 WeakPolarHBondContact CH2-O 3.5Å; W291-G293 WeakPolarHBondContact CZ3-O 3.38Å
294	S	95.7	Very high	96.4	Very high	53 Å²	53	61.8 Å²	61.8	37%	0.371	34%	0.338	S	S	.	.			trans	-81.4	153.8	177.4	73	0	0	0	0	112.6	W291 K296 Q297 L298	W291-S294 WeakPolarHBondContact CH2-O 3.33Å; S294-K296 PolarHBondContact O-N 2.87Å; S294-Q297 PolarHBondContact O-N 3.13Å; S294-Q297 PolarHBondContact OG-OE1 2.62Å; S294-L298 PolarHBondContact O-N 2.75Å; S294-L298 VanDerWaalsContact O-N 3.11Å
295	L	92.8	Very high	96.3	Very high	66 Å²	66	63.9 Å²	63.9	35%	0.346	35%	0.346	S	S	.	.	H	α-helix	trans	-53.1	-27.7	176.3	-172.6	70.5	0	0	0	113.6	Q244 V246 L298	Q244-L295 HydrophobicContact CB-CD1 4.13Å; Q244-L295 HydrophobicContact CB-CD2 3.97Å; Q244-L295 WeakPolarHBondContact O-CD2 3.44Å; V246-L295 HydrophobicContact CG2-CB 4.37Å; V246-L295 HydrophobicContact CG2-CD1 4.38Å; L295-L298 HydrophobicContact CD1-CD2 4.01Å
296	K	94	Very high	96.1	Very high	196 Å²	196	64.1 Å²	64.1	85%	0.852	35%	0.347	S	S	*	.	H	α-helix	trans	-69	-33.9	175.7	-67	-177.8	179.1	178.3	0	113	S294	S294-K296 PolarHBondContact O-N 2.87Å
297	Q	96.4	Very high	95.8	Very high	98 Å²	98	64.9 Å²	64.9	46%	0.458	36%	0.359	S	S	.	.	H	α-helix	trans	-84.6	-26.1	178.6	-67.7	157.4	-60.8	0	0	112.1	W291 S294 L299 T300 E301	W291-Q297 HydrophobicContact CZ2-CB 4.38Å; S294-Q297 PolarHBondContact O-N 3.13Å; S294-Q297 PolarHBondContact OG-OE1 2.62Å; Q297-L299 VanDerWaalsContact C-N 3.32Å; Q297-L299 PolarHBondContact O-N 2.96Å; Q297-L299 VanDerWaalsContact O-N 3.16Å; Q297-T300 PolarHBondContact O-N 2.7Å; Q297-T300 VanDerWaalsContact O-N 3.08Å; Q297-E301 HydrophobicContact CB-CG 4.49Å; Q297-E301 PolarHBondContact O-N 2.67Å
298	L	97.5	Very high	95.6	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-50.4	-44.9	-170.5	-179	57.3	0	0	0	114	V246 F249 K281 F284 L285 W291 S294 L295 T302	V246-L298 HydrophobicContact CG2-CD2 4.45Å; F249-L298 HydrophobicContact CD2-CD2 4.5Å; K281-L298 HydrophobicContact CB-CD2 3.91Å; K281-L298 HydrophobicContact CB-CG 4.09Å; K281-L298 HydrophobicContact CD-CD2 4.09Å; K281-L298 HydrophobicContact CD-CG 4.33Å; K281-L298 HydrophobicContact CG-CD2 4.11Å; K281-L298 HydrophobicContact CG-CG 3.98Å; F284-L298 HydrophobicContact CD1-CD1 3.79Å; F284-L298 HydrophobicContact CE1-CD1 3.94Å; L285-L298 HydrophobicContact CD1-CD1 4.06Å; L285-L298 HydrophobicContact CD1-CD2 3.91Å; L285-L298 HydrophobicContact CD2-CD1 3.87Å; L285-L298 HydrophobicContact CG-CD1 3.89Å; W291-L298 HydrophobicContact CD2-CD1 4.45Å; W291-L298 HydrophobicContact CE3-CD1 4.12Å; W291-L298 HydrophobicContact CH2-CB 3.64Å; W291-L298 HydrophobicContact CH2-CD1 3.7Å; W291-L298 HydrophobicContact CH2-CG 4.19Å; W291-L298 HydrophobicContact CZ2-CB 4.15Å; W291-L298 HydrophobicContact CZ2-CD1 4.06Å; W291-L298 HydrophobicContact CZ3-CB 4.35Å; W291-L298 HydrophobicContact CZ3-CD1 3.74Å; W291-L298 HydrophobicContact CZ3-CG 4.49Å; S294-L298 PolarHBondContact O-N 2.75Å; S294-L298 VanDerWaalsContact O-N 3.11Å; L295-L298 HydrophobicContact CD1-CD2 4.01Å; L298-T302 WeakPolarHBondContact O-CB 3.41Å; L298-T302 PolarHBondContact O-N 2.66Å; L298-T302 PolarHBondContact O-OG1 3.36Å
299	L	96.9	Very high	95.1	Very high	59 Å²	59	69 Å²	69	31%	0.309	37%	0.373	S	S	.	.	H	α-helix	trans	-66	-48.2	179.8	-176.2	54.9	0	0	0	111.7	T277 K281 Q297 E301 T302 D303	T277-L299 HydrophobicContact CG2-CD1 3.76Å; T277-L299 HydrophobicContact CG2-CD2 4.04Å; K281-L299 HydrophobicContact CG-CD1 4.47Å; Q297-L299 VanDerWaalsContact C-N 3.32Å; Q297-L299 PolarHBondContact O-N 2.96Å; Q297-L299 VanDerWaalsContact O-N 3.16Å; L299-E301 VanDerWaalsContact C-N 3.35Å; L299-E301 PolarHBondContact O-N 2.98Å; L299-T302 WeakPolarHBondContact O-CB 3.29Å; L299-T302 PolarHBondContact O-N 3.09Å; L299-T302 VanDerWaalsContact O-N 3.17Å; L299-D303 PolarHBondContact O-N 2.98Å
300	T	97.1	Very high	94.5	Very high	85 Å²	85	70.8 Å²	70.8	52%	0.521	37%	0.368	S	S	.	.	H	α-helix	trans	-58.9	-45.1	179.3	-47.8	0	0	0	0	111.9	Q297 D303 V304	Q297-T300 PolarHBondContact O-N 2.7Å; Q297-T300 VanDerWaalsContact O-N 3.08Å; T300-D303 PolarHBondContact O-N 2.97Å; T300-V304 WeakPolarHBondContact O-CB 3.46Å; T300-V304 VanDerWaalsContact O-CG2 3.28Å; T300-V304 WeakPolarHBondContact O-CG2 3.31Å; T300-V304 PolarHBondContact O-N 2.96Å
301	E	97.6	Very high	93.8	Very high	84 Å²	84	74.1 Å²	74.1	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-38.8	177.2	-64.6	-56.1	146.7	0	0	111.9	F284 W291 Q297 L299 V304 W305	F284-E301 HydrophobicContact CZ-CB 4.38Å; W291-E301 HydrophobicContact CZ2-CB 4.49Å; W291-E301 HydrophobicContact CZ2-CG 4.34Å; Q297-E301 HydrophobicContact CB-CG 4.49Å; Q297-E301 PolarHBondContact O-N 2.67Å; L299-E301 VanDerWaalsContact C-N 3.35Å; L299-E301 PolarHBondContact O-N 2.98Å; E301-V304 PolarHBondContact O-N 3.44Å; E301-W305 WeakPolarHBondContact O-CB 3.27Å; E301-W305 PolarHBondContact O-N 3.18Å
302	T	97.5	Very high	92.9	Very high	0 Å²	0	77.8 Å²	77.8	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-59.1	-48.5	173.5	-64.2	0	0	0	0	111	K280 F284 L298 L299 W305 F306	K280-T302 HydrophobicContact CB-CG2 4.38Å; K280-T302 HydrophobicContact CD-CG2 4.02Å; K280-T302 HydrophobicContact CG-CG2 3.63Å; F284-T302 HydrophobicContact CB-CG2 3.88Å; F284-T302 WeakPolarHBondContact CD1-OG1 3.4Å; F284-T302 HydrophobicContact CG-CG2 4.34Å; L298-T302 WeakPolarHBondContact O-CB 3.41Å; L298-T302 PolarHBondContact O-N 2.66Å; L298-T302 PolarHBondContact O-OG1 3.36Å; L299-T302 WeakPolarHBondContact O-CB 3.29Å; L299-T302 PolarHBondContact O-N 3.09Å; L299-T302 VanDerWaalsContact O-N 3.17Å; T302-W305 PolarHBondContact O-N 2.69Å; T302-F306 HydrophobicContact CG2-CD2 3.71Å; T302-F306 HydrophobicContact CG2-CE2 3.72Å; T302-F306 VanDerWaalsContact O-CD2 3.29Å; T302-F306 WeakPolarHBondContact O-CD2 3.5Å; T302-F306 PolarHBondContact O-N 2.9Å
303	D	96.4	Very high	91.9	Very high	61 Å²	61	73.9 Å²	73.9	33%	0.326	37%	0.368	S	S	.	.	H	α-helix	trans	-64.5	-42.6	-179.4	-64	-20.8	0	0	0	111.5	K280 L299 T300 W305 S307	K280-D303 VanDerWaalsContact CE-OD1 3.32Å; K280-D303 WeakPolarHBondContact CE-OD1 3.11Å; K280-D303 IonicContact NZ-OD1 3.88Å; K280-D303 PolarHBondContact NZ-OD1 3.12Å; L299-D303 PolarHBondContact O-N 2.98Å; T300-D303 PolarHBondContact O-N 2.97Å; D303-W305 VanDerWaalsContact C-N 3.32Å; D303-W305 PolarHBondContact O-N 3.12Å; D303-S307 WeakPolarHBondContact O-CB 3.35Å; D303-S307 PolarHBondContact O-N 3.1Å
304	V	95.8	Very high	90.7	Very high	62 Å²	62	82.2 Å²	82.2	38%	0.376	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-38.1	174.3	168.4	0	0	0	0	111.5	T300 E301 K308	T300-V304 WeakPolarHBondContact O-CB 3.46Å; T300-V304 VanDerWaalsContact O-CG2 3.28Å; T300-V304 WeakPolarHBondContact O-CG2 3.31Å; T300-V304 PolarHBondContact O-N 2.96Å; E301-V304 PolarHBondContact O-N 3.44Å; V304-K308 HydrophobicContact CG1-CD 4.36Å; V304-K308 WeakPolarHBondContact O-CG 3.46Å; V304-K308 PolarHBondContact O-N 3.44Å
305	W	95.7	Very high	89.9	Confident	50 Å²	50	82.8 Å²	82.8	19%	0.189	42%	0.416	C	S	.	.	H	α-helix	trans	-67.5	-53	178.3	-170.9	89.1	0	0	0	111.8	F284 L287 V288 E301 T302 D303 S307 K308 Q309 F318	F284-W305 HydrophobicContact CD2-CB 3.75Å; F284-W305 AromaticContact CD2-CD2 3.9Å; F284-W305 HydrophobicContact CD2-CD2 3.9Å; F284-W305 HydrophobicContact CD2-CE3 4.21Å; F284-W305 AromaticContact CD2-CG 3.69Å; F284-W305 HydrophobicContact CD2-CG 3.69Å; F284-W305 HydrophobicContact CE2-CB 3.61Å; F284-W305 AromaticContact CE2-CD1 3.81Å; F284-W305 HydrophobicContact CE2-CD2 4.25Å; F284-W305 AromaticContact CE2-CG 3.61Å; F284-W305 HydrophobicContact CE2-CG 3.61Å; L287-W305 HydrophobicContact CB-CH2 4.23Å; L287-W305 HydrophobicContact CB-CZ2 4.42Å; L287-W305 HydrophobicContact CD1-CH2 3.74Å; L287-W305 HydrophobicContact CD1-CZ3 3.95Å; V288-W305 HydrophobicContact CG2-CZ2 4.34Å; E301-W305 WeakPolarHBondContact O-CB 3.27Å; E301-W305 PolarHBondContact O-N 3.18Å; T302-W305 PolarHBondContact O-N 2.69Å; D303-W305 VanDerWaalsContact C-N 3.32Å; D303-W305 PolarHBondContact O-N 3.12Å; W305-S307 VanDerWaalsContact C-N 3.31Å; W305-S307 PolarHBondContact O-N 3.01Å; W305-K308 WeakPolarHBondContact O-CB 3.35Å; W305-K308 PolarHBondContact O-N 3.49Å; W305-K308 VanDerWaalsContact O-N 3.11Å; W305-Q309 HydrophobicContact CD2-CG 3.92Å; W305-Q309 HydrophobicContact CE3-CG 3.83Å; W305-Q309 HydrophobicContact CH2-CG 3.63Å; W305-Q309 HydrophobicContact CZ2-CG 3.74Å; W305-Q309 HydrophobicContact CZ3-CG 3.69Å; W305-Q309 WeakPolarHBondContact O-CG 3.33Å; W305-Q309 PolarHBondContact O-N 3.36Å; W305-F318 HydrophobicContact CH2-CE2 4.01Å; W305-F318 HydrophobicContact CH2-CZ 4.1Å; W305-F318 HydrophobicContact CZ3-CE2 4.02Å; W305-F318 HydrophobicContact CZ3-CZ 4.15Å
306	F	94	Very high	89.8	Confident	7 Å²	7	84.2 Å²	84.2	3%	0.031	42%	0.422	C	S	.	.	H	α-helix	trans	-62.3	-36.7	177.9	-79	-70	0	0	0	112.6	K280 M283 F284 T302 K308 Q309 R310 F318 I354	K280-F306 HydrophobicContact CG-CD2 3.97Å; K280-F306 HydrophobicContact CG-CE2 3.78Å; M283-F306 HydrophobicContact CE-CE1 3.77Å; M283-F306 HydrophobicContact CE-CE2 4.46Å; M283-F306 HydrophobicContact CE-CZ 3.46Å; M283-F306 VanDerWaalsContact CE-CZ 3.46Å; M283-F306 HydrophobicContact CG-CZ 4.31Å; F284-F306 HydrophobicContact CB-CE2 4.17Å; T302-F306 HydrophobicContact CG2-CD2 3.71Å; T302-F306 HydrophobicContact CG2-CE2 3.72Å; T302-F306 VanDerWaalsContact O-CD2 3.29Å; T302-F306 WeakPolarHBondContact O-CD2 3.5Å; T302-F306 PolarHBondContact O-N 2.9Å; F306-K308 VanDerWaalsContact C-N 3.29Å; F306-K308 PolarHBondContact O-N 3.43Å; F306-Q309 PolarHBondContact O-N 3.05Å; F306-R310 WeakPolarHBondContact O-CB 3.48Å; F306-R310 PolarHBondContact O-N 2.93Å; F306-F318 HydrophobicContact CD1-CD2 4.23Å; F306-F318 HydrophobicContact CD1-CG 4.21Å; F306-F318 HydrophobicContact CE1-CB 4.49Å; F306-F318 AromaticContact CE1-CD1 3.76Å; F306-F318 HydrophobicContact CE1-CD1 3.76Å; F306-F318 AromaticContact CE1-CD2 3.99Å; F306-F318 HydrophobicContact CE1-CD2 3.99Å; F306-F318 AromaticContact CE1-CE1 3.96Å; F306-F318 HydrophobicContact CE1-CE1 3.96Å; F306-F318 HydrophobicContact CE1-CE2 4.18Å; F306-F318 AromaticContact CE1-CG 3.79Å; F306-F318 HydrophobicContact CE1-CG 3.79Å; F306-F318 HydrophobicContact CE1-CZ 4.17Å; F306-I354 HydrophobicContact CB-CD1 4.45Å; F306-I354 HydrophobicContact CD1-CD1 3.73Å; F306-I354 HydrophobicContact CD1-CG1 3.91Å; F306-I354 HydrophobicContact CD2-CD1 3.85Å; F306-I354 HydrophobicContact CE1-CD1 3.86Å; F306-I354 HydrophobicContact CE1-CG1 4.14Å; F306-I354 HydrophobicContact CE2-CD1 3.98Å; F306-I354 HydrophobicContact CG-CD1 3.74Å; F306-I354 HydrophobicContact CG-CG1 4.3Å; F306-I354 HydrophobicContact CZ-CD1 4.01Å
307	S	92.6	Very high	89.8	Confident	77 Å²	77	75.3 Å²	75.3	54%	0.538	39%	0.385	S	S	.	.	H	α-helix	trans	-63.5	-31.2	175.2	-177.1	0	0	0	0	113.5	D303 W305	D303-S307 WeakPolarHBondContact O-CB 3.35Å; D303-S307 PolarHBondContact O-N 3.1Å; W305-S307 VanDerWaalsContact C-N 3.31Å; W305-S307 PolarHBondContact O-N 3.01Å
308	K	91.2	Very high	89.8	Confident	129 Å²	129	71.1 Å²	71.1	56%	0.561	37%	0.365	S	S	*	.	H	α-helix	trans	-71.6	-55.2	170.9	-71.5	166.4	-177.9	173.1	0	110.5	V304 W305 F306 R310 K311	V304-K308 HydrophobicContact CG1-CD 4.36Å; V304-K308 WeakPolarHBondContact O-CG 3.46Å; V304-K308 PolarHBondContact O-N 3.44Å; W305-K308 WeakPolarHBondContact O-CB 3.35Å; W305-K308 PolarHBondContact O-N 3.49Å; W305-K308 VanDerWaalsContact O-N 3.11Å; F306-K308 VanDerWaalsContact C-N 3.29Å; F306-K308 PolarHBondContact O-N 3.43Å; K308-R310 PolarHBondContact O-N 3.48Å; K308-K311 WeakPolarHBondContact O-CB 3.24Å; K308-K311 PolarHBondContact O-N 2.94Å
309	Q	86.6	Confident	89.8	Confident	37 Å²	37	71.2 Å²	71.2	17%	0.173	37%	0.366	C	S	.	.	H	α-helix	trans	-53.6	-38	-179.1	-69.4	-61.7	-54	0	0	113	W305 F306 K311 D312 F313	W305-Q309 HydrophobicContact CD2-CG 3.92Å; W305-Q309 HydrophobicContact CE3-CG 3.83Å; W305-Q309 HydrophobicContact CH2-CG 3.63Å; W305-Q309 HydrophobicContact CZ2-CG 3.74Å; W305-Q309 HydrophobicContact CZ3-CG 3.69Å; W305-Q309 WeakPolarHBondContact O-CG 3.33Å; W305-Q309 PolarHBondContact O-N 3.36Å; F306-Q309 PolarHBondContact O-N 3.05Å; Q309-K311 PolarHBondContact O-N 3.44Å; Q309-K311 VanDerWaalsContact O-N 3.08Å; Q309-D312 PolarHBondContact O-N 3.46Å; Q309-F313 HydrophobicContact CB-CE2 4.06Å; Q309-F313 WeakPolarHBondContact O-CD2 3.44Å
310	R	83.3	Confident	89.7	Confident	126 Å²	126	72.5 Å²	72.5	48%	0.475	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.5	177.8	-173.5	175	-179.9	-168.1	-1.2	113.8	F306 K308 D312 Q351	F306-R310 WeakPolarHBondContact O-CB 3.48Å; F306-R310 PolarHBondContact O-N 2.93Å; K308-R310 PolarHBondContact O-N 3.48Å; R310-D312 VanDerWaalsContact C-N 3.29Å; R310-Q351 PolarHBondContact NH1-O 3.47Å
311	K	80.6	Confident	89.6	Confident	170 Å²	170	68.9 Å²	68.9	74%	0.739	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-23	177.2	-61.4	-176.9	180	-177.5	0	113	K308 Q309	K308-K311 WeakPolarHBondContact O-CB 3.24Å; K308-K311 PolarHBondContact O-N 2.94Å; Q309-K311 PolarHBondContact O-N 3.44Å; Q309-K311 VanDerWaalsContact O-N 3.08Å
312	D	78.9	Confident	89.4	Confident	108 Å²	108	71.6 Å²	71.6	58%	0.578	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-12.2	-170.6	-53	-32.3	0	0	0	112.4	Q309 R310	Q309-D312 PolarHBondContact O-N 3.46Å; R310-D312 VanDerWaalsContact C-N 3.29Å
313	F	73.6	Confident	89.3	Confident	60 Å²	60	76 Å²	76	26%	0.263	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	24	-171.1	-58.5	-56	0	0	0	115.4	Q309 G315 M316 F318 T321	Q309-F313 HydrophobicContact CB-CE2 4.06Å; Q309-F313 WeakPolarHBondContact O-CD2 3.44Å; F313-G315 PolarHBondContact O-N 2.85Å; F313-M316 VanDerWaalsContact O-CB 3.3Å; F313-M316 WeakPolarHBondContact O-CB 3.27Å; F313-M316 PolarHBondContact O-N 3.5Å; F313-F318 HydrophobicContact CE2-CD2 4.37Å; F313-F318 HydrophobicContact CE2-CE2 4.42Å; F313-T321 HydrophobicContact CB-CG2 4.33Å; F313-T321 HydrophobicContact CD1-CG2 3.9Å; F313-T321 HydrophobicContact CD2-CG2 3.93Å; F313-T321 HydrophobicContact CE1-CG2 4.16Å; F313-T321 HydrophobicContact CE2-CG2 4.19Å; F313-T321 HydrophobicContact CG-CG2 3.79Å; F313-T321 HydrophobicContact CZ-CG2 4.31Å
314	E	71.1	Confident	89.3	Confident	198 Å²	198	73.1 Å²	73.1	93%	0.925	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	27.9	168	-60.1	-165.3	154.6	0	0	117.2
315	G	78.3	Confident	89.3	Confident	66 Å²	66	75 Å²	75	68%	0.68	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	0.4	179.1	0	0	0	0	0	115.9	F313	F313-G315 PolarHBondContact O-N 2.85Å
316	M	90.5	Very high	89.4	Confident	96 Å²	96	75.7 Å²	75.7	47%	0.473	38%	0.379	S	S	.	.			trans	-63.9	148	165.5	-178.2	180	-73.3	0	0	110.8	F313 E320 T321	F313-M316 VanDerWaalsContact O-CB 3.3Å; F313-M316 WeakPolarHBondContact O-CB 3.27Å; F313-M316 PolarHBondContact O-N 3.5Å; M316-E320 HydrophobicContact CG-CB 3.61Å; M316-E320 WeakPolarHBondContact CG-OE2 3.36Å; M316-E320 HydrophobicContact SD-CB 3.77Å; M316-T321 HydrophobicContact SD-CG2 4.03Å
317	A	94.5	Very high	89.6	Confident	8 Å²	8	75.9 Å²	75.9	7%	0.066	38%	0.38	C	S	.	.			trans	-78.3	145.4	173.9	0	0	0	0	0	111.4	L319 E320 A353 P356	A317-L319 VanDerWaalsContact C-N 3.25Å; A317-L319 PolarHBondContact O-N 2.85Å; A317-L319 VanDerWaalsContact O-N 3.1Å; A317-E320 HydrophobicContact CB-CG 4.43Å; A317-E320 WeakPolarHBondContact CB-OE2 3.12Å; A317-E320 PolarHBondContact N-OE2 3.2Å; A317-E320 WeakPolarHBondContact O-CB 3.45Å; A317-E320 PolarHBondContact O-N 3.26Å; A317-A353 CarbonylContact C-O 3.53Å; A317-A353 WeakPolarHBondContact CA-O 3.06Å; A317-P356 HydrophobicContact CB-CB 4.32Å; A317-P356 HydrophobicContact CB-CG 4.18Å
318	F	96	Very high	89.9	Confident	11 Å²	11	74 Å²	74	5%	0.048	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-54.2	-40.2	-172.9	-176.2	-95.4	0	0	0	113.3	M283 L287 W305 F306 F313 E320 T321 Q323 G324 A353 I354	M283-F318 HydrophobicContact CE-CD1 3.71Å; M283-F318 HydrophobicContact CE-CE1 3.96Å; M283-F318 HydrophobicContact CG-CE1 4.38Å; M283-F318 HydrophobicContact SD-CD1 4.03Å; M283-F318 HydrophobicContact SD-CE1 3.81Å; L287-F318 HydrophobicContact CD1-CE1 3.84Å; L287-F318 HydrophobicContact CD1-CZ 3.53Å; W305-F318 HydrophobicContact CH2-CE2 4.01Å; W305-F318 HydrophobicContact CH2-CZ 4.1Å; W305-F318 HydrophobicContact CZ3-CE2 4.02Å; W305-F318 HydrophobicContact CZ3-CZ 4.15Å; F306-F318 HydrophobicContact CD1-CD2 4.23Å; F306-F318 HydrophobicContact CD1-CG 4.21Å; F306-F318 HydrophobicContact CE1-CB 4.49Å; F306-F318 AromaticContact CE1-CD1 3.76Å; F306-F318 HydrophobicContact CE1-CD1 3.76Å; F306-F318 AromaticContact CE1-CD2 3.99Å; F306-F318 HydrophobicContact CE1-CD2 3.99Å; F306-F318 AromaticContact CE1-CE1 3.96Å; F306-F318 HydrophobicContact CE1-CE1 3.96Å; F306-F318 HydrophobicContact CE1-CE2 4.18Å; F306-F318 AromaticContact CE1-CG 3.79Å; F306-F318 HydrophobicContact CE1-CG 3.79Å; F306-F318 HydrophobicContact CE1-CZ 4.17Å; F313-F318 HydrophobicContact CE2-CD2 4.37Å; F313-F318 HydrophobicContact CE2-CE2 4.42Å; F318-E320 PolarHBondContact O-N 2.96Å; F318-T321 WeakPolarHBondContact O-CB 3.32Å; F318-T321 WeakPolarHBondContact O-CG2 3.3Å; F318-T321 PolarHBondContact O-N 2.79Å; F318-T321 VanDerWaalsContact O-N 3.16Å; F318-T321 PolarHBondContact O-OG1 2.9Å; F318-Q323 HydrophobicContact CE2-CB 4.47Å; F318-Q323 HydrophobicContact CZ-CB 4Å; F318-G324 WeakPolarHBondContact O-CA 3.38Å; F318-A353 PolarHBondContact N-O 3.33Å; F318-I354 HydrophobicContact CB-CB 4.47Å; F318-I354 HydrophobicContact CB-CG1 4.23Å
319	L	96.9	Very high	90.3	Very high	2 Å²	2	70.1 Å²	70.1	1%	0.01	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-66.6	-11.7	179.9	-71.5	177.3	0	0	0	115.1	M283 A317 F327 V328 F331 I354 V355 W359	M283-L319 HydrophobicContact CE-CD2 4.5Å; M283-L319 HydrophobicContact SD-CD2 4.06Å; A317-L319 VanDerWaalsContact C-N 3.25Å; A317-L319 PolarHBondContact O-N 2.85Å; A317-L319 VanDerWaalsContact O-N 3.1Å; L319-F327 HydrophobicContact CD2-CB 3.84Å; L319-V328 HydrophobicContact CB-CG2 4.05Å; L319-V328 HydrophobicContact CD2-CG2 4.41Å; L319-V328 WeakPolarHBondContact O-CG2 3.34Å; L319-F331 HydrophobicContact CD1-CB 3.6Å; L319-F331 HydrophobicContact CD1-CD1 3.95Å; L319-F331 HydrophobicContact CD1-CD2 4.24Å; L319-F331 HydrophobicContact CD1-CG 3.68Å; L319-F331 HydrophobicContact CD2-CD2 3.98Å; L319-F331 HydrophobicContact CD2-CE2 4.34Å; L319-F331 HydrophobicContact CD2-CG 4.27Å; L319-I354 WeakPolarHBondContact CB-O 3.34Å; L319-I354 HydrophobicContact CD1-CG2 4.38Å; L319-I354 HydrophobicContact CG-CG2 4.14Å; L319-I354 VanDerWaalsContact CG-O 3.25Å; L319-I354 WeakPolarHBondContact CG-O 3.49Å; L319-I354 PolarHBondContact N-O 2.82Å; L319-I354 VanDerWaalsContact N-O 3.15Å; L319-V355 HydrophobicContact CD1-CG2 4.33Å; L319-W359 HydrophobicContact CD1-CH2 3.99Å; L319-W359 HydrophobicContact CD1-CZ3 4.2Å
320	E	95.2	Very high	90.8	Very high	85 Å²	85	68.4 Å²	68.4	40%	0.397	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-89.5	-21.5	176.4	-60.8	170.6	138.5	0	0	111.9	M316 A317 F318 K325 P356	M316-E320 HydrophobicContact CG-CB 3.61Å; M316-E320 WeakPolarHBondContact CG-OE2 3.36Å; M316-E320 HydrophobicContact SD-CB 3.77Å; A317-E320 HydrophobicContact CB-CG 4.43Å; A317-E320 WeakPolarHBondContact CB-OE2 3.12Å; A317-E320 PolarHBondContact N-OE2 3.2Å; A317-E320 WeakPolarHBondContact O-CB 3.45Å; A317-E320 PolarHBondContact O-N 3.26Å; F318-E320 PolarHBondContact O-N 2.96Å; E320-K325 WeakPolarHBondContact O-CE 3.45Å; E320-P356 HydrophobicContact CG-CB 4.41Å; E320-P356 HydrophobicContact CG-CG 3.78Å
