A0A087XJA9_POEFO Loading...

Glucocorticoid receptor

AlphaFold DB , UniProt , Accession A0A087XJA9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 765 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	31.7	Very low	33.7	Very low	227 Å²	227	141.3 Å²	141.3	100%	1.118	82%	0.823	S	S	*	*				0	93.9	0	-63.2	163	-175.3	0	0	107.3
2	D	34.9	Very low	33.7	Very low	134 Å²	134	148.5 Å²	148.5	72%	0.717	83%	0.826	S	S	*	*			cis	-148.8	134.4	-2.2	-85.7	-47.1	0	0	0	108.4
3	Q	34.9	Very low	33.6	Very low	180 Å²	180	147.1 Å²	147.1	84%	0.841	82%	0.816	S	S	*	*				67.2	117.9	79.4	-72.3	-126	70.3	0	0	115.4
4	G	30.9	Very low	33.8	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	81%	0.813	S	S	*	*			trans	70.1	112	136.9	0	0	0	0	0	119.6
5	G	33	Very low	33.7	Very low	76 Å²	76	146.5 Å²	146.5	78%	0.784	81%	0.809	S	S	*	*			trans	-107.6	162.5	151.6	0	0	0	0	0	111.2
6	P	45.5	Very low	33.5	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	81%	0.807	S	S	*	*			trans	-137.3	125.5	153	34.4	-19	0	0	0	115.8
7	K	35.8	Very low	33.3	Very low	185 Å²	185	144.5 Å²	144.5	80%	0.804	80%	0.799	S	S	*	*			trans	16.8	143.1	137.4	-62.4	-178.5	177.3	-178.3	0	122.8
8	H	32.8	Very low	33	Very low	162 Å²	162	147.3 Å²	147.3	75%	0.75	80%	0.803	S	S	*	*			trans	66.9	157.8	146.9	-76.2	-62.9	0	0	0	117.8
9	N	29.2	Very low	32.8	Very low	152 Å²	152	144.4 Å²	144.4	81%	0.813	80%	0.8	S	S	*	*			cis	-150.9	166.2	-2.6	-137.7	1.3	0	0	0	110.8
10	G	30.7	Very low	32.5	Very low	72 Å²	72	141 Å²	141	74%	0.742	80%	0.8	S	S	*	*			trans	164.9	91.7	165.6	0	0	0	0	0	117.3
11	N	31.3	Very low	32.4	Very low	163 Å²	163	142.6 Å²	142.6	87%	0.872	80%	0.804	S	S	*	*			trans	-83.7	142.7	168.2	-96	-4.3	0	0	0	111.6
12	R	33.7	Very low	32.3	Very low	228 Å²	228	142 Å²	142	86%	0.86	79%	0.789	S	S	*	*			trans	-158.6	132.1	132	-142.9	169.6	170.7	145.6	-2	112.2
13	N	32.8	Very low	32.8	Very low	130 Å²	130	141 Å²	141	70%	0.695	79%	0.79	S	S	*	*			trans	-88	168.2	166.5	-59.4	-24.3	0	0	0	109.5
14	D	36.4	Very low	32.7	Very low	144 Å²	144	140.2 Å²	140.2	77%	0.77	79%	0.787	S	S	*	*				-161	152.3	125.7	-90.4	-38.2	0	0	0	110.1
15	N	31.2	Very low	32.7	Very low	141 Å²	141	143 Å²	143	75%	0.754	79%	0.788	S	S	*	*			trans	-100	173.1	177.4	-56.7	-62.1	0	0	0	109.3
16	L	31.3	Very low	32.5	Very low	149 Å²	149	142.3 Å²	142.3	78%	0.78	78%	0.781	S	S	*	*				-178.9	136.5	61.1	-105.8	126.5	0	0	0	111.9
17	T	29.5	Very low	31.9	Very low	110 Å²	110	147.3 Å²	147.3	68%	0.675	78%	0.784	S	S	*	*			trans	42.2	139.4	136.9	57.3	0	0	0	0	126.5
18	F	27.9	Very low	31.6	Very low	196 Å²	196	144.8 Å²	144.8	86%	0.86	78%	0.779	S	S	*	*			trans	94.6	102.6	131.6	-98.9	-116.6	0	0	0	124.3
19	A	29.3	Very low	31.4	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	78%	0.779	S	S	*	*				43.8	132.9	120.7	0	0	0	0	0	124.9
20	G	27.3	Very low	31.5	Very low	77 Å²	77	141 Å²	141	79%	0.794	78%	0.777	S	S	*	*			trans	90.7	147.6	154.8	0	0	0	0	0	115.6
21	I	29.9	Very low	31.4	Very low	174 Å²	174	144.7 Å²	144.7	89%	0.892	78%	0.779	S	S	*	*			cis	-151.8	165.4	17.1	-91.3	161.8	0	0	0	110.2
22	R	29.3	Very low	31.4	Very low	214 Å²	214	143 Å²	143	81%	0.808	78%	0.776	S	S	*	*			trans	-80.9	161.8	177.4	-132.7	-167.7	-178.3	-173	1.5	112.1
23	P	46.7	Very low	31.3	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	77%	0.773	S	S	*	*				-150.6	163.6	71.4	36	-14.6	0	0	0	117.9
24	E	32.5	Very low	31.1	Very low	164 Å²	164	135.1 Å²	135.1	77%	0.766	78%	0.778	S	S	*	*			trans	33.9	165	151	-49.5	-165	142.5	0	0	123.1
25	V	31.1	Very low	30.7	Very low	136 Å²	136	136.4 Å²	136.4	82%	0.824	78%	0.783	S	S	*	*			cis	-145.8	143.3	16.1	-176.8	0	0	0	0	111.3
26	G	29.5	Very low	30.5	Very low	62 Å²	62	137.1 Å²	137.1	64%	0.639	79%	0.786	S	S	*	*			trans	99.2	106	134.1	0	0	0	0	0	123.4
27	R	32.4	Very low	30.3	Very low	231 Å²	231	137.9 Å²	137.9	87%	0.872	79%	0.79	S	S	*	*			trans	66.3	146.5	141.9	-66.3	-174.6	178.9	-161	3	119.7
28	D	28.4	Very low	30.1	Very low	132 Å²	132	141.1 Å²	141.1	71%	0.706	80%	0.798	S	S	*	*			cis	-153.4	157.6	-2.9	-113.1	-25.4	0	0	0	113.5
29	S	29	Very low	31	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	79%	0.787	S	S	*	*			trans	56.2	103.3	155.1	-152	0	0	0	0	121.7
30	V	30.8	Very low	30.9	Very low	128 Å²	128	137.7 Å²	137.7	78%	0.776	79%	0.786	S	S	*	*				173.3	124.7	100.3	162.3	0	0	0	0	109.5
31	N	30	Very low	30.9	Very low	149 Å²	149	141 Å²	141	80%	0.797	78%	0.782	S	S	*	*			trans	-161.1	173.1	170.6	-99.2	-37.8	0	0	0	106.8
32	T	31	Very low	30.8	Very low	129 Å²	129	141.1 Å²	141.1	79%	0.791	78%	0.778	S	S	*	*			cis	-158.7	163.5	34.5	-40.9	0	0	0	0	111.8
33	S	31.1	Very low	30.6	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	77%	0.772	S	S	*	*			trans	-68.9	175.9	167.5	-30.5	0	0	0	0	114.4
34	G	28.5	Very low	30.6	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	78%	0.777	S	S	*	*			trans	144.9	124.8	139.8	0	0	0	0	0	118.6
35	L	29.1	Very low	30.4	Very low	170 Å²	170	134.5 Å²	134.5	89%	0.89	77%	0.772	S	S	*	*			trans	-59.4	139.7	167.7	-66.5	152.2	0	0	0	113.1
36	L	26.2	Very low	31.4	Very low	156 Å²	156	134.2 Å²	134.2	82%	0.817	77%	0.773	S	S	*	*				169.8	153.6	118.5	-95.4	162.2	0	0	0	114.6
37	L	26.3	Very low	31.4	Very low	165 Å²	165	134.4 Å²	134.4	86%	0.864	78%	0.775	S	S	*	*			trans	71.5	158.8	156.8	-67.3	162.1	0	0	0	121.1
38	Q	25.9	Very low	31.4	Very low	178 Å²	178	129 Å²	129	83%	0.832	77%	0.773	S	S	*	*			trans	-140.8	175.6	-177	-117.7	-169.2	21.3	0	0	106.7
39	P	47.3	Very low	31.5	Very low	97 Å²	97	127.2 Å²	127.2	63%	0.63	78%	0.776	S	S	*	*			cis	-136.7	-152.1	-15.7	37.3	-16.2	0	0	0	112.5
40	T	27.5	Very low	31.6	Very low	119 Å²	119	127.9 Å²	127.9	73%	0.73	77%	0.772	S	S	*	*			trans	76.3	147.7	161.7	9	0	0	0	0	116.7
41	M	26.4	Very low	31.5	Very low	146 Å²	146	129.7 Å²	129.7	72%	0.719	77%	0.771	S	S	*	*			cis	-141.8	150.2	12	-75.1	-84.7	-84.1	0	0	111.9
42	H	27.3	Very low	31.4	Very low	176 Å²	176	126.6 Å²	126.6	82%	0.815	76%	0.762	S	S	*	*				177.3	164.7	108.8	-110.5	-84.8	0	0	0	114.8
43	L	26.6	Very low	31.3	Very low	130 Å²	130	126.5 Å²	126.5	68%	0.681	76%	0.761	S	S	*	*			trans	-126.9	171.7	-170.5	-147.8	77.6	0	0	0	111.4	S45	L43-S45 VanDerWaalsContact CD2-OG 3.24Å; L43-S45 WeakPolarHBondContact CD2-OG 3.44Å
44	P	45.2	Very low	31.1	Very low	128 Å²	128	127.9 Å²	127.9	83%	0.831	76%	0.764	S	S	*	*				-147	170.3	93.3	38	-20.7	0	0	0	117.1
45	S	29.3	Very low	31.1	Very low	94 Å²	94	128.3 Å²	128.3	66%	0.657	76%	0.76	S	S	*	*			trans	-102	-147.6	-179.3	-40.4	0	0	0	0	111.6	L43	L43-S45 VanDerWaalsContact CD2-OG 3.24Å; L43-S45 WeakPolarHBondContact CD2-OG 3.44Å
46	P	52.8	Low	31.8	Very low	130 Å²	130	125.5 Å²	125.5	84%	0.844	75%	0.752	S	S	*	*			cis	-119.2	176.8	15.7	41.3	-26	0	0	0	115.3
47	G	29.4	Very low	31.9	Very low	66 Å²	66	125.8 Å²	125.8	68%	0.68	76%	0.755	S	S	*	*			cis	-147	-128.4	5	0	0	0	0	0	110.6