321	T	94.9	Very high	91.5	Very high	9 Å²	9	62.4 Å²	62.4	6%	0.055	32%	0.324	C	S	.	.	S	Bend	trans	-66.3	157.5	175.6	74.4	0	0	0	0	111.8	F313 M316 F318 Q323 G324 K325	F313-T321 HydrophobicContact CB-CG2 4.33Å; F313-T321 HydrophobicContact CD1-CG2 3.9Å; F313-T321 HydrophobicContact CD2-CG2 3.93Å; F313-T321 HydrophobicContact CE1-CG2 4.16Å; F313-T321 HydrophobicContact CE2-CG2 4.19Å; F313-T321 HydrophobicContact CG-CG2 3.79Å; F313-T321 HydrophobicContact CZ-CG2 4.31Å; M316-T321 HydrophobicContact SD-CG2 4.03Å; F318-T321 WeakPolarHBondContact O-CB 3.32Å; F318-T321 WeakPolarHBondContact O-CG2 3.3Å; F318-T321 PolarHBondContact O-N 2.79Å; F318-T321 VanDerWaalsContact O-N 3.16Å; F318-T321 PolarHBondContact O-OG1 2.9Å; T321-Q323 PolarHBondContact O-N 3.25Å; T321-G324 PolarHBondContact O-N 2.91Å; T321-G324 PolarHBondContact OG1-N 3.16Å; T321-G324 VanDerWaalsContact OG1-N 3.09Å; T321-K325 WeakPolarHBondContact O-CG 3.49Å; T321-K325 PolarHBondContact O-N 3.29Å
322	E	93.9	Very high	92.3	Very high	142 Å²	142	61.4 Å²	61.4	66%	0.664	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-33.5	175.7	-56.9	-51.7	141.3	0	0	113.2	K325	E322-K325 IonicContact OE1-NZ 3.71Å; E322-K325 PolarHBondContact OE1-NZ 2.72Å; E322-K325 WeakPolarHBondContact OE2-CD 3.4Å; E322-K325 WeakPolarHBondContact OE2-CE 3.41Å; E322-K325 IonicContact OE2-NZ 2.7Å; E322-K325 PolarHBondContact OE2-NZ 3.39Å
323	Q	94.5	Very high	93.2	Very high	93 Å²	93	59.4 Å²	59.4	44%	0.435	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-32	176	-65	-175.2	1.6	0	0	112.6	L287 F318 T321 P326 F327	L287-Q323 HydrophobicContact CD2-CB 4.29Å; F318-Q323 HydrophobicContact CE2-CB 4.47Å; F318-Q323 HydrophobicContact CZ-CB 4Å; T321-Q323 PolarHBondContact O-N 3.25Å; Q323-P326 WeakPolarHBondContact O-CD 3.14Å; Q323-F327 WeakPolarHBondContact O-CD2 3.25Å; Q323-F327 VanDerWaalsContact O-CE2 3.3Å; Q323-F327 WeakPolarHBondContact O-CE2 3.32Å
324	G	96.3	Very high	94.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-29.6	-179.7	0	0	0	0	0	114.7	F318 T321 P326 F327 V328	F318-G324 WeakPolarHBondContact O-CA 3.38Å; T321-G324 PolarHBondContact O-N 2.91Å; T321-G324 PolarHBondContact OG1-N 3.16Å; T321-G324 VanDerWaalsContact OG1-N 3.09Å; G324-P326 VanDerWaalsContact C-CD 3.43Å; G324-F327 WeakPolarHBondContact O-CB 3.29Å; G324-F327 PolarHBondContact O-N 3.34Å; G324-V328 PolarHBondContact O-N 3.03Å
325	K	96.9	Very high	95.5	Very high	102 Å²	102	48.4 Å²	48.4	44%	0.443	25%	0.252	S	S	.	.	H	α-helix	trans	-47.9	-44.4	-176.9	-79.9	175.1	-165.5	175.1	0	115.4	E320 T321 E322 F327 V328	E320-K325 WeakPolarHBondContact O-CE 3.45Å; T321-K325 WeakPolarHBondContact O-CG 3.49Å; T321-K325 PolarHBondContact O-N 3.29Å; E322-K325 IonicContact OE1-NZ 3.71Å; E322-K325 PolarHBondContact OE1-NZ 2.72Å; E322-K325 WeakPolarHBondContact OE2-CD 3.4Å; E322-K325 WeakPolarHBondContact OE2-CE 3.41Å; E322-K325 IonicContact OE2-NZ 2.7Å; E322-K325 PolarHBondContact OE2-NZ 3.39Å; K325-F327 PolarHBondContact O-N 3.44Å; K325-V328 WeakPolarHBondContact O-CB 3.45Å; K325-V328 WeakPolarHBondContact O-CG2 3.15Å; K325-V328 PolarHBondContact O-N 3.35Å
326	P	98.3	Very high	96.3	Very high	63 Å²	63	45.9 Å²	45.9	41%	0.409	22%	0.222	S	C	.	.	H	α-helix	trans	-58.3	-33.3	178.5	-25.2	35.8	0	0	0	113.5	I254 Q323 G324 S329	I254-P326 HydrophobicContact CD1-CB 3.61Å; Q323-P326 WeakPolarHBondContact O-CD 3.14Å; G324-P326 VanDerWaalsContact C-CD 3.43Å; P326-S329 PolarHBondContact O-OG 3.47Å
327	F	98.5	Very high	96.4	Very high	11 Å²	11	43.1 Å²	43.1	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-82.7	-18.2	-175.5	-55.8	-78.3	0	0	0	113.6	I254 W282 M283 Q286 L287 L319 Q323 G324 K325 S329 V330 F331	I254-F327 HydrophobicContact CD1-CE1 4.48Å; I254-F327 HydrophobicContact CG1-CE1 4.49Å; W282-F327 HydrophobicContact CE3-CD1 4.35Å; W282-F327 AromaticContact CH2-CD1 3.59Å; W282-F327 HydrophobicContact CH2-CD1 3.59Å; W282-F327 AromaticContact CH2-CE1 3.92Å; W282-F327 HydrophobicContact CH2-CE1 3.92Å; W282-F327 HydrophobicContact CZ2-CD1 4.47Å; W282-F327 HydrophobicContact CZ2-CE1 4.37Å; W282-F327 AromaticContact CZ3-CD1 3.54Å; W282-F327 HydrophobicContact CZ3-CD1 3.54Å; W282-F327 HydrophobicContact CZ3-CE1 4.1Å; M283-F327 HydrophobicContact CB-CD1 4.28Å; M283-F327 HydrophobicContact CB-CE1 4.38Å; M283-F327 HydrophobicContact CG-CB 4.45Å; M283-F327 HydrophobicContact CG-CD1 3.86Å; M283-F327 HydrophobicContact CG-CD2 3.81Å; M283-F327 HydrophobicContact CG-CE1 3.99Å; M283-F327 HydrophobicContact CG-CE2 3.95Å; M283-F327 HydrophobicContact CG-CG 3.77Å; M283-F327 HydrophobicContact CG-CZ 4.03Å; M283-F327 HydrophobicContact SD-CB 3.57Å; M283-F327 VanDerWaalsContact SD-CB 3.57Å; M283-F327 HydrophobicContact SD-CD1 4.1Å; M283-F327 HydrophobicContact SD-CD2 3.65Å; M283-F327 HydrophobicContact SD-CE2 4.37Å; M283-F327 HydrophobicContact SD-CG 3.49Å; M283-F327 WeakPolarHBondContact SD-CG 3.48Å; Q286-F327 HydrophobicContact CB-CE1 3.85Å; Q286-F327 HydrophobicContact CB-CZ 3.83Å; Q286-F327 HydrophobicContact CG-CE1 4.13Å; L287-F327 HydrophobicContact CD1-CE2 4.26Å; L287-F327 HydrophobicContact CD2-CE2 4.03Å; L287-F327 HydrophobicContact CD2-CZ 4.4Å; L287-F327 HydrophobicContact CG-CE2 4.1Å; L287-F327 HydrophobicContact CG-CZ 4.18Å; L319-F327 HydrophobicContact CD2-CB 3.84Å; Q323-F327 WeakPolarHBondContact O-CD2 3.25Å; Q323-F327 VanDerWaalsContact O-CE2 3.3Å; Q323-F327 WeakPolarHBondContact O-CE2 3.32Å; G324-F327 WeakPolarHBondContact O-CB 3.29Å; G324-F327 PolarHBondContact O-N 3.34Å; K325-F327 PolarHBondContact O-N 3.44Å; F327-S329 PolarHBondContact O-N 3.36Å; F327-S329 VanDerWaalsContact O-N 3.13Å; F327-V330 WeakPolarHBondContact O-CB 3.41Å; F327-V330 PolarHBondContact O-N 2.93Å; F327-F331 HydrophobicContact CB-CD2 4.13Å; F327-F331 HydrophobicContact CB-CE2 4.2Å; F327-F331 WeakPolarHBondContact O-CD2 3.47Å; F327-F331 PolarHBondContact O-N 3.06Å; F327-F331 VanDerWaalsContact O-N 3.11Å
328	V	98.5	Very high	96.3	Very high	39 Å²	39	44.2 Å²	44.2	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-48.1	-44.6	177.8	169.7	0	0	0	0	111.5	L319 G324 K325 V330 F331 R332 W359	L319-V328 HydrophobicContact CB-CG2 4.05Å; L319-V328 HydrophobicContact CD2-CG2 4.41Å; L319-V328 WeakPolarHBondContact O-CG2 3.34Å; G324-V328 PolarHBondContact O-N 3.03Å; K325-V328 WeakPolarHBondContact O-CB 3.45Å; K325-V328 WeakPolarHBondContact O-CG2 3.15Å; K325-V328 PolarHBondContact O-N 3.35Å; V328-V330 PolarHBondContact O-N 3.46Å; V328-V330 VanDerWaalsContact O-N 3.16Å; V328-F331 PolarHBondContact O-N 2.87Å; V328-R332 HydrophobicContact CG1-CG 4.2Å; V328-R332 VanDerWaalsContact O-CG 3.22Å; V328-R332 WeakPolarHBondContact O-CG 3.43Å; V328-R332 PolarHBondContact O-N 2.9Å; V328-W359 HydrophobicContact CG1-CH2 3.98Å; V328-W359 HydrophobicContact CG1-CZ2 4.07Å
329	S	98.1	Very high	96.2	Very high	47 Å²	47	43.7 Å²	43.7	33%	0.329	21%	0.209	S	C	.	.	H	α-helix	trans	-62	-23.9	-178.1	72.4	0	0	0	0	114	P326 F327 H333	P326-S329 PolarHBondContact O-OG 3.47Å; F327-S329 PolarHBondContact O-N 3.36Å; F327-S329 VanDerWaalsContact O-N 3.13Å; S329-H333 PolarHBondContact O-CE1 2.95Å; S329-H333 PolarHBondContact O-ND1 2.97Å
330	V	98.6	Very high	96	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-87.1	-52.6	176.2	-175.9	0	0	0	0	110.1	I254 M257 K258 I261 L279 W282 F327 V328 R332 H333	I254-V330 HydrophobicContact CG2-CG2 3.72Å; M257-V330 HydrophobicContact CB-CG1 4.28Å; M257-V330 HydrophobicContact CG-CG1 3.68Å; K258-V330 HydrophobicContact CB-CG2 4.06Å; I261-V330 HydrophobicContact CG1-CG1 4.27Å; L279-V330 HydrophobicContact CD1-CG1 3.99Å; L279-V330 HydrophobicContact CD2-CG1 3.49Å; L279-V330 VanDerWaalsContact CD2-CG1 3.49Å; L279-V330 HydrophobicContact CG-CG1 4.41Å; W282-V330 HydrophobicContact CH2-CB 4.49Å; W282-V330 HydrophobicContact CH2-CG2 3.84Å; W282-V330 HydrophobicContact CZ3-CB 4.19Å; W282-V330 HydrophobicContact CZ3-CG1 4.04Å; W282-V330 HydrophobicContact CZ3-CG2 4.04Å; F327-V330 WeakPolarHBondContact O-CB 3.41Å; F327-V330 PolarHBondContact O-N 2.93Å; V328-V330 PolarHBondContact O-N 3.46Å; V328-V330 VanDerWaalsContact O-N 3.16Å; V330-R332 PolarHBondContact O-N 3.41Å; V330-R332 VanDerWaalsContact O-N 3.16Å; V330-H333 WeakPolarHBondContact O-CB 3.47Å; V330-H333 PolarHBondContact O-N 3.27Å; V330-H333 PolarHBondContact O-ND1 3.34Å
331	F	98.4	Very high	95.7	Very high	1 Å²	1	41.8 Å²	41.8	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-25.3	-177.4	-82.6	-102.5	0	0	0	113.3	Y276 L279 M283 L319 F327 V328 H333 L334 I354 V355 W359	Y276-F331 HydrophobicContact CD2-CE1 4.25Å; Y276-F331 HydrophobicContact CE2-CE1 4.23Å; L279-F331 HydrophobicContact CB-CE1 3.96Å; L279-F331 HydrophobicContact CB-CE2 4Å; L279-F331 HydrophobicContact CB-CZ 3.62Å; L279-F331 HydrophobicContact CD1-CD1 4.25Å; L279-F331 HydrophobicContact CD1-CD2 4.24Å; L279-F331 HydrophobicContact CD1-CE1 4.38Å; L279-F331 HydrophobicContact CD1-CE2 4.38Å; L279-F331 HydrophobicContact CD1-CG 4.18Å; L279-F331 HydrophobicContact CD1-CZ 4.45Å; M283-F331 HydrophobicContact CB-CE2 4.41Å; M283-F331 HydrophobicContact CE-CE1 4.48Å; M283-F331 HydrophobicContact CE-CE2 3.86Å; M283-F331 HydrophobicContact CE-CZ 3.59Å; M283-F331 HydrophobicContact SD-CE2 3.62Å; M283-F331 HydrophobicContact SD-CZ 4.01Å; L319-F331 HydrophobicContact CD1-CB 3.6Å; L319-F331 HydrophobicContact CD1-CD1 3.95Å; L319-F331 HydrophobicContact CD1-CD2 4.24Å; L319-F331 HydrophobicContact CD1-CG 3.68Å; L319-F331 HydrophobicContact CD2-CD2 3.98Å; L319-F331 HydrophobicContact CD2-CE2 4.34Å; L319-F331 HydrophobicContact CD2-CG 4.27Å; F327-F331 HydrophobicContact CB-CD2 4.13Å; F327-F331 HydrophobicContact CB-CE2 4.2Å; F327-F331 WeakPolarHBondContact O-CD2 3.47Å; F327-F331 PolarHBondContact O-N 3.06Å; F327-F331 VanDerWaalsContact O-N 3.11Å; V328-F331 PolarHBondContact O-N 2.87Å; F331-H333 PolarHBondContact O-N 3.14Å; F331-H333 VanDerWaalsContact O-N 3.13Å; F331-L334 HydrophobicContact CB-CD1 4.5Å; F331-L334 HydrophobicContact CD1-CD1 3.64Å; F331-L334 HydrophobicContact CE1-CD1 4.31Å; F331-L334 HydrophobicContact CG-CD1 4.39Å; F331-L334 WeakPolarHBondContact O-CB 3.5Å; F331-L334 PolarHBondContact O-N 3.15Å; F331-L334 VanDerWaalsContact O-N 3.07Å; F331-I354 HydrophobicContact CE1-CG2 3.98Å; F331-I354 HydrophobicContact CZ-CG2 4.3Å; F331-V355 HydrophobicContact CD1-CG2 4.22Å; F331-W359 HydrophobicContact CB-CZ3 4.24Å
332	R	97.4	Very high	95.4	Very high	149 Å²	149	44.1 Å²	44.1	56%	0.562	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-14.5	170.3	-75.2	-70.5	-168	-175.2	1.8	114.8	V328 V330 W359	V328-R332 HydrophobicContact CG1-CG 4.2Å; V328-R332 VanDerWaalsContact O-CG 3.22Å; V328-R332 WeakPolarHBondContact O-CG 3.43Å; V328-R332 PolarHBondContact O-N 2.9Å; V330-R332 PolarHBondContact O-N 3.41Å; V330-R332 VanDerWaalsContact O-N 3.16Å; R332-W359 HydrophobicContact CG-CH2 3.88Å; R332-W359 HydrophobicContact CG-CZ2 4.47Å; R332-W359 HydrophobicContact CG-CZ3 4.09Å; R332-W359 VanDerWaalsContact CZ-CZ2 3.44Å
333	H	97.4	Very high	95.2	Very high	66 Å²	66	42.7 Å²	42.7	31%	0.306	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	2.9	175.9	-60.7	82.2	0	0	0	113.6	I261 G262 S329 V330 F331 R396	I261-H333 HydrophobicContact CB-CB 4.32Å; I261-H333 HydrophobicContact CG2-CB 3.87Å; G262-H333 VanDerWaalsContact CA-CD2 3.45Å; G262-H333 WeakPolarHBondContact CA-CD2 3.42Å; S329-H333 PolarHBondContact O-CE1 2.95Å; S329-H333 PolarHBondContact O-ND1 2.97Å; V330-H333 WeakPolarHBondContact O-CB 3.47Å; V330-H333 PolarHBondContact O-N 3.27Å; V330-H333 PolarHBondContact O-ND1 3.34Å; F331-H333 PolarHBondContact O-N 3.14Å; F331-H333 VanDerWaalsContact O-N 3.13Å; H333-R396 PolarHBondContact O-NH2 3.01Å
334	L	97.1	Very high	95.2	Very high	12 Å²	12	40.9 Å²	40.9	6%	0.063	21%	0.213	C	C	.	.	S	Bend	trans	-70.4	133	167.4	-70.9	172.2	0	0	0	110	I275 Y276 L279 F331 L336	I275-L334 HydrophobicContact CB-CD2 4.13Å; I275-L334 HydrophobicContact CG2-CD2 3.95Å; Y276-L334 HydrophobicContact CD2-CD1 3.87Å; L279-L334 HydrophobicContact CD1-CD1 4.22Å; L279-L334 HydrophobicContact CD1-CD2 3.97Å; L279-L334 HydrophobicContact CD1-CG 3.98Å; F331-L334 HydrophobicContact CB-CD1 4.5Å; F331-L334 HydrophobicContact CD1-CD1 3.64Å; F331-L334 HydrophobicContact CE1-CD1 4.31Å; F331-L334 HydrophobicContact CG-CD1 4.39Å; F331-L334 WeakPolarHBondContact O-CB 3.5Å; F331-L334 PolarHBondContact O-N 3.15Å; F331-L334 VanDerWaalsContact O-N 3.07Å; L334-L336 HydrophobicContact CB-CD2 3.96Å; L334-L336 HydrophobicContact CB-CG 4.36Å; L334-L336 HydrophobicContact CD1-CD2 4.38Å; L334-L336 PolarHBondContact O-N 2.85Å
335	R	94.8	Very high	95.1	Very high	14 Å²	14	41.6 Å²	41.6	5%	0.053	22%	0.218	C	C	.	.			trans	-87.9	67.2	177.9	-54.7	177.7	-172.2	-163.2	-9.2	108.8	E272 Q337 Y338 E391 G392 S394	E272-R335 HydrophobicContact CG-CB 4.08Å; E272-R335 WeakPolarHBondContact OE1-CB 3.24Å; E272-R335 PolarHBondContact OE1-N 2.88Å; R335-Q337 VanDerWaalsContact CA-OE1 3.31Å; R335-Q337 PolarHBondContact O-N 3.02Å; R335-Q337 PolarHBondContact O-OE1 3.19Å; R335-Y338 HydrophobicContact CB-CD2 3.73Å; R335-Y338 HydrophobicContact CB-CE2 4.23Å; R335-Y338 PolarHBondContact O-N 2.85Å; R335-E391 PolarHBondContact NH1-O 3.27Å; R335-E391 PolarHBondContact NH2-O 2.95Å; R335-G392 VanDerWaalsContact CZ-O 3.22Å; R335-G392 PolarHBondContact NE-O 3.32Å; R335-G392 PolarHBondContact NH2-O 3.46Å; R335-S394 WeakPolarHBondContact CD-O 3.47Å; R335-S394 PolarHBondContact NH1-O 3.14Å; R335-S394 PolarHBondContact NH1-OG 3.16Å
336	L	95.4	Very high	95	Very high	13 Å²	13	37 Å²	37	7%	0.068	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-30.8	-171.4	-64.4	177.1	0	0	0	113.3	L334 Y338 I339 I340 I349 V355 W359 L360 V363	L334-L336 HydrophobicContact CB-CD2 3.96Å; L334-L336 HydrophobicContact CB-CG 4.36Å; L334-L336 HydrophobicContact CD1-CD2 4.38Å; L334-L336 PolarHBondContact O-N 2.85Å; L336-Y338 PolarHBondContact O-N 2.9Å; L336-I339 HydrophobicContact CD2-CD1 4.31Å; L336-I339 PolarHBondContact O-N 3.45Å; L336-I340 WeakPolarHBondContact O-CG1 3.22Å; L336-I340 PolarHBondContact O-N 2.93Å; L336-I349 HydrophobicContact CD2-CD1 3.79Å; L336-V355 HydrophobicContact CD1-CG1 4.29Å; L336-W359 HydrophobicContact CD1-CB 4.12Å; L336-W359 HydrophobicContact CD1-CE3 4.47Å; L336-L360 HydrophobicContact CD1-CD2 4.32Å; L336-L360 HydrophobicContact CD2-CD2 4.49Å; L336-V363 HydrophobicContact CB-CG1 4.28Å; L336-V363 HydrophobicContact CB-CG2 4.21Å; L336-V363 HydrophobicContact CD1-CG2 4.47Å
337	Q	92.4	Very high	94.9	Very high	38 Å²	38	41.5 Å²	41.5	18%	0.178	21%	0.208	C	C	.	.	H	α-helix	trans	-52	-40.7	174.9	65	-85.2	28.6	0	0	112.8	R335 I339 S341 V363 Q367	R335-Q337 VanDerWaalsContact CA-OE1 3.31Å; R335-Q337 PolarHBondContact O-N 3.02Å; R335-Q337 PolarHBondContact O-OE1 3.19Å; Q337-I339 VanDerWaalsContact C-N 3.34Å; Q337-S341 PolarHBondContact O-N 3.02Å; Q337-S341 PolarHBondContact O-OG 3.38Å; Q337-V363 HydrophobicContact CB-CG1 3.93Å; Q337-Q367 HydrophobicContact CB-CG 4.25Å
338	Y	93	Very high	94.8	Very high	32 Å²	32	44.4 Å²	44.4	13%	0.125	22%	0.223	C	C	.	.	H	α-helix	trans	-85.7	-4.5	179.9	-55.5	-63	0	0	0	114.3	R335 L336 N393 S394 M395	R335-Y338 HydrophobicContact CB-CD2 3.73Å; R335-Y338 HydrophobicContact CB-CE2 4.23Å; R335-Y338 PolarHBondContact O-N 2.85Å; L336-Y338 PolarHBondContact O-N 2.9Å; Y338-N393 WeakPolarHBondContact CE2-O 3.26Å; Y338-N393 PolarHBondContact OH-O 3.3Å; Y338-S394 WeakPolarHBondContact CE2-O 3.39Å; Y338-M395 HydrophobicContact CD1-CB 3.6Å; Y338-M395 HydrophobicContact CD1-CG 3.78Å; Y338-M395 HydrophobicContact CD1-SD 4.14Å; Y338-M395 VanDerWaalsContact CD2-CA 3.49Å; Y338-M395 HydrophobicContact CD2-CB 3.97Å; Y338-M395 HydrophobicContact CD2-CG 4.3Å; Y338-M395 HydrophobicContact CE1-CB 3.67Å; Y338-M395 HydrophobicContact CE1-CG 4.36Å; Y338-M395 VanDerWaalsContact CE2-CA 3.45Å; Y338-M395 HydrophobicContact CE2-CB 4.02Å; Y338-M395 HydrophobicContact CG-CB 3.76Å; Y338-M395 HydrophobicContact CG-CG 3.75Å; Y338-M395 VanDerWaalsContact CZ-N 3.27Å; Y338-M395 PolarHBondContact OH-N 3.2Å
339	I	94.1	Very high	94.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-89.1	-47.5	169.5	-58.4	-176.7	0	0	0	108.9	E272 M273 L336 Q337 S341 D342 S345 I349	E272-I339 HydrophobicContact CB-CG1 3.98Å; E272-I339 HydrophobicContact CG-CD1 4.11Å; E272-I339 HydrophobicContact CG-CG1 3.78Å; M273-I339 HydrophobicContact SD-CG2 3.7Å; L336-I339 HydrophobicContact CD2-CD1 4.31Å; L336-I339 PolarHBondContact O-N 3.45Å; Q337-I339 VanDerWaalsContact C-N 3.34Å; I339-S341 VanDerWaalsContact C-N 3.28Å; I339-S341 PolarHBondContact O-N 3.05Å; I339-D342 PolarHBondContact O-N 2.89Å; I339-S345 VanDerWaalsContact O-CB 3.29Å; I339-S345 WeakPolarHBondContact O-CB 3.48Å; I339-I349 HydrophobicContact CD1-CD1 4.41Å; I339-I349 HydrophobicContact CG2-CD1 4.28Å; I339-I349 HydrophobicContact CG2-CG2 4.39Å
340	I	93.2	Very high	94.5	Very high	16 Å²	16	44.9 Å²	44.9	8%	0.082	22%	0.217	C	C	.	.	H	α-helix	trans	-76.3	-10.5	-176	67.5	147.7	0	0	0	114.4	L336 D342 A346 L360 V363 Y364 Q367	L336-I340 WeakPolarHBondContact O-CG1 3.22Å; L336-I340 PolarHBondContact O-N 2.93Å; I340-D342 PolarHBondContact O-N 3.04Å; I340-A346 HydrophobicContact CB-CB 4.49Å; I340-L360 HydrophobicContact CG2-CD2 4.15Å; I340-V363 HydrophobicContact CD1-CB 4.28Å; I340-V363 HydrophobicContact CD1-CG1 3.75Å; I340-V363 HydrophobicContact CG1-CG1 4.01Å; I340-Y364 HydrophobicContact CB-CD1 4.39Å; I340-Y364 HydrophobicContact CB-CE1 3.86Å; I340-Y364 HydrophobicContact CD1-CD1 3.32Å; I340-Y364 HydrophobicContact CD1-CE1 3.7Å; I340-Y364 HydrophobicContact CD1-CG 3.86Å; I340-Y364 HydrophobicContact CG1-CD1 4.47Å; I340-Y364 HydrophobicContact CG1-CE1 4.43Å; I340-Y364 HydrophobicContact CG2-CE1 4.2Å; I340-Q367 HydrophobicContact CD1-CB 4.31Å; I340-Q367 HydrophobicContact CD1-CG 3.76Å; I340-Q367 HydrophobicContact CG1-CG 4.18Å
341	S	88.1	Confident	94.2	Very high	30 Å²	30	51.6 Å²	51.6	21%	0.21	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-5.8	170.9	-57.4	0	0	0	0	114.3	Q337 I339	Q337-S341 PolarHBondContact O-N 3.02Å; Q337-S341 PolarHBondContact O-OG 3.38Å; I339-S341 VanDerWaalsContact C-N 3.28Å; I339-S341 PolarHBondContact O-N 3.05Å
342	D	88.7	Confident	94	Very high	59 Å²	59	53 Å²	53	32%	0.316	26%	0.257	S	S	.	.	S	Bend	trans	-117.2	128.3	170.1	166.7	53.1	0	0	0	110.5	I339 I340 A344 S345 A346	I339-D342 PolarHBondContact O-N 2.89Å; I340-D342 PolarHBondContact O-N 3.04Å; D342-A344 VanDerWaalsContact C-N 3.32Å; D342-A344 PolarHBondContact O-N 3.46Å; D342-A344 PolarHBondContact OD2-N 3.17Å; D342-S345 PolarHBondContact O-N 3.43Å; D342-S345 VanDerWaalsContact OD2-CB 3.25Å; D342-S345 WeakPolarHBondContact OD2-CB 3.33Å; D342-S345 PolarHBondContact OD2-N 3.4Å; D342-S345 PolarHBondContact OD2-OG 3.23Å; D342-A346 VanDerWaalsContact O-CB 3.27Å; D342-A346 WeakPolarHBondContact O-CB 3.45Å; D342-A346 PolarHBondContact O-N 2.99Å
343	L	90.4	Very high	93.9	Very high	111 Å²	111	46.9 Å²	46.9	58%	0.581	24%	0.238	S	C	*	.	H	α-helix	trans	-65.8	-31.9	-175.1	179.5	61.6	0	0	0	113	R347	L343-R347 HydrophobicContact CD1-CG 4.4Å; L343-R347 WeakPolarHBondContact O-CB 3.48Å; L343-R347 VanDerWaalsContact O-CG 3.28Å; L343-R347 WeakPolarHBondContact O-CG 3.16Å; L343-R347 PolarHBondContact O-N 2.85Å