48	S	31.9	Very low	32	Very low	119 Å²	119	121.9 Å²	121.9	83%	0.832	75%	0.754	S	S	*	*			cis	163.6	151.2	-25.4	45.2	0	0	0	0	108.8
49	A	30.3	Very low	32.1	Very low	94 Å²	94	123.3 Å²	123.3	78%	0.777	76%	0.761	S	S	*	*			cis	-174.6	-180	-22.2	0	0	0	0	0	106.4
50	N	29.8	Very low	31.1	Very low	120 Å²	120	122.5 Å²	122.5	64%	0.642	77%	0.77	S	S	*	*			cis	-165.8	141.7	-2.7	-149.3	27.8	0	0	0	111.9
51	Q	29.7	Very low	31.2	Very low	165 Å²	165	119.9 Å²	119.9	77%	0.771	77%	0.767	S	S	*	*			trans	52.9	161.5	137.7	-72	175.5	28.4	0	0	123.6
52	S	28.2	Very low	31.5	Very low	85 Å²	85	119.4 Å²	119.4	59%	0.594	77%	0.772	S	S	*	*			cis	-176.1	154.8	-20.3	179.7	0	0	0	0	113.8
53	T	27.7	Very low	31.7	Very low	127 Å²	127	118.7 Å²	118.7	78%	0.779	77%	0.767	S	S	*	*			trans	61.8	144.9	147.9	37.8	0	0	0	0	124.8
54	V	28.8	Very low	32.1	Very low	144 Å²	144	117 Å²	117	87%	0.873	76%	0.758	S	S	*	*			trans	145.7	148.1	133.5	168.8	0	0	0	0	113.6
55	A	26.7	Very low	31.4	Very low	86 Å²	86	119.2 Å²	119.2	71%	0.711	76%	0.757	S	S	*	*			trans	-140.3	164.9	170.9	0	0	0	0	0	107.9
56	P	44.9	Very low	31.5	Very low	111 Å²	111	117.8 Å²	117.8	72%	0.721	76%	0.757	S	S	*	*			cis	-154.3	-165.3	46.3	44.3	-21.4	0	0	0	117.4
57	N	28.6	Very low	30.7	Very low	162 Å²	162	119.9 Å²	119.9	87%	0.866	76%	0.756	S	S	*	*			trans	48	134.6	150.1	-66.2	-7.4	0	0	0	123.5
58	G	26.9	Very low	30.7	Very low	82 Å²	82	124 Å²	124	85%	0.845	76%	0.761	S	S	*	*			trans	-179.6	130.5	160.2	0	0	0	0	0	114.5
59	Q	29.6	Very low	30.4	Very low	209 Å²	209	121.9 Å²	121.9	98%	0.977	76%	0.759	S	S	*	*			trans	-88.8	165.8	-175.3	-59.8	163.6	-50.8	0	0	113.5
60	G	26.6	Very low	30.3	Very low	80 Å²	80	121 Å²	121	83%	0.825	76%	0.758	S	S	*	*			trans	169.7	49.2	162.5	0	0	0	0	0	123.6
61	G	29.4	Very low	30.1	Very low	64 Å²	64	123.5 Å²	123.5	66%	0.66	77%	0.771	S	S	*	*			trans	69.9	127.1	141.6	0	0	0	0	0	124.6
62	T	31	Very low	30	Very low	135 Å²	135	124.7 Å²	124.7	83%	0.828	77%	0.774	S	S	*	*				67.2	142.5	127.8	55.5	0	0	0	0	121.7
63	K	33.2	Very low	29.9	Very low	162 Å²	162	129.6 Å²	129.6	70%	0.704	79%	0.787	S	S	*	*			cis	-163.1	161.5	-4.1	-130.7	171	162.2	-84.7	0	113.7
64	D	33.5	Very low	29.8	Very low	94 Å²	94	129 Å²	129	50%	0.503	79%	0.789	S	S	.	*			trans	67.3	123.4	145.9	-70.9	-42.5	0	0	0	124.6
65	Q	31.8	Very low	29.7	Very low	174 Å²	174	129.1 Å²	129.1	81%	0.813	78%	0.784	S	S	*	*			trans	71.1	138.1	131	-63.9	163	43.1	0	0	121
66	G	31.8	Very low	29.8	Very low	64 Å²	64	133 Å²	133	66%	0.66	79%	0.785	S	S	*	*			cis	167.4	146.2	-10.7	0	0	0	0	0	115.7
67	E	34.6	Very low	28.9	Very low	175 Å²	175	136.7 Å²	136.7	82%	0.818	79%	0.793	S	S	*	*			trans	60	147.5	139.4	-71.7	-168.4	119.8	0	0	121.5
68	L	29.8	Very low	28.8	Very low	151 Å²	151	132.8 Å²	132.8	79%	0.791	79%	0.791	S	S	*	*			cis	-136.9	153.2	-4.1	-93	132.1	0	0	0	107.4
69	G	26.5	Very low	28.8	Very low	76 Å²	76	138.1 Å²	138.1	78%	0.784	79%	0.791	S	S	*	*				88.4	134.5	72.1	0	0	0	0	0	111.4
70	G	26.8	Very low	28.6	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	78%	0.78	S	S	*	*			cis	120.5	109.8	-6.9	0	0	0	0	0	114.2
71	L	26.2	Very low	28.4	Very low	173 Å²	173	135.8 Å²	135.8	91%	0.906	77%	0.772	S	S	*	*			trans	-168.4	172.7	150.1	-133	72.7	0	0	0	114.1
72	F	26.8	Very low	28.3	Very low	191 Å²	191	143.3 Å²	143.3	84%	0.838	78%	0.78	S	S	*	*			trans	-84.5	161.7	174.1	-74.1	-117	0	0	0	111.7
73	E	26	Very low	28.1	Very low	187 Å²	187	143.5 Å²	143.5	87%	0.874	77%	0.773	S	S	*	*				-178.8	168.3	102.8	-96.6	-169.4	117.5	0	0	113
74	S	27.3	Very low	27.9	Very low	115 Å²	115	143.1 Å²	143.1	80%	0.804	77%	0.774	S	S	*	*			trans	-111.5	142.6	176.7	-57.2	0	0	0	0	110.1
75	D	26	Very low	27.6	Very low	146 Å²	146	146 Å²	146	78%	0.781	78%	0.782	S	S	*	*			trans	-158.4	-176.7	141.7	-135.9	-29.4	0	0	0	113.7
76	K	28.6	Very low	27.4	Very low	168 Å²	168	144 Å²	144	73%	0.73	77%	0.773	S	S	*	*			trans	-94.1	171	-158.3	-63.6	154.1	-171	156.2	0	116.7
77	E	25.4	Very low	27.2	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.883	78%	0.776	S	S	*	*			trans	11.5	119.5	143	-56.8	174.6	95.9	0	0	118.6
78	G	27	Very low	26.9	Very low	80 Å²	80	148.6 Å²	148.6	83%	0.825	78%	0.777	S	S	*	*			trans	-160.5	75	178.9	0	0	0	0	0	115.8
79	K	26.7	Very low	26.8	Very low	194 Å²	194	147.8 Å²	147.8	84%	0.843	77%	0.774	S	S	*	*			trans	-57.1	151.2	177.6	-110.2	174.1	175.1	173.4	0	115.3
80	I	25.2	Very low	26.9	Very low	145 Å²	145	150.8 Å²	150.8	74%	0.744	77%	0.77	S	S	*	*			trans	98.3	115	137.9	-75.3	165.5	0	0	0	122.2
81	S	23.7	Very low	26.9	Very low	94 Å²	94	156 Å²	156	66%	0.657	77%	0.772	S	S	*	*			trans	89.2	131	136.9	-86.8	0	0	0	0	126.1
82	R	26.8	Very low	26.8	Very low	223 Å²	223	152.1 Å²	152.1	84%	0.842	76%	0.76	S	S	*	*			trans	75.7	152	140.2	-73.4	177.8	174.5	177.1	-2.1	117.8
83	M	26.1	Very low	26.8	Very low	138 Å²	138	153.6 Å²	153.6	68%	0.68	76%	0.761	S	S	*	*			cis	-155.4	177.2	11	-135.4	156.7	67.8	0	0	113.2
84	H	30.1	Very low	26.8	Very low	154 Å²	154	147.9 Å²	147.9	71%	0.713	75%	0.752	S	S	*	*			trans	75.5	143.2	164.5	-81.4	-156.4	0	0	0	118.3
85	K	27.6	Very low	26.8	Very low	154 Å²	154	149.8 Å²	149.8	67%	0.67	75%	0.753	S	S	*	*			cis	-163.9	154.8	-10.5	-157.9	-166.2	175.4	-156.1	0	112.3
86	Q	26.7	Very low	26.9	Very low	134 Å²	134	148.8 Å²	148.8	63%	0.626	76%	0.758	S	S	*	*			trans	81.1	90.1	147.7	-113.7	175.3	-45.6	0	0	123.1
87	E	28.1	Very low	26.9	Very low	156 Å²	156	148 Å²	148	73%	0.729	76%	0.761	S	S	*	*				37.8	121.4	117.5	-58	156.3	113.8	0	0	122.4
88	Q	28.4	Very low	27.6	Very low	178 Å²	178	144.8 Å²	144.8	83%	0.832	76%	0.757	S	S	*	*				-178.9	115	103.3	-93.5	177.3	-9.8	0	0	108.8
89	D	28	Very low	27.7	Very low	135 Å²	135	148.5 Å²	148.5	72%	0.722	76%	0.757	S	S	*	*				71.9	131.4	85.2	-76.4	-29.7	0	0	0	113.6
90	I	28	Very low	27.6	Very low	138 Å²	138	147.6 Å²	147.6	71%	0.708	76%	0.76	S	S	*	*			cis	-155.4	169.7	8	-150.8	146.6	0	0	0	107.4
91	F	25.7	Very low	27.7	Very low	184 Å²	184	147.8 Å²	147.8	81%	0.807	76%	0.762	S	S	*	*			cis	-143.9	-126.5	30.2	-146	-18.7	0	0	0	114.5
92	S	25.4	Very low	27.8	Very low	92 Å²	92	151.8 Å²	151.8	64%	0.643	77%	0.771	S	S	*	*			trans	-158.5	-179.8	-153	-162.3	0	0	0	0	118.3
93	Y	25.7	Very low	27.8	Very low	221 Å²	221	146.3 Å²	146.3	87%	0.867	77%	0.767	S	S	*	*			trans	83.3	133.5	174.1	-66.4	-82.6	0	0	0	118.5
94	G	27.2	Very low	27.8	Very low	67 Å²	67	145.9 Å²	145.9	69%	0.691	77%	0.772	S	S	*	*			cis	-172.3	163.3	-3	0	0	0	0	0	114.9
95	D	27.2	Very low	27.7	Very low	155 Å²	155	143 Å²	143	83%	0.829	77%	0.77	S	S	*	*			trans	-61.7	154.3	-164.4	-49.9	-74	0	0	0	118.5
96	S	26.7	Very low	27.8	Very low	126 Å²	126	142.9 Å²	142.9	88%	0.881	78%	0.776	S	S	*	*				174.9	141.2	111.8	-76.2	0	0	0	0	114.8
97	L	28.6	Very low	28	Very low	152 Å²	152	142 Å²	142	80%	0.796	78%	0.779	S	S	*	*			trans	-143.2	151.2	167.3	-121.3	175.4	0	0	0	107.9
98	P	40	Very low	27.9	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	78%	0.777	S	S	*	*				-151.5	169.8	104	38.5	-21.1	0	0	0	116.5