344	A	93.3	Very high	93.8	Very high	56 Å²	56	43.7 Å²	43.7	46%	0.463	22%	0.223	S	C	.	.	H	α-helix	trans	-70.7	-48	177.2	0	0	0	0	0	110.5	D342 R347 I348	D342-A344 VanDerWaalsContact C-N 3.32Å; D342-A344 PolarHBondContact O-N 3.46Å; D342-A344 PolarHBondContact OD2-N 3.17Å; A344-R347 PolarHBondContact O-N 3.06Å; A344-I348 VanDerWaalsContact O-CG1 3.29Å; A344-I348 WeakPolarHBondContact O-CG1 3.43Å; A344-I348 PolarHBondContact O-N 3.01Å
345	S	94.7	Very high	93.8	Very high	15 Å²	15	43.3 Å²	43.3	11%	0.105	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-42.5	177	-58.3	0	0	0	0	112.5	I339 D342 R347 I348 I349	I339-S345 VanDerWaalsContact O-CB 3.29Å; I339-S345 WeakPolarHBondContact O-CB 3.48Å; D342-S345 PolarHBondContact O-N 3.43Å; D342-S345 VanDerWaalsContact OD2-CB 3.25Å; D342-S345 WeakPolarHBondContact OD2-CB 3.33Å; D342-S345 PolarHBondContact OD2-N 3.4Å; D342-S345 PolarHBondContact OD2-OG 3.23Å; S345-R347 PolarHBondContact O-N 3.29Å; S345-I348 PolarHBondContact O-N 3.49Å; S345-I349 PolarHBondContact O-N 3.38Å
346	A	94.8	Very high	93.9	Very high	5 Å²	5	42.8 Å²	42.8	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-46.2	173.3	0	0	0	0	0	112.4	I340 D342 I348 I349 E350	I340-A346 HydrophobicContact CB-CB 4.49Å; D342-A346 VanDerWaalsContact O-CB 3.27Å; D342-A346 WeakPolarHBondContact O-CB 3.45Å; D342-A346 PolarHBondContact O-N 2.99Å; A346-I348 PolarHBondContact O-N 3.36Å; A346-I349 VanDerWaalsContact O-CG2 3.3Å; A346-I349 WeakPolarHBondContact O-CG2 3.36Å; A346-E350 WeakPolarHBondContact O-CG 3.17Å; A346-E350 PolarHBondContact O-N 2.96Å
347	R	96	Very high	93.8	Very high	157 Å²	157	46.2 Å²	46.2	59%	0.592	25%	0.245	S	C	*	.	H	α-helix	trans	-65	-38	176.2	-75.8	171.9	174.1	172.3	-0.7	112.7	L343 A344 S345 Q351	L343-R347 HydrophobicContact CD1-CG 4.4Å; L343-R347 WeakPolarHBondContact O-CB 3.48Å; L343-R347 VanDerWaalsContact O-CG 3.28Å; L343-R347 WeakPolarHBondContact O-CG 3.16Å; L343-R347 PolarHBondContact O-N 2.85Å; A344-R347 PolarHBondContact O-N 3.06Å; S345-R347 PolarHBondContact O-N 3.29Å; R347-Q351 WeakPolarHBondContact O-CB 3.32Å; R347-Q351 PolarHBondContact O-N 2.92Å
348	I	96.1	Very high	93.8	Very high	73 Å²	73	50.9 Å²	50.9	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-47.3	178.8	-66.6	161.4	0	0	0	110.7	M273 A344 S345 A346 E350 Q351 D352	M273-I348 HydrophobicContact CE-CB 3.74Å; M273-I348 HydrophobicContact CE-CD1 4.16Å; M273-I348 HydrophobicContact CE-CG2 3.43Å; M273-I348 VanDerWaalsContact CE-CG2 3.43Å; A344-I348 VanDerWaalsContact O-CG1 3.29Å; A344-I348 WeakPolarHBondContact O-CG1 3.43Å; A344-I348 PolarHBondContact O-N 3.01Å; S345-I348 PolarHBondContact O-N 3.49Å; A346-I348 PolarHBondContact O-N 3.36Å; I348-E350 VanDerWaalsContact C-N 3.33Å; I348-E350 PolarHBondContact O-N 3.04Å; I348-Q351 PolarHBondContact O-N 3.34Å; I348-D352 WeakPolarHBondContact O-CB 3.05Å; I348-D352 PolarHBondContact O-N 3.38Å
349	I	96.1	Very high	94	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.7	-33.8	-178	-164.8	164.7	0	0	0	112.5	Y276 L336 I339 S345 A346 V355 L360	Y276-I349 HydrophobicContact CD2-CD1 3.97Å; Y276-I349 HydrophobicContact CD2-CG1 4.37Å; Y276-I349 HydrophobicContact CE2-CD1 4Å; Y276-I349 HydrophobicContact CE2-CG1 3.92Å; Y276-I349 HydrophobicContact CG-CD1 4.47Å; L336-I349 HydrophobicContact CD2-CD1 3.79Å; I339-I349 HydrophobicContact CD1-CD1 4.41Å; I339-I349 HydrophobicContact CG2-CD1 4.28Å; I339-I349 HydrophobicContact CG2-CG2 4.39Å; S345-I349 PolarHBondContact O-N 3.38Å; A346-I349 VanDerWaalsContact O-CG2 3.3Å; A346-I349 WeakPolarHBondContact O-CG2 3.36Å; I349-V355 HydrophobicContact CD1-CB 4.41Å; I349-V355 HydrophobicContact CD1-CG2 4.07Å; I349-V355 HydrophobicContact CG1-CB 4.33Å; I349-V355 HydrophobicContact CG1-CG2 4.27Å; I349-L360 HydrophobicContact CD1-CD2 4.24Å; I349-L360 HydrophobicContact CG2-CD1 4.26Å; I349-L360 HydrophobicContact CG2-CD2 4.24Å
350	E	94.4	Very high	94.1	Very high	95 Å²	95	51.2 Å²	51.2	44%	0.444	27%	0.268	S	S	.	.	H	α-helix	trans	-70.3	-42.8	170.5	-72.7	180	177.8	0	0	112.8	A346 I348 D352 A353 L360 Y364	A346-E350 WeakPolarHBondContact O-CG 3.17Å; A346-E350 PolarHBondContact O-N 2.96Å; I348-E350 VanDerWaalsContact C-N 3.33Å; I348-E350 PolarHBondContact O-N 3.04Å; E350-D352 VanDerWaalsContact C-N 3.34Å; E350-D352 PolarHBondContact O-N 3.11Å; E350-A353 PolarHBondContact O-N 2.95Å; E350-L360 HydrophobicContact CG-CD1 3.89Å; E350-Y364 WeakPolarHBondContact OE1-CE2 3.19Å; E350-Y364 VanDerWaalsContact OE1-CZ 3.28Å; E350-Y364 PolarHBondContact OE1-OH 3.38Å
351	Q	93.2	Very high	94.1	Very high	141 Å²	141	53 Å²	53	66%	0.659	28%	0.282	S	S	*	.	H	α-helix	trans	-67.5	-34.5	179.9	-179.4	175.5	-1.6	0	0	112.3	R310 R347 I348 A353	R310-Q351 PolarHBondContact NH1-O 3.47Å; R347-Q351 WeakPolarHBondContact O-CB 3.32Å; R347-Q351 PolarHBondContact O-N 2.92Å; I348-Q351 PolarHBondContact O-N 3.34Å; Q351-A353 VanDerWaalsContact C-N 3.25Å; Q351-A353 PolarHBondContact O-N 3.1Å
352	D	94.5	Very high	94.4	Very high	31 Å²	31	54.3 Å²	54.3	17%	0.166	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-29.2	175.8	-82.4	-18.8	0	0	0	112.5	Y276 K280 I348 E350 I354	Y276-D352 WeakPolarHBondContact CE1-OD2 3.42Å; Y276-D352 WeakPolarHBondContact OH-CB 3.48Å; Y276-D352 VanDerWaalsContact OH-CG 3.28Å; Y276-D352 PolarHBondContact OH-OD2 2.98Å; K280-D352 WeakPolarHBondContact CE-OD2 3.28Å; K280-D352 IonicContact NZ-OD1 2.74Å; K280-D352 PolarHBondContact NZ-OD1 3.08Å; K280-D352 IonicContact NZ-OD2 2.74Å; K280-D352 PolarHBondContact NZ-OD2 3.18Å; I348-D352 WeakPolarHBondContact O-CB 3.05Å; I348-D352 PolarHBondContact O-N 3.38Å; E350-D352 VanDerWaalsContact C-N 3.34Å; E350-D352 PolarHBondContact O-N 3.11Å; D352-I354 HydrophobicContact CB-CD1 4.3Å; D352-I354 HydrophobicContact CB-CG1 4.22Å; D352-I354 PolarHBondContact O-N 2.96Å; D352-I354 VanDerWaalsContact O-N 3.12Å
353	A	94.3	Very high	94.7	Very high	20 Å²	20	52.3 Å²	52.3	17%	0.165	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	32.4	-176.1	0	0	0	0	0	113.6	A317 F318 E350 Q351	A317-A353 CarbonylContact C-O 3.53Å; A317-A353 WeakPolarHBondContact CA-O 3.06Å; F318-A353 PolarHBondContact N-O 3.33Å; E350-A353 PolarHBondContact O-N 2.95Å; Q351-A353 VanDerWaalsContact C-N 3.25Å; Q351-A353 PolarHBondContact O-N 3.1Å
354	I	96.4	Very high	94.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.			trans	-83.6	-46.6	176.3	-71.1	175.3	0	0	0	110.5	K280 M283 F306 F318 L319 F331 D352	K280-I354 HydrophobicContact CD-CD1 4.02Å; K280-I354 HydrophobicContact CG-CD1 3.63Å; M283-I354 HydrophobicContact CE-CD1 4.41Å; M283-I354 HydrophobicContact CE-CG2 3.63Å; F306-I354 HydrophobicContact CB-CD1 4.45Å; F306-I354 HydrophobicContact CD1-CD1 3.73Å; F306-I354 HydrophobicContact CD1-CG1 3.91Å; F306-I354 HydrophobicContact CD2-CD1 3.85Å; F306-I354 HydrophobicContact CE1-CD1 3.86Å; F306-I354 HydrophobicContact CE1-CG1 4.14Å; F306-I354 HydrophobicContact CE2-CD1 3.98Å; F306-I354 HydrophobicContact CG-CD1 3.74Å; F306-I354 HydrophobicContact CG-CG1 4.3Å; F306-I354 HydrophobicContact CZ-CD1 4.01Å; F318-I354 HydrophobicContact CB-CB 4.47Å; F318-I354 HydrophobicContact CB-CG1 4.23Å; L319-I354 WeakPolarHBondContact CB-O 3.34Å; L319-I354 HydrophobicContact CD1-CG2 4.38Å; L319-I354 HydrophobicContact CG-CG2 4.14Å; L319-I354 VanDerWaalsContact CG-O 3.25Å; L319-I354 WeakPolarHBondContact CG-O 3.49Å; L319-I354 PolarHBondContact N-O 2.82Å; L319-I354 VanDerWaalsContact N-O 3.15Å; F331-I354 HydrophobicContact CE1-CG2 3.98Å; F331-I354 HydrophobicContact CZ-CG2 4.3Å; D352-I354 HydrophobicContact CB-CD1 4.3Å; D352-I354 HydrophobicContact CB-CG1 4.22Å; D352-I354 PolarHBondContact O-N 2.96Å; D352-I354 VanDerWaalsContact O-N 3.12Å
355	V	96.8	Very high	94.9	Very high	4 Å²	4	55 Å²	55	2%	0.024	28%	0.276	C	S	.	.	S	Bend	trans	-86.3	134.5	178.2	177	0	0	0	0	109.3	Y276 L319 F331 L336 I349 W359 L360	Y276-V355 HydrophobicContact CE2-CG2 4.18Å; L319-V355 HydrophobicContact CD1-CG2 4.33Å; F331-V355 HydrophobicContact CD1-CG2 4.22Å; L336-V355 HydrophobicContact CD1-CG1 4.29Å; I349-V355 HydrophobicContact CD1-CB 4.41Å; I349-V355 HydrophobicContact CD1-CG2 4.07Å; I349-V355 HydrophobicContact CG1-CB 4.33Å; I349-V355 HydrophobicContact CG1-CG2 4.27Å; V355-W359 HydrophobicContact CG1-CB 4.01Å; V355-W359 HydrophobicContact CG1-CD2 4.15Å; V355-W359 HydrophobicContact CG1-CE3 3.71Å; V355-W359 HydrophobicContact CG1-CG 4.36Å; V355-W359 HydrophobicContact CG1-CZ3 4.39Å; V355-L360 HydrophobicContact CG1-CD2 4.37Å; V355-L360 HydrophobicContact CG1-CG 4.41Å
356	P	95.6	Very high	94.8	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.019	29%	0.294	C	S	.	.			trans	-58	138.3	178.1	-27.6	37.4	0	0	0	112.8	A317 E320 E358 W359	A317-P356 HydrophobicContact CB-CB 4.32Å; A317-P356 HydrophobicContact CB-CG 4.18Å; E320-P356 HydrophobicContact CG-CB 4.41Å; E320-P356 HydrophobicContact CG-CG 3.78Å; P356-E358 PolarHBondContact O-N 3.28Å; P356-W359 HydrophobicContact CB-CG 4.19Å; P356-W359 HydrophobicContact CG-CD2 4.23Å; P356-W359 HydrophobicContact CG-CG 4.39Å; P356-W359 HydrophobicContact CG-CZ2 4Å; P356-W359 WeakPolarHBondContact O-CB 3.22Å; P356-W359 PolarHBondContact O-N 3.05Å
357	S	93.3	Very high	94.6	Very high	85 Å²	85	60.7 Å²	60.7	59%	0.594	30%	0.3	S	S	*	.	H	α-helix	trans	-55.8	-34.6	177.7	53	0	0	0	0	112.3	W359 L360 S361	S357-W359 VanDerWaalsContact C-N 3.26Å; S357-W359 PolarHBondContact O-N 3.47Å; S357-L360 PolarHBondContact O-N 2.88Å; S357-L360 VanDerWaalsContact O-N 3.09Å; S357-S361 PolarHBondContact O-N 2.98Å
358	E	94.1	Very high	94.3	Very high	135 Å²	135	60.2 Å²	60.2	63%	0.631	30%	0.298	S	S	*	.	H	α-helix	trans	-67.9	-21.4	177.4	-65.8	-62.8	178.8	0	0	114.5	P356 S361	P356-E358 PolarHBondContact O-N 3.28Å; E358-S361 WeakPolarHBondContact CA-OG 3.24Å; E358-S361 PolarHBondContact O-OG 2.93Å; E358-S361 PolarHBondContact OE2-OG 3.32Å
359	W	96.3	Very high	94	Very high	33 Å²	33	61.4 Å²	61.4	13%	0.125	30%	0.301	C	S	.	.	H	α-helix	trans	-75.9	-38.4	171.6	-60	17.2	0	0	0	109.6	L319 V328 F331 R332 L336 V355 P356 S357 V363	L319-W359 HydrophobicContact CD1-CH2 3.99Å; L319-W359 HydrophobicContact CD1-CZ3 4.2Å; V328-W359 HydrophobicContact CG1-CH2 3.98Å; V328-W359 HydrophobicContact CG1-CZ2 4.07Å; F331-W359 HydrophobicContact CB-CZ3 4.24Å; R332-W359 HydrophobicContact CG-CH2 3.88Å; R332-W359 HydrophobicContact CG-CZ2 4.47Å; R332-W359 HydrophobicContact CG-CZ3 4.09Å; R332-W359 VanDerWaalsContact CZ-CZ2 3.44Å; L336-W359 HydrophobicContact CD1-CB 4.12Å; L336-W359 HydrophobicContact CD1-CE3 4.47Å; V355-W359 HydrophobicContact CG1-CB 4.01Å; V355-W359 HydrophobicContact CG1-CD2 4.15Å; V355-W359 HydrophobicContact CG1-CE3 3.71Å; V355-W359 HydrophobicContact CG1-CG 4.36Å; V355-W359 HydrophobicContact CG1-CZ3 4.39Å; P356-W359 HydrophobicContact CB-CG 4.19Å; P356-W359 HydrophobicContact CG-CD2 4.23Å; P356-W359 HydrophobicContact CG-CG 4.39Å; P356-W359 HydrophobicContact CG-CZ2 4Å; P356-W359 WeakPolarHBondContact O-CB 3.22Å; P356-W359 PolarHBondContact O-N 3.05Å; S357-W359 VanDerWaalsContact C-N 3.26Å; S357-W359 PolarHBondContact O-N 3.47Å; W359-V363 VanDerWaalsContact O-CG2 3.23Å; W359-V363 WeakPolarHBondContact O-CG2 3.49Å; W359-V363 PolarHBondContact O-N 2.69Å
360	L	95.8	Very high	93.6	Very high	7 Å²	7	61.7 Å²	61.7	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-72.2	-42.5	178.5	-58.3	176	0	0	0	111.7	L336 I340 I349 E350 V355 S357 S362 V363 Y364	L336-L360 HydrophobicContact CD1-CD2 4.32Å; L336-L360 HydrophobicContact CD2-CD2 4.49Å; I340-L360 HydrophobicContact CG2-CD2 4.15Å; I349-L360 HydrophobicContact CD1-CD2 4.24Å; I349-L360 HydrophobicContact CG2-CD1 4.26Å; I349-L360 HydrophobicContact CG2-CD2 4.24Å; E350-L360 HydrophobicContact CG-CD1 3.89Å; V355-L360 HydrophobicContact CG1-CD2 4.37Å; V355-L360 HydrophobicContact CG1-CG 4.41Å; S357-L360 PolarHBondContact O-N 2.88Å; S357-L360 VanDerWaalsContact O-N 3.09Å; L360-S362 VanDerWaalsContact C-N 3.33Å; L360-S362 PolarHBondContact O-N 2.8Å; L360-V363 PolarHBondContact O-N 3.22Å; L360-V363 VanDerWaalsContact O-N 3.08Å; L360-Y364 HydrophobicContact CB-CD2 4.22Å; L360-Y364 HydrophobicContact CB-CE2 3.99Å; L360-Y364 WeakPolarHBondContact O-CD2 3.46Å; L360-Y364 PolarHBondContact O-N 2.91Å
361	S	94.5	Very high	93.2	Very high	54 Å²	54	59.6 Å²	59.6	38%	0.378	29%	0.294	S	S	.	.	H	α-helix	trans	-56.1	-45.1	-179.2	71.7	0	0	0	0	112.2	S357 E358 K365	S357-S361 PolarHBondContact O-N 2.98Å; E358-S361 WeakPolarHBondContact CA-OG 3.24Å; E358-S361 PolarHBondContact O-OG 2.93Å; E358-S361 PolarHBondContact OE2-OG 3.32Å; S361-K365 PolarHBondContact O-N 3.44Å; S361-K365 VanDerWaalsContact O-N 3.12Å
362	S	93.8	Very high	92.9	Very high	57 Å²	57	54.9 Å²	54.9	40%	0.399	27%	0.273	S	S	.	.	H	α-helix	trans	-60.6	-45.7	175.1	-175.7	0	0	0	0	111.9	L360 K365 Q366	L360-S362 VanDerWaalsContact C-N 3.33Å; L360-S362 PolarHBondContact O-N 2.8Å; S362-K365 PolarHBondContact O-N 3.26Å; S362-Q366 WeakPolarHBondContact O-CG 3.29Å; S362-Q366 PolarHBondContact O-N 2.86Å
363	V	94.6	Very high	92.4	Very high	16 Å²	16	55.7 Å²	55.7	10%	0.097	27%	0.274	C	S	.	.	H	α-helix	trans	-71.8	-39.6	-177.7	-177.6	0	0	0	0	111.1	L336 Q337 I340 W359 L360 K365 Q366 Q367	L336-V363 HydrophobicContact CB-CG1 4.28Å; L336-V363 HydrophobicContact CB-CG2 4.21Å; L336-V363 HydrophobicContact CD1-CG2 4.47Å; Q337-V363 HydrophobicContact CB-CG1 3.93Å; I340-V363 HydrophobicContact CD1-CB 4.28Å; I340-V363 HydrophobicContact CD1-CG1 3.75Å; I340-V363 HydrophobicContact CG1-CG1 4.01Å; W359-V363 VanDerWaalsContact O-CG2 3.23Å; W359-V363 WeakPolarHBondContact O-CG2 3.49Å; W359-V363 PolarHBondContact O-N 2.69Å; L360-V363 PolarHBondContact O-N 3.22Å; L360-V363 VanDerWaalsContact O-N 3.08Å; V363-K365 VanDerWaalsContact C-N 3.33Å; V363-K365 PolarHBondContact O-N 3.44Å; V363-Q366 PolarHBondContact O-N 3.33Å; V363-Q367 HydrophobicContact CG1-CG 4.26Å; V363-Q367 WeakPolarHBondContact O-CG 3.36Å; V363-Q367 PolarHBondContact O-N 3.11Å
364	Y	94.9	Very high	91.8	Very high	83 Å²	83	54.8 Å²	54.8	33%	0.325	27%	0.266	S	S	.	.	H	α-helix	trans	-56.1	-46.7	171.7	-78	-58.6	0	0	0	111.8	I340 E350 L360 Q366 Q367 W368	I340-Y364 HydrophobicContact CB-CD1 4.39Å; I340-Y364 HydrophobicContact CB-CE1 3.86Å; I340-Y364 HydrophobicContact CD1-CD1 3.32Å; I340-Y364 HydrophobicContact CD1-CE1 3.7Å; I340-Y364 HydrophobicContact CD1-CG 3.86Å; I340-Y364 HydrophobicContact CG1-CD1 4.47Å; I340-Y364 HydrophobicContact CG1-CE1 4.43Å; I340-Y364 HydrophobicContact CG2-CE1 4.2Å; E350-Y364 WeakPolarHBondContact OE1-CE2 3.19Å; E350-Y364 VanDerWaalsContact OE1-CZ 3.28Å; E350-Y364 PolarHBondContact OE1-OH 3.38Å; L360-Y364 HydrophobicContact CB-CD2 4.22Å; L360-Y364 HydrophobicContact CB-CE2 3.99Å; L360-Y364 WeakPolarHBondContact O-CD2 3.46Å; L360-Y364 PolarHBondContact O-N 2.91Å; Y364-Q366 PolarHBondContact O-N 3.5Å; Y364-Q367 PolarHBondContact O-N 3.07Å; Y364-W368 WeakPolarHBondContact O-CB 3.33Å; Y364-W368 PolarHBondContact O-N 2.62Å
365	K	93.6	Very high	91.1	Very high	141 Å²	141	59.4 Å²	59.4	61%	0.613	29%	0.288	S	S	*	.	H	α-helix	trans	-59.9	-44.9	176.1	-177.8	-179.7	177.2	-177.3	0	111.6	S361 S362 V363 W368 F369	S361-K365 PolarHBondContact O-N 3.44Å; S361-K365 VanDerWaalsContact O-N 3.12Å; S362-K365 PolarHBondContact O-N 3.26Å; V363-K365 VanDerWaalsContact C-N 3.33Å; V363-K365 PolarHBondContact O-N 3.44Å; K365-W368 PolarHBondContact O-N 2.82Å; K365-F369 HydrophobicContact CD-CE2 4.44Å; K365-F369 HydrophobicContact CG-CD2 4.02Å; K365-F369 HydrophobicContact CG-CE2 3.79Å; K365-F369 WeakPolarHBondContact O-CD2 3.4Å; K365-F369 PolarHBondContact O-N 3.19Å; K365-F369 VanDerWaalsContact O-N 3.15Å
366	Q	91.6	Very high	90.5	Very high	107 Å²	107	65.8 Å²	65.8	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-44.1	177.3	-70.9	169.4	6.3	0	0	112.4	S362 V363 Y364 W368 F369 A370	S362-Q366 WeakPolarHBondContact O-CG 3.29Å; S362-Q366 PolarHBondContact O-N 2.86Å; V363-Q366 PolarHBondContact O-N 3.33Å; Y364-Q366 PolarHBondContact O-N 3.5Å; Q366-W368 VanDerWaalsContact C-N 3.35Å; Q366-F369 PolarHBondContact O-N 3.24Å; Q366-A370 WeakPolarHBondContact O-CB 3.32Å; Q366-A370 PolarHBondContact O-N 2.85Å
367	Q	90.4	Very high	89.5	Confident	33 Å²	33	70.7 Å²	70.7	15%	0.154	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-36.7	177.8	-67	-55.2	-88	0	0	112.2	Q337 I340 V363 Y364 A370 M371	Q337-Q367 HydrophobicContact CB-CG 4.25Å; I340-Q367 HydrophobicContact CD1-CB 4.31Å; I340-Q367 HydrophobicContact CD1-CG 3.76Å; I340-Q367 HydrophobicContact CG1-CG 4.18Å; V363-Q367 HydrophobicContact CG1-CG 4.26Å; V363-Q367 WeakPolarHBondContact O-CG 3.36Å; V363-Q367 PolarHBondContact O-N 3.11Å; Y364-Q367 PolarHBondContact O-N 3.07Å; Q367-A370 PolarHBondContact O-N 2.89Å; Q367-M371 WeakPolarHBondContact O-CB 3.38Å; Q367-M371 PolarHBondContact O-N 2.89Å
368	W	90.3	Very high	88.6	Confident	146 Å²	146	70.9 Å²	70.9	55%	0.553	35%	0.345	S	S	*	.	H	α-helix	trans	-60.3	-48.8	173.1	176.8	-106.6	0	0	0	112	Y364 K365 Q366 M371 L372	Y364-W368 WeakPolarHBondContact O-CB 3.33Å; Y364-W368 PolarHBondContact O-N 2.62Å; K365-W368 PolarHBondContact O-N 2.82Å; Q366-W368 VanDerWaalsContact C-N 3.35Å; W368-M371 HydrophobicContact CE3-CE 3.7Å; W368-M371 HydrophobicContact CE3-SD 4.47Å; W368-M371 HydrophobicContact CH2-CE 3.83Å; W368-M371 HydrophobicContact CZ3-CE 3.32Å; W368-M371 HydrophobicContact CZ3-SD 4.3Å; W368-M371 PolarHBondContact O-N 2.56Å; W368-L372 HydrophobicContact CH2-CD2 4.42Å; W368-L372 HydrophobicContact CZ2-CD1 4.13Å; W368-L372 HydrophobicContact CZ2-CD2 4.02Å; W368-L372 HydrophobicContact CZ2-CG 4.26Å; W368-L372 WeakPolarHBondContact O-CG 3.45Å; W368-L372 PolarHBondContact O-N 3.16Å
369	F	88.9	Confident	87.7	Confident	98 Å²	98	66 Å²	66	43%	0.43	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-41.1	175.9	-76.4	-65.1	0	0	0	112.7	K365 Q366 M371 L372 R373	K365-F369 HydrophobicContact CD-CE2 4.44Å; K365-F369 HydrophobicContact CG-CD2 4.02Å; K365-F369 HydrophobicContact CG-CE2 3.79Å; K365-F369 WeakPolarHBondContact O-CD2 3.4Å; K365-F369 PolarHBondContact O-N 3.19Å; K365-F369 VanDerWaalsContact O-N 3.15Å; Q366-F369 PolarHBondContact O-N 3.24Å; F369-M371 VanDerWaalsContact C-N 3.29Å; F369-M371 PolarHBondContact O-N 3.24Å; F369-L372 HydrophobicContact CD1-CD1 4.49Å; F369-L372 PolarHBondContact O-N 3.32Å; F369-R373 WeakPolarHBondContact O-CG 3.29Å; F369-R373 PolarHBondContact O-N 3.42Å
370	A	87.6	Confident	87.2	Confident	6 Å²	6	66.9 Å²	66.9	5%	0.05	33%	0.331	C	S	.	.	H	α-helix	trans	-60.8	-37.6	175.7	0	0	0	0	0	112.4	Q366 Q367 A374 F416 I509	Q366-A370 WeakPolarHBondContact O-CB 3.32Å; Q366-A370 PolarHBondContact O-N 2.85Å; Q367-A370 PolarHBondContact O-N 2.89Å; A370-A374 WeakPolarHBondContact O-CB 3.44Å; A370-A374 PolarHBondContact O-N 3.41Å; A370-F416 HydrophobicContact CB-CD1 4.38Å; A370-F416 HydrophobicContact CB-CE1 3.64Å; A370-F416 HydrophobicContact CB-CZ 3.72Å; A370-I509 HydrophobicContact CB-CD1 4.1Å; A370-I509 WeakPolarHBondContact O-CD1 3.34Å
371	M	86.8	Confident	86.9	Confident	52 Å²	52	66.7 Å²	66.7	26%	0.256	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-45.4	172.9	-170.7	-156.8	73.9	0	0	112.1	Q367 W368 F369 A374 E375 F414 F416	Q367-M371 WeakPolarHBondContact O-CB 3.38Å; Q367-M371 PolarHBondContact O-N 2.89Å; W368-M371 HydrophobicContact CE3-CE 3.7Å; W368-M371 HydrophobicContact CE3-SD 4.47Å; W368-M371 HydrophobicContact CH2-CE 3.83Å; W368-M371 HydrophobicContact CZ3-CE 3.32Å; W368-M371 HydrophobicContact CZ3-SD 4.3Å; W368-M371 PolarHBondContact O-N 2.56Å; F369-M371 VanDerWaalsContact C-N 3.29Å; F369-M371 PolarHBondContact O-N 3.24Å; M371-A374 PolarHBondContact O-N 3.45Å; M371-E375 PolarHBondContact O-N 2.89Å; M371-F414 HydrophobicContact CG-CE1 4.34Å; M371-F416 HydrophobicContact CB-CD1 3.9Å; M371-F416 HydrophobicContact CB-CE1 4.29Å; M371-F416 HydrophobicContact CG-CD1 4.47Å