99	L	29.2	Very low	28.1	Very low	158 Å²	158	139.2 Å²	139.2	83%	0.827	77%	0.771	S	S	*	*			trans	-85.2	162.8	167.9	-80.7	147.2	0	0	0	112.5
100	L	25.2	Very low	28	Very low	174 Å²	174	138.1 Å²	138.1	91%	0.911	77%	0.769	S	S	*	*			trans	-147.4	170.7	156.1	-111.8	172.5	0	0	0	112
101	N	26.7	Very low	28	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	77%	0.767	S	S	*	*			trans	-120	176.9	-147.5	-109.4	-14	0	0	0	117.3
102	Q	27.3	Very low	28	Very low	178 Å²	178	133.7 Å²	133.7	83%	0.832	77%	0.768	S	S	*	*			trans	-60.1	156.4	-174.9	-56.3	162.8	-24.2	0	0	117.9
103	S	26.4	Very low	28.1	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	78%	0.776	S	S	*	*			trans	-178.2	119.7	140.5	-98.6	0	0	0	0	109.7
104	T	26.6	Very low	28.1	Very low	129 Å²	129	130.3 Å²	130.3	79%	0.791	77%	0.771	S	S	*	*				56.4	131.8	86.1	61.7	0	0	0	0	114.5
105	S	27.7	Very low	28	Very low	95 Å²	95	135 Å²	135	66%	0.664	78%	0.778	S	S	*	*			cis	-167.5	151.9	27.8	51.7	0	0	0	0	115.3
106	D	29	Very low	27.9	Very low	150 Å²	150	134.3 Å²	134.3	80%	0.802	78%	0.775	S	S	*	*			trans	60.3	151.2	137.9	-59.2	-19.7	0	0	0	122.5
107	V	30.5	Very low	27.9	Very low	115 Å²	115	134 Å²	134	70%	0.697	77%	0.768	S	S	*	*			cis	-163.8	155.6	-3.9	118.9	0	0	0	0	112.7
108	D	27.5	Very low	27.8	Very low	127 Å²	127	131.7 Å²	131.7	68%	0.679	76%	0.764	S	S	*	*			trans	62.7	154.5	161	-83.1	6.6	0	0	0	121.7
109	Q	30.9	Very low	27.5	Very low	149 Å²	149	135.4 Å²	135.4	70%	0.696	77%	0.771	S	S	*	*			cis	-154.7	162.6	7.5	-136	168.4	64.5	0	0	115.9
110	T	27.6	Very low	27.7	Very low	113 Å²	113	134.1 Å²	134.1	69%	0.693	77%	0.77	S	S	*	*			trans	69.6	110.7	152.5	41.6	0	0	0	0	124.5
111	S	27	Very low	27.9	Very low	95 Å²	95	130.9 Å²	130.9	66%	0.664	76%	0.762	S	S	*	*				96	101	117.2	-61.7	0	0	0	0	123.3
112	T	26.7	Very low	28.3	Very low	134 Å²	134	131.4 Å²	131.4	82%	0.822	77%	0.77	S	S	*	*				39.9	139	125.2	59.7	0	0	0	0	121.1
113	S	26.3	Very low	28.7	Very low	116 Å²	116	127.9 Å²	127.9	81%	0.811	76%	0.756	S	S	*	*			cis	-158.9	168.6	46.5	55.4	0	0	0	0	114.2
114	V	25.8	Very low	28.8	Very low	126 Å²	126	126 Å²	126	76%	0.764	76%	0.755	S	S	*	*			trans	-109.6	135	-177.5	174	0	0	0	0	110.7	N116	V114-N116 HydrophobicContact CG1-CB 4.03Å
115	I	24.7	Very low	29	Very low	164 Å²	164	127.4 Å²	127.4	84%	0.841	76%	0.757	S	S	*	*			trans	-124.8	123.2	145.7	-62.8	-177.7	0	0	0	106.5
116	N	25.9	Very low	29.3	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	75%	0.748	S	S	*	*			trans	-109.8	129.4	-176.7	-172.5	14.8	0	0	0	109.3	V114	V114-N116 HydrophobicContact CG1-CB 4.03Å
117	T	26.3	Very low	29.4	Very low	119 Å²	119	125.4 Å²	125.4	73%	0.73	75%	0.745	S	S	*	*			trans	-127.4	84.4	178.4	52	0	0	0	0	111.5
118	S	26.6	Very low	29.5	Very low	104 Å²	104	125.6 Å²	125.6	73%	0.727	74%	0.741	S	S	*	*			trans	46.2	98.6	144.5	-51.8	0	0	0	0	118.6	T120	S118-T120 PolarHBondContact O-N 3.39Å
119	E	33	Very low	29.8	Very low	198 Å²	198	124.4 Å²	124.4	93%	0.925	74%	0.74	S	S	*	*			trans	-60.4	121.2	161	-58.4	178.5	128	0	0	111.3
120	T	33.9	Very low	30	Very low	132 Å²	132	123.5 Å²	123.5	81%	0.81	74%	0.74	S	S	*	*			trans	-156.5	72.8	155.5	31.8	0	0	0	0	110.7	S118	S118-T120 PolarHBondContact O-N 3.39Å
121	S	29.9	Very low	30.6	Very low	106 Å²	106	122.7 Å²	122.7	74%	0.741	73%	0.731	S	S	*	*			trans	-157.5	100	168	-80.1	0	0	0	0	111.1	L123	S121-L123 PolarHBondContact O-N 3.26Å
122	V	34	Very low	31.3	Very low	159 Å²	159	124.1 Å²	124.1	96%	0.964	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	71	175.8	-172.6	0	0	0	0	109
123	L	36.8	Very low	31.4	Very low	104 Å²	104	122.9 Å²	122.9	55%	0.545	72%	0.72	S	S	.	*	T	Hydrogen-bonded Turn	trans	-139	-6.7	-178.6	-116	166.4	0	0	0	113.5	S121 N125	S121-L123 PolarHBondContact O-N 3.26Å; L123-N125 VanDerWaalsContact C-N 3.33Å; L123-N125 PolarHBondContact O-N 2.93Å
124	G	28.7	Very low	31.8	Very low	70 Å²	70	126.3 Å²	126.3	72%	0.722	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	9.9	-174.2	0	0	0	0	0	116.8
125	N	30.5	Very low	31.9	Very low	157 Å²	157	129.2 Å²	129.2	84%	0.84	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	30.6	-170.5	-78.2	-52.3	0	0	0	114.8	L123	L123-N125 VanDerWaalsContact C-N 3.33Å; L123-N125 PolarHBondContact O-N 2.93Å
126	L	33.4	Very low	32	Very low	92 Å²	92	128.9 Å²	128.9	48%	0.482	73%	0.727	S	S	.	*	S	Bend	trans	-91.2	120.9	152	-75.3	176.8	0	0	0	108.3	L128 I723	L126-L128 PolarHBondContact O-N 3.06Å; L126-I723 HydrophobicContact CD1-CD1 4.19Å
127	P	31.6	Very low	32	Very low	112 Å²	112	131.2 Å²	131.2	73%	0.727	73%	0.73	S	S	*	*			trans	-69.9	105.2	174.5	28.4	-32.5	0	0	0	109.3	P129	P127-P129 WeakPolarHBondContact O-CD 3.24Å
128	L	33	Very low	32	Very low	118 Å²	118	134.4 Å²	134.4	62%	0.618	74%	0.737	S	S	*	*			trans	-94.4	83.9	160.9	-86.3	154.4	0	0	0	108.3	L126 L131 Y726	L126-L128 PolarHBondContact O-N 3.06Å; L128-L131 HydrophobicContact CD2-CD1 4.45Å; L128-Y726 HydrophobicContact CD2-CD2 4.42Å
129	P	32.8	Very low	32	Very low	103 Å²	103	138.7 Å²	138.7	67%	0.669	75%	0.745	S	S	*	*			trans	-64.5	151.8	158.8	32.5	-34.5	0	0	0	108.7	P127 L131	P127-P129 WeakPolarHBondContact O-CD 3.24Å; P129-L131 PolarHBondContact O-N 3.01Å; P129-L131 VanDerWaalsContact O-N 3.13Å
130	D	36.6	Very low	31.7	Very low	129 Å²	129	132.8 Å²	132.8	69%	0.69	74%	0.738	S	S	*	*			trans	-47.5	115.7	-169.4	-62.9	-74.8	0	0	0	114.5	F132 P133	D130-F132 PolarHBondContact O-N 2.93Å; D130-P133 HydrophobicContact CB-CG 4.13Å
131	L	38.5	Very low	31.4	Very low	96 Å²	96	134 Å²	134	50%	0.503	74%	0.738	S	S	.	*	S	Bend	trans	-66.5	-11.5	161.8	-76.7	172.8	0	0	0	112.2	L128 P129 V729	L128-L131 HydrophobicContact CD2-CD1 4.45Å; P129-L131 PolarHBondContact O-N 3.01Å; P129-L131 VanDerWaalsContact O-N 3.13Å; L131-V729 HydrophobicContact CD2-CG1 4.13Å
132	F	42.1	Very low	31	Very low	125 Å²	125	138.3 Å²	138.3	55%	0.548	74%	0.743	S	S	.	*	S	Bend	trans	-146.1	79.8	179.7	-60.4	-81.1	0	0	0	112.4	D130 Q134 K753	D130-F132 PolarHBondContact O-N 2.93Å; F132-Q134 PolarHBondContact O-N 2.77Å; F132-Q134 VanDerWaalsContact O-N 3.16Å; F132-K753 VanDerWaalsContact CD2-NZ 3.25Å; F132-K753 HydrophobicContact CE2-CD 4.12Å; F132-K753 HydrophobicContact CZ-CD 4.48Å
133	P	29.4	Very low	30.5	Very low	108 Å²	108	135.7 Å²	135.7	70%	0.701	73%	0.732	S	S	*	*			trans	-60.7	116.9	170.5	-21.2	33.2	0	0	0	111	D130 Q135	D130-P133 HydrophobicContact CB-CG 4.13Å; P133-Q135 PolarHBondContact O-N 3.32Å
134	Q	34.8	Very low	30	Very low	188 Å²	188	138.3 Å²	138.3	88%	0.879	75%	0.746	S	S	*	*			trans	-73.4	116.3	172.6	-75.2	-174.4	-17.5	0	0	110.8	F132	F132-Q134 PolarHBondContact O-N 2.77Å; F132-Q134 VanDerWaalsContact O-N 3.16Å
135	Q	28.4	Very low	29.9	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	74%	0.74	S	S	*	*			trans	-167.9	168	147.4	-114.3	166.4	58.5	0	0	113.2	P133	P133-Q135 PolarHBondContact O-N 3.32Å