372	L	86.6	Confident	86.6	Confident	42 Å²	42	64.3 Å²	64.3	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-44.6	176.2	-68.9	179.8	0	0	0	111.7	W368 F369 A374 E375 Q376	W368-L372 HydrophobicContact CH2-CD2 4.42Å; W368-L372 HydrophobicContact CZ2-CD1 4.13Å; W368-L372 HydrophobicContact CZ2-CD2 4.02Å; W368-L372 HydrophobicContact CZ2-CG 4.26Å; W368-L372 WeakPolarHBondContact O-CG 3.45Å; W368-L372 PolarHBondContact O-N 3.16Å; F369-L372 HydrophobicContact CD1-CD1 4.49Å; F369-L372 PolarHBondContact O-N 3.32Å; L372-A374 PolarHBondContact O-N 3.25Å; L372-E375 PolarHBondContact O-N 2.98Å; L372-Q376 VanDerWaalsContact O-CB 3.26Å; L372-Q376 WeakPolarHBondContact O-CB 3.46Å; L372-Q376 WeakPolarHBondContact O-CG 3.27Å; L372-Q376 PolarHBondContact O-N 3.35Å
373	R	84.8	Confident	86.4	Confident	48 Å²	48	67.2 Å²	67.2	18%	0.181	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-44.9	176.2	-69.5	-162.5	-78	103.7	-0.2	112.3	F369 E375 Q376 D377 E379 E512	F369-R373 WeakPolarHBondContact O-CG 3.29Å; F369-R373 PolarHBondContact O-N 3.42Å; R373-E375 VanDerWaalsContact C-N 3.28Å; R373-E375 PolarHBondContact O-N 3.22Å; R373-Q376 PolarHBondContact O-N 2.94Å; R373-D377 WeakPolarHBondContact CB-OD2 3.13Å; R373-D377 VanDerWaalsContact CG-OD2 3.25Å; R373-D377 WeakPolarHBondContact CG-OD2 3.35Å; R373-D377 WeakPolarHBondContact O-CB 3.44Å; R373-D377 PolarHBondContact O-N 3.16Å; R373-E379 IonicContact NH1-OE2 2.67Å; R373-E379 PolarHBondContact NH1-OE2 2.66Å; R373-E379 VanDerWaalsContact NH1-OE2 3.13Å; R373-E512 IonicContact CZ-OE1 2.8Å; R373-E512 VanDerWaalsContact CZ-OE1 3.27Å; R373-E512 IonicContact NE-OE1 3.13Å; R373-E512 PolarHBondContact NE-OE1 2.94Å; R373-E512 IonicContact NH2-OE1 2.97Å; R373-E512 PolarHBondContact NH2-OE1 2.86Å
374	A	82.2	Confident	86.2	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.008	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-31.2	179.3	0	0	0	0	0	114	A370 M371 L372 F416 Q447 I509	A370-A374 WeakPolarHBondContact O-CB 3.44Å; A370-A374 PolarHBondContact O-N 3.41Å; M371-A374 PolarHBondContact O-N 3.45Å; L372-A374 PolarHBondContact O-N 3.25Å; A374-F416 HydrophobicContact CB-CB 3.71Å; A374-Q447 PolarHBondContact O-NE2 3.43Å; A374-I509 HydrophobicContact CB-CD1 3.83Å
375	E	80.4	Confident	85.8	Confident	96 Å²	96	74.8 Å²	74.8	45%	0.449	36%	0.36	S	S	.	.	H	α-helix	trans	-87.7	-33.8	177.1	-69	-61.1	131.6	0	0	113.1	M371 L372 R373	M371-E375 PolarHBondContact O-N 2.89Å; L372-E375 PolarHBondContact O-N 2.98Å; R373-E375 VanDerWaalsContact C-N 3.28Å; R373-E375 PolarHBondContact O-N 3.22Å
376	Q	84.2	Confident	85.6	Confident	138 Å²	138	71.4 Å²	71.4	65%	0.645	35%	0.349	S	S	*	.	H	α-helix	trans	-100	-43.7	-171	-62.5	179.2	-0.7	0	0	114.1	L372 R373 S378	L372-Q376 VanDerWaalsContact O-CB 3.26Å; L372-Q376 WeakPolarHBondContact O-CB 3.46Å; L372-Q376 WeakPolarHBondContact O-CG 3.27Å; L372-Q376 PolarHBondContact O-N 3.35Å; R373-Q376 PolarHBondContact O-N 2.94Å; Q376-S378 PolarHBondContact O-N 3.01Å
377	D	75.6	Confident	85.5	Confident	107 Å²	107	70.8 Å²	70.8	57%	0.572	35%	0.345	S	S	*	.	S	Bend	trans	-81.9	5.4	-170.8	-64.9	-26.2	0	0	0	113.3	R373 E379	R373-D377 WeakPolarHBondContact CB-OD2 3.13Å; R373-D377 VanDerWaalsContact CG-OD2 3.25Å; R373-D377 WeakPolarHBondContact CG-OD2 3.35Å; R373-D377 WeakPolarHBondContact O-CB 3.44Å; R373-D377 PolarHBondContact O-N 3.16Å; D377-E379 PolarHBondContact O-N 2.93Å; D377-E379 VanDerWaalsContact O-N 3.14Å
378	S	72.9	Confident	85.6	Confident	88 Å²	88	75.6 Å²	75.6	62%	0.615	37%	0.367	S	S	*	.			trans	52.6	30	-172.4	-57.5	0	0	0	0	113.2	Q376 V380	Q376-S378 PolarHBondContact O-N 3.01Å; S378-V380 PolarHBondContact O-N 2.91Å; S378-V380 VanDerWaalsContact O-N 3.09Å
379	E	77.1	Confident	85.4	Confident	34 Å²	34	70.2 Å²	70.2	16%	0.159	35%	0.348	C	S	.	.			trans	-66.5	112.7	-177.4	-161.2	-160.3	139.3	0	0	110	R373 D377 G381 Q447 S510	R373-E379 IonicContact NH1-OE2 2.67Å; R373-E379 PolarHBondContact NH1-OE2 2.66Å; R373-E379 VanDerWaalsContact NH1-OE2 3.13Å; D377-E379 PolarHBondContact O-N 2.93Å; D377-E379 VanDerWaalsContact O-N 3.14Å; E379-G381 PolarHBondContact O-N 3.03Å; E379-Q447 PolarHBondContact O-NE2 3.03Å; E379-Q447 PolarHBondContact O-OE1 3.02Å; E379-S510 WeakPolarHBondContact OE1-CB 3.47Å; E379-S510 PolarHBondContact OE1-N 2.65Å; E379-S510 PolarHBondContact OE1-OG 2.93Å
380	V	85.3	Confident	85.5	Confident	51 Å²	51	65.8 Å²	65.8	31%	0.309	33%	0.329	S	S	.	.			trans	-66.5	-29.3	179.2	-177.5	0	0	0	0	110.7	S378 R450 S451	S378-V380 PolarHBondContact O-N 2.91Å; S378-V380 VanDerWaalsContact O-N 3.09Å; V380-R450 CarbonylContact O-C 3.54Å; V380-R450 VanDerWaalsContact O-CA 3.26Å; V380-R450 WeakPolarHBondContact O-CA 3.28Å; V380-R450 WeakPolarHBondContact O-CD 3.47Å; V380-R450 PolarHBondContact O-NE 3.26Å; V380-R450 VanDerWaalsContact O-NE 3.15Å; V380-S451 WeakPolarHBondContact CG1-OG 3.47Å; V380-S451 PolarHBondContact O-N 3.06Å
381	G	87.9	Confident	85.7	Confident	3 Å²	3	67.7 Å²	67.7	3%	0.031	34%	0.337	C	S	.	.			trans	112.8	-171.2	-172.2	0	0	0	0	0	111.5	E379 Q383	E379-G381 PolarHBondContact O-N 3.03Å; G381-Q383 PolarHBondContact O-N 3.48Å; G381-Q383 PolarHBondContact O-NE2 3.2Å
382	P	90.1	Very high	85.9	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.019	34%	0.344	C	S	.	.			trans	-57.2	130.4	-174.3	-27.5	36	0	0	0	113.7	S451 A453 L507	P382-S451 VanDerWaalsContact O-CB 3.27Å; P382-S451 WeakPolarHBondContact O-CB 3.33Å; P382-A453 HydrophobicContact CB-CB 3.87Å; P382-A453 HydrophobicContact CG-CB 4.25Å; P382-L507 HydrophobicContact CG-CB 4.35Å; P382-L507 HydrophobicContact CG-CD2 3.97Å; P382-L507 HydrophobicContact CG-CG 3.97Å
383	Q	89	Confident	86	Confident	119 Å²	119	68.9 Å²	68.9	56%	0.556	35%	0.353	S	S	*	.			trans	-109.1	-20.7	179.4	-58.3	-55.5	-60.2	0	0	113.6	G381 S451 I477	G381-Q383 PolarHBondContact O-N 3.48Å; G381-Q383 PolarHBondContact O-NE2 3.2Å; Q383-S451 PolarHBondContact NE2-OG 3.1Å; Q383-I477 WeakPolarHBondContact O-CD1 3.49Å
384	E	89.5	Confident	86.4	Confident	170 Å²	170	66.6 Å²	66.6	79%	0.794	35%	0.345	S	S	*	.	S	Bend	trans	-125.6	147.5	179	-67.9	179.3	-172	0	0	110.6	N386 I477	E384-N386 PolarHBondContact O-N 2.98Å; E384-N386 VanDerWaalsContact O-N 3.15Å; E384-I477 VanDerWaalsContact C-CD1 3.47Å
385	I	87.5	Confident	86.9	Confident	88 Å²	88	66.7 Å²	66.7	45%	0.451	35%	0.345	S	S	.	.			trans	-83.8	93.2	179.7	-61.8	174	0	0	0	109	Y475 I477	I385-Y475 WeakPolarHBondContact CD1-O 3.45Å; I385-Y475 HydrophobicContact CG2-CG 4.39Å; I385-I477 HydrophobicContact CG1-CD1 3.79Å; I385-I477 HydrophobicContact CG1-CG1 3.82Å
386	N	88.6	Confident	87.6	Confident	69 Å²	69	62.1 Å²	62.1	37%	0.369	32%	0.324	S	S	.	.			trans	-86.7	107.9	163.1	-174.9	-18.5	0	0	0	109.1	E384 E388 E389 L390	E384-N386 PolarHBondContact O-N 2.98Å; E384-N386 VanDerWaalsContact O-N 3.15Å; N386-E388 PolarHBondContact OD1-N 3.41Å; N386-E389 HydrophobicContact CB-CB 3.74Å; N386-E389 HydrophobicContact CB-CG 4.46Å; N386-E389 WeakPolarHBondContact CB-OE2 3.43Å; N386-E389 WeakPolarHBondContact ND2-CB 3.41Å; N386-E389 PolarHBondContact ND2-OE2 2.98Å; N386-E389 WeakPolarHBondContact OD1-CB 3.48Å; N386-E389 PolarHBondContact OD1-N 2.99Å; N386-E389 VanDerWaalsContact OD1-N 3.15Å; N386-L390 WeakPolarHBondContact O-CB 3.4Å; N386-L390 PolarHBondContact O-N 3.42Å
387	K	90.6	Very high	88.1	Confident	95 Å²	95	55.6 Å²	55.6	41%	0.413	29%	0.293	S	S	.	.	H	α-helix	trans	-69.7	-47.4	-174.5	179.2	-170	165.6	-158.7	0	111.1	E389 L390 E391 Y475	K387-E389 VanDerWaalsContact C-N 3.27Å; K387-E389 PolarHBondContact O-N 3.48Å; K387-L390 PolarHBondContact O-N 3.34Å; K387-E391 WeakPolarHBondContact CE-OE1 3.3Å; K387-E391 HydrophobicContact CG-CG 4.32Å; K387-E391 IonicContact NZ-OE1 3.27Å; K387-E391 VanDerWaalsContact O-CB 3.3Å; K387-E391 WeakPolarHBondContact O-CB 3.48Å; K387-E391 VanDerWaalsContact O-CG 3.31Å; K387-E391 WeakPolarHBondContact O-CG 3.35Å; K387-E391 PolarHBondContact O-N 2.85Å; K387-Y475 HydrophobicContact CD-CE2 4.23Å; K387-Y475 HydrophobicContact CG-CD2 4.36Å; K387-Y475 HydrophobicContact CG-CE1 4.39Å; K387-Y475 HydrophobicContact CG-CE2 3.94Å
388	E	90.8	Very high	89	Confident	133 Å²	133	50.5 Å²	50.5	62%	0.621	27%	0.267	S	S	*	.	H	α-helix	trans	-61.4	-40.5	-177.5	-69.4	60.2	-136.3	0	0	110.5	N386 G392	N386-E388 PolarHBondContact OD1-N 3.41Å; E388-G392 PolarHBondContact O-N 3.24Å
389	E	87.6	Confident	90.1	Very high	34 Å²	34	51.4 Å²	51.4	16%	0.159	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-46.9	175.4	179.2	-168.2	125.2	0	0	112.8	N386 K387 E391 G392 N393 L507 P511	N386-E389 HydrophobicContact CB-CB 3.74Å; N386-E389 HydrophobicContact CB-CG 4.46Å; N386-E389 WeakPolarHBondContact CB-OE2 3.43Å; N386-E389 WeakPolarHBondContact ND2-CB 3.41Å; N386-E389 PolarHBondContact ND2-OE2 2.98Å; N386-E389 WeakPolarHBondContact OD1-CB 3.48Å; N386-E389 PolarHBondContact OD1-N 2.99Å; N386-E389 VanDerWaalsContact OD1-N 3.15Å; K387-E389 VanDerWaalsContact C-N 3.27Å; K387-E389 PolarHBondContact O-N 3.48Å; E389-E391 VanDerWaalsContact C-N 3.33Å; E389-G392 PolarHBondContact O-N 2.85Å; E389-N393 WeakPolarHBondContact O-CA 3.41Å; E389-N393 VanDerWaalsContact O-CB 3.3Å; E389-N393 WeakPolarHBondContact O-CB 3.31Å; E389-N393 PolarHBondContact O-N 3.48Å; E389-L507 HydrophobicContact CG-CD2 4.14Å; E389-L507 WeakPolarHBondContact OE1-CD2 3.43Å; E389-P511 HydrophobicContact CG-CG 3.93Å; E389-P511 WeakPolarHBondContact OE1-CD 3.19Å; E389-P511 VanDerWaalsContact OE2-CG 3.31Å; E389-P511 WeakPolarHBondContact OE2-CG 3.3Å
390	L	90.1	Very high	91	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-41.7	176.1	-163.7	151.8	0	0	0	110.5	N386 K387 S394 A453 R455 Y475 N505	N386-L390 WeakPolarHBondContact O-CB 3.4Å; N386-L390 PolarHBondContact O-N 3.42Å; K387-L390 PolarHBondContact O-N 3.34Å; L390-S394 WeakPolarHBondContact O-CB 3.48Å; L390-S394 PolarHBondContact O-N 2.93Å; L390-S394 VanDerWaalsContact O-N 3.12Å; L390-S394 PolarHBondContact O-OG 3.4Å; L390-A453 HydrophobicContact CD1-CB 3.63Å; L390-R455 HydrophobicContact CD2-CB 4.46Å; L390-Y475 HydrophobicContact CD1-CD1 4.24Å; L390-Y475 HydrophobicContact CD2-CD1 3.97Å; L390-Y475 HydrophobicContact CD2-CE1 3.86Å; L390-Y475 HydrophobicContact CG-CD1 4.49Å; L390-N505 HydrophobicContact CD2-CB 3.77Å
391	E	92.3	Very high	91.4	Very high	47 Å²	47	52.2 Å²	52.2	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-42.1	177.5	-75.1	-164.5	-162.2	0	0	112.4	S264 R335 K387 E389 Y475	S264-E391 WeakPolarHBondContact CB-O 3.43Å; S264-E391 WeakPolarHBondContact OG-CG 3.25Å; S264-E391 PolarHBondContact OG-OE2 2.81Å; R335-E391 PolarHBondContact NH1-O 3.27Å; R335-E391 PolarHBondContact NH2-O 2.95Å; K387-E391 WeakPolarHBondContact CE-OE1 3.3Å; K387-E391 HydrophobicContact CG-CG 4.32Å; K387-E391 IonicContact NZ-OE1 3.27Å; K387-E391 VanDerWaalsContact O-CB 3.3Å; K387-E391 WeakPolarHBondContact O-CB 3.48Å; K387-E391 VanDerWaalsContact O-CG 3.31Å; K387-E391 WeakPolarHBondContact O-CG 3.35Å; K387-E391 PolarHBondContact O-N 2.85Å; E389-E391 VanDerWaalsContact C-N 3.33Å; E391-Y475 VanDerWaalsContact CD-OH 3.27Å; E391-Y475 HydrophobicContact CG-CE1 4.1Å; E391-Y475 WeakPolarHBondContact CG-OH 3.43Å; E391-Y475 PolarHBondContact OE1-OH 2.83Å
392	G	90.7	Very high	91.8	Very high	40 Å²	40	55.4 Å²	55.4	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-74.6	-46.2	178.3	0	0	0	0	0	114.3	R335 E388 E389	R335-G392 VanDerWaalsContact CZ-O 3.22Å; R335-G392 PolarHBondContact NE-O 3.32Å; R335-G392 PolarHBondContact NH2-O 3.46Å; E388-G392 PolarHBondContact O-N 3.24Å; E389-G392 PolarHBondContact O-N 2.85Å
393	N	89.2	Confident	92	Very high	78 Å²	78	62.1 Å²	62.1	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-109.4	-4.7	-162.8	-61.4	-51.3	0	0	0	115.3	Y338 E389	Y338-N393 WeakPolarHBondContact CE2-O 3.26Å; Y338-N393 PolarHBondContact OH-O 3.3Å; E389-N393 WeakPolarHBondContact O-CA 3.41Å; E389-N393 VanDerWaalsContact O-CB 3.3Å; E389-N393 WeakPolarHBondContact O-CB 3.31Å; E389-N393 PolarHBondContact O-N 3.48Å
394	S	92.7	Very high	92.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.299	C	S	.	.			trans	-65.8	151.1	-177.2	50.3	0	0	0	0	115.1	R335 Y338 L390 N505 F506	R335-S394 WeakPolarHBondContact CD-O 3.47Å; R335-S394 PolarHBondContact NH1-O 3.14Å; R335-S394 PolarHBondContact NH1-OG 3.16Å; Y338-S394 WeakPolarHBondContact CE2-O 3.39Å; L390-S394 WeakPolarHBondContact O-CB 3.48Å; L390-S394 PolarHBondContact O-N 2.93Å; L390-S394 VanDerWaalsContact O-N 3.12Å; L390-S394 PolarHBondContact O-OG 3.4Å; S394-N505 PolarHBondContact OG-ND2 2.91Å; S394-F506 CarbonylContact C-O 3.6Å; S394-F506 WeakPolarHBondContact CA-O 3.47Å; S394-F506 WeakPolarHBondContact CB-O 3.44Å
395	M	92.4	Very high	92.3	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.02	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	135.9	161.2	-171.4	174.8	75.5	0	0	109.2	Y338 C397 W411 N505 F506 Y508	Y338-M395 HydrophobicContact CD1-CB 3.6Å; Y338-M395 HydrophobicContact CD1-CG 3.78Å; Y338-M395 HydrophobicContact CD1-SD 4.14Å; Y338-M395 VanDerWaalsContact CD2-CA 3.49Å; Y338-M395 HydrophobicContact CD2-CB 3.97Å; Y338-M395 HydrophobicContact CD2-CG 4.3Å; Y338-M395 HydrophobicContact CE1-CB 3.67Å; Y338-M395 HydrophobicContact CE1-CG 4.36Å; Y338-M395 VanDerWaalsContact CE2-CA 3.45Å; Y338-M395 HydrophobicContact CE2-CB 4.02Å; Y338-M395 HydrophobicContact CG-CB 3.76Å; Y338-M395 HydrophobicContact CG-CG 3.75Å; Y338-M395 VanDerWaalsContact CZ-N 3.27Å; Y338-M395 PolarHBondContact OH-N 3.2Å; M395-C397 HydrophobicContact CE-CB 4.06Å; M395-W411 HydrophobicContact CE-CB 4.04Å; M395-N505 CarbonylContact O-C 3.6Å; M395-N505 VanDerWaalsContact O-CA 3.28Å; M395-N505 WeakPolarHBondContact O-CA 3.31Å; M395-F506 HydrophobicContact CB-CB 4.38Å; M395-F506 HydrophobicContact CE-CD2 4.08Å; M395-F506 PolarHBondContact N-O 3.14Å; M395-F506 PolarHBondContact O-N 2.79Å; M395-Y508 HydrophobicContact CB-CE2 4.28Å; M395-Y508 HydrophobicContact CE-CE2 3.98Å; M395-Y508 WeakPolarHBondContact CE-OH 3.45Å; M395-Y508 HydrophobicContact SD-CE2 4.24Å
396	R	95	Very high	92.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.7	173.3	-58.4	-178	-74.3	-161.6	-7.4	109.5	I261 S263 V268 V271 E272 I275 H333	I261-R396 PolarHBondContact O-NH1 2.61Å; I261-R396 PolarHBondContact O-NH2 3.24Å; S263-R396 PolarHBondContact O-NH1 2.89Å; V268-R396 HydrophobicContact CB-CB 4.08Å; V268-R396 HydrophobicContact CG1-CB 4.34Å; V268-R396 HydrophobicContact CG2-CB 3.77Å; V271-R396 CarbonylContact C-O 3.58Å; E272-R396 PolarHBondContact N-O 3.28Å; E272-R396 IonicContact OE1-CZ 2.75Å; E272-R396 IonicContact OE1-NE 3.92Å; E272-R396 IonicContact OE1-NH2 3.65Å; E272-R396 PolarHBondContact OE1-NH2 3.29Å; E272-R396 IonicContact OE2-CZ 3.4Å; E272-R396 IonicContact OE2-NE 2.69Å; E272-R396 PolarHBondContact OE2-NE 2.6Å; E272-R396 IonicContact OE2-NH2 3.23Å; E272-R396 PolarHBondContact OE2-NH2 2.78Å; I275-R396 HydrophobicContact CD1-CB 4.48Å; H333-R396 PolarHBondContact O-NH2 3.01Å
397	C	94.4	Very high	93.1	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	167.6	-175.5	62	0	0	0	0	110.7	Q270 M395 W411 C503 C504 F506	Q270-C397 WeakPolarHBondContact O-CA 3.27Å; Q270-C397 WeakPolarHBondContact O-CB 3.39Å; M395-C397 HydrophobicContact CE-CB 4.06Å; C397-W411 HydrophobicContact CB-CB 4.49Å; C397-W411 HydrophobicContact CB-CD2 4.1Å; C397-W411 HydrophobicContact CB-CG 3.86Å; C397-C503 CarbonylContact O-C 3.56Å; C397-C503 WeakPolarHBondContact O-CA 3.49Å; C397-C504 PolarHBondContact N-O 3.35Å; C397-C504 VanDerWaalsContact N-O 3.07Å; C397-C504 PolarHBondContact O-N 3.19Å; C397-C504 PolarHBondContact SG-O 3.49Å; C397-C504 VanDerWaalsContact SG-O 3.4Å; C397-F506 VanDerWaalsContact SG-CD2 3.59Å; C397-F506 VanDerWaalsContact SG-CE2 3.59Å
398	G	95.3	Very high	93.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	-171.2	-179.5	0	0	0	0	0	115.5	V268 M269 Q270 W411 I502	V268-G398 WeakPolarHBondContact O-CA 3.32Å; M269-G398 CarbonylContact O-C 3.51Å; Q270-G398 PolarHBondContact O-N 3.33Å; G398-W411 PolarHBondContact O-NE1 3.44Å; G398-I502 CarbonylContact C-O 3.57Å; G398-I502 WeakPolarHBondContact CA-O 3.39Å
399	R	95.6	Very high	93.5	Very high	106 Å²	106	49 Å²	49	40%	0.4	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	143.4	173.9	-160.5	69.3	178	177.4	-2.2	110.1	M269 L401 W409 I502	M269-R399 PolarHBondContact O-N 3.18Å; R399-L401 HydrophobicContact CG-CD2 3.89Å; R399-W409 HydrophobicContact CB-CD2 4.41Å; R399-W409 HydrophobicContact CB-CH2 4.46Å; R399-W409 HydrophobicContact CB-CZ2 3.84Å; R399-W409 HydrophobicContact CG-CD2 4.02Å; R399-W409 HydrophobicContact CG-CE3 4.36Å; R399-W409 HydrophobicContact CG-CG 4.42Å; R399-W409 HydrophobicContact CG-CZ2 4.23Å; R399-I502 HydrophobicContact CB-CB 4.48Å; R399-I502 PolarHBondContact N-O 3.29Å; R399-I502 PolarHBondContact O-N 3.19Å
400	K	95.6	Very high	93.6	Very high	103 Å²	103	52.4 Å²	52.4	45%	0.448	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.9	164.6	-178.2	178.5	-176.6	162.1	0	109.2	M269 P499 Y501	M269-K400 HydrophobicContact SD-CB 4.37Å; K400-P499 HydrophobicContact CD-CB 4.46Å; K400-P499 VanDerWaalsContact CE-CB 3.43Å; K400-P499 HydrophobicContact CG-CB 4.21Å; K400-Y501 HydrophobicContact CB-CD1 4.22Å; K400-Y501 HydrophobicContact CB-CE1 4.28Å; K400-Y501 HydrophobicContact CD-CD1 4.31Å; K400-Y501 HydrophobicContact CD-CE1 3.57Å; K400-Y501 WeakPolarHBondContact CE-OH 3.36Å; K400-Y501 HydrophobicContact CG-CD1 4.07Å; K400-Y501 HydrophobicContact CG-CE1 3.81Å; K400-Y501 PolarHBondContact NZ-OH 3.22Å
401	L	95.4	Very high	93.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.9	169	-49.8	-170.3	0	0	0	108	R399 Y407 W409 Y424 F498 P499 L500 I502	R399-L401 HydrophobicContact CG-CD2 3.89Å; L401-Y407 HydrophobicContact CB-CD2 4.46Å; L401-Y407 HydrophobicContact CB-CE2 4.11Å; L401-Y407 HydrophobicContact CD1-CD2 4.04Å; L401-Y407 HydrophobicContact CD1-CE2 4.4Å; L401-Y407 HydrophobicContact CD2-CD1 3.93Å; L401-Y407 HydrophobicContact CD2-CD2 3.9Å; L401-Y407 HydrophobicContact CD2-CE1 4.32Å; L401-Y407 HydrophobicContact CD2-CE2 4.29Å; L401-Y407 HydrophobicContact CD2-CG 3.7Å; L401-Y407 HydrophobicContact CG-CD2 4.35Å; L401-Y407 HydrophobicContact CG-CE2 4.5Å; L401-W409 HydrophobicContact CD2-CZ3 4.26Å; L401-Y424 HydrophobicContact CD1-CD1 3.88Å; L401-Y424 HydrophobicContact CD1-CD2 3.85Å; L401-Y424 HydrophobicContact CD1-CE1 4.38Å; L401-Y424 HydrophobicContact CD1-CE2 4.34Å; L401-Y424 HydrophobicContact CD1-CG 3.59Å; L401-F498 HydrophobicContact CB-CD1 4.42Å; L401-F498 HydrophobicContact CB-CE1 4.09Å; L401-P499 CarbonylContact O-C 3.6Å; L401-P499 VanDerWaalsContact O-CA 3.25Å; L401-P499 WeakPolarHBondContact O-CA 3.47Å; L401-P499 WeakPolarHBondContact O-CB 3.35Å; L401-L500 HydrophobicContact CB-CB 4.34Å; L401-L500 PolarHBondContact N-O 3.42Å; L401-L500 PolarHBondContact O-N 3.19Å; L401-I502 HydrophobicContact CD1-CD1 3.76Å; L401-I502 HydrophobicContact CD2-CD1 4.46Å; L401-I502 HydrophobicContact CG-CD1 3.92Å
402	A	94.8	Very high	92.1	Very high	70 Å²	70	54.7 Å²	54.7	58%	0.579	29%	0.291	S	S	*	.			trans	-77.6	-28.2	-172.8	0	0	0	0	0	113.4