136	I	25.8	Very low	29.8	Very low	156 Å²	156	140.5 Å²	140.5	80%	0.8	73%	0.733	S	S	*	*			trans	81.5	112.7	-177.9	-51.2	174.5	0	0	0	113.7
137	K	26.8	Very low	29.5	Very low	192 Å²	192	145.2 Å²	145.2	84%	0.835	75%	0.753	S	S	*	*			cis	-156.8	160.3	-17.6	-133	169.3	-173.2	177.5	0	110.8
138	Q	25.6	Very low	29.3	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	76%	0.76	S	S	*	*			trans	-58.9	147.6	170.8	-173.6	172.7	8	0	0	111.9
139	E	27.1	Very low	29	Very low	193 Å²	193	146 Å²	146	90%	0.902	77%	0.77	S	S	*	*			trans	-59	141.9	177.7	-63	-176.5	127.7	0	0	112.4
140	G	25.4	Very low	28.7	Very low	75 Å²	75	147.7 Å²	147.7	77%	0.773	77%	0.773	S	S	*	*			trans	-153.2	86.9	179.4	0	0	0	0	0	111.3
141	I	27.5	Very low	28.3	Very low	157 Å²	157	152.6 Å²	152.6	81%	0.805	78%	0.783	S	S	*	*			trans	-68.4	127.2	173.8	-60.8	167.1	0	0	0	109
142	F	22.6	Very low	27.6	Very low	196 Å²	196	151.7 Å²	151.7	86%	0.86	80%	0.797	S	S	*	*			trans	-171.3	176.4	139.5	-101.8	-59.5	0	0	0	112.4
143	S	23.5	Very low	26.9	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	81%	0.808	S	S	*	*			trans	-99.7	150	-147.2	-52.4	0	0	0	0	118.2
144	L	26.2	Very low	26.8	Very low	159 Å²	159	153.5 Å²	153.5	83%	0.832	82%	0.818	S	S	*	*			trans	-6.7	126.7	134.4	-178.2	76.1	0	0	0	117.6
145	D	26.5	Very low	26.4	Very low	111 Å²	111	149.7 Å²	149.7	59%	0.594	82%	0.819	S	S	*	*				-170.1	174.1	104.6	-145.1	-15.4	0	0	0	112.3
146	K	29	Very low	26.2	Very low	163 Å²	163	144.5 Å²	144.5	71%	0.709	82%	0.816	S	S	*	*			trans	-7.2	156.6	164.4	-72.2	155	-160.1	128	0	121
147	E	25.5	Very low	26.3	Very low	191 Å²	191	144.8 Å²	144.8	89%	0.893	83%	0.825	S	S	*	*			cis	-147.1	169.9	48.9	-94	-163.9	152.6	0	0	118.7
148	L	27.4	Very low	26.1	Very low	168 Å²	168	138.9 Å²	138.9	88%	0.88	82%	0.818	S	S	*	*			trans	-63.3	147.5	-178.7	179.8	71.1	0	0	0	115.8
149	G	26.5	Very low	26	Very low	79 Å²	79	135.4 Å²	135.4	81%	0.814	82%	0.815	S	S	*	*			trans	-162.6	104.5	170	0	0	0	0	0	114.2
150	N	27.7	Very low	26	Very low	138 Å²	138	132.3 Å²	132.3	74%	0.738	81%	0.813	S	S	*	*			trans	-96.7	141.5	-171.4	-177.1	55.9	0	0	0	113.3
151	Y	27	Very low	25.9	Very low	231 Å²	231	134.4 Å²	134.4	91%	0.906	82%	0.815	S	S	*	*			trans	179.8	159.1	142.4	-100.6	-64.9	0	0	0	111.2
152	G	25.3	Very low	26.1	Very low	77 Å²	77	134.6 Å²	134.6	79%	0.794	82%	0.817	S	S	*	*			trans	-165.8	169.7	176.4	0	0	0	0	0	113.7
153	G	26.4	Very low	26.2	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	82%	0.82	S	S	*	*			trans	171.5	114.1	177.8	0	0	0	0	0	116.6
154	Q	27.1	Very low	26.5	Very low	195 Å²	195	131.7 Å²	131.7	91%	0.911	82%	0.819	S	S	*	*			trans	39.1	111.6	150	-66.2	-178.7	-55.8	0	0	122.5
155	A	26.8	Very low	26.5	Very low	108 Å²	108	129.9 Å²	129.9	89%	0.893	82%	0.819	S	S	*	*				50.2	116.5	120.7	0	0	0	0	0	121.8
156	G	25.3	Very low	26.5	Very low	79 Å²	79	130.5 Å²	130.5	81%	0.814	83%	0.828	S	S	*	*			trans	-156.9	140.3	156.8	0	0	0	0	0	110.3
157	V	27	Very low	26.8	Very low	163 Å²	163	128 Å²	128	99%	0.988	84%	0.837	S	S	*	*			trans	-101.8	127	-175.9	174.7	0	0	0	0	110.8
158	G	23	Very low	27	Very low	68 Å²	68	126.3 Å²	126.3	70%	0.701	83%	0.829	S	S	*	*			trans	166.7	125.5	164.9	0	0	0	0	0	116.8
159	S	23.6	Very low	27.5	Very low	113 Å²	113	127 Å²	127	79%	0.79	83%	0.833	S	S	*	*			trans	68.4	105.4	157.2	-166.4	0	0	0	0	120.6
160	C	27.3	Very low	27.7	Very low	127 Å²	127	130.3 Å²	130.3	86%	0.858	83%	0.83	S	S	*	*			trans	34.3	112.9	130.8	-51.3	0	0	0	0	120.5
161	S	22.8	Very low	28	Very low	119 Å²	119	129.5 Å²	129.5	83%	0.832	83%	0.826	S	S	*	*			trans	-148.9	172.4	144.6	-164.5	0	0	0	0	110
162	L	30.8	Very low	28.4	Very low	162 Å²	162	124.4 Å²	124.4	85%	0.848	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-75.9	140.5	-177.2	-66.1	73.6	0	0	0	111.7
163	D	24.9	Very low	29	Very low	170 Å²	170	122.9 Å²	122.9	91%	0.909	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-96.5	136.9	149.9	-99.2	-41.6	0	0	0	109
164	G	29.8	Very low	29.4	Very low	69 Å²	69	123.1 Å²	123.1	71%	0.711	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-100.6	131.8	177.1	0	0	0	0	0	111.6
165	S	26.9	Very low	30.3	Very low	120 Å²	120	118.1 Å²	118.1	84%	0.839	76%	0.756	S	S	*	*			trans	-159.1	71.4	172.2	-80.9	0	0	0	0	112.3
166	T	27.4	Very low	30.9	Very low	125 Å²	125	114.6 Å²	114.6	77%	0.767	72%	0.72	S	S	*	*			trans	-138.9	51.7	168.8	-24.4	0	0	0	0	112.2	Q168	T166-Q168 PolarHBondContact O-N 2.89Å
167	A	34.3	Very low	31.6	Very low	110 Å²	110	116.2 Å²	116.2	91%	0.909	71%	0.706	S	S	*	*			trans	-82.9	65.8	159.4	0	0	0	0	0	109.2
168	Q	30.6	Very low	32	Very low	156 Å²	156	115.5 Å²	115.5	73%	0.729	70%	0.697	S	S	*	*			trans	-116.3	124.2	166.7	-75.2	-170.6	-72.5	0	0	108.6	T166	T166-Q168 PolarHBondContact O-N 2.89Å
169	L	36.9	Very low	32.8	Very low	182 Å²	182	114.6 Å²	114.6	95%	0.953	68%	0.676	S	S	*	*			trans	-65.1	128.6	164.9	-61.7	162.3	0	0	0	106.9
170	I	31.6	Very low	33.3	Very low	148 Å²	148	116 Å²	116	76%	0.759	67%	0.674	S	S	*	*			trans	-105.9	140.2	172.6	-64	175.8	0	0	0	106.4	D172	I170-D172 PolarHBondContact O-N 3.49Å
171	D	32.9	Very low	33.7	Very low	121 Å²	121	116.9 Å²	116.9	65%	0.647	67%	0.669	S	S	*	*			trans	-59.6	129.4	-169.1	-91.1	-80.4	0	0	0	114	A173	D171-A173 HydrophobicContact CB-CB 4.46Å; D171-A173 PolarHBondContact O-N 2.79Å
172	D	36.8	Very low	34	Very low	125 Å²	125	116.7 Å²	116.7	67%	0.668	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	4.3	170.8	-78.2	-64.7	0	0	0	113.6	I170	I170-D172 PolarHBondContact O-N 3.49Å
173	A	37	Very low	34.2	Very low	44 Å²	44	116.7 Å²	116.7	36%	0.364	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105	-25.5	-170.3	0	0	0	0	0	114.9	D171 Q177	D171-A173 HydrophobicContact CB-CB 4.46Å; D171-A173 PolarHBondContact O-N 2.79Å; A173-Q177 WeakPolarHBondContact O-CG 3.22Å; A173-Q177 PolarHBondContact O-NE2 3.37Å
174	D	35.6	Very low	34.5	Very low	81 Å²	81	114 Å²	114	43%	0.433	66%	0.661	S	S	.	*	G	3₁₀ helix	trans	-78.4	-36.6	-162.7	-71.1	-14.4	0	0	0	113.7	W176 Q177 D178	D174-W176 PolarHBondContact O-N 3.1Å; D174-Q177 PolarHBondContact O-N 3.15Å; D174-Q177 PolarHBondContact OD1-NE2 2.92Å; D174-Q177 VanDerWaalsContact OD1-NE2 3.15Å; D174-D178 PolarHBondContact O-N 2.97Å
175	I	44.5	Very low	34.4	Very low	90 Å²	90	118.6 Å²	118.6	46%	0.462	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-56.7	-27	178.2	-62.5	175.1	0	0	0	112.2
176	W	39.6	Very low	34.5	Very low	34 Å²	34	118.4 Å²	118.4	13%	0.129	66%	0.664	C	S	.	*	G	3₁₀ helix	trans	-95.2	-6.4	-178.5	-64.4	107	0	0	0	114.6	D174 V559 V563 K567 M740 E743 I744	D174-W176 PolarHBondContact O-N 3.1Å; W176-V559 HydrophobicContact CH2-CG1 4.1Å; W176-V563 HydrophobicContact CE3-CG1 4.12Å; W176-V563 HydrophobicContact CE3-CG2 4.24Å; W176-V563 HydrophobicContact CH2-CG2 3.97Å; W176-V563 HydrophobicContact CZ3-CB 4.13Å; W176-V563 HydrophobicContact CZ3-CG1 4.03Å; W176-V563 HydrophobicContact CZ3-CG2 3.38Å; W176-K567 PolarHBondContact O-NZ 2.98Å; W176-M740 HydrophobicContact CH2-CE 3.65Å; W176-M740 HydrophobicContact CH2-CG 4.13Å; W176-M740 HydrophobicContact CH2-SD 3.87Å; W176-M740 HydrophobicContact CZ2-CE 4.34Å; W176-M740 HydrophobicContact CZ2-CG 4.44Å; W176-M740 HydrophobicContact CZ3-CE 3.81Å; W176-M740 HydrophobicContact CZ3-SD 4.4Å; W176-E743 PolarHBondContact NE1-OE1 3.09Å; W176-I744 HydrophobicContact CH2-CD1 4.31Å; W176-I744 HydrophobicContact CZ2-CD1 4.23Å; W176-I744 HydrophobicContact CZ2-CG1 4.47Å
177	Q	41.1	Very low	34.5	Very low	114 Å²	114	121.5 Å²	121.5	53%	0.533	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	-39.6	177.2	-70.2	175.5	90.3	0	0	112.4	A173 D174 L179	A173-Q177 WeakPolarHBondContact O-CG 3.22Å; A173-Q177 PolarHBondContact O-NE2 3.37Å; D174-Q177 PolarHBondContact O-N 3.15Å; D174-Q177 PolarHBondContact OD1-NE2 2.92Å; D174-Q177 VanDerWaalsContact OD1-NE2 3.15Å; Q177-L179 PolarHBondContact O-N 3.09Å
178	D	35.2	Very low	34.2	Very low	147 Å²	147	124.2 Å²	124.2	79%	0.786	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	17.2	-174.8	-91.8	-6.2	0	0	0	116.7	D174	D174-D178 PolarHBondContact O-N 2.97Å
179	L	39.6	Very low	34.1	Very low	50 Å²	50	122 Å²	122	26%	0.262	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.5	7.8	178.4	-74.6	176.1	0	0	0	114.6	Q177 I560	Q177-L179 PolarHBondContact O-N 3.09Å; L179-I560 HydrophobicContact CD1-CG2 4.42Å; L179-I560 HydrophobicContact CD2-CG2 4.33Å
180	D	34.2	Very low	34	Very low	141 Å²	141	117.8 Å²	117.8	75%	0.754	66%	0.661	S	S	*	*			trans	-76.2	121.6	179.3	-88.9	0.7	0	0	0	112.8
181	L	34.4	Very low	33.8	Very low	146 Å²	146	120.3 Å²	120.3	76%	0.764	67%	0.666	S	S	*	*			trans	-127	154.6	172.7	-84.7	172.1	0	0	0	109.1
182	P	30	Very low	33.7	Very low	116 Å²	116	124 Å²	124	75%	0.753	68%	0.679	S	S	*	*			trans	-67.7	133.9	-141	20.1	-33.4	0	0	0	116.6	S184	P182-S184 PolarHBondContact O-N 3.36Å
183	N	36	Very low	33.7	Very low	162 Å²	162	126.2 Å²	126.2	87%	0.866	69%	0.691	S	S	*	*			trans	-61.2	116.7	175.2	-72.9	-50.6	0	0	0	112.8
184	S	29.6	Very low	33.3	Very low	113 Å²	113	131.5 Å²	131.5	79%	0.79	71%	0.713	S	S	*	*			trans	-160	60	162.3	54.4	0	0	0	0	114.9	P182	P182-S184 PolarHBondContact O-N 3.36Å
185	L	27.8	Very low	33.3	Very low	166 Å²	166	133.2 Å²	133.2	87%	0.869	73%	0.731	S	S	*	*	S	Bend	trans	-133.3	144.6	154.9	-91.4	168.8	0	0	0	108.5
186	P	29.1	Very low	32.6	Very low	115 Å²	115	138.1 Å²	138.1	75%	0.747	75%	0.752	S	S	*	*			trans	-73	133.7	-158.2	27.4	-35	0	0	0	113.4
187	E	26.6	Very low	32.3	Very low	191 Å²	191	143.2 Å²	143.2	89%	0.893	79%	0.787	S	S	*	*			trans	-61.3	131.9	174.3	-60.8	174.6	115.7	0	0	111.3
188	I	29.8	Very low	31.9	Very low	167 Å²	167	142.1 Å²	142.1	86%	0.856	80%	0.797	S	S	*	*			trans	-99.1	98.3	162.1	-60.4	179.3	0	0	0	106.3	A190	I188-A190 PolarHBondContact O-N 3.19Å; I188-A190 VanDerWaalsContact O-N 3.14Å
189	S	28.5	Very low	31.7	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	80%	0.8	S	S	*	*			trans	-60.1	111.2	-175.8	56.5	0	0	0	0	112.1	F191	S189-F191 PolarHBondContact O-N 3.43Å
190	A	33.4	Very low	31.3	Very low	93 Å²	93	149 Å²	149	77%	0.769	83%	0.827	S	S	*	*			trans	-91.2	76.7	178.9	0	0	0	0	0	111.7	I188	I188-A190 PolarHBondContact O-N 3.19Å; I188-A190 VanDerWaalsContact O-N 3.14Å
191	F	27.8	Very low	31	Very low	201 Å²	201	150.1 Å²	150.1	88%	0.882	83%	0.833	S	S	*	*			trans	-144.5	98.1	171.6	-88.6	-71.9	0	0	0	112.6	S189	S189-F191 PolarHBondContact O-N 3.43Å
192	E	30.8	Very low	30.8	Very low	197 Å²	197	148.5 Å²	148.5	92%	0.921	83%	0.829	S	S	*	*			trans	-179.2	80.1	141.1	-105.9	-170	168.5	0	0	108.2
193	L	36.5	Very low	30.8	Very low	173 Å²	173	149.8 Å²	149.8	91%	0.906	83%	0.828	S	S	*	*			trans	-147.7	44.9	172.7	-154.9	88	0	0	0	113.1
194	D	28.8	Very low	30.6	Very low	154 Å²	154	150.8 Å²	150.8	82%	0.824	83%	0.833	S	S	*	*			trans	-144.3	89.8	172.2	-124.2	-28.8	0	0	0	111.3
195	S	35.3	Very low	30.6	Very low	117 Å²	117	153.3 Å²	153.3	82%	0.818	83%	0.832	S	S	*	*	S	Bend	trans	-168.6	42.4	172.1	-176.8	0	0	0	0	113.4
196	E	31.4	Very low	30.6	Very low	193 Å²	193	154 Å²	154	90%	0.902	83%	0.831	S	S	*	*	S	Bend	trans	-156.9	29.2	165.4	-122.7	162.5	-158.2	0	0	115.8
197	V	33.3	Very low	30.4	Very low	142 Å²	142	154.8 Å²	154.8	86%	0.861	84%	0.839	S	S	*	*	S	Bend	trans	-123.5	54.1	173	-163.5	0	0	0	0	111.3
198	A	32.5	Very low	30.4	Very low	90 Å²	90	148.3 Å²	148.3	74%	0.744	82%	0.824	S	S	*	*	S	Bend	trans	-141.3	6.8	178.7	0	0	0	0	0	114.8
199	H	30.8	Very low	30.3	Very low	182 Å²	182	146.2 Å²	146.2	84%	0.843	82%	0.824	S	S	*	*	S	Bend	trans	-146.3	102.1	175.1	-78.3	-45.2	0	0	0	111.7
200	L	30	Very low	30.2	Very low	159 Å²	159	145 Å²	145	83%	0.832	83%	0.828	S	S	*	*			trans	161.7	37.3	141	-86.6	168.1	0	0	0	113.2	T202	L200-T202 PolarHBondContact O-N 2.97Å
201	D	29.2	Very low	29.8	Very low	165 Å²	165	144.5 Å²	144.5	88%	0.882	83%	0.833	S	S	*	*	S	Bend	trans	-94.3	44.6	160.1	-163.6	25.9	0	0	0	110.8
202	T	29.1	Very low	29.9	Very low	113 Å²	113	142.2 Å²	142.2	69%	0.693	83%	0.825	S	S	*	*	S	Bend	trans	-157.9	148.4	177	-48.2	0	0	0	0	107.6	L200	L200-T202 PolarHBondContact O-N 2.97Å
203	I	30.6	Very low	29.8	Very low	142 Å²	142	140.6 Å²	140.6	73%	0.728	82%	0.815	S	S	*	*			trans	73.9	47.6	-170	-37	175.9	0	0	0	113.1
204	L	32.5	Very low	29.3	Very low	183 Å²	183	137 Å²	137	96%	0.958	80%	0.804	S	S	*	*				-89.6	59.2	128.9	-102.4	179.3	0	0	0	109.4
205	Q	29.1	Very low	29.3	Very low	166 Å²	166	136.8 Å²	136.8	78%	0.776	80%	0.802	S	S	*	*	S	Bend	trans	-155.8	120.5	168.1	-113.9	161.4	25.1	0	0	112
206	E	27.3	Very low	28.9	Very low	180 Å²	180	139.4 Å²	139.4	84%	0.841	81%	0.806	S	S	*	*			trans	47.3	111.4	158.1	-52	-157	150.1	0	0	121.5
207	S	26.1	Very low	28.6	Very low	132 Å²	132	133.8 Å²	133.8	92%	0.923	80%	0.8	S	S	*	*			trans	-92.2	89.3	145.1	60.7	0	0	0	0	109.6
208	G	26.2	Very low	28.4	Very low	56 Å²	56	135.3 Å²	135.3	58%	0.577	80%	0.803	S	S	*	*			trans	-111.8	23.4	-165.2	0	0	0	0	0	117.9
209	S	27	Very low	28.1	Very low	122 Å²	122	134.7 Å²	134.7	85%	0.853	81%	0.806	S	S	*	*			trans	76	142.6	174.9	83.8	0	0	0	0	119.5
210	G	26.1	Very low	28.2	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	80%	0.803	S	S	*	*			trans	82.8	136.7	148.1	0	0	0	0	0	119.6
211	G	26.5	Very low	28.3	Very low	83 Å²	83	130.3 Å²	130.3	86%	0.856	80%	0.802	S	S	*	*			trans	127	142.5	160.1	0	0	0	0	0	116
212	E	29.2	Very low	28.2	Very low	154 Å²	154	127.1 Å²	127.1	72%	0.72	79%	0.792	S	S	*	*			trans	-105.1	157.7	-174.4	-56.5	-168.8	91.1	0	0	114.6
213	K	29.5	Very low	28.3	Very low	163 Å²	163	129.7 Å²	129.7	71%	0.709	80%	0.8	S	S	*	*			trans	63.4	108.9	141.6	-72.7	157.6	-174.4	154.2	0	121.3
214	S	25.9	Very low	28.3	Very low	98 Å²	98	126 Å²	126	69%	0.685	80%	0.797	S	S	*	*				96.4	123.3	104.7	-159.5	0	0	0	0	122.8