403	K	94.4	Very high	90.8	Very high	143 Å²	143	54 Å²	54	62%	0.622	28%	0.283	S	S	*	.	S	Bend	trans	-154.6	172.4	-178.2	56.6	173.3	-178.4	175.4	0	109.5	Y407 F498	K403-Y407 VanDerWaalsContact O-CE2 3.31Å; K403-Y407 WeakPolarHBondContact O-CE2 3.5Å; K403-Y407 PolarHBondContact O-OH 3.17Å; K403-F498 VanDerWaalsContact CA-CD1 3.5Å; K403-F498 WeakPolarHBondContact O-CD1 3.4Å; K403-F498 WeakPolarHBondContact O-CE1 3.31Å
404	D	93.4	Very high	89.5	Confident	59 Å²	59	54.5 Å²	54.5	32%	0.316	28%	0.282	S	S	.	.	S	Bend	trans	-68.1	153.8	168.4	-157	10.9	0	0	0	110.8	Y424 R427 F498	D404-Y424 VanDerWaalsContact OD1-CE1 3.32Å; D404-Y424 WeakPolarHBondContact OD1-CE1 3.5Å; D404-Y424 PolarHBondContact OD1-OH 2.99Å; D404-R427 IonicContact OD2-CZ 2.87Å; D404-R427 VanDerWaalsContact OD2-CZ 3.23Å; D404-R427 IonicContact OD2-NE 3.56Å; D404-R427 PolarHBondContact OD2-NE 3.21Å; D404-R427 VanDerWaalsContact OD2-NE 3.15Å; D404-R427 IonicContact OD2-NH2 3.7Å; D404-R427 PolarHBondContact OD2-NH2 3.33Å; D404-F498 HydrophobicContact CB-CD2 4.4Å; D404-F498 HydrophobicContact CB-CE2 3.71Å; D404-F498 HydrophobicContact CB-CZ 3.85Å
405	G	92.6	Very high	88.8	Confident	34 Å²	34	54.6 Å²	54.6	35%	0.351	28%	0.283	S	S	.	.	S	Bend	trans	147	-161.6	-174.1	0	0	0	0	0	112.5	Y424	G405-Y424 WeakPolarHBondContact O-CD1 3.38Å; G405-Y424 WeakPolarHBondContact O-CE1 3.38Å
406	E	95.6	Very high	88.3	Confident	152 Å²	152	55.2 Å²	55.2	71%	0.71	29%	0.285	S	S	*	.			trans	-104.6	133.4	177.6	-58.4	-161	124	0	0	111.4	Y424 T425	E406-Y424 WeakPolarHBondContact CA-O 3.29Å; E406-T425 PolarHBondContact OE1-OG1 2.9Å
407	Y	97.1	Very high	87.7	Confident	56 Å²	56	55.2 Å²	55.2	22%	0.22	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	129.5	177.3	-63.5	-92.4	0	0	0	109.4	L401 K403 T423 Y424	L401-Y407 HydrophobicContact CB-CD2 4.46Å; L401-Y407 HydrophobicContact CB-CE2 4.11Å; L401-Y407 HydrophobicContact CD1-CD2 4.04Å; L401-Y407 HydrophobicContact CD1-CE2 4.4Å; L401-Y407 HydrophobicContact CD2-CD1 3.93Å; L401-Y407 HydrophobicContact CD2-CD2 3.9Å; L401-Y407 HydrophobicContact CD2-CE1 4.32Å; L401-Y407 HydrophobicContact CD2-CE2 4.29Å; L401-Y407 HydrophobicContact CD2-CG 3.7Å; L401-Y407 HydrophobicContact CG-CD2 4.35Å; L401-Y407 HydrophobicContact CG-CE2 4.5Å; K403-Y407 VanDerWaalsContact O-CE2 3.31Å; K403-Y407 WeakPolarHBondContact O-CE2 3.5Å; K403-Y407 PolarHBondContact O-OH 3.17Å; Y407-T423 CarbonylContact O-C 3.56Å; Y407-T423 WeakPolarHBondContact O-CA 3.27Å; Y407-Y424 AromaticContact CD2-CD1 3.94Å; Y407-Y424 HydrophobicContact CD2-CD1 3.94Å; Y407-Y424 PolarHBondContact N-O 3.46Å; Y407-Y424 PolarHBondContact O-N 3.45Å
408	C	95.4	Very high	87.3	Confident	84 Å²	84	55.3 Å²	55.3	57%	0.568	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.6	167.5	-179.4	0	0	0	0	108.6	V422	C408-V422 WeakPolarHBondContact CA-O 3.5Å
409	W	94.1	Very high	87	Confident	15 Å²	15	56 Å²	56	6%	0.057	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	166.1	176.9	70.9	96.1	0	0	0	111.7	R399 L401 W411 V422 I502	R399-W409 HydrophobicContact CB-CD2 4.41Å; R399-W409 HydrophobicContact CB-CH2 4.46Å; R399-W409 HydrophobicContact CB-CZ2 3.84Å; R399-W409 HydrophobicContact CG-CD2 4.02Å; R399-W409 HydrophobicContact CG-CE3 4.36Å; R399-W409 HydrophobicContact CG-CG 4.42Å; R399-W409 HydrophobicContact CG-CZ2 4.23Å; L401-W409 HydrophobicContact CD2-CZ3 4.26Å; W409-W411 AromaticContact CD1-NE1 3.84Å; W409-W411 HydrophobicContact CZ2-CH2 4.24Å; W409-W411 HydrophobicContact CZ2-CZ2 4.06Å; W409-W411 AromaticContact NE1-CD2 3.82Å; W409-W411 AromaticContact NE1-CE2 3.24Å; W409-W411 AromaticContact NE1-CH2 4Å; W409-W411 AromaticContact NE1-CZ2 3.36Å; W409-W411 AromaticContact NE1-NE1 3.43Å; W409-V422 HydrophobicContact CD2-CB 4.1Å; W409-V422 HydrophobicContact CD2-CG1 4.42Å; W409-V422 HydrophobicContact CH2-CB 4.31Å; W409-V422 HydrophobicContact CH2-CG1 3.58Å; W409-V422 HydrophobicContact CZ2-CB 3.87Å; W409-V422 HydrophobicContact CZ2-CG1 3.36Å; W409-V422 HydrophobicContact CZ3-CG1 4.19Å; W409-V422 PolarHBondContact N-O 3.23Å; W409-V422 PolarHBondContact O-N 2.8Å; W409-I502 HydrophobicContact CH2-CD1 3.82Å; W409-I502 HydrophobicContact CZ2-CD1 4.26Å
410	R	88.9	Confident	86.7	Confident	105 Å²	105	51 Å²	51	40%	0.396	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.6	174.3	-178	178.3	-78.9	127.8	-9.4	108.3	T412 D419 L421 N434	R410-T412 HydrophobicContact CB-CG2 4.45Å; R410-T412 HydrophobicContact CG-CG2 4.06Å; R410-D419 VanDerWaalsContact CD-OD1 3.31Å; R410-D419 WeakPolarHBondContact CD-OD1 3.11Å; R410-D419 IonicContact CZ-OD1 3.82Å; R410-D419 IonicContact CZ-OD2 2.93Å; R410-D419 VanDerWaalsContact NE-CG 3.32Å; R410-D419 IonicContact NE-OD1 2.82Å; R410-D419 PolarHBondContact NE-OD1 3.16Å; R410-D419 IonicContact NE-OD2 3.21Å; R410-D419 PolarHBondContact NE-OD2 2.96Å; R410-D419 IonicContact NH2-OD1 3.18Å; R410-D419 IonicContact NH2-OD2 3.15Å; R410-D419 PolarHBondContact NH2-OD2 3.02Å; R410-L421 HydrophobicContact CB-CD2 3.89Å; R410-L421 HydrophobicContact CG-CD2 4.41Å; R410-N434 PolarHBondContact NH2-ND2 3.33Å
411	W	83.8	Confident	86.6	Confident	9 Å²	9	47.5 Å²	47.5	3%	0.034	26%	0.257	C	S	.	.			trans	-89.9	103.5	160.6	-71.1	-53.1	0	0	0	107.7	M395 C397 G398 W409 L420 V422 F431 C504 F506	M395-W411 HydrophobicContact CE-CB 4.04Å; C397-W411 HydrophobicContact CB-CB 4.49Å; C397-W411 HydrophobicContact CB-CD2 4.1Å; C397-W411 HydrophobicContact CB-CG 3.86Å; G398-W411 PolarHBondContact O-NE1 3.44Å; W409-W411 AromaticContact CD1-NE1 3.84Å; W409-W411 HydrophobicContact CZ2-CH2 4.24Å; W409-W411 HydrophobicContact CZ2-CZ2 4.06Å; W409-W411 AromaticContact NE1-CD2 3.82Å; W409-W411 AromaticContact NE1-CE2 3.24Å; W409-W411 AromaticContact NE1-CH2 4Å; W409-W411 AromaticContact NE1-CZ2 3.36Å; W409-W411 AromaticContact NE1-NE1 3.43Å; W411-L420 HydrophobicContact CE3-CD2 4.27Å; W411-V422 HydrophobicContact CD2-CG2 4.43Å; W411-V422 HydrophobicContact CE3-CG2 3.59Å; W411-V422 HydrophobicContact CH2-CG1 4.5Å; W411-V422 HydrophobicContact CH2-CG2 4.12Å; W411-V422 HydrophobicContact CZ3-CB 4.45Å; W411-V422 HydrophobicContact CZ3-CG1 4.49Å; W411-V422 HydrophobicContact CZ3-CG2 3.41Å; W411-V422 VanDerWaalsContact CZ3-CG2 3.41Å; W411-F431 HydrophobicContact CZ3-CE1 4.25Å; W411-F431 HydrophobicContact CZ3-CZ 4.38Å; W411-C504 HydrophobicContact CH2-CB 3.79Å; W411-C504 HydrophobicContact CZ2-CB 4.43Å; W411-C504 HydrophobicContact CZ3-CB 4.09Å; W411-F506 HydrophobicContact CD2-CE2 4.34Å; W411-F506 HydrophobicContact CE3-CD2 4.42Å; W411-F506 AromaticContact CE3-CE2 3.39Å; W411-F506 HydrophobicContact CE3-CE2 3.39Å; W411-F506 AromaticContact CE3-CZ 3.88Å; W411-F506 HydrophobicContact CE3-CZ 3.88Å; W411-F506 HydrophobicContact CH2-CE2 4.21Å; W411-F506 AromaticContact CZ3-CE2 3.3Å; W411-F506 HydrophobicContact CZ3-CE2 3.3Å; W411-F506 AromaticContact CZ3-CZ 3.5Å; W411-F506 HydrophobicContact CZ3-CZ 3.5Å
412	T	67.1	Low	86.6	Confident	89 Å²	89	47.5 Å²	47.5	55%	0.546	26%	0.257	S	S	.	.			trans	-75.8	157.7	-170.9	46.9	0	0	0	0	112.7	R410	R410-T412 HydrophobicContact CB-CG2 4.45Å; R410-T412 HydrophobicContact CG-CG2 4.06Å
413	G	63.8	Low	86.7	Confident	25 Å²	25	45.8 Å²	45.8	26%	0.258	24%	0.239	S	C	.	.	S	Bend	trans	130.5	128.7	-167.7	0	0	0	0	0	107.1	N415	G413-N415 PolarHBondContact O-N 3.49Å; G413-N415 PolarHBondContact O-ND2 3.2Å
414	F	62.7	Low	86.8	Confident	89 Å²	89	39 Å²	39	39%	0.39	21%	0.209	S	C	.	.			trans	-72.4	82	171.8	-178.6	-86	0	0	0	106.7	M371 F416 G442 S443	M371-F414 HydrophobicContact CG-CE1 4.34Å; F414-F416 PolarHBondContact O-N 2.99Å; F414-G442 WeakPolarHBondContact CE2-O 3.38Å; F414-G442 WeakPolarHBondContact CZ-O 3.34Å; F414-S443 WeakPolarHBondContact CD2-O 3.28Å; F414-S443 VanDerWaalsContact CE2-C 3.49Å; F414-S443 VanDerWaalsContact CE2-O 3.3Å; F414-S443 WeakPolarHBondContact CE2-O 3.33Å
415	N	76.7	Confident	86.9	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	20%	0.2	C	C	.	.			trans	-76.2	58.5	-176	-68.8	-54.4	0	0	0	110.2	G413 G417 F418 Y508	G413-N415 PolarHBondContact O-N 3.49Å; G413-N415 PolarHBondContact O-ND2 3.2Å; N415-G417 VanDerWaalsContact C-N 3.31Å; N415-G417 PolarHBondContact O-N 3.03Å; N415-F418 HydrophobicContact CB-CB 4.36Å; N415-F418 WeakPolarHBondContact O-CB 3.45Å; N415-F418 PolarHBondContact O-N 3.1Å; N415-Y508 HydrophobicContact CB-CD1 4.17Å; N415-Y508 HydrophobicContact CB-CD2 3.89Å; N415-Y508 HydrophobicContact CB-CE1 4.31Å; N415-Y508 HydrophobicContact CB-CE2 4.02Å; N415-Y508 HydrophobicContact CB-CG 3.98Å
416	F	82.8	Confident	86.8	Confident	16 Å²	16	41.6 Å²	41.6	7%	0.07	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	52.3	-176.6	-40.3	-77.1	0	0	0	111.1	A370 M371 A374 F414 F418 R450 I509	A370-F416 HydrophobicContact CB-CD1 4.38Å; A370-F416 HydrophobicContact CB-CE1 3.64Å; A370-F416 HydrophobicContact CB-CZ 3.72Å; M371-F416 HydrophobicContact CB-CD1 3.9Å; M371-F416 HydrophobicContact CB-CE1 4.29Å; M371-F416 HydrophobicContact CG-CD1 4.47Å; A374-F416 HydrophobicContact CB-CB 3.71Å; F414-F416 PolarHBondContact O-N 2.99Å; F416-F418 VanDerWaalsContact C-N 3.28Å; F416-F418 PolarHBondContact O-N 2.65Å; F416-R450 PolarHBondContact O-NH1 3.03Å; F416-I509 HydrophobicContact CB-CD1 3.74Å; F416-I509 HydrophobicContact CB-CG1 4.44Å; F416-I509 HydrophobicContact CD1-CD1 3.93Å; F416-I509 HydrophobicContact CD2-CD1 3.2Å; F416-I509 HydrophobicContact CD2-CG1 3.72Å; F416-I509 HydrophobicContact CE1-CD1 4.28Å; F416-I509 HydrophobicContact CE2-CD1 3.62Å; F416-I509 HydrophobicContact CE2-CG1 4.2Å; F416-I509 HydrophobicContact CG-CD1 3.33Å; F416-I509 HydrophobicContact CG-CG1 4.23Å; F416-I509 HydrophobicContact CZ-CD1 4.11Å
417	G	82.7	Confident	86.6	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	8.7	-176.6	0	0	0	0	0	116.3	N415 D419 V444 S445	N415-G417 VanDerWaalsContact C-N 3.31Å; N415-G417 PolarHBondContact O-N 3.03Å; G417-D419 PolarHBondContact O-N 3.08Å; G417-V444 CarbonylContact O-C 3.53Å; G417-V444 VanDerWaalsContact O-CA 3.28Å; G417-V444 WeakPolarHBondContact O-CA 3.13Å; G417-S445 VanDerWaalsContact CA-N 3.31Å; G417-S445 PolarHBondContact O-N 2.86Å
418	F	86.4	Confident	86.5	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.009	20%	0.2	C	C	.	.			trans	-90.9	92.5	174.2	-156.5	-67.7	0	0	0	111.4	N415 F416 L420 R433 R450 I452 L480 Y508	N415-F418 HydrophobicContact CB-CB 4.36Å; N415-F418 WeakPolarHBondContact O-CB 3.45Å; N415-F418 PolarHBondContact O-N 3.1Å; F416-F418 VanDerWaalsContact C-N 3.28Å; F416-F418 PolarHBondContact O-N 2.65Å; F418-L420 HydrophobicContact CD1-CB 4.14Å; F418-L420 HydrophobicContact CE1-CB 4.04Å; F418-L420 HydrophobicContact CE1-CD1 4.27Å; F418-R433 HydrophobicContact CE1-CB 4.38Å; F418-R433 HydrophobicContact CE1-CG 4.31Å; F418-R433 HydrophobicContact CE2-CG 4.33Å; F418-R433 HydrophobicContact CZ-CB 4.15Å; F418-R433 HydrophobicContact CZ-CG 4.07Å; F418-R450 HydrophobicContact CD2-CB 3.61Å; F418-R450 HydrophobicContact CD2-CG 4.32Å; F418-R450 HydrophobicContact CE2-CB 3.48Å; F418-R450 VanDerWaalsContact CE2-CB 3.48Å; F418-I452 HydrophobicContact CD1-CG2 4.22Å; F418-I452 HydrophobicContact CD2-CG2 3.93Å; F418-I452 HydrophobicContact CE1-CD1 4.34Å; F418-I452 HydrophobicContact CE1-CG2 3.91Å; F418-I452 HydrophobicContact CE2-CG2 3.58Å; F418-I452 HydrophobicContact CG-CG2 4.25Å; F418-I452 HydrophobicContact CZ-CD1 4.29Å; F418-I452 HydrophobicContact CZ-CG2 3.58Å; F418-L480 HydrophobicContact CZ-CD1 4.47Å; F418-Y508 HydrophobicContact CB-CD1 3.96Å; F418-Y508 HydrophobicContact CB-CE1 4.48Å; F418-Y508 HydrophobicContact CD1-CD1 4.07Å; F418-Y508 HydrophobicContact CD1-CE1 4Å; F418-Y508 AromaticContact CG-CD1 3.94Å; F418-Y508 HydrophobicContact CG-CD1 3.94Å; F418-Y508 HydrophobicContact CG-CE1 4.34Å
419	D	87.9	Confident	86.6	Confident	15 Å²	15	34.9 Å²	34.9	8%	0.08	17%	0.173	C	C	.	.			trans	-83.9	111.9	169.6	178.9	21.2	0	0	0	110.7	R410 G417 R433 N434 Q438 V444	R410-D419 VanDerWaalsContact CD-OD1 3.31Å; R410-D419 WeakPolarHBondContact CD-OD1 3.11Å; R410-D419 IonicContact CZ-OD1 3.82Å; R410-D419 IonicContact CZ-OD2 2.93Å; R410-D419 VanDerWaalsContact NE-CG 3.32Å; R410-D419 IonicContact NE-OD1 2.82Å; R410-D419 PolarHBondContact NE-OD1 3.16Å; R410-D419 IonicContact NE-OD2 3.21Å; R410-D419 PolarHBondContact NE-OD2 2.96Å; R410-D419 IonicContact NH2-OD1 3.18Å; R410-D419 IonicContact NH2-OD2 3.15Å; R410-D419 PolarHBondContact NH2-OD2 3.02Å; G417-D419 PolarHBondContact O-N 3.08Å; D419-R433 CarbonylContact O-C 2.98Å; D419-R433 WeakPolarHBondContact O-CA 3.2Å; D419-N434 WeakPolarHBondContact CB-O 3.43Å; D419-N434 PolarHBondContact O-N 3.22Å; D419-N434 PolarHBondContact OD2-ND2 3.3Å; D419-Q438 PolarHBondContact OD2-NE2 3.46Å; D419-V444 HydrophobicContact CB-CG1 3.82Å
420	L	90.3	Very high	86.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	109.6	178	-180	62.3	0	0	0	110.4	W411 F418 V422 F431 I452 F506	W411-L420 HydrophobicContact CE3-CD2 4.27Å; F418-L420 HydrophobicContact CD1-CB 4.14Å; F418-L420 HydrophobicContact CE1-CB 4.04Å; F418-L420 HydrophobicContact CE1-CD1 4.27Å; L420-V422 HydrophobicContact CD2-CG2 4.45Å; L420-V422 HydrophobicContact CG-CG2 4.14Å; L420-F431 HydrophobicContact CD1-CB 3.78Å; L420-F431 HydrophobicContact CD1-CD1 4.44Å; L420-F431 HydrophobicContact CD1-CD2 4.25Å; L420-F431 HydrophobicContact CD1-CG 3.92Å; L420-F431 HydrophobicContact CD2-CD2 4.44Å; L420-I452 HydrophobicContact CD2-CD1 4.19Å; L420-F506 HydrophobicContact CD2-CD1 4.27Å; L420-F506 HydrophobicContact CD2-CE1 3.52Å; L420-F506 HydrophobicContact CD2-CE2 4.03Å; L420-F506 HydrophobicContact CD2-CZ 3.37Å
421	L	92.8	Very high	87.1	Confident	29 Å²	29	30.3 Å²	30.3	15%	0.152	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	142.7	163.6	-70.4	-178.1	0	0	0	110.1	R410 K432 N434	R410-L421 HydrophobicContact CB-CD2 3.89Å; R410-L421 HydrophobicContact CG-CD2 4.41Å; L421-K432 HydrophobicContact CB-CB 4.2Å; L421-K432 PolarHBondContact N-O 3.46Å; L421-K432 PolarHBondContact O-N 3.05Å; L421-N434 HydrophobicContact CB-CB 4.49Å; L421-N434 HydrophobicContact CD1-CB 3.66Å; L421-N434 HydrophobicContact CG-CB 3.75Å
422	V	95.3	Very high	87.6	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126	179.7	-172.6	0	0	0	0	108.9	C408 W409 W411 L420 I429 I430 F431	C408-V422 WeakPolarHBondContact CA-O 3.5Å; W409-V422 HydrophobicContact CD2-CB 4.1Å; W409-V422 HydrophobicContact CD2-CG1 4.42Å; W409-V422 HydrophobicContact CH2-CB 4.31Å; W409-V422 HydrophobicContact CH2-CG1 3.58Å; W409-V422 HydrophobicContact CZ2-CB 3.87Å; W409-V422 HydrophobicContact CZ2-CG1 3.36Å; W409-V422 HydrophobicContact CZ3-CG1 4.19Å; W409-V422 PolarHBondContact N-O 3.23Å; W409-V422 PolarHBondContact O-N 2.8Å; W411-V422 HydrophobicContact CD2-CG2 4.43Å; W411-V422 HydrophobicContact CE3-CG2 3.59Å; W411-V422 HydrophobicContact CH2-CG1 4.5Å; W411-V422 HydrophobicContact CH2-CG2 4.12Å; W411-V422 HydrophobicContact CZ3-CB 4.45Å; W411-V422 HydrophobicContact CZ3-CG1 4.49Å; W411-V422 HydrophobicContact CZ3-CG2 3.41Å; W411-V422 VanDerWaalsContact CZ3-CG2 3.41Å; L420-V422 HydrophobicContact CD2-CG2 4.45Å; L420-V422 HydrophobicContact CG-CG2 4.14Å; V422-I429 HydrophobicContact CG1-CG2 4.01Å; V422-I430 WeakPolarHBondContact CA-O 3.33Å; V422-F431 HydrophobicContact CB-CD1 4.41Å; V422-F431 HydrophobicContact CG1-CD1 3.95Å; V422-F431 HydrophobicContact CG1-CE1 3.82Å; V422-F431 HydrophobicContact CG2-CD1 3.95Å; V422-F431 HydrophobicContact CG2-CE1 3.95Å
423	T	97.1	Very high	88.8	Confident	34 Å²	34	27.8 Å²	27.8	21%	0.209	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.3	178.2	-53.2	0	0	0	0	109.5	Y407 T425 I429 I430	Y407-T423 CarbonylContact O-C 3.56Å; Y407-T423 WeakPolarHBondContact O-CA 3.27Å; T423-T425 HydrophobicContact CG2-CG2 3.85Å; T423-I429 WeakPolarHBondContact O-CA 3.24Å; T423-I430 PolarHBondContact N-O 2.97Å; T423-I430 PolarHBondContact O-N 3.36Å
424	Y	96.5	Very high	90.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	115	157.2	174.4	-85.8	0	0	0	107.8	L401 D404 G405 E406 Y407 Y428 I429 L491 L500	L401-Y424 HydrophobicContact CD1-CD1 3.88Å; L401-Y424 HydrophobicContact CD1-CD2 3.85Å; L401-Y424 HydrophobicContact CD1-CE1 4.38Å; L401-Y424 HydrophobicContact CD1-CE2 4.34Å; L401-Y424 HydrophobicContact CD1-CG 3.59Å; D404-Y424 VanDerWaalsContact OD1-CE1 3.32Å; D404-Y424 WeakPolarHBondContact OD1-CE1 3.5Å; D404-Y424 PolarHBondContact OD1-OH 2.99Å; G405-Y424 WeakPolarHBondContact O-CD1 3.38Å; G405-Y424 WeakPolarHBondContact O-CE1 3.38Å; E406-Y424 WeakPolarHBondContact CA-O 3.29Å; Y407-Y424 AromaticContact CD2-CD1 3.94Å; Y407-Y424 HydrophobicContact CD2-CD1 3.94Å; Y407-Y424 PolarHBondContact N-O 3.46Å; Y407-Y424 PolarHBondContact O-N 3.45Å; Y424-Y428 WeakPolarHBondContact CA-O 3.35Å; Y424-I429 HydrophobicContact CD2-CD1 3.73Å; Y424-I429 HydrophobicContact CG-CD1 4.38Å; Y424-L491 HydrophobicContact CD2-CD1 4.17Å; Y424-L491 HydrophobicContact CE2-CD1 3.74Å; Y424-L500 HydrophobicContact CE2-CD2 4.43Å
425	T	95.3	Very high	91.3	Very high	21 Å²	21	24.5 Å²	24.5	13%	0.129	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	146.8	170.9	178	0	0	0	0	108.6	E406 T423 R427 Y428 I430	E406-T425 PolarHBondContact OE1-OG1 2.9Å; T423-T425 HydrophobicContact CG2-CG2 3.85Å; T425-R427 PolarHBondContact O-N 2.88Å; T425-Y428 PolarHBondContact N-O 3.12Å; T425-Y428 PolarHBondContact O-N 3.03Å; T425-I430 HydrophobicContact CG2-CD1 4.14Å
426	N	91.6	Very high	91.6	Very high	127 Å²	127	29.1 Å²	29.1	68%	0.679	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.5	32.4	179.3	-63.1	-51.2	0	0	0	114.1	Y428	N426-Y428 HydrophobicContact CB-CD2 4.16Å; N426-Y428 HydrophobicContact CB-CE2 4.48Å; N426-Y428 WeakPolarHBondContact O-CD2 3.22Å; N426-Y428 WeakPolarHBondContact O-CE2 3.26Å; N426-Y428 PolarHBondContact O-N 3.21Å
427	R	91.2	Very high	91.1	Very high	62 Å²	62	35.9 Å²	35.9	23%	0.234	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	16.3	-178.1	-54.4	177	174.5	-130.3	2.3	115.3	D404 T425 L491 S493 L496	D404-R427 IonicContact OD2-CZ 2.87Å; D404-R427 VanDerWaalsContact OD2-CZ 3.23Å; D404-R427 IonicContact OD2-NE 3.56Å; D404-R427 PolarHBondContact OD2-NE 3.21Å; D404-R427 VanDerWaalsContact OD2-NE 3.15Å; D404-R427 IonicContact OD2-NH2 3.7Å; D404-R427 PolarHBondContact OD2-NH2 3.33Å; T425-R427 PolarHBondContact O-N 2.88Å; R427-L491 HydrophobicContact CB-CB 4.3Å; R427-L491 WeakPolarHBondContact CB-O 3.44Å; R427-L491 VanDerWaalsContact O-CB 3.23Å; R427-L491 WeakPolarHBondContact O-CB 3.31Å; R427-L491 WeakPolarHBondContact O-CG 3.45Å; R427-L491 PolarHBondContact O-N 2.86Å; R427-S493 VanDerWaalsContact NH1-CA 3.26Å; R427-S493 PolarHBondContact NH1-O 3.46Å; R427-L496 HydrophobicContact CB-CD1 4.25Å; R427-L496 HydrophobicContact CG-CD1 3.99Å
428	Y	94.3	Very high	90.7	Very high	90 Å²	90	38.1 Å²	38.1	35%	0.353	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	143.2	167.6	-63	-81.5	0	0	0	110.9	Y424 T425 N426 V487 M489 N490	Y424-Y428 WeakPolarHBondContact CA-O 3.35Å; T425-Y428 PolarHBondContact N-O 3.12Å; T425-Y428 PolarHBondContact O-N 3.03Å; N426-Y428 HydrophobicContact CB-CD2 4.16Å; N426-Y428 HydrophobicContact CB-CE2 4.48Å; N426-Y428 WeakPolarHBondContact O-CD2 3.22Å; N426-Y428 WeakPolarHBondContact O-CE2 3.26Å; N426-Y428 PolarHBondContact O-N 3.21Å; Y428-V487 HydrophobicContact CD1-CG1 3.57Å; Y428-V487 HydrophobicContact CD1-CG2 4.36Å; Y428-V487 HydrophobicContact CE1-CG1 4.34Å; Y428-V487 HydrophobicContact CG-CG1 4.36Å; Y428-M489 CarbonylContact C-O 3.57Å; Y428-M489 WeakPolarHBondContact CA-O 3.31Å; Y428-N490 HydrophobicContact CD1-CB 3.85Å; Y428-N490 HydrophobicContact CE1-CB 3.64Å; Y428-N490 WeakPolarHBondContact CE1-ND2 3.46Å