215	L	27	Very low	28.2	Very low	148 Å²	148	124.9 Å²	124.9	78%	0.775	79%	0.791	S	S	*	*			trans	79.6	122.4	148	-67.8	159.8	0	0	0	123.7
216	L	26.9	Very low	28.3	Very low	172 Å²	172	124.2 Å²	124.2	90%	0.901	79%	0.793	S	S	*	*			trans	53.7	139.6	139.6	-99.7	76.7	0	0	0	124.1
217	G	25.9	Very low	28.5	Very low	75 Å²	75	118.9 Å²	118.9	77%	0.773	79%	0.786	S	S	*	*			trans	150.5	102.4	141.4	0	0	0	0	0	119.5
218	N	28.1	Very low	28.8	Very low	174 Å²	174	119.1 Å²	119.1	93%	0.93	78%	0.782	S	S	*	*			trans	-59	162.7	176.3	-52.9	-22.6	0	0	0	116.9
219	G	27.8	Very low	29	Very low	78 Å²	78	124.3 Å²	124.3	80%	0.804	79%	0.791	S	S	*	*			trans	163.4	60.3	150.5	0	0	0	0	0	125.3
220	A	31.7	Very low	29.2	Very low	94 Å²	94	124.8 Å²	124.8	78%	0.777	78%	0.78	S	S	*	*			trans	44.6	132.4	141.9	0	0	0	0	0	126.8
221	N	31.9	Very low	29.5	Very low	154 Å²	154	127.5 Å²	127.5	82%	0.824	77%	0.77	S	S	*	*				85	130.9	128.3	-79.2	10.2	0	0	0	127.4
222	C	27.7	Very low	29.7	Very low	99 Å²	99	131 Å²	131	67%	0.669	77%	0.765	S	S	*	*			trans	92.6	108.4	135	-71.4	0	0	0	0	126.2
223	I	30.9	Very low	29.7	Very low	167 Å²	167	130.3 Å²	130.3	86%	0.856	77%	0.765	S	S	*	*				57.8	124.8	123.1	-55.7	165.5	0	0	0	122.9
224	G	30.7	Very low	29.5	Very low	64 Å²	64	128.1 Å²	128.1	66%	0.66	77%	0.765	S	S	*	*				133.6	112.7	122.8	0	0	0	0	0	124.8
225	L	29.9	Very low	29.8	Very low	160 Å²	160	131.1 Å²	131.1	84%	0.838	77%	0.768	S	S	*	*			trans	75.9	124.2	132.6	-56.8	174.7	0	0	0	127.1
226	N	32.6	Very low	30	Very low	151 Å²	151	131 Å²	131	81%	0.807	76%	0.764	S	S	*	*				68.8	126.3	129.7	-64.2	3.5	0	0	0	128.3
227	G	30.7	Very low	30.1	Very low	68 Å²	68	129.4 Å²	129.4	70%	0.701	75%	0.751	S	S	*	*			trans	84.6	164.8	133	0	0	0	0	0	121.3
228	T	33.1	Very low	30.3	Very low	138 Å²	138	133.5 Å²	133.5	85%	0.847	75%	0.75	S	S	*	*			cis	-170.4	171.3	-29.8	-2.6	0	0	0	0	111.1
229	E	30.3	Very low	30.2	Very low	164 Å²	164	131.3 Å²	131.3	77%	0.766	74%	0.738	S	S	*	*			trans	72	165.4	165.6	-55.6	-161	107.7	0	0	120.9
230	Q	31.3	Very low	30	Very low	133 Å²	133	136.4 Å²	136.4	62%	0.621	74%	0.741	S	S	*	*			cis	-162.9	149.9	-39.6	-97.7	-159.1	63	0	0	113.3
231	Q	31	Very low	29.8	Very low	141 Å²	141	139.9 Å²	139.9	66%	0.659	74%	0.741	S	S	*	*			trans	63.8	137.1	147	-70.3	-166.3	40.8	0	0	127.9
232	Q	31.5	Very low	29.5	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	75%	0.746	S	S	*	*			trans	72	151.2	138	-78	-169	23.6	0	0	122.5
233	L	28.9	Very low	29.3	Very low	138 Å²	138	145.9 Å²	145.9	72%	0.723	75%	0.754	S	S	*	*			cis	-167.6	168.1	-8.9	-173.1	71.1	0	0	0	112
234	V	26.3	Very low	30	Very low	118 Å²	118	143 Å²	143	72%	0.715	75%	0.747	S	S	*	*			trans	109.3	114.1	150.7	-171.6	0	0	0	0	122.1
235	Q	31.2	Very low	30.4	Very low	161 Å²	161	146 Å²	146	75%	0.752	75%	0.754	S	S	*	*			trans	3.4	167.1	135.8	-109.6	92.9	19.8	0	0	123.9
236	Q	32.3	Very low	30.1	Very low	145 Å²	145	141.5 Å²	141.5	68%	0.678	75%	0.746	S	S	*	*			cis	-167.1	168.7	8.5	-148.7	171	16.2	0	0	115.4
237	H	28.4	Very low	29.7	Very low	138 Å²	138	142.7 Å²	142.7	64%	0.639	75%	0.749	S	S	*	*			trans	65.4	143.5	163	-64.9	116.8	0	0	0	119.3
238	Q	29.2	Very low	29.4	Very low	162 Å²	162	147 Å²	147	76%	0.757	76%	0.756	S	S	*	*			cis	79.2	147.1	31.5	-69.9	-166.6	-4.4	0	0	115.5
239	L	26	Very low	29	Very low	128 Å²	128	145.9 Å²	145.9	67%	0.67	75%	0.753	S	S	*	*			cis	-167.1	151.1	-8.6	-122.7	172.1	0	0	0	110
240	Q	24.9	Very low	28.8	Very low	185 Å²	185	143.4 Å²	143.4	86%	0.864	75%	0.754	S	S	*	*			trans	-165.8	161.9	148.8	-148.5	70.2	78.6	0	0	112.1
241	Q	26.4	Very low	28.6	Very low	167 Å²	167	143.8 Å²	143.8	78%	0.78	77%	0.765	S	S	*	*			trans	-123.8	154.3	-177.8	-60.5	168.9	-24.4	0	0	111.7
242	Q	25.2	Very low	28.4	Very low	200 Å²	200	143.5 Å²	143.5	94%	0.935	77%	0.772	S	S	*	*			trans	-173.5	161.9	135.9	-104.8	162.4	27.5	0	0	114.2
243	Q	24.3	Very low	28.2	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	78%	0.775	S	S	*	*			trans	-155.4	178.2	178.8	-114.2	-163.1	4.3	0	0	107.1
244	P	44.9	Very low	28.1	Very low	107 Å²	107	145.1 Å²	145.1	70%	0.695	78%	0.777	S	S	*	*			cis	-113.7	-144.7	-7.2	43.9	-29.9	0	0	0	108.8
245	P	38.8	Very low	28.3	Very low	125 Å²	125	148.2 Å²	148.2	81%	0.812	78%	0.784	S	S	*	*			cis	-129.1	-156.4	-18.8	41.6	-23.5	0	0	0	112.7
246	G	25.1	Very low	28.2	Very low	66 Å²	66	148.9 Å²	148.9	68%	0.68	79%	0.787	S	S	*	*			trans	130.3	51.1	136	0	0	0	0	0	122.3
247	M	23.8	Very low	28	Very low	177 Å²	177	151.5 Å²	151.5	87%	0.872	80%	0.796	S	S	*	*			trans	74.9	144.2	152.7	-73.7	-74	105.9	0	0	122.2
248	L	24.8	Very low	28.3	Very low	159 Å²	159	151.1 Å²	151.1	83%	0.832	80%	0.799	S	S	*	*			trans	77.1	108.8	163.8	-61.6	-179.6	0	0	0	121.9
249	S	24.8	Very low	28.9	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	80%	0.796	S	S	*	*			trans	65	106.5	136.3	-165.5	0	0	0	0	121.4
250	S	26.4	Very low	28.9	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	80%	0.797	S	S	*	*				-163.8	144.3	125.4	-81.5	0	0	0	0	110.9
251	V	25.6	Very low	29.1	Very low	141 Å²	141	149.6 Å²	149.6	86%	0.855	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.2	133.9	170.9	173	0	0	0	0	108.8	I253	V251-I253 PolarHBondContact O-N 3.24Å
252	V	26.9	Very low	29.2	Very low	134 Å²	134	149.1 Å²	149.1	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.8	120.7	-179.8	176.6	0	0	0	0	110.4
253	I	27.3	Very low	29.2	Very low	153 Å²	153	146 Å²	146	79%	0.785	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-83.9	129.1	160.8	-62.4	173.9	0	0	0	107	V251	V251-I253 PolarHBondContact O-N 3.24Å
254	K	26.6	Very low	29.4	Very low	176 Å²	176	144.8 Å²	144.8	77%	0.765	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-87.6	126.3	168.6	-173.9	-169.5	175.5	-156.3	0	108.3
255	E	31	Very low	28.7	Very low	183 Å²	183	149.2 Å²	149.2	86%	0.855	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.5	131.7	174.2	-67.2	-172.7	117.5	0	0	111.6
256	E	29	Very low	28.5	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	79%	0.787	S	S	*	*			trans	-147.2	134.2	158.2	-173.3	168.8	170.2	0	0	105.2
257	K	29.2	Very low	29	Very low	199 Å²	199	152.4 Å²	152.4	87%	0.865	79%	0.792	S	S	*	*			trans	-144.5	98.1	-168.9	-159.7	178.3	177.7	-174.3	0	114.6
258	D	33.2	Very low	29.2	Very low	131 Å²	131	147.4 Å²	147.4	70%	0.701	79%	0.786	S	S	*	*			trans	-33.7	153.2	151.4	-117.7	-53.7	0	0	0	114.3	D260	D258-D260 PolarHBondContact OD1-N 3.19Å; D258-D260 VanDerWaalsContact OD1-N 3.14Å
259	P	41.8	Very low	29.3	Very low	106 Å²	106	146.6 Å²	146.6	69%	0.688	79%	0.788	S	S	*	*				-146.3	143.9	75.8	39.3	-22.5	0	0	0	116.6
260	D	27.2	Very low	29.5	Very low	131 Å²	131	148.1 Å²	148.1	70%	0.701	79%	0.791	S	S	*	*				176	126.9	94.7	-104.5	-30.1	0	0	0	113.4	D258	D258-D260 PolarHBondContact OD1-N 3.19Å; D258-D260 VanDerWaalsContact OD1-N 3.14Å
261	F	28.6	Very low	29.6	Very low	205 Å²	205	152.3 Å²	152.3	90%	0.899	80%	0.796	S	S	*	*			trans	-148.2	123.5	161.7	-100.8	-76.4	0	0	0	112.6