429	I	96.6	Very high	89.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.6	159.1	-55.9	-68.5	0	0	0	107.4	V422 T423 Y424 F431 L456 V488 M489 L491 I502	V422-I429 HydrophobicContact CG1-CG2 4.01Å; T423-I429 WeakPolarHBondContact O-CA 3.24Å; Y424-I429 HydrophobicContact CD2-CD1 3.73Å; Y424-I429 HydrophobicContact CG-CD1 4.38Å; I429-F431 HydrophobicContact CG2-CD1 4.23Å; I429-F431 HydrophobicContact CG2-CE1 3.87Å; I429-L456 HydrophobicContact CB-CD2 4.18Å; I429-L456 HydrophobicContact CG1-CD2 4.26Å; I429-L456 HydrophobicContact CG2-CD2 3.83Å; I429-V488 HydrophobicContact CB-CG2 4.09Å; I429-V488 HydrophobicContact CG2-CG2 3.69Å; I429-V488 WeakPolarHBondContact O-CG2 3.47Å; I429-V488 PolarHBondContact O-N 3.13Å; I429-M489 HydrophobicContact CB-CB 4.28Å; I429-M489 HydrophobicContact CG1-CB 4.4Å; I429-M489 PolarHBondContact N-O 2.88Å; I429-M489 PolarHBondContact O-N 3.19Å; I429-L491 HydrophobicContact CD1-CD1 4.48Å; I429-L491 HydrophobicContact CG1-CD1 4.21Å; I429-I502 HydrophobicContact CD1-CD1 3.8Å
430	I	97.4	Very high	89.2	Confident	24 Å²	24	47 Å²	47	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.8	-178.8	-55.4	175.1	0	0	0	108.2	V422 T423 T425 E485 Q486 V487	V422-I430 WeakPolarHBondContact CA-O 3.33Å; T423-I430 PolarHBondContact N-O 2.97Å; T423-I430 PolarHBondContact O-N 3.36Å; T425-I430 HydrophobicContact CG2-CD1 4.14Å; I430-E485 HydrophobicContact CG2-CB 3.99Å; I430-Q486 WeakPolarHBondContact CA-O 3.43Å; I430-V487 HydrophobicContact CG1-CG2 4.12Å
431	F	96.6	Very high	88.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	136.4	171.6	-76.7	1.2	0	0	0	109.7	W411 L420 V422 I429 I452 F454 L456 L478 E485 Q486 V488 F506	W411-F431 HydrophobicContact CZ3-CE1 4.25Å; W411-F431 HydrophobicContact CZ3-CZ 4.38Å; L420-F431 HydrophobicContact CD1-CB 3.78Å; L420-F431 HydrophobicContact CD1-CD1 4.44Å; L420-F431 HydrophobicContact CD1-CD2 4.25Å; L420-F431 HydrophobicContact CD1-CG 3.92Å; L420-F431 HydrophobicContact CD2-CD2 4.44Å; V422-F431 HydrophobicContact CB-CD1 4.41Å; V422-F431 HydrophobicContact CG1-CD1 3.95Å; V422-F431 HydrophobicContact CG1-CE1 3.82Å; V422-F431 HydrophobicContact CG2-CD1 3.95Å; V422-F431 HydrophobicContact CG2-CE1 3.95Å; I429-F431 HydrophobicContact CG2-CD1 4.23Å; I429-F431 HydrophobicContact CG2-CE1 3.87Å; F431-I452 HydrophobicContact CD2-CD1 4.31Å; F431-F454 AromaticContact CE2-CD2 3.68Å; F431-F454 HydrophobicContact CE2-CD2 3.68Å; F431-F454 AromaticContact CE2-CE2 3.73Å; F431-F454 HydrophobicContact CE2-CE2 3.73Å; F431-F454 HydrophobicContact CE2-CG 4.15Å; F431-F454 HydrophobicContact CE2-CZ 4.25Å; F431-F454 HydrophobicContact CZ-CD2 4.22Å; F431-F454 HydrophobicContact CZ-CE2 4.27Å; F431-L456 HydrophobicContact CZ-CD2 4.48Å; F431-L478 HydrophobicContact CB-CD2 3.87Å; F431-L478 HydrophobicContact CD2-CD2 3.74Å; F431-L478 HydrophobicContact CG-CD2 4.31Å; F431-E485 CarbonylContact O-C 3.41Å; F431-E485 WeakPolarHBondContact O-CA 3.35Å; F431-Q486 PolarHBondContact N-O 3.26Å; F431-Q486 PolarHBondContact O-N 2.78Å; F431-V488 HydrophobicContact CB-CG1 4.06Å; F431-V488 HydrophobicContact CD1-CG2 3.75Å; F431-V488 HydrophobicContact CD2-CB 4.38Å; F431-V488 HydrophobicContact CD2-CG1 3.67Å; F431-V488 HydrophobicContact CD2-CG2 4.02Å; F431-V488 HydrophobicContact CE1-CG2 3.78Å; F431-V488 HydrophobicContact CE2-CG1 4.2Å; F431-V488 HydrophobicContact CE2-CG2 4.03Å; F431-V488 HydrophobicContact CG-CG1 3.87Å; F431-V488 HydrophobicContact CG-CG2 3.86Å; F431-V488 HydrophobicContact CZ-CG2 3.91Å; F431-F506 HydrophobicContact CD2-CE1 4.39Å; F431-F506 HydrophobicContact CE1-CZ 4.44Å; F431-F506 AromaticContact CE2-CE1 3.61Å; F431-F506 HydrophobicContact CE2-CE1 3.61Å; F431-F506 AromaticContact CE2-CZ 3.71Å; F431-F506 HydrophobicContact CE2-CZ 3.71Å; F431-F506 HydrophobicContact CZ-CE1 4.01Å; F431-F506 AromaticContact CZ-CZ 3.6Å; F431-F506 HydrophobicContact CZ-CZ 3.6Å
432	K	94.9	Very high	87.2	Confident	44 Å²	44	54.5 Å²	54.5	19%	0.191	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.9	175.8	-179.5	178.4	-159.6	152.9	0	110.8	L421 N434 D483 Q484 E485	L421-K432 HydrophobicContact CB-CB 4.2Å; L421-K432 PolarHBondContact N-O 3.46Å; L421-K432 PolarHBondContact O-N 3.05Å; K432-N434 PolarHBondContact O-N 3.15Å; K432-D483 VanDerWaalsContact CE-O 3.26Å; K432-D483 WeakPolarHBondContact CE-O 3.47Å; K432-Q484 WeakPolarHBondContact CA-O 3.17Å; K432-E485 HydrophobicContact CB-CG 3.96Å; K432-E485 HydrophobicContact CD-CG 3.75Å; K432-E485 WeakPolarHBondContact CD-OE1 3.48Å; K432-E485 WeakPolarHBondContact CE-OE1 3.46Å; K432-E485 HydrophobicContact CG-CG 3.79Å; K432-E485 IonicContact NZ-OE1 2.66Å; K432-E485 PolarHBondContact NZ-OE1 3.22Å
433	R	92.9	Very high	86.4	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	90.2	168.9	-179.7	-176	166.5	-147.1	-7.5	109	F418 D419 T435 S445 Q447 P448 L480 D483 Q484	F418-R433 HydrophobicContact CE1-CB 4.38Å; F418-R433 HydrophobicContact CE1-CG 4.31Å; F418-R433 HydrophobicContact CE2-CG 4.33Å; F418-R433 HydrophobicContact CZ-CB 4.15Å; F418-R433 HydrophobicContact CZ-CG 4.07Å; D419-R433 CarbonylContact O-C 2.98Å; D419-R433 WeakPolarHBondContact O-CA 3.2Å; R433-T435 HydrophobicContact CG-CG2 4.46Å; R433-T435 PolarHBondContact O-N 3.24Å; R433-S445 PolarHBondContact NH2-O 2.92Å; R433-Q447 PolarHBondContact NH1-O 2.99Å; R433-Q447 PolarHBondContact NH2-O 2.8Å; R433-P448 PolarHBondContact NH1-O 3.49Å; R433-L480 HydrophobicContact CB-CB 3.68Å; R433-L480 HydrophobicContact CB-CD1 3.86Å; R433-L480 HydrophobicContact CB-CG 4.43Å; R433-L480 WeakPolarHBondContact CD-O 3.23Å; R433-L480 PolarHBondContact NH1-O 2.82Å; R433-D483 WeakPolarHBondContact O-CA 3.25Å; R433-D483 PolarHBondContact O-N 2.84Å; R433-Q484 PolarHBondContact N-O 2.78Å
434	N	90.3	Very high	85.9	Confident	15 Å²	15	54.1 Å²	54.1	8%	0.08	31%	0.313	C	S	.	.			trans	-77.9	114.7	-173.3	177.2	72.3	0	0	0	111.3	R410 D419 L421 K432 L436 Q438 D483	R410-N434 PolarHBondContact NH2-ND2 3.33Å; D419-N434 WeakPolarHBondContact CB-O 3.43Å; D419-N434 PolarHBondContact O-N 3.22Å; D419-N434 PolarHBondContact OD2-ND2 3.3Å; L421-N434 HydrophobicContact CB-CB 4.49Å; L421-N434 HydrophobicContact CD1-CB 3.66Å; L421-N434 HydrophobicContact CG-CB 3.75Å; K432-N434 PolarHBondContact O-N 3.15Å; N434-L436 PolarHBondContact ND2-O 2.89Å; N434-Q438 PolarHBondContact ND2-NE2 2.98Å; N434-Q438 PolarHBondContact O-NE2 2.67Å; N434-D483 WeakPolarHBondContact CA-OD1 3.25Å
435	T	88.2	Confident	85.3	Confident	29 Å²	29	54.1 Å²	54.1	18%	0.178	31%	0.313	C	S	.	.			trans	-108.7	-9	173.5	79.2	0	0	0	0	113.4	R433 K482 D483	R433-T435 HydrophobicContact CG-CG2 4.46Å; R433-T435 PolarHBondContact O-N 3.24Å; T435-K482 HydrophobicContact CG2-CB 4.1Å; T435-K482 HydrophobicContact CG2-CG 4.04Å; T435-D483 WeakPolarHBondContact CB-OD2 3.48Å; T435-D483 PolarHBondContact N-OD1 2.86Å; T435-D483 PolarHBondContact N-OD2 3Å; T435-D483 PolarHBondContact OG1-OD2 3.23Å
436	L	82.3	Confident	84.7	Confident	100 Å²	100	59 Å²	59	52%	0.524	34%	0.337	S	S	.	.	S	Bend	trans	-80.5	159.2	173.1	-61.9	171.7	0	0	0	113.2	N434 Q438 D483	N434-L436 PolarHBondContact ND2-O 2.89Å; L436-Q438 PolarHBondContact O-N 2.75Å; L436-D483 PolarHBondContact N-OD1 3Å
437	N	73.2	Confident	84.5	Confident	158 Å²	158	54.2 Å²	54.2	85%	0.845	31%	0.311	S	S	*	.	S	Bend	trans	54.3	45.5	167.4	-58.7	-29.7	0	0	0	115.3
438	Q	74.4	Confident	84.4	Confident	49 Å²	49	56.1 Å²	56.1	23%	0.229	33%	0.331	C	S	.	.			trans	-88.8	144	178.9	-63.4	-61.1	-19.2	0	0	112.7	D419 N434 L436 C440 V444	D419-Q438 PolarHBondContact OD2-NE2 3.46Å; N434-Q438 PolarHBondContact ND2-NE2 2.98Å; N434-Q438 PolarHBondContact O-NE2 2.67Å; L436-Q438 PolarHBondContact O-N 2.75Å; Q438-C440 VanDerWaalsContact C-N 3.34Å; Q438-C440 PolarHBondContact O-N 2.85Å; Q438-V444 HydrophobicContact CG-CB 4.45Å; Q438-V444 HydrophobicContact CG-CG1 3.71Å; Q438-V444 HydrophobicContact CG-CG2 3.93Å; Q438-V444 VanDerWaalsContact NE2-CG1 3.31Å
439	P	69.1	Low	84.3	Confident	122 Å²	122	58.1 Å²	58.1	79%	0.792	34%	0.338	S	S	*	.	S	Bend	trans	-72.9	-22.8	-173.3	29.6	-35.8	0	0	0	113.9
440	C	73.3	Confident	84	Confident	81 Å²	81	58.1 Å²	58.1	55%	0.547	34%	0.338	S	S	.	.	S	Bend	trans	-142.8	147.5	174.1	55.9	0	0	0	0	112.4	Q438 G442 S443	Q438-C440 VanDerWaalsContact C-N 3.34Å; Q438-C440 PolarHBondContact O-N 2.85Å; C440-G442 PolarHBondContact O-N 3.16Å; C440-S443 PolarHBondContact N-OG 3.05Å; C440-S443 VanDerWaalsContact O-CB 3.26Å; C440-S443 WeakPolarHBondContact O-CB 3.47Å; C440-S443 PolarHBondContact O-N 2.84Å; C440-S443 VanDerWaalsContact O-N 3.09Å; C440-S443 PolarHBondContact O-OG 2.92Å; C440-S443 PolarHBondContact SG-OG 3.07Å
441	S	69	Low	83.8	Confident	134 Å²	134	57 Å²	57	94%	0.937	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	134.1	174.4	-56.5	0	0	0	0	110.7
442	G	72.4	Confident	83.6	Confident	53 Å²	53	57 Å²	57	55%	0.546	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	-1.9	-174.9	0	0	0	0	0	115.1	F414 C440 V444	F414-G442 WeakPolarHBondContact CE2-O 3.38Å; F414-G442 WeakPolarHBondContact CZ-O 3.34Å; C440-G442 PolarHBondContact O-N 3.16Å; G442-V444 PolarHBondContact O-N 2.82Å
443	S	78.6	Confident	83.6	Confident	15 Å²	15	55 Å²	55	11%	0.105	32%	0.324	C	S	.	.	S	Bend	trans	-51.1	-24.8	172.7	-70.3	0	0	0	0	114.7	F414 C440	F414-S443 WeakPolarHBondContact CD2-O 3.28Å; F414-S443 VanDerWaalsContact CE2-C 3.49Å; F414-S443 VanDerWaalsContact CE2-O 3.3Å; F414-S443 WeakPolarHBondContact CE2-O 3.33Å; C440-S443 PolarHBondContact N-OG 3.05Å; C440-S443 VanDerWaalsContact O-CB 3.26Å; C440-S443 WeakPolarHBondContact O-CB 3.47Å; C440-S443 PolarHBondContact O-N 2.84Å; C440-S443 VanDerWaalsContact O-N 3.09Å; C440-S443 PolarHBondContact O-OG 2.92Å; C440-S443 PolarHBondContact SG-OG 3.07Å
444	V	85.6	Confident	83.7	Confident	12 Å²	12	55 Å²	55	7%	0.073	32%	0.324	C	S	.	.	S	Bend	trans	-135.8	143.9	-171.9	-71.4	0	0	0	0	111.5	G417 D419 Q438 G442 L446	G417-V444 CarbonylContact O-C 3.53Å; G417-V444 VanDerWaalsContact O-CA 3.28Å; G417-V444 WeakPolarHBondContact O-CA 3.13Å; D419-V444 HydrophobicContact CB-CG1 3.82Å; Q438-V444 HydrophobicContact CG-CB 4.45Å; Q438-V444 HydrophobicContact CG-CG1 3.71Å; Q438-V444 HydrophobicContact CG-CG2 3.93Å; Q438-V444 VanDerWaalsContact NE2-CG1 3.31Å; G442-V444 PolarHBondContact O-N 2.82Å; V444-L446 PolarHBondContact O-N 3.19Å
445	S	85.3	Confident	84	Confident	0 Å²	0	56 Å²	56	0%	0	33%	0.327	C	S	.	.			trans	-70.5	122.8	179.9	-178.6	0	0	0	0	109.2	G417 R433 Q447 R450	G417-S445 VanDerWaalsContact CA-N 3.31Å; G417-S445 PolarHBondContact O-N 2.86Å; R433-S445 PolarHBondContact NH2-O 2.92Å; S445-Q447 VanDerWaalsContact C-N 3.25Å; S445-Q447 PolarHBondContact O-N 3.15Å; S445-R450 PolarHBondContact OG-NH1 3.27Å; S445-R450 VanDerWaalsContact OG-NH1 3.13Å
446	L	81.9	Confident	84.4	Confident	122 Å²	122	54.7 Å²	54.7	64%	0.639	32%	0.319	S	S	*	.			trans	-81.6	1.1	-178	-63.7	-179.3	0	0	0	113.8	V444 K482	V444-L446 PolarHBondContact O-N 3.19Å; L446-K482 WeakPolarHBondContact O-CE 3.15Å; L446-K482 PolarHBondContact O-NZ 3.11Å
447	Q	86.6	Confident	85.1	Confident	27 Å²	27	50.6 Å²	50.6	13%	0.126	30%	0.297	C	S	.	.			trans	-53.3	143.9	173.1	-67.3	-170.6	21.9	0	0	111.1	A374 E379 R433 S445 R449 R450 K482	A374-Q447 PolarHBondContact O-NE2 3.43Å; E379-Q447 PolarHBondContact O-NE2 3.03Å; E379-Q447 PolarHBondContact O-OE1 3.02Å; R433-Q447 PolarHBondContact NH1-O 2.99Å; R433-Q447 PolarHBondContact NH2-O 2.8Å; S445-Q447 VanDerWaalsContact C-N 3.25Å; S445-Q447 PolarHBondContact O-N 3.15Å; Q447-R449 PolarHBondContact O-N 3.41Å; Q447-R450 HydrophobicContact CB-CG 4.31Å; Q447-R450 VanDerWaalsContact OE1-CD 3.22Å; Q447-K482 WeakPolarHBondContact O-CE 3.46Å
448	P	89.4	Confident	86.1	Confident	103 Å²	103	43.2 Å²	43.2	67%	0.669	26%	0.257	S	S	*	.	S	Bend	trans	-58.9	-48.2	-178.6	-25.3	34.7	0	0	0	112.6	R433 E481	R433-P448 PolarHBondContact NH1-O 3.49Å; P448-E481 WeakPolarHBondContact O-CA 3.45Å
449	R	91.6	Very high	87.1	Confident	131 Å²	131	40.9 Å²	40.9	49%	0.494	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.9	-178.3	-68.2	175.5	76.2	-156.8	1.4	109.5	Q447 T479 E481	Q447-R449 PolarHBondContact O-N 3.41Å; R449-T479 HydrophobicContact CB-CG2 4.06Å; R449-E481 HydrophobicContact CG-CG 3.53Å
450	R	91.2	Very high	88.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.9	170	-72.4	-71.4	-61.3	-84.1	-3.1	109.3	V380 F416 F418 S445 Q447 T479 L480 Y508	V380-R450 CarbonylContact O-C 3.54Å; V380-R450 VanDerWaalsContact O-CA 3.26Å; V380-R450 WeakPolarHBondContact O-CA 3.28Å; V380-R450 WeakPolarHBondContact O-CD 3.47Å; V380-R450 PolarHBondContact O-NE 3.26Å; V380-R450 VanDerWaalsContact O-NE 3.15Å; F416-R450 PolarHBondContact O-NH1 3.03Å; F418-R450 HydrophobicContact CD2-CB 3.61Å; F418-R450 HydrophobicContact CD2-CG 4.32Å; F418-R450 HydrophobicContact CE2-CB 3.48Å; F418-R450 VanDerWaalsContact CE2-CB 3.48Å; S445-R450 PolarHBondContact OG-NH1 3.27Å; S445-R450 VanDerWaalsContact OG-NH1 3.13Å; Q447-R450 HydrophobicContact CB-CG 4.31Å; Q447-R450 VanDerWaalsContact OE1-CD 3.22Å; R450-T479 WeakPolarHBondContact O-CA 3.43Å; R450-L480 PolarHBondContact N-O 2.76Å; R450-L480 VanDerWaalsContact N-O 3.08Å; R450-L480 PolarHBondContact O-N 3.35Å; R450-Y508 PolarHBondContact NH2-O 3.04Å
451	S	92.6	Very high	89.3	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	143.7	179.8	-56.1	0	0	0	0	110.9	V380 P382 Q383 L478 T479	V380-S451 WeakPolarHBondContact CG1-OG 3.47Å; V380-S451 PolarHBondContact O-N 3.06Å; P382-S451 VanDerWaalsContact O-CB 3.27Å; P382-S451 WeakPolarHBondContact O-CB 3.33Å; Q383-S451 PolarHBondContact NE2-OG 3.1Å; S451-L478 CarbonylContact C-O 3.55Å; S451-L478 VanDerWaalsContact CA-O 3.29Å; S451-L478 WeakPolarHBondContact CA-O 3.34Å; S451-T479 PolarHBondContact OG-OG1 2.88Å
452	I	92.9	Very high	90.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.9	167.2	61.4	-176.5	0	0	0	109	F418 L420 F431 I477 L478 F506 L507 Y508	F418-I452 HydrophobicContact CD1-CG2 4.22Å; F418-I452 HydrophobicContact CD2-CG2 3.93Å; F418-I452 HydrophobicContact CE1-CD1 4.34Å; F418-I452 HydrophobicContact CE1-CG2 3.91Å; F418-I452 HydrophobicContact CE2-CG2 3.58Å; F418-I452 HydrophobicContact CG-CG2 4.25Å; F418-I452 HydrophobicContact CZ-CD1 4.29Å; F418-I452 HydrophobicContact CZ-CG2 3.58Å; L420-I452 HydrophobicContact CD2-CD1 4.19Å; F431-I452 HydrophobicContact CD2-CD1 4.31Å; I452-I477 WeakPolarHBondContact O-CA 3.48Å; I452-L478 HydrophobicContact CD1-CD2 4.41Å; I452-L478 HydrophobicContact CG1-CB 3.99Å; I452-L478 PolarHBondContact N-O 3.19Å; I452-L478 PolarHBondContact O-N 3.03Å; I452-F506 HydrophobicContact CD1-CD1 3.96Å; I452-F506 HydrophobicContact CD1-CE1 3.77Å; I452-L507 WeakPolarHBondContact CA-O 3.3Å; I452-Y508 HydrophobicContact CG2-CD1 3.52Å; I452-Y508 HydrophobicContact CG2-CE1 3.94Å; I452-Y508 HydrophobicContact CG2-CG 4.49Å
453	A	94.8	Very high	91.2	Very high	3 Å²	3	32.4 Å²	32.4	3%	0.025	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.1	163.4	0	0	0	0	0	108.4	P382 L390 Q476 I477 F506 L507	P382-A453 HydrophobicContact CB-CB 3.87Å; P382-A453 HydrophobicContact CG-CB 4.25Å; L390-A453 HydrophobicContact CD1-CB 3.63Å; A453-Q476 CarbonylContact C-O 3.48Å; A453-Q476 WeakPolarHBondContact CA-O 3.38Å; A453-I477 HydrophobicContact CB-CG1 3.9Å; A453-F506 CarbonylContact O-C 3.55Å; A453-L507 HydrophobicContact CB-CB 4.38Å; A453-L507 PolarHBondContact N-O 3.44Å; A453-L507 PolarHBondContact O-N 3Å
454	F	95.5	Very high	91.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	159.6	-175.5	78.9	-74.2	0	0	0	114.1	F431 L456 T473 Q476 L478 V488 N505 F506	F431-F454 AromaticContact CE2-CD2 3.68Å; F431-F454 HydrophobicContact CE2-CD2 3.68Å; F431-F454 AromaticContact CE2-CE2 3.73Å; F431-F454 HydrophobicContact CE2-CE2 3.73Å; F431-F454 HydrophobicContact CE2-CG 4.15Å; F431-F454 HydrophobicContact CE2-CZ 4.25Å; F431-F454 HydrophobicContact CZ-CD2 4.22Å; F431-F454 HydrophobicContact CZ-CE2 4.27Å; F454-L456 HydrophobicContact CD2-CB 4.13Å; F454-L456 HydrophobicContact CE2-CB 4.06Å; F454-T473 HydrophobicContact CE2-CG2 3.98Å; F454-T473 HydrophobicContact CZ-CG2 4.4Å; F454-Q476 HydrophobicContact CD1-CB 4.15Å; F454-Q476 HydrophobicContact CE1-CB 3.56Å; F454-Q476 HydrophobicContact CZ-CB 3.94Å; F454-Q476 PolarHBondContact N-O 2.88Å; F454-Q476 PolarHBondContact O-N 2.91Å; F454-L478 HydrophobicContact CD1-CB 4.26Å; F454-L478 HydrophobicContact CE1-CB 3.89Å; F454-V488 HydrophobicContact CE2-CB 4.24Å; F454-V488 HydrophobicContact CZ-CB 4Å; F454-V488 HydrophobicContact CZ-CG1 3.96Å; F454-N505 CarbonylContact C-O 3.51Å; F454-N505 WeakPolarHBondContact CA-O 3.22Å; F454-N505 WeakPolarHBondContact CB-O 3.35Å; F454-F506 HydrophobicContact CB-CD1 3.55Å; F454-F506 HydrophobicContact CB-CE1 3.62Å; F454-F506 HydrophobicContact CB-CG 4.49Å; F454-F506 HydrophobicContact CD2-CE1 4.49Å; F454-F506 HydrophobicContact CG-CE1 4.2Å
455	R	96.8	Very high	92.1	Very high	38 Å²	38	33.2 Å²	33.2	14%	0.143	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	108	165.5	173	172	172.8	-134.9	-2.6	109.3	N265 L390 R457 G474 Y475 C504 N505	N265-R455 PolarHBondContact OD1-NH1 3.06Å; N265-R455 PolarHBondContact OD1-NH2 2.91Å; L390-R455 HydrophobicContact CD2-CB 4.46Å; R455-R457 HydrophobicContact CG-CG 4.31Å; R455-G474 WeakPolarHBondContact CA-O 3.46Å; R455-G474 WeakPolarHBondContact CG-O 3.38Å; R455-Y475 HydrophobicContact CB-CD1 3.93Å; R455-Y475 HydrophobicContact CB-CE1 3.99Å; R455-Y475 VanDerWaalsContact CD-CE1 3.44Å; R455-Y475 WeakPolarHBondContact CD-OH 3.09Å; R455-Y475 HydrophobicContact CG-CE1 4.35Å; R455-Y475 PolarHBondContact NH1-OH 2.92Å; R455-C504 WeakPolarHBondContact O-CA 3.43Å; R455-N505 HydrophobicContact CB-CB 4.38Å; R455-N505 PolarHBondContact N-O 2.79Å; R455-N505 PolarHBondContact O-N 3.36Å
456	L	96.3	Very high	92.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	138.3	174.4	-173.9	67.2	0	0	0	109.6	I429 F431 F454 L458 T472 T473 V488 M489 I502 C504	I429-L456 HydrophobicContact CB-CD2 4.18Å; I429-L456 HydrophobicContact CG1-CD2 4.26Å; I429-L456 HydrophobicContact CG2-CD2 3.83Å; F431-L456 HydrophobicContact CZ-CD2 4.48Å; F454-L456 HydrophobicContact CD2-CB 4.13Å; F454-L456 HydrophobicContact CE2-CB 4.06Å; L456-L458 HydrophobicContact CD2-CD1 4.16Å; L456-L458 HydrophobicContact CG-CD1 4Å; L456-T472 WeakPolarHBondContact O-CA 3.15Å; L456-T472 WeakPolarHBondContact O-CB 3.33Å; L456-T472 PolarHBondContact O-OG1 2.96Å; L456-T473 HydrophobicContact CB-CG2 3.92Å; L456-T473 PolarHBondContact N-OG1 3.35Å; L456-T473 PolarHBondContact O-N 3.38Å; L456-T473 VanDerWaalsContact O-N 3.08Å; L456-T473 PolarHBondContact O-OG1 2.91Å; L456-V488 HydrophobicContact CD2-CG2 4.2Å; L456-M489 HydrophobicContact CD2-CB 4.44Å; L456-M489 HydrophobicContact CD2-CE 4.23Å; L456-M489 HydrophobicContact CG-CE 4.45Å; L456-I502 HydrophobicContact CD1-CG2 3.6Å; L456-C504 HydrophobicContact CD1-CB 3.74Å
457	R	95.9	Very high	92.9	Very high	15 Å²	15	35.6 Å²	35.6	6%	0.057	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.8	178.1	-68.6	-178.7	-75.5	138.8	-2.9	109.4	S264 N265 L266 F267 R455 R471 C503 N505	S264-R457 PolarHBondContact O-NH2 2.87Å; N265-R457 PolarHBondContact O-NH1 3.11Å; L266-R457 PolarHBondContact O-NH2 2.99Å; L266-R457 VanDerWaalsContact O-NH2 3.09Å; F267-R457 HydrophobicContact CE2-CB 4.19Å; F267-R457 HydrophobicContact CZ-CB 4.48Å; R455-R457 HydrophobicContact CG-CG 4.31Å; R457-R471 WeakPolarHBondContact CA-O 3.39Å; R457-C503 PolarHBondContact N-O 3.15Å; R457-C503 PolarHBondContact NH2-SG 2.69Å; R457-C503 VanDerWaalsContact NH2-SG 3.45Å; R457-C503 PolarHBondContact O-N 2.93Å; R457-C503 VanDerWaalsContact O-O 3.07Å; R457-N505 PolarHBondContact NH2-OD1 2.84Å; R457-N505 VanDerWaalsContact NH2-OD1 3.08Å
458	L	94.5	Very high	93.2	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.2	172.7	-63.1	89	0	0	0	109.7	L456 S470 R471 M489 L491 L500 Y501 I502	L456-L458 HydrophobicContact CD2-CD1 4.16Å; L456-L458 HydrophobicContact CG-CD1 4Å; L458-S470 WeakPolarHBondContact O-CA 3.21Å; L458-S470 WeakPolarHBondContact O-CB 3.28Å; L458-S470 PolarHBondContact O-OG 3.27Å; L458-R471 PolarHBondContact N-O 2.82Å; L458-R471 PolarHBondContact O-N 3.15Å; L458-M489 HydrophobicContact CD1-CE 3.6Å; L458-M489 HydrophobicContact CD1-SD 3.51Å; L458-M489 VanDerWaalsContact CD1-SD 3.51Å; L458-L491 HydrophobicContact CD1-CD2 4.43Å; L458-L491 HydrophobicContact CD2-CD1 3.81Å; L458-L491 HydrophobicContact CD2-CD2 3.9Å; L458-L500 HydrophobicContact CB-CD1 4.26Å; L458-L500 HydrophobicContact CD2-CD1 4.27Å; L458-L500 HydrophobicContact CD2-CD2 3.79Å; L458-L500 HydrophobicContact CD2-CG 4.09Å; L458-Y501 CarbonylContact C-O 3.59Å; L458-Y501 VanDerWaalsContact CA-O 3.24Å; L458-Y501 WeakPolarHBondContact CA-O 3.38Å; L458-I502 HydrophobicContact CD2-CD1 4.2Å; L458-I502 HydrophobicContact CD2-CG1 3.86Å; L458-I502 HydrophobicContact CG-CG1 4.09Å; L458-I502 HydrophobicContact CG-CG2 4.43Å
459	A	94.8	Very high	93.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	149	178.9	0	0	0	0	0	111	F267 F461 L467 C469 Y501	F267-A459 HydrophobicContact CE2-CB 3.7Å; F267-A459 HydrophobicContact CZ-CB 3.73Å; A459-F461 HydrophobicContact CB-CE1 4.01Å; A459-F461 HydrophobicContact CB-CE2 3.82Å; A459-F461 HydrophobicContact CB-CZ 3.41Å; A459-F461 VanDerWaalsContact CB-CZ 3.41Å; A459-L467 HydrophobicContact CB-CD1 3.63Å; A459-C469 CarbonylContact C-O 3.57Å; A459-C469 VanDerWaalsContact CA-O 3.32Å; A459-C469 WeakPolarHBondContact CA-O 3.43Å; A459-Y501 PolarHBondContact N-O 3.15Å; A459-Y501 WeakPolarHBondContact O-CB 3.48Å; A459-Y501 PolarHBondContact O-N 3.5Å
460	S	94.6	Very high	93.2	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.007	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	148.4	160.3	67	0	0	0	0	108.7	I468 C469 I497	S460-I468 PolarHBondContact O-N 3.05Å; S460-C469 PolarHBondContact N-O 3.12Å; S460-C469 PolarHBondContact OG-N 3.31Å; S460-C469 PolarHBondContact OG-SG 3.05Å; S460-I497 VanDerWaalsContact CB-O 3.29Å; S460-I497 WeakPolarHBondContact CB-O 3.41Å
461	F	94.1	Very high	93.3	Very high	14 Å²	14	36.4 Å²	36.4	6%	0.061	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.8	-175.6	-53.3	-74.5	0	0	0	110.2	N238 T242 H243 A459 G465 K466 L467 Y501	N238-F461 HydrophobicContact CB-CE1 3.62Å; N238-F461 HydrophobicContact CB-CZ 3.73Å; T242-F461 HydrophobicContact CG2-CE2 4.4Å; H243-F461 AromaticContact CE1-CD2 3.87Å; A459-F461 HydrophobicContact CB-CE1 4.01Å; A459-F461 HydrophobicContact CB-CE2 3.82Å; A459-F461 HydrophobicContact CB-CZ 3.41Å; A459-F461 VanDerWaalsContact CB-CZ 3.41Å; F461-G465 WeakPolarHBondContact CD1-O 3.25Å; F461-K466 CarbonylContact C-O 3.58Å; F461-K466 VanDerWaalsContact CA-O 3.24Å; F461-K466 WeakPolarHBondContact CA-O 3.38Å; F461-L467 HydrophobicContact CD1-CB 4.34Å; F461-L467 HydrophobicContact CD1-CD1 4.03Å; F461-L467 HydrophobicContact CE1-CB 4.33Å; F461-L467 HydrophobicContact CE1-CD1 3.54Å; F461-L467 HydrophobicContact CZ-CD1 4.26Å; F461-Y501 AromaticContact CD2-CD2 3.44Å; F461-Y501 HydrophobicContact CD2-CD2 3.44Å; F461-Y501 VanDerWaalsContact CD2-CD2 3.44Å; F461-Y501 AromaticContact CD2-CE2 3.59Å; F461-Y501 HydrophobicContact CD2-CE2 3.59Å; F461-Y501 HydrophobicContact CD2-CG 4.16Å; F461-Y501 AromaticContact CE2-CD2 3.66Å; F461-Y501 HydrophobicContact CE2-CD2 3.66Å; F461-Y501 HydrophobicContact CE2-CE2 4.2Å; F461-Y501 AromaticContact CE2-CG 3.92Å; F461-Y501 HydrophobicContact CE2-CG 3.92Å
462	D	92.4	Very high	93.4	Very high	56 Å²	56	39.8 Å²	39.8	30%	0.299	22%	0.218	S	C	.	.			trans	-79.7	-177	169.6	71.4	12.6	0	0	0	111.7	S464 G465 K466 I468	D462-S464 PolarHBondContact O-N 3.04Å; D462-S464 VanDerWaalsContact OD1-CA 3.3Å; D462-S464 WeakPolarHBondContact OD1-CA 3.41Å; D462-S464 WeakPolarHBondContact OD1-CB 3.45Å; D462-S464 PolarHBondContact OD1-N 3.14Å; D462-S464 PolarHBondContact OD1-OG 3.36Å; D462-S464 PolarHBondContact OD2-OG 3.37Å; D462-G465 PolarHBondContact O-N 3.13Å; D462-G465 PolarHBondContact OD1-N 2.87Å; D462-G465 VanDerWaalsContact OD1-N 3.11Å; D462-K466 PolarHBondContact N-O 2.91Å; D462-K466 WeakPolarHBondContact OD1-CB 3.48Å; D462-K466 PolarHBondContact OD1-N 3.41Å; D462-K466 WeakPolarHBondContact OD2-CB 3.49Å; D462-I468 HydrophobicContact CB-CD1 3.93Å; D462-I468 HydrophobicContact CB-CG1 4.02Å
463	S	90.4	Very high	93.5	Very high	140 Å²	140	40.9 Å²	40.9	98%	0.979	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-16	177.9	53.2	0	0	0	0	114.3
464	S	90.4	Very high	93.6	Very high	41 Å²	41	42 Å²	42	29%	0.287	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-4	175.4	80.2	0	0	0	0	113.4	W235 D462 K466	W235-S464 VanDerWaalsContact CZ2-O 3.27Å; W235-S464 WeakPolarHBondContact CZ2-O 3.4Å; W235-S464 PolarHBondContact NE1-O 2.79Å; D462-S464 PolarHBondContact O-N 3.04Å; D462-S464 VanDerWaalsContact OD1-CA 3.3Å; D462-S464 WeakPolarHBondContact OD1-CA 3.41Å; D462-S464 WeakPolarHBondContact OD1-CB 3.45Å; D462-S464 PolarHBondContact OD1-N 3.14Å; D462-S464 PolarHBondContact OD1-OG 3.36Å; D462-S464 PolarHBondContact OD2-OG 3.37Å; S464-K466 VanDerWaalsContact C-N 3.31Å; S464-K466 WeakPolarHBondContact OG-CB 3.47Å; S464-K466 PolarHBondContact OG-N 3.44Å
465	G	92.1	Very high	93.6	Very high	4 Å²	4	44.5 Å²	44.5	4%	0.041	25%	0.246	C	C	.	.	S	Bend	trans	81	6.7	-172.8	0	0	0	0	0	114	W235 N239 F461 D462	W235-G465 PolarHBondContact NE1-O 3.21Å; N239-G465 PolarHBondContact ND2-O 3.5Å; N239-G465 VanDerWaalsContact OD1-CA 3.22Å; N239-G465 WeakPolarHBondContact OD1-CA 3.13Å; N239-G465 PolarHBondContact OD1-O 2.84Å; F461-G465 WeakPolarHBondContact CD1-O 3.25Å; D462-G465 PolarHBondContact O-N 3.13Å; D462-G465 PolarHBondContact OD1-N 2.87Å; D462-G465 VanDerWaalsContact OD1-N 3.11Å
466	K	92.4	Very high	93.5	Very high	93 Å²	93	46.3 Å²	46.3	40%	0.404	26%	0.256	S	S	.	.			trans	-74.5	137.9	177.1	-172.8	176.6	-175.6	168.5	0	109.4	E206 F461 D462 S464 I468	E206-K466 PolarHBondContact O-NZ 2.92Å; E206-K466 VanDerWaalsContact O-NZ 3.1Å; F461-K466 CarbonylContact C-O 3.58Å; F461-K466 VanDerWaalsContact CA-O 3.24Å; F461-K466 WeakPolarHBondContact CA-O 3.38Å; D462-K466 PolarHBondContact N-O 2.91Å; D462-K466 WeakPolarHBondContact OD1-CB 3.48Å; D462-K466 PolarHBondContact OD1-N 3.41Å; D462-K466 WeakPolarHBondContact OD2-CB 3.49Å; S464-K466 VanDerWaalsContact C-N 3.31Å; S464-K466 WeakPolarHBondContact OG-CB 3.47Å; S464-K466 PolarHBondContact OG-N 3.44Å; K466-I468 PolarHBondContact O-N 3.42Å
467	L	92.3	Very high	93.5	Very high	79 Å²	79	48.7 Å²	48.7	41%	0.414	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119.6	-177.3	-175.5	72.9	0	0	0	110.6	A459 F461 C469	A459-L467 HydrophobicContact CB-CD1 3.63Å; F461-L467 HydrophobicContact CD1-CB 4.34Å; F461-L467 HydrophobicContact CD1-CD1 4.03Å; F461-L467 HydrophobicContact CE1-CB 4.33Å; F461-L467 HydrophobicContact CE1-CD1 3.54Å; F461-L467 HydrophobicContact CZ-CD1 4.26Å; L467-C469 WeakPolarHBondContact CD1-O 3.14Å
468	I	92.5	Very high	93.4	Very high	85 Å²	85	48.3 Å²	48.3	44%	0.436	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-51	176.1	-46.7	168.6	0	0	0	110.3	S460 D462 K466 I497	S460-I468 PolarHBondContact O-N 3.05Å; D462-I468 HydrophobicContact CB-CD1 3.93Å; D462-I468 HydrophobicContact CB-CG1 4.02Å; K466-I468 PolarHBondContact O-N 3.42Å; I468-I497 HydrophobicContact CB-CD1 4.28Å; I468-I497 HydrophobicContact CD1-CD1 4.37Å; I468-I497 HydrophobicContact CD1-CG2 4.2Å; I468-I497 HydrophobicContact CG2-CD1 3.51Å
469	C	89.8	Confident	93.5	Very high	24 Å²	24	49.9 Å²	49.9	16%	0.162	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.7	174.5	83.2	0	0	0	0	111.4	A459 S460 L467	A459-C469 CarbonylContact C-O 3.57Å; A459-C469 VanDerWaalsContact CA-O 3.32Å; A459-C469 WeakPolarHBondContact CA-O 3.43Å; S460-C469 PolarHBondContact N-O 3.12Å; S460-C469 PolarHBondContact OG-N 3.31Å; S460-C469 PolarHBondContact OG-SG 3.05Å; L467-C469 WeakPolarHBondContact CD1-O 3.14Å
470	S	91.8	Very high	93.5	Very high	51 Å²	51	49.9 Å²	49.9	36%	0.357	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	154.3	167	-171.1	0	0	0	0	112.4	L458	L458-S470 WeakPolarHBondContact O-CA 3.21Å; L458-S470 WeakPolarHBondContact O-CB 3.28Å; L458-S470 PolarHBondContact O-OG 3.27Å
471	R	92.6	Very high	93.5	Very high	117 Å²	117	54.8 Å²	54.8	44%	0.442	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	152	170.8	-67.2	-64.4	-177.3	-98.3	6.1	109.3	R457 L458 M489 L491	R457-R471 WeakPolarHBondContact CA-O 3.39Å; L458-R471 PolarHBondContact N-O 2.82Å; L458-R471 PolarHBondContact O-N 3.15Å; R471-M489 HydrophobicContact CB-CE 4.44Å; R471-M489 HydrophobicContact CB-SD 3.83Å; R471-L491 HydrophobicContact CG-CD2 4.48Å
472	T	95.1	Very high	93.4	Very high	72 Å²	72	58.5 Å²	58.5	44%	0.442	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150	171.3	-174.5	0	0	0	0	110.2	L456 G474	L456-T472 WeakPolarHBondContact O-CA 3.15Å; L456-T472 WeakPolarHBondContact O-CB 3.33Å; L456-T472 PolarHBondContact O-OG1 2.96Å; T472-G474 PolarHBondContact O-N 3.37Å; T472-G474 PolarHBondContact OG1-N 3.34Å
473	T	95.5	Very high	93.4	Very high	22 Å²	22	57.6 Å²	57.6	14%	0.135	31%	0.311	C	S	.	.			trans	-71.6	-13.1	169.8	47.4	0	0	0	0	113.2	F454 L456 Q476 V488 M489	F454-T473 HydrophobicContact CE2-CG2 3.98Å; F454-T473 HydrophobicContact CZ-CG2 4.4Å; L456-T473 HydrophobicContact CB-CG2 3.92Å; L456-T473 PolarHBondContact N-OG1 3.35Å; L456-T473 PolarHBondContact O-N 3.38Å; L456-T473 VanDerWaalsContact O-N 3.08Å; L456-T473 PolarHBondContact O-OG1 2.91Å; T473-Q476 PolarHBondContact O-NE2 3.42Å; T473-V488 WeakPolarHBondContact CG2-O 3.33Å; T473-M489 HydrophobicContact CG2-CE 3.58Å
474	G	95	Very high	93.7	Very high	27 Å²	27	54.3 Å²	54.3	28%	0.278	28%	0.28	S	S	.	.			trans	67.3	-162.8	-153.6	0	0	0	0	0	110.6	R455 T472	R455-G474 WeakPolarHBondContact CA-O 3.46Å; R455-G474 WeakPolarHBondContact CG-O 3.38Å; T472-G474 PolarHBondContact O-N 3.37Å; T472-G474 PolarHBondContact OG1-N 3.34Å
475	Y	95.4	Very high	93.9	Very high	52 Å²	52	57.4 Å²	57.4	20%	0.204	29%	0.29	C	S	.	.	S	Bend	trans	-85.1	131.4	170.1	-60.3	-83.8	0	0	0	108.8	I385 K387 L390 E391 R455	I385-Y475 WeakPolarHBondContact CD1-O 3.45Å; I385-Y475 HydrophobicContact CG2-CG 4.39Å; K387-Y475 HydrophobicContact CD-CE2 4.23Å; K387-Y475 HydrophobicContact CG-CD2 4.36Å; K387-Y475 HydrophobicContact CG-CE1 4.39Å; K387-Y475 HydrophobicContact CG-CE2 3.94Å; L390-Y475 HydrophobicContact CD1-CD1 4.24Å; L390-Y475 HydrophobicContact CD2-CD1 3.97Å; L390-Y475 HydrophobicContact CD2-CE1 3.86Å; L390-Y475 HydrophobicContact CG-CD1 4.49Å; E391-Y475 VanDerWaalsContact CD-OH 3.27Å; E391-Y475 HydrophobicContact CG-CE1 4.1Å; E391-Y475 WeakPolarHBondContact CG-OH 3.43Å; E391-Y475 PolarHBondContact OE1-OH 2.83Å; R455-Y475 HydrophobicContact CB-CD1 3.93Å; R455-Y475 HydrophobicContact CB-CE1 3.99Å; R455-Y475 VanDerWaalsContact CD-CE1 3.44Å; R455-Y475 WeakPolarHBondContact CD-OH 3.09Å; R455-Y475 HydrophobicContact CG-CE1 4.35Å; R455-Y475 PolarHBondContact NH1-OH 2.92Å
476	Q	95.8	Very high	94.2	Very high	76 Å²	76	61.2 Å²	61.2	36%	0.355	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	158.9	-179.3	-65.1	-170.3	10.2	0	0	110.7	A453 F454 T473	A453-Q476 CarbonylContact C-O 3.48Å; A453-Q476 WeakPolarHBondContact CA-O 3.38Å; F454-Q476 HydrophobicContact CD1-CB 4.15Å; F454-Q476 HydrophobicContact CE1-CB 3.56Å; F454-Q476 HydrophobicContact CZ-CB 3.94Å; F454-Q476 PolarHBondContact N-O 2.88Å; F454-Q476 PolarHBondContact O-N 2.91Å; T473-Q476 PolarHBondContact O-NE2 3.42Å
477	I	95.6	Very high	94.4	Very high	50 Å²	50	60.4 Å²	60.4	26%	0.256	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.8	166.7	-69.5	173.1	0	0	0	108.5	Q383 E384 I385 I452 A453	Q383-I477 WeakPolarHBondContact O-CD1 3.49Å; E384-I477 VanDerWaalsContact C-CD1 3.47Å; I385-I477 HydrophobicContact CG1-CD1 3.79Å; I385-I477 HydrophobicContact CG1-CG1 3.82Å; I452-I477 WeakPolarHBondContact O-CA 3.48Å; A453-I477 HydrophobicContact CB-CG1 3.9Å
478	L	95.2	Very high	94.6	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.8	177.6	-171.1	73	0	0	0	108.8	F431 S451 I452 F454 L480 Q486 V488	F431-L478 HydrophobicContact CB-CD2 3.87Å; F431-L478 HydrophobicContact CD2-CD2 3.74Å; F431-L478 HydrophobicContact CG-CD2 4.31Å; S451-L478 CarbonylContact C-O 3.55Å; S451-L478 VanDerWaalsContact CA-O 3.29Å; S451-L478 WeakPolarHBondContact CA-O 3.34Å; I452-L478 HydrophobicContact CD1-CD2 4.41Å; I452-L478 HydrophobicContact CG1-CB 3.99Å; I452-L478 PolarHBondContact N-O 3.19Å; I452-L478 PolarHBondContact O-N 3.03Å; F454-L478 HydrophobicContact CD1-CB 4.26Å; F454-L478 HydrophobicContact CE1-CB 3.89Å; L478-L480 HydrophobicContact CD1-CD2 4.44Å; L478-L480 HydrophobicContact CD2-CD1 3.84Å; L478-L480 HydrophobicContact CD2-CD2 4.11Å; L478-L480 HydrophobicContact CD2-CG 3.98Å; L478-L480 HydrophobicContact CG-CD1 4.42Å; L478-L480 HydrophobicContact CG-CD2 4.06Å; L478-L480 HydrophobicContact CG-CG 4.01Å; L478-Q486 HydrophobicContact CD1-CB 4.2Å; L478-Q486 HydrophobicContact CD1-CG 3.98Å; L478-V488 HydrophobicContact CD1-CG1 4.24Å; L478-V488 HydrophobicContact CD2-CG1 3.82Å
479	T	95.3	Very high	94.7	Very high	35 Å²	35	54.2 Å²	54.2	22%	0.215	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.8	175.8	-56.1	0	0	0	0	109.4	R449 R450 S451	R449-T479 HydrophobicContact CB-CG2 4.06Å; R450-T479 WeakPolarHBondContact O-CA 3.43Å; S451-T479 PolarHBondContact OG-OG1 2.88Å
480	L	94.4	Very high	94.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.6	-176.5	-63.4	177.7	0	0	0	112	F418 R433 R450 L478 Q484 Q486	F418-L480 HydrophobicContact CZ-CD1 4.47Å; R433-L480 HydrophobicContact CB-CB 3.68Å; R433-L480 HydrophobicContact CB-CD1 3.86Å; R433-L480 HydrophobicContact CB-CG 4.43Å; R433-L480 WeakPolarHBondContact CD-O 3.23Å; R433-L480 PolarHBondContact NH1-O 2.82Å; R450-L480 PolarHBondContact N-O 2.76Å; R450-L480 VanDerWaalsContact N-O 3.08Å; R450-L480 PolarHBondContact O-N 3.35Å; L478-L480 HydrophobicContact CD1-CD2 4.44Å; L478-L480 HydrophobicContact CD2-CD1 3.84Å; L478-L480 HydrophobicContact CD2-CD2 4.11Å; L478-L480 HydrophobicContact CD2-CG 3.98Å; L478-L480 HydrophobicContact CG-CD1 4.42Å; L478-L480 HydrophobicContact CG-CD2 4.06Å; L478-L480 HydrophobicContact CG-CG 4.01Å; L480-Q484 HydrophobicContact CD2-CB 4.33Å; L480-Q484 HydrophobicContact CD2-CG 4.15Å; L480-Q486 HydrophobicContact CD2-CB 3.97Å
481	E	95.2	Very high	94.7	Very high	104 Å²	104	55.5 Å²	55.5	49%	0.486	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	173	161.6	-73.2	178.3	-161.7	0	0	111.2	P448 R449 D483 Q484	P448-E481 WeakPolarHBondContact O-CA 3.45Å; R449-E481 HydrophobicContact CG-CG 3.53Å; E481-D483 PolarHBondContact O-N 2.74Å; E481-Q484 HydrophobicContact CB-CB 4.11Å; E481-Q484 PolarHBondContact O-N 2.74Å
482	K	92	Very high	94	Very high	93 Å²	93	54.2 Å²	54.2	40%	0.404	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	124.4	177.9	-63.4	-175.1	-179.7	174.5	0	110.2	T435 L446 Q447 Q484	T435-K482 HydrophobicContact CG2-CB 4.1Å; T435-K482 HydrophobicContact CG2-CG 4.04Å; L446-K482 WeakPolarHBondContact O-CE 3.15Å; L446-K482 PolarHBondContact O-NZ 3.11Å; Q447-K482 WeakPolarHBondContact O-CE 3.46Å; K482-Q484 PolarHBondContact O-N 2.74Å
483	D	92.8	Very high	92.7	Very high	36 Å²	36	54.2 Å²	54.2	19%	0.193	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	13.8	178.7	-58.9	-79.4	0	0	0	115.1	K432 R433 N434 T435 L436 E481	K432-D483 VanDerWaalsContact CE-O 3.26Å; K432-D483 WeakPolarHBondContact CE-O 3.47Å; R433-D483 WeakPolarHBondContact O-CA 3.25Å; R433-D483 PolarHBondContact O-N 2.84Å; N434-D483 WeakPolarHBondContact CA-OD1 3.25Å; T435-D483 WeakPolarHBondContact CB-OD2 3.48Å; T435-D483 PolarHBondContact N-OD1 2.86Å; T435-D483 PolarHBondContact N-OD2 3Å; T435-D483 PolarHBondContact OG1-OD2 3.23Å; L436-D483 PolarHBondContact N-OD1 3Å; E481-D483 PolarHBondContact O-N 2.74Å
484	Q	95.8	Very high	91.4	Very high	72 Å²	72	63.7 Å²	63.7	34%	0.336	32%	0.317	S	S	.	.			trans	-67.5	134.4	172.3	-172.4	178.1	17.7	0	0	110.5	K432 R433 L480 E481 K482	K432-Q484 WeakPolarHBondContact CA-O 3.17Å; R433-Q484 PolarHBondContact N-O 2.78Å; L480-Q484 HydrophobicContact CD2-CB 4.33Å; L480-Q484 HydrophobicContact CD2-CG 4.15Å; E481-Q484 HydrophobicContact CB-CB 4.11Å; E481-Q484 PolarHBondContact O-N 2.74Å; K482-Q484 PolarHBondContact O-N 2.74Å
485	E	96.4	Very high	90	Very high	105 Å²	105	67 Å²	67	49%	0.491	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.9	172.8	-55.7	-166.7	-176.2	0	0	110	I430 F431 K432	I430-E485 HydrophobicContact CG2-CB 3.99Å; F431-E485 CarbonylContact O-C 3.41Å; F431-E485 WeakPolarHBondContact O-CA 3.35Å; K432-E485 HydrophobicContact CB-CG 3.96Å; K432-E485 HydrophobicContact CD-CG 3.75Å; K432-E485 WeakPolarHBondContact CD-OE1 3.48Å; K432-E485 WeakPolarHBondContact CE-OE1 3.46Å; K432-E485 HydrophobicContact CG-CG 3.79Å; K432-E485 IonicContact NZ-OE1 2.66Å; K432-E485 PolarHBondContact NZ-OE1 3.22Å
486	Q	97.4	Very high	89.5	Confident	84 Å²	84	66 Å²	66	39%	0.393	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	132	174.5	-171.3	162.1	-4.1	0	0	111.4	I430 F431 L478 L480 V488	I430-Q486 WeakPolarHBondContact CA-O 3.43Å; F431-Q486 PolarHBondContact N-O 3.26Å; F431-Q486 PolarHBondContact O-N 2.78Å; L478-Q486 HydrophobicContact CD1-CB 4.2Å; L478-Q486 HydrophobicContact CD1-CG 3.98Å; L480-Q486 HydrophobicContact CD2-CB 3.97Å; Q486-V488 PolarHBondContact O-N 3.24Å
487	V	97.1	Very high	89.2	Confident	76 Å²	76	65.7 Å²	65.7	46%	0.461	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	120.4	170.1	176.5	0	0	0	0	108.5	Y428 I430	Y428-V487 HydrophobicContact CD1-CG1 3.57Å; Y428-V487 HydrophobicContact CD1-CG2 4.36Å; Y428-V487 HydrophobicContact CE1-CG1 4.34Å; Y428-V487 HydrophobicContact CG-CG1 4.36Å; I430-V487 HydrophobicContact CG1-CG2 4.12Å
488	V	96.6	Very high	89.1	Confident	14 Å²	14	65.8 Å²	65.8	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-17.2	178.1	-64.6	0	0	0	0	113.3	I429 F431 F454 L456 T473 L478 Q486	I429-V488 HydrophobicContact CB-CG2 4.09Å; I429-V488 HydrophobicContact CG2-CG2 3.69Å; I429-V488 WeakPolarHBondContact O-CG2 3.47Å; I429-V488 PolarHBondContact O-N 3.13Å; F431-V488 HydrophobicContact CB-CG1 4.06Å; F431-V488 HydrophobicContact CD1-CG2 3.75Å; F431-V488 HydrophobicContact CD2-CB 4.38Å; F431-V488 HydrophobicContact CD2-CG1 3.67Å; F431-V488 HydrophobicContact CD2-CG2 4.02Å; F431-V488 HydrophobicContact CE1-CG2 3.78Å; F431-V488 HydrophobicContact CE2-CG1 4.2Å; F431-V488 HydrophobicContact CE2-CG2 4.03Å; F431-V488 HydrophobicContact CG-CG1 3.87Å; F431-V488 HydrophobicContact CG-CG2 3.86Å; F431-V488 HydrophobicContact CZ-CG2 3.91Å; F454-V488 HydrophobicContact CE2-CB 4.24Å; F454-V488 HydrophobicContact CZ-CB 4Å; F454-V488 HydrophobicContact CZ-CG1 3.96Å; L456-V488 HydrophobicContact CD2-CG2 4.2Å; T473-V488 WeakPolarHBondContact CG2-O 3.33Å; L478-V488 HydrophobicContact CD1-CG1 4.24Å; L478-V488 HydrophobicContact CD2-CG1 3.82Å; Q486-V488 PolarHBondContact O-N 3.24Å