262	I	28.3	Very low	29.6	Very low	158 Å²	158	154.5 Å²	154.5	81%	0.81	80%	0.796	S	S	*	*			trans	-82.2	124.8	179.4	-62.4	174.6	0	0	0	110.3	I264	I262-I264 HydrophobicContact CG2-CG1 4.32Å
263	H	25.6	Very low	29.5	Very low	135 Å²	135	157.4 Å²	157.4	63%	0.625	80%	0.801	S	S	*	*			trans	-104.8	101.1	-175.3	176.2	-84.1	0	0	0	112.6	R265	H263-R265 VanDerWaalsContact CE1-CD 3.49Å; H263-R265 WeakPolarHBondContact CE1-CD 3.46Å; H263-R265 VanDerWaalsContact CE1-CG 3.47Å; H263-R265 WeakPolarHBondContact CE1-CG 3.48Å; H263-R265 PolarHBondContact CE1-NE 3.2Å; H263-R265 VanDerWaalsContact CE1-NE 3.27Å; H263-R265 PolarHBondContact NE2-NE 2.75Å
264	I	29.2	Very low	29.6	Very low	153 Å²	153	157.1 Å²	157.1	79%	0.785	79%	0.794	S	S	*	*			trans	-94.7	117.6	174.7	-56.7	179.2	0	0	0	110.2	I262	I262-I264 HydrophobicContact CG2-CG1 4.32Å
265	R	30.3	Very low	29.7	Very low	199 Å²	199	158 Å²	158	75%	0.751	80%	0.801	S	S	*	*			trans	-128.9	134.5	164.3	-78.1	-171.4	-162.6	179.4	3.1	110.8	H263	H263-R265 VanDerWaalsContact CE1-CD 3.49Å; H263-R265 WeakPolarHBondContact CE1-CD 3.46Å; H263-R265 VanDerWaalsContact CE1-CG 3.47Å; H263-R265 WeakPolarHBondContact CE1-CG 3.48Å; H263-R265 PolarHBondContact CE1-NE 3.2Å; H263-R265 VanDerWaalsContact CE1-NE 3.27Å; H263-R265 PolarHBondContact NE2-NE 2.75Å
266	T	33.5	Very low	29.4	Very low	136 Å²	136	154.1 Å²	154.1	83%	0.834	79%	0.786	S	S	*	*			trans	-86.5	136.5	169.6	-45.5	0	0	0	0	109.9
267	P	35.5	Very low	29.4	Very low	122 Å²	122	150.6 Å²	150.6	79%	0.792	78%	0.781	S	S	*	*			trans	-97.9	145.6	-169.6	35.3	-35	0	0	0	115.8
268	G	28.2	Very low	29.5	Very low	73 Å²	73	147.8 Å²	147.8	75%	0.753	78%	0.78	S	S	*	*			trans	97.3	152.3	161.9	0	0	0	0	0	116.4
269	V	28.1	Very low	29.2	Very low	142 Å²	142	146.9 Å²	146.9	86%	0.861	78%	0.784	S	S	*	*			cis	-151.5	124.6	-5.5	177.9	0	0	0	0	109.9
270	V	28.8	Very low	28.5	Very low	144 Å²	144	152.5 Å²	152.5	87%	0.873	79%	0.793	S	S	*	*			trans	-142.8	148.6	154.1	-177.2	0	0	0	0	108.3
271	K	28.2	Very low	28.5	Very low	202 Å²	202	151.1 Å²	151.1	88%	0.878	79%	0.793	S	S	*	*			trans	-69	150.4	179.6	-77.3	-178.5	173.2	-178.4	0	112.8
272	Q	26.1	Very low	28.5	Very low	186 Å²	186	149.1 Å²	149.1	87%	0.869	79%	0.786	S	S	*	*			trans	-92.7	137.2	160.9	-175.9	178.6	15.6	0	0	109.5
273	E	24.9	Very low	28.5	Very low	195 Å²	195	145.7 Å²	145.7	91%	0.911	78%	0.777	S	S	*	*			trans	-130.9	153.4	163.9	-168.1	159.3	179	0	0	108.2
274	K	28.6	Very low	28.7	Very low	148 Å²	148	148 Å²	148	64%	0.643	79%	0.787	S	S	*	*			trans	-134.8	125.3	-161.9	-174.6	-137.2	-176.8	-135.7	0	111	D276	K274-D276 VanDerWaalsContact CE-OD1 3.27Å; K274-D276 WeakPolarHBondContact CE-OD1 3.01Å; K274-D276 IonicContact NZ-OD1 2.89Å; K274-D276 PolarHBondContact NZ-OD1 3.3Å; K274-D276 IonicContact NZ-OD2 2.67Å; K274-D276 PolarHBondContact NZ-OD2 3.36Å
275	Q	28.4	Very low	28.5	Very low	193 Å²	193	145.6 Å²	145.6	90%	0.902	78%	0.783	S	S	*	*			trans	-148.5	154.9	157.3	-155.5	134.3	14.3	0	0	111.6
276	D	25.8	Very low	28.4	Very low	103 Å²	103	142.7 Å²	142.7	55%	0.551	78%	0.782	S	S	*	*			trans	-111.4	150.9	-161.7	-51.6	-91.6	0	0	0	113.4	K274	K274-D276 VanDerWaalsContact CE-OD1 3.27Å; K274-D276 WeakPolarHBondContact CE-OD1 3.01Å; K274-D276 IonicContact NZ-OD1 2.89Å; K274-D276 PolarHBondContact NZ-OD1 3.3Å; K274-D276 IonicContact NZ-OD2 2.67Å; K274-D276 PolarHBondContact NZ-OD2 3.36Å
277	S	28.6	Very low	28.2	Very low	102 Å²	102	144.5 Å²	144.5	71%	0.713	78%	0.781	S	S	*	*			trans	61.3	122.4	144.2	64.6	0	0	0	0	123.6
278	V	30.5	Very low	27.7	Very low	139 Å²	139	144.6 Å²	144.6	84%	0.842	79%	0.785	S	S	*	*				70.2	145.9	126.5	179	0	0	0	0	117.3
279	S	26.3	Very low	27.7	Very low	113 Å²	113	144.3 Å²	144.3	79%	0.79	78%	0.782	S	S	*	*			cis	-144.6	-176.8	15.4	15.8	0	0	0	0	113.6
280	Y	28.2	Very low	27.6	Very low	223 Å²	223	146.6 Å²	146.6	88%	0.875	79%	0.785	S	S	*	*			trans	-107.9	-178.4	-173.2	-116	-105.9	0	0	0	114.8
281	C	26.3	Very low	27.7	Very low	103 Å²	103	145.2 Å²	145.2	70%	0.696	78%	0.782	S	S	*	*			trans	82.5	152.9	157.3	-72.2	0	0	0	0	120.2
282	Q	28.5	Very low	28.8	Very low	163 Å²	163	140.9 Å²	140.9	76%	0.762	77%	0.774	S	S	*	*			cis	-170.2	156	-23.8	-160.6	178.7	-19.2	0	0	112
283	S	28.3	Very low	28.9	Very low	86 Å²	86	138.9 Å²	138.9	60%	0.601	77%	0.769	S	S	*	*			trans	53.8	124.2	147.7	53.9	0	0	0	0	125.8
284	Q	30.6	Very low	29.3	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	77%	0.766	S	S	*	*				79.1	134.8	125.5	-71.3	-175.9	-8.3	0	0	125.5
285	C	25.9	Very low	29.3	Very low	104 Å²	104	135.2 Å²	135.2	70%	0.703	78%	0.775	S	S	*	*			trans	91.6	121.9	135.6	-81	0	0	0	0	125.5
286	L	27	Very low	29.3	Very low	138 Å²	138	133.1 Å²	133.1	72%	0.723	78%	0.775	S	S	*	*			trans	79.6	110	136.2	-64.7	171.1	0	0	0	124.3
287	Q	29.6	Very low	29.5	Very low	174 Å²	174	131.8 Å²	131.8	81%	0.813	79%	0.786	S	S	*	*				59.2	122.9	127.2	-68.6	-177.2	-0.6	0	0	124.3
288	S	25.9	Very low	29.6	Very low	124 Å²	124	133.8 Å²	133.8	87%	0.867	79%	0.794	S	S	*	*				-176	124.9	119.5	-77.2	0	0	0	0	108.6
289	G	27.3	Very low	29.9	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	79%	0.79	S	S	*	*				95.6	135.4	85.2	0	0	0	0	0	110.6
290	M	26.8	Very low	30.8	Very low	189 Å²	189	134.9 Å²	134.9	93%	0.931	79%	0.792	S	S	*	*			cis	-149.9	169.2	9.3	-72.7	-65.9	-173.7	0	0	111.9
291	S	30	Very low	30.9	Very low	115 Å²	115	130 Å²	130	80%	0.804	79%	0.79	S	S	*	*			trans	-88.2	-162.1	175.4	-33.1	0	0	0	0	112
292	P	51.9	Low	31	Very low	111 Å²	111	130.2 Å²	130.2	72%	0.721	80%	0.799	S	S	*	*			cis	-150	-165.6	33.2	39.8	-14	0	0	0	118.6
293	L	28.6	Very low	31	Very low	144 Å²	144	130.6 Å²	130.6	75%	0.754	80%	0.803	S	S	*	*			trans	104.4	92.6	154.8	-70.5	149.7	0	0	0	122.3
294	H	32.7	Very low	30.8	Very low	185 Å²	185	133.4 Å²	133.4	86%	0.856	81%	0.812	S	S	*	*				42.9	134.5	125.9	-73.4	-96.3	0	0	0	124
295	G	27.3	Very low	30.7	Very low	81 Å²	81	131.2 Å²	131.2	84%	0.835	81%	0.81	S	S	*	*			trans	-176.6	117.8	158.6	0	0	0	0	0	114.8
296	V	29.7	Very low	30.7	Very low	149 Å²	149	130.8 Å²	130.8	90%	0.903	82%	0.815	S	S	*	*			trans	-95.4	151.5	-175.5	174.4	0	0	0	0	112.1
297	G	29	Very low	30.9	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	82%	0.823	S	S	*	*			trans	174.3	127.2	162.4	0	0	0	0	0	118.1
298	T	31.3	Very low	30.8	Very low	143 Å²	143	126.6 Å²	126.6	88%	0.877	82%	0.822	S	S	*	*			trans	-92.6	161.8	-178.2	-33	0	0	0	0	113.5
299	I	36	Very low	31	Very low	149 Å²	149	126 Å²	126	76%	0.764	82%	0.818	S	S	*	*			trans	-80.8	157.3	172.1	-18.4	178.4	0	0	0	111.6
300	P	45	Very low	31.1	Very low	126 Å²	126	125.7 Å²	125.7	82%	0.818	82%	0.815	S	S	*	*				-146.7	-177.1	96.4	39.6	-22.4	0	0	0	115.7
301	S	31.8	Very low	31.2	Very low	121 Å²	121	126 Å²	126	85%	0.846	81%	0.807	S	S	*	*			trans	-81.6	159	-164.2	-42.4	0	0	0	0	117.6