489	M	95	Very high	89	Confident	21 Å²	21	67.3 Å²	67.3	10%	0.103	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	139.9	167.5	-164.4	175.3	-61	0	0	111.6	Y428 I429 L456 L458 R471 T473 L491	Y428-M489 CarbonylContact C-O 3.57Å; Y428-M489 WeakPolarHBondContact CA-O 3.31Å; I429-M489 HydrophobicContact CB-CB 4.28Å; I429-M489 HydrophobicContact CG1-CB 4.4Å; I429-M489 PolarHBondContact N-O 2.88Å; I429-M489 PolarHBondContact O-N 3.19Å; L456-M489 HydrophobicContact CD2-CB 4.44Å; L456-M489 HydrophobicContact CD2-CE 4.23Å; L456-M489 HydrophobicContact CG-CE 4.45Å; L458-M489 HydrophobicContact CD1-CE 3.6Å; L458-M489 HydrophobicContact CD1-SD 3.51Å; L458-M489 VanDerWaalsContact CD1-SD 3.51Å; R471-M489 HydrophobicContact CB-CE 4.44Å; R471-M489 HydrophobicContact CB-SD 3.83Å; T473-M489 HydrophobicContact CG2-CE 3.58Å; M489-L491 HydrophobicContact CG-CD2 4.06Å; M489-L491 HydrophobicContact CG-CG 4.46Å; M489-L491 HydrophobicContact SD-CD2 3.48Å; M489-L491 WeakPolarHBondContact SD-CD2 3.47Å; M489-L491 HydrophobicContact SD-CG 4.43Å
490	N	92.6	Very high	89	Confident	97 Å²	97	65.7 Å²	65.7	52%	0.519	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.2	163.9	-176.1	-5.8	0	0	0	108.6	Y428	Y428-N490 HydrophobicContact CD1-CB 3.85Å; Y428-N490 HydrophobicContact CE1-CB 3.64Å; Y428-N490 WeakPolarHBondContact CE1-ND2 3.46Å
491	L	87.3	Confident	89.1	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.021	33%	0.326	C	S	.	.			trans	-111.5	104.6	-178.2	-57.8	162.4	0	0	0	110	Y424 R427 I429 L458 R471 M489 S493 L496 L500	Y424-L491 HydrophobicContact CD2-CD1 4.17Å; Y424-L491 HydrophobicContact CE2-CD1 3.74Å; R427-L491 HydrophobicContact CB-CB 4.3Å; R427-L491 WeakPolarHBondContact CB-O 3.44Å; R427-L491 VanDerWaalsContact O-CB 3.23Å; R427-L491 WeakPolarHBondContact O-CB 3.31Å; R427-L491 WeakPolarHBondContact O-CG 3.45Å; R427-L491 PolarHBondContact O-N 2.86Å; I429-L491 HydrophobicContact CD1-CD1 4.48Å; I429-L491 HydrophobicContact CG1-CD1 4.21Å; L458-L491 HydrophobicContact CD1-CD2 4.43Å; L458-L491 HydrophobicContact CD2-CD1 3.81Å; L458-L491 HydrophobicContact CD2-CD2 3.9Å; R471-L491 HydrophobicContact CG-CD2 4.48Å; M489-L491 HydrophobicContact CG-CD2 4.06Å; M489-L491 HydrophobicContact CG-CG 4.46Å; M489-L491 HydrophobicContact SD-CD2 3.48Å; M489-L491 WeakPolarHBondContact SD-CD2 3.47Å; M489-L491 HydrophobicContact SD-CG 4.43Å; L491-S493 PolarHBondContact O-N 3.01Å; L491-L496 HydrophobicContact CB-CD1 3.72Å; L491-L496 HydrophobicContact CB-CD2 4.1Å; L491-L496 HydrophobicContact CB-CG 4.13Å; L491-L496 HydrophobicContact CD1-CD1 4.42Å; L491-L496 HydrophobicContact CD1-CD2 4.38Å; L491-L496 HydrophobicContact CD2-CD2 4.45Å; L491-L500 HydrophobicContact CD1-CD2 4.3Å
492	D	79.1	Confident	89.1	Confident	90 Å²	90	60.9 Å²	60.9	48%	0.481	30%	0.303	S	S	.	.			trans	-49.3	130.3	178.2	-176.9	-3.2	0	0	0	111.8	R494	D492-R494 VanDerWaalsContact C-N 3.27Å; D492-R494 PolarHBondContact O-N 3.4Å; D492-R494 PolarHBondContact OD1-N 3.21Å
493	S	67.6	Low	89.3	Confident	73 Å²	73	56.5 Å²	56.5	51%	0.51	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.8	-166.4	62.6	0	0	0	0	114	R427 L491 L495	R427-S493 VanDerWaalsContact NH1-CA 3.26Å; R427-S493 PolarHBondContact NH1-O 3.46Å; L491-S493 PolarHBondContact O-N 3.01Å; S493-L495 PolarHBondContact O-N 3.48Å
494	R	67.1	Low	89.4	Confident	220 Å²	220	54.8 Å²	54.8	83%	0.83	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.6	-170.4	-63.6	-178.7	177.9	-178.7	-0.4	115.1	D492	D492-R494 VanDerWaalsContact C-N 3.27Å; D492-R494 PolarHBondContact O-N 3.4Å; D492-R494 PolarHBondContact OD1-N 3.21Å
495	L	67.3	Low	89.4	Confident	98 Å²	98	51.4 Å²	51.4	51%	0.513	26%	0.259	S	S	.	.	S	Bend	trans	-127.8	4.8	-170.1	-62.5	175.2	0	0	0	114.5	S493 I497	S493-L495 PolarHBondContact O-N 3.48Å; L495-I497 PolarHBondContact O-N 3.36Å
496	L	83.4	Confident	89.2	Confident	29 Å²	29	46.4 Å²	46.4	15%	0.152	24%	0.236	C	C	.	.			trans	-77.2	117.8	176	-81.9	179.4	0	0	0	111.2	R427 L491 F498 L500	R427-L496 HydrophobicContact CB-CD1 4.25Å; R427-L496 HydrophobicContact CG-CD1 3.99Å; L491-L496 HydrophobicContact CB-CD1 3.72Å; L491-L496 HydrophobicContact CB-CD2 4.1Å; L491-L496 HydrophobicContact CB-CG 4.13Å; L491-L496 HydrophobicContact CD1-CD1 4.42Å; L491-L496 HydrophobicContact CD1-CD2 4.38Å; L491-L496 HydrophobicContact CD2-CD2 4.45Å; L496-F498 HydrophobicContact CB-CE2 4.26Å; L496-L500 HydrophobicContact CD2-CD1 3.99Å; L496-L500 HydrophobicContact CD2-CD2 3.89Å
497	I	90.6	Very high	88.9	Confident	71 Å²	71	43 Å²	43	36%	0.364	22%	0.22	S	C	.	.			trans	-112.6	134.9	175	-63.5	168.4	0	0	0	108.3	S460 I468 L495	S460-I497 VanDerWaalsContact CB-O 3.29Å; S460-I497 WeakPolarHBondContact CB-O 3.41Å; I468-I497 HydrophobicContact CB-CD1 4.28Å; I468-I497 HydrophobicContact CD1-CD1 4.37Å; I468-I497 HydrophobicContact CD1-CG2 4.2Å; I468-I497 HydrophobicContact CG2-CD1 3.51Å; L495-I497 PolarHBondContact O-N 3.36Å
498	F	92.5	Very high	88.4	Confident	52 Å²	52	39.4 Å²	39.4	23%	0.228	20%	0.198	C	C	.	.	S	Bend	trans	-105.7	147.6	179.1	-72.8	-91	0	0	0	111	L401 K403 D404 L496 L500	L401-F498 HydrophobicContact CB-CD1 4.42Å; L401-F498 HydrophobicContact CB-CE1 4.09Å; K403-F498 VanDerWaalsContact CA-CD1 3.5Å; K403-F498 WeakPolarHBondContact O-CD1 3.4Å; K403-F498 WeakPolarHBondContact O-CE1 3.31Å; D404-F498 HydrophobicContact CB-CD2 4.4Å; D404-F498 HydrophobicContact CB-CE2 3.71Å; D404-F498 HydrophobicContact CB-CZ 3.85Å; L496-F498 HydrophobicContact CB-CE2 4.26Å; F498-L500 HydrophobicContact CD1-CB 3.74Å; F498-L500 HydrophobicContact CE1-CB 3.68Å; F498-L500 HydrophobicContact CE1-CD2 4.24Å; F498-L500 HydrophobicContact CZ-CB 4.42Å; F498-L500 HydrophobicContact CZ-CD2 4.38Å
499	P	94.7	Very high	87.8	Confident	40 Å²	40	39.5 Å²	39.5	26%	0.26	20%	0.198	S	C	.	.	S	Bend	cis	-71.2	137.7	4.5	29.2	-35.4	0	0	0	113.5	K400 L401 Y501	K400-P499 HydrophobicContact CD-CB 4.46Å; K400-P499 VanDerWaalsContact CE-CB 3.43Å; K400-P499 HydrophobicContact CG-CB 4.21Å; L401-P499 CarbonylContact O-C 3.6Å; L401-P499 VanDerWaalsContact O-CA 3.25Å; L401-P499 WeakPolarHBondContact O-CA 3.47Å; L401-P499 WeakPolarHBondContact O-CB 3.35Å; P499-Y501 HydrophobicContact CB-CE2 4.25Å; P499-Y501 HydrophobicContact CG-CE2 3.85Å; P499-Y501 WeakPolarHBondContact O-CD2 3.45Å
500	L	94.3	Very high	87.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.7	179.6	-174.2	65.6	0	0	0	108.9	L401 Y424 L458 L491 L496 F498	L401-L500 HydrophobicContact CB-CB 4.34Å; L401-L500 PolarHBondContact N-O 3.42Å; L401-L500 PolarHBondContact O-N 3.19Å; Y424-L500 HydrophobicContact CE2-CD2 4.43Å; L458-L500 HydrophobicContact CB-CD1 4.26Å; L458-L500 HydrophobicContact CD2-CD1 4.27Å; L458-L500 HydrophobicContact CD2-CD2 3.79Å; L458-L500 HydrophobicContact CD2-CG 4.09Å; L491-L500 HydrophobicContact CD1-CD2 4.3Å; L496-L500 HydrophobicContact CD2-CD1 3.99Å; L496-L500 HydrophobicContact CD2-CD2 3.89Å; F498-L500 HydrophobicContact CD1-CB 3.74Å; F498-L500 HydrophobicContact CE1-CB 3.68Å; F498-L500 HydrophobicContact CE1-CD2 4.24Å; F498-L500 HydrophobicContact CZ-CB 4.42Å; F498-L500 HydrophobicContact CZ-CD2 4.38Å
501	Y	95.6	Very high	86.1	Confident	3 Å²	3	38.4 Å²	38.4	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	125.7	178.6	-65.1	-89.9	0	0	0	109.2	T242 H243 F267 M269 K400 L458 A459 F461 P499	T242-Y501 HydrophobicContact CG2-CD1 3.71Å; T242-Y501 HydrophobicContact CG2-CE1 3.99Å; T242-Y501 HydrophobicContact CG2-CG 4.34Å; H243-Y501 AromaticContact NE2-CZ 3.69Å; H243-Y501 PolarHBondContact NE2-OH 2.91Å; F267-Y501 WeakPolarHBondContact CZ-O 3.13Å; M269-Y501 HydrophobicContact CE-CD1 4.04Å; M269-Y501 HydrophobicContact SD-CD1 3.62Å; M269-Y501 HydrophobicContact SD-CE1 4.17Å; K400-Y501 HydrophobicContact CB-CD1 4.22Å; K400-Y501 HydrophobicContact CB-CE1 4.28Å; K400-Y501 HydrophobicContact CD-CD1 4.31Å; K400-Y501 HydrophobicContact CD-CE1 3.57Å; K400-Y501 WeakPolarHBondContact CE-OH 3.36Å; K400-Y501 HydrophobicContact CG-CD1 4.07Å; K400-Y501 HydrophobicContact CG-CE1 3.81Å; K400-Y501 PolarHBondContact NZ-OH 3.22Å; L458-Y501 CarbonylContact C-O 3.59Å; L458-Y501 VanDerWaalsContact CA-O 3.24Å; L458-Y501 WeakPolarHBondContact CA-O 3.38Å; A459-Y501 PolarHBondContact N-O 3.15Å; A459-Y501 WeakPolarHBondContact O-CB 3.48Å; A459-Y501 PolarHBondContact O-N 3.5Å; F461-Y501 AromaticContact CD2-CD2 3.44Å; F461-Y501 HydrophobicContact CD2-CD2 3.44Å; F461-Y501 VanDerWaalsContact CD2-CD2 3.44Å; F461-Y501 AromaticContact CD2-CE2 3.59Å; F461-Y501 HydrophobicContact CD2-CE2 3.59Å; F461-Y501 HydrophobicContact CD2-CG 4.16Å; F461-Y501 AromaticContact CE2-CD2 3.66Å; F461-Y501 HydrophobicContact CE2-CD2 3.66Å; F461-Y501 HydrophobicContact CE2-CE2 4.2Å; F461-Y501 AromaticContact CE2-CG 3.92Å; F461-Y501 HydrophobicContact CE2-CG 3.92Å; P499-Y501 HydrophobicContact CB-CE2 4.25Å; P499-Y501 HydrophobicContact CG-CE2 3.85Å; P499-Y501 WeakPolarHBondContact O-CD2 3.45Å
502	I	95.8	Very high	85.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128.4	179.3	-53.2	-178.6	0	0	0	107.4	G398 R399 L401 W409 I429 L456 L458	G398-I502 CarbonylContact C-O 3.57Å; G398-I502 WeakPolarHBondContact CA-O 3.39Å; R399-I502 HydrophobicContact CB-CB 4.48Å; R399-I502 PolarHBondContact N-O 3.29Å; R399-I502 PolarHBondContact O-N 3.19Å; L401-I502 HydrophobicContact CD1-CD1 3.76Å; L401-I502 HydrophobicContact CD2-CD1 4.46Å; L401-I502 HydrophobicContact CG-CD1 3.92Å; W409-I502 HydrophobicContact CH2-CD1 3.82Å; W409-I502 HydrophobicContact CZ2-CD1 4.26Å; I429-I502 HydrophobicContact CD1-CD1 3.8Å; L456-I502 HydrophobicContact CD1-CG2 3.6Å; L458-I502 HydrophobicContact CD2-CD1 4.2Å; L458-I502 HydrophobicContact CD2-CG1 3.86Å; L458-I502 HydrophobicContact CG-CG1 4.09Å; L458-I502 HydrophobicContact CG-CG2 4.43Å
503	C	95.8	Very high	84.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.1	171.9	178.1	0	0	0	0	108.4	F267 V268 C397 R457	F267-C503 HydrophobicContact CD1-CB 3.49Å; F267-C503 VanDerWaalsContact CD1-CB 3.49Å; F267-C503 HydrophobicContact CD2-CB 4.25Å; F267-C503 HydrophobicContact CE1-CB 3.36Å; F267-C503 HydrophobicContact CE2-CB 4.16Å; F267-C503 HydrophobicContact CG-CB 3.93Å; F267-C503 HydrophobicContact CZ-CB 3.71Å; V268-C503 PolarHBondContact N-SG 3.39Å; C397-C503 CarbonylContact O-C 3.56Å; C397-C503 WeakPolarHBondContact O-CA 3.49Å; R457-C503 PolarHBondContact N-O 3.15Å; R457-C503 PolarHBondContact NH2-SG 2.69Å; R457-C503 VanDerWaalsContact NH2-SG 3.45Å; R457-C503 PolarHBondContact O-N 2.93Å; R457-C503 VanDerWaalsContact O-O 3.07Å
504	C	95.8	Very high	83.7	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.4	176.8	-156.7	0	0	0	0	111.3	C397 W411 R455 L456 F506	C397-C504 PolarHBondContact N-O 3.35Å; C397-C504 VanDerWaalsContact N-O 3.07Å; C397-C504 PolarHBondContact O-N 3.19Å; C397-C504 PolarHBondContact SG-O 3.49Å; C397-C504 VanDerWaalsContact SG-O 3.4Å; W411-C504 HydrophobicContact CH2-CB 3.79Å; W411-C504 HydrophobicContact CZ2-CB 4.43Å; W411-C504 HydrophobicContact CZ3-CB 4.09Å; R455-C504 WeakPolarHBondContact O-CA 3.43Å; L456-C504 HydrophobicContact CD1-CB 3.74Å; C504-F506 HydrophobicContact CB-CD2 4.15Å; C504-F506 HydrophobicContact CB-CE2 3.48Å; C504-F506 VanDerWaalsContact CB-CE2 3.48Å; C504-F506 HydrophobicContact CB-CZ 3.94Å; C504-F506 WeakPolarHBondContact SG-CE2 3.43Å; C504-F506 WeakPolarHBondContact SG-CZ 3.4Å
505	N	95.3	Very high	82.1	Confident	2 Å²	2	55 Å²	55	1%	0.011	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.4	170.8	-68.9	89.3	0	0	0	107.6	S264 L390 S394 M395 F454 R455 R457	S264-N505 PolarHBondContact O-ND2 2.84Å; S264-N505 PolarHBondContact O-OD1 2.99Å; L390-N505 HydrophobicContact CD2-CB 3.77Å; S394-N505 PolarHBondContact OG-ND2 2.91Å; M395-N505 CarbonylContact O-C 3.6Å; M395-N505 VanDerWaalsContact O-CA 3.28Å; M395-N505 WeakPolarHBondContact O-CA 3.31Å; F454-N505 CarbonylContact C-O 3.51Å; F454-N505 WeakPolarHBondContact CA-O 3.22Å; F454-N505 WeakPolarHBondContact CB-O 3.35Å; R455-N505 HydrophobicContact CB-CB 4.38Å; R455-N505 PolarHBondContact N-O 2.79Å; R455-N505 PolarHBondContact O-N 3.36Å; R457-N505 PolarHBondContact NH2-OD1 2.84Å; R457-N505 VanDerWaalsContact NH2-OD1 3.08Å
506	F	91.8	Very high	82.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.4	179.5	-72.2	-74.6	0	0	0	114.4	S394 M395 C397 W411 L420 F431 I452 A453 F454 C504 Y508	S394-F506 CarbonylContact C-O 3.6Å; S394-F506 WeakPolarHBondContact CA-O 3.47Å; S394-F506 WeakPolarHBondContact CB-O 3.44Å; M395-F506 HydrophobicContact CB-CB 4.38Å; M395-F506 HydrophobicContact CE-CD2 4.08Å; M395-F506 PolarHBondContact N-O 3.14Å; M395-F506 PolarHBondContact O-N 2.79Å; C397-F506 VanDerWaalsContact SG-CD2 3.59Å; C397-F506 VanDerWaalsContact SG-CE2 3.59Å; W411-F506 HydrophobicContact CD2-CE2 4.34Å; W411-F506 HydrophobicContact CE3-CD2 4.42Å; W411-F506 AromaticContact CE3-CE2 3.39Å; W411-F506 HydrophobicContact CE3-CE2 3.39Å; W411-F506 AromaticContact CE3-CZ 3.88Å; W411-F506 HydrophobicContact CE3-CZ 3.88Å; W411-F506 HydrophobicContact CH2-CE2 4.21Å; W411-F506 AromaticContact CZ3-CE2 3.3Å; W411-F506 HydrophobicContact CZ3-CE2 3.3Å; W411-F506 AromaticContact CZ3-CZ 3.5Å; W411-F506 HydrophobicContact CZ3-CZ 3.5Å; L420-F506 HydrophobicContact CD2-CD1 4.27Å; L420-F506 HydrophobicContact CD2-CE1 3.52Å; L420-F506 HydrophobicContact CD2-CE2 4.03Å; L420-F506 HydrophobicContact CD2-CZ 3.37Å; F431-F506 HydrophobicContact CD2-CE1 4.39Å; F431-F506 HydrophobicContact CE1-CZ 4.44Å; F431-F506 AromaticContact CE2-CE1 3.61Å; F431-F506 HydrophobicContact CE2-CE1 3.61Å; F431-F506 AromaticContact CE2-CZ 3.71Å; F431-F506 HydrophobicContact CE2-CZ 3.71Å; F431-F506 HydrophobicContact CZ-CE1 4.01Å; F431-F506 AromaticContact CZ-CZ 3.6Å; F431-F506 HydrophobicContact CZ-CZ 3.6Å; I452-F506 HydrophobicContact CD1-CD1 3.96Å; I452-F506 HydrophobicContact CD1-CE1 3.77Å; A453-F506 CarbonylContact O-C 3.55Å; F454-F506 HydrophobicContact CB-CD1 3.55Å; F454-F506 HydrophobicContact CB-CE1 3.62Å; F454-F506 HydrophobicContact CB-CG 4.49Å; F454-F506 HydrophobicContact CD2-CE1 4.49Å; F454-F506 HydrophobicContact CG-CE1 4.2Å; C504-F506 HydrophobicContact CB-CD2 4.15Å; C504-F506 HydrophobicContact CB-CE2 3.48Å; C504-F506 VanDerWaalsContact CB-CE2 3.48Å; C504-F506 HydrophobicContact CB-CZ 3.94Å; C504-F506 WeakPolarHBondContact SG-CE2 3.43Å; C504-F506 WeakPolarHBondContact SG-CZ 3.4Å; F506-Y508 HydrophobicContact CB-CD2 4.4Å; F506-Y508 HydrophobicContact CB-CE1 4.33Å; F506-Y508 HydrophobicContact CB-CE2 3.68Å; F506-Y508 HydrophobicContact CG-CE1 4.49Å; F506-Y508 HydrophobicContact CG-CE2 4.45Å; F506-Y508 AromaticContact CG-CZ 3.93Å
507	L	91.4	Very high	82.8	Confident	11 Å²	11	54.2 Å²	54.2	6%	0.058	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.1	166.2	-171	69	0	0	0	109.5	P382 E389 I452 A453 I509	P382-L507 HydrophobicContact CG-CB 4.35Å; P382-L507 HydrophobicContact CG-CD2 3.97Å; P382-L507 HydrophobicContact CG-CG 3.97Å; E389-L507 HydrophobicContact CG-CD2 4.14Å; E389-L507 WeakPolarHBondContact OE1-CD2 3.43Å; I452-L507 WeakPolarHBondContact CA-O 3.3Å; A453-L507 HydrophobicContact CB-CB 4.38Å; A453-L507 PolarHBondContact N-O 3.44Å; A453-L507 PolarHBondContact O-N 3Å; L507-I509 WeakPolarHBondContact CG-O 3.39Å
508	Y	87.1	Confident	82.4	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.008	26%	0.264	C	S	.	.			trans	-105.5	-16.8	-170.6	-60.2	-79.4	0	0	0	114.7	M395 N415 F418 R450 I452 F506	M395-Y508 HydrophobicContact CB-CE2 4.28Å; M395-Y508 HydrophobicContact CE-CE2 3.98Å; M395-Y508 WeakPolarHBondContact CE-OH 3.45Å; M395-Y508 HydrophobicContact SD-CE2 4.24Å; N415-Y508 HydrophobicContact CB-CD1 4.17Å; N415-Y508 HydrophobicContact CB-CD2 3.89Å; N415-Y508 HydrophobicContact CB-CE1 4.31Å; N415-Y508 HydrophobicContact CB-CE2 4.02Å; N415-Y508 HydrophobicContact CB-CG 3.98Å; F418-Y508 HydrophobicContact CB-CD1 3.96Å; F418-Y508 HydrophobicContact CB-CE1 4.48Å; F418-Y508 HydrophobicContact CD1-CD1 4.07Å; F418-Y508 HydrophobicContact CD1-CE1 4Å; F418-Y508 AromaticContact CG-CD1 3.94Å; F418-Y508 HydrophobicContact CG-CD1 3.94Å; F418-Y508 HydrophobicContact CG-CE1 4.34Å; R450-Y508 PolarHBondContact NH2-O 3.04Å; I452-Y508 HydrophobicContact CG2-CD1 3.52Å; I452-Y508 HydrophobicContact CG2-CE1 3.94Å; I452-Y508 HydrophobicContact CG2-CG 4.49Å; F506-Y508 HydrophobicContact CB-CD2 4.4Å; F506-Y508 HydrophobicContact CB-CE1 4.33Å; F506-Y508 HydrophobicContact CB-CE2 3.68Å; F506-Y508 HydrophobicContact CG-CE1 4.49Å; F506-Y508 HydrophobicContact CG-CE2 4.45Å; F506-Y508 AromaticContact CG-CZ 3.93Å
509	I	84.2	Confident	81.8	Confident	15 Å²	15	53.3 Å²	53.3	8%	0.077	27%	0.266	C	S	.	.	S	Bend	trans	-139.6	140.8	-177.5	-75.9	-172.3	0	0	0	106.8	A370 A374 F416 L507	A370-I509 HydrophobicContact CB-CD1 4.1Å; A370-I509 WeakPolarHBondContact O-CD1 3.34Å; A374-I509 HydrophobicContact CB-CD1 3.83Å; F416-I509 HydrophobicContact CB-CD1 3.74Å; F416-I509 HydrophobicContact CB-CG1 4.44Å; F416-I509 HydrophobicContact CD1-CD1 3.93Å; F416-I509 HydrophobicContact CD2-CD1 3.2Å; F416-I509 HydrophobicContact CD2-CG1 3.72Å; F416-I509 HydrophobicContact CE1-CD1 4.28Å; F416-I509 HydrophobicContact CE2-CD1 3.62Å; F416-I509 HydrophobicContact CE2-CG1 4.2Å; F416-I509 HydrophobicContact CG-CD1 3.33Å; F416-I509 HydrophobicContact CG-CG1 4.23Å; F416-I509 HydrophobicContact CZ-CD1 4.11Å; L507-I509 WeakPolarHBondContact CG-O 3.39Å
510	S	80.1	Confident	81	Confident	34 Å²	34	54.1 Å²	54.1	24%	0.238	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-72.4	137.3	172.7	-34.2	0	0	0	0	109	E379	E379-S510 WeakPolarHBondContact OE1-CB 3.47Å; E379-S510 PolarHBondContact OE1-N 2.65Å; E379-S510 PolarHBondContact OE1-OG 2.93Å
511	P	71.8	Confident	80.1	Confident	61 Å²	61	57.7 Å²	57.7	40%	0.396	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-61.2	156.1	174.4	30	-37.6	0	0	0	110.2	E389 K513	E389-P511 HydrophobicContact CG-CG 3.93Å; E389-P511 WeakPolarHBondContact OE1-CD 3.19Å; E389-P511 VanDerWaalsContact OE2-CG 3.31Å; E389-P511 WeakPolarHBondContact OE2-CG 3.3Å; P511-K513 PolarHBondContact O-N 3.33Å
512	E	69.6	Low	79	Confident	118 Å²	118	61.6 Å²	61.6	55%	0.551	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-61.5	124.7	174	-67	172.6	-173.2	0	0	108.6	R373 K514	R373-E512 IonicContact CZ-OE1 2.8Å; R373-E512 VanDerWaalsContact CZ-OE1 3.27Å; R373-E512 IonicContact NE-OE1 3.13Å; R373-E512 PolarHBondContact NE-OE1 2.94Å; R373-E512 IonicContact NH2-OE1 2.97Å; R373-E512 PolarHBondContact NH2-OE1 2.86Å; E512-K514 PolarHBondContact O-N 3.35Å; E512-K514 VanDerWaalsContact O-N 3.07Å
513	K	62.2	Low	77.7	Confident	185 Å²	185	66.3 Å²	66.3	80%	0.804	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-57	118.2	166.3	-68.2	-176	178.9	-178	0	106.4	P511 N515	P511-K513 PolarHBondContact O-N 3.33Å; K513-N515 VanDerWaalsContact C-N 3.34Å; K513-N515 PolarHBondContact O-N 3.5Å
514	K	52	Low	76.2	Confident	212 Å²	212	71.8 Å²	71.8	92%	0.922	35%	0.354	S	S	*	.			trans	-66.7	100.1	169.4	-69.6	-176.4	178.7	-179.8	0	106.8	E512	E512-K514 PolarHBondContact O-N 3.35Å; E512-K514 VanDerWaalsContact O-N 3.07Å
515	N	33.3	Very low	74.4	Confident	222 Å²	222	78.4 Å²	78.4	100%	1.187	39%	0.387	S	S	*	.			trans	-66.9	0	170.2	-68.5	-19.5	0	0	0	110.6	K513	K513-N515 VanDerWaalsContact C-N 3.34Å; K513-N515 PolarHBondContact O-N 3.5Å

Retrieved 515 of 515 residues in 152.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).