302	A	27.7	Very low	31.4	Very low	107 Å²	107	128 Å²	128	88%	0.884	80%	0.803	S	S	*	*			trans	-147.2	162	158.3	0	0	0	0	0	111
303	M	27.8	Very low	30.2	Very low	171 Å²	171	132.3 Å²	132.3	84%	0.842	81%	0.806	S	S	*	*			trans	-111.8	157.5	-172	-73.8	-176.2	170	0	0	114.8
304	N	25.4	Very low	30.3	Very low	145 Å²	145	135.2 Å²	135.2	78%	0.775	81%	0.807	S	S	*	*			trans	80.9	128.7	143.7	-79.4	-3.1	0	0	0	123.2
305	V	27.2	Very low	30.1	Very low	136 Å²	136	129.5 Å²	129.5	82%	0.824	80%	0.798	S	S	*	*			trans	65.4	104.7	142.3	-177.9	0	0	0	0	118.8
306	A	27.2	Very low	30.1	Very low	96 Å²	96	132.8 Å²	132.8	79%	0.793	80%	0.797	S	S	*	*			trans	-166.1	92.4	133.7	0	0	0	0	0	113
307	T	30.1	Very low	31.4	Very low	148 Å²	148	131.5 Å²	131.5	91%	0.908	79%	0.791	S	S	*	*			trans	-142.9	118.5	152.8	24.8	0	0	0	0	109.1
308	G	27.4	Very low	31.5	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	79%	0.789	S	S	*	*			trans	-82.3	160.1	-179.9	0	0	0	0	0	113.7
309	S	31.3	Very low	31.6	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	79%	0.791	S	S	*	*			trans	-17.6	149.8	155.2	-45.3	0	0	0	0	117
310	G	28.6	Very low	31.6	Very low	61 Å²	61	129.7 Å²	129.7	63%	0.629	80%	0.798	S	S	*	*			cis	86	164.4	25.2	0	0	0	0	0	111.9
311	Y	29	Very low	30.9	Very low	195 Å²	195	127.4 Å²	127.4	77%	0.765	80%	0.797	S	S	*	*			cis	-173.3	147	-3.9	-97.3	-56.1	0	0	0	109.9
312	H	34.3	Very low	30.6	Very low	156 Å²	156	129.5 Å²	129.5	72%	0.722	80%	0.798	S	S	*	*			trans	56.9	-171.8	144.8	-62.1	-48.5	0	0	0	117.4
313	Y	26.6	Very low	30.6	Very low	202 Å²	202	131.8 Å²	131.8	79%	0.792	79%	0.79	S	S	*	*			cis	-149.4	-154.4	32.3	-145.5	-100.7	0	0	0	116.3
314	R	31.3	Very low	30.4	Very low	206 Å²	206	129.5 Å²	129.5	78%	0.777	78%	0.781	S	S	*	*			trans	-161.7	155.5	-143	171.8	-165.7	-173.6	-150.3	7.7	112.9
315	G	27.8	Very low	30.6	Very low	64 Å²	64	131.3 Å²	131.3	66%	0.66	79%	0.785	S	S	*	*			trans	155.9	142.8	158.8	0	0	0	0	0	114.5
316	N	27.8	Very low	30.4	Very low	151 Å²	151	134 Å²	134	81%	0.807	79%	0.786	S	S	*	*			cis	82.7	158.6	43.8	-96.5	23.8	0	0	0	115.1
317	P	56.2	Low	31	Very low	122 Å²	122	134.9 Å²	134.9	79%	0.792	78%	0.783	S	S	*	*			cis	-138.5	-167.4	-33.8	39.5	-20.1	0	0	0	113.8
318	G	31.9	Very low	30.7	Very low	71 Å²	71	137 Å²	137	73%	0.732	78%	0.78	S	S	*	*			trans	177.2	152.9	169.9	0	0	0	0	0	116.3
319	T	33.2	Very low	30.7	Very low	150 Å²	150	137.1 Å²	137.1	92%	0.92	78%	0.781	S	S	*	*			trans	-151.1	154.4	-159.5	48.5	0	0	0	0	119
320	A	36.7	Very low	30.5	Very low	109 Å²	109	136.7 Å²	136.7	90%	0.901	77%	0.774	S	S	*	*			trans	-169	169.4	164.6	0	0	0	0	0	110.5
321	G	29.4	Very low	30.5	Very low	78 Å²	78	143.7 Å²	143.7	80%	0.804	78%	0.783	S	S	*	*			cis	170.3	100.9	-11.5	0	0	0	0	0	117
322	L	26.8	Very low	30.4	Very low	165 Å²	165	139.5 Å²	139.5	86%	0.864	78%	0.782	S	S	*	*			trans	68.5	135.1	152.4	-132	78.1	0	0	0	126.3
323	Q	25.9	Very low	30	Very low	155 Å²	155	140 Å²	140	72%	0.724	79%	0.79	S	S	*	*			trans	93.6	105.3	138.9	-108	-168.6	-46.7	0	0	126.3
324	D	25.2	Very low	30.2	Very low	123 Å²	123	138.4 Å²	138.4	66%	0.658	80%	0.795	S	S	*	*				98.8	145.2	121.1	-112.8	-43.6	0	0	0	126.4
325	Q	28	Very low	29.9	Very low	182 Å²	182	134.8 Å²	134.8	85%	0.85	80%	0.801	S	S	*	*			trans	64.5	140.5	164.8	-60.2	-167.1	46.2	0	0	123.1
326	K	24.8	Very low	29.9	Very low	193 Å²	193	135.4 Å²	135.4	84%	0.839	81%	0.808	S	S	*	*			trans	-157.3	141.7	177.6	-165.4	-179.1	-171.8	178.1	0	108
327	P	38.2	Very low	29.9	Very low	114 Å²	114	135.8 Å²	135.8	74%	0.74	82%	0.815	S	S	*	*				-144.6	150.2	117.9	29	-10.6	0	0	0	115.7
328	F	24.1	Very low	28.5	Very low	192 Å²	192	133.6 Å²	133.6	84%	0.842	81%	0.814	S	S	*	*			trans	34.4	119.9	152.8	-72.6	-88.4	0	0	0	122.2
329	G	27.1	Very low	28.3	Very low	79 Å²	79	138.4 Å²	138.4	81%	0.814	82%	0.818	S	S	*	*			trans	-174.8	75.9	167.9	0	0	0	0	0	109.9
330	T	27.2	Very low	28	Very low	102 Å²	102	136.4 Å²	136.4	63%	0.626	81%	0.81	S	S	*	*			trans	-79.8	117.7	-171.7	46.5	0	0	0	0	112.6
331	Y	29.1	Very low	27.5	Very low	208 Å²	208	143.1 Å²	143.1	82%	0.816	81%	0.812	S	S	*	*				179.5	136.3	98.2	-94.4	-70.6	0	0	0	113.6
332	S	27.4	Very low	27.4	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	82%	0.815	S	S	*	*			trans	15.1	102.9	161.3	-53	0	0	0	0	122.9
333	N	25	Very low	27.4	Very low	166 Å²	166	145.2 Å²	145.2	89%	0.888	81%	0.814	S	S	*	*			trans	23.7	133.9	138	-70.4	-18.5	0	0	0	123
334	L	30.7	Very low	27.4	Very low	169 Å²	169	141.1 Å²	141.1	89%	0.885	81%	0.813	S	S	*	*			trans	-88.9	144.1	158.8	-63.2	83.6	0	0	0	112.3
335	S	25.1	Very low	27.5	Very low	131 Å²	131	143.4 Å²	143.4	92%	0.916	82%	0.817	S	S	*	*			trans	179.1	137.8	138.2	-79.2	0	0	0	0	109.1
336	G	28.3	Very low	27.4	Very low	77 Å²	77	146.3 Å²	146.3	79%	0.794	82%	0.82	S	S	*	*			cis	-147.7	179.2	-1	0	0	0	0	0	112.1
337	V	27.4	Very low	27.6	Very low	158 Å²	158	146.2 Å²	146.2	96%	0.958	82%	0.816	S	S	*	*			trans	-69.2	138.8	-168.6	176.3	0	0	0	0	113.1
338	G	27.9	Very low	27.1	Very low	76 Å²	76	144.5 Å²	144.5	78%	0.784	82%	0.819	S	S	*	*			trans	-167.1	42.1	-179.1	0	0	0	0	0	115.8
339	E	26.6	Very low	27.3	Very low	172 Å²	172	144.8 Å²	144.8	80%	0.804	82%	0.823	S	S	*	*			trans	-93.4	118.5	172.6	-68.6	-172.8	131.7	0	0	109.9
340	S	26.4	Very low	27.3	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	82%	0.822	S	S	*	*				76.3	110.9	80.9	-166.2	0	0	0	0	113.3
341	W	26.1	Very low	27.8	Very low	250 Å²	250	147.3 Å²	147.3	95%	0.947	84%	0.838	S	S	*	*			trans	-139.4	92	177.9	-84.4	81	0	0	0	111.5
342	I	28.9	Very low	27.7	Very low	170 Å²	170	141 Å²	141	87%	0.872	84%	0.836	S	S	*	*			trans	-132.5	116.9	154.4	-62.6	-177.7	0	0	0	108.3
343	S	26.9	Very low	27.9	Very low	118 Å²	118	143.6 Å²	143.6	83%	0.825	84%	0.84	S	S	*	*			trans	-156.3	125.4	156	-160.5	0	0	0	0	109.6
344	G	25.4	Very low	28.1	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	84%	0.835	S	S	*	*			trans	-111.9	145.8	172.7	0	0	0	0	0	110.7
345	K	26.5	Very low	27.9	Very low	170 Å²	170	140 Å²	140	74%	0.739	82%	0.823	S	S	*	*			trans	-130.3	105.6	164.1	-90.2	-166	171	-172.1	0	111.2	Y347	K345-Y347 HydrophobicContact CD-CE2 4.41Å
346	R	26.6	Very low	27.9	Very low	243 Å²	243	140.2 Å²	140.2	92%	0.917	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-85.9	130.2	153.9	-174	-170	-67.6	179.6	-2.1	106.6
347	Y	29	Very low	27.9	Very low	191 Å²	191	140.8 Å²	140.8	75%	0.749	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-89.5	143.3	163.8	-87.9	-76.6	0	0	0	109.5	K345	K345-Y347 HydrophobicContact CD-CE2 4.41Å
348	G	28.4	Very low	28	Very low	78 Å²	78	140.8 Å²	140.8	80%	0.804	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.2	148.6	-178.8	0	0	0	0	0	112.6
349	E	26.7	Very low	28	Very low	199 Å²	199	140.6 Å²	140.6	93%	0.93	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-99.6	148	169.3	-171.5	169.2	-159.2	0	0	108.7
350	A	27.7	Very low	28.1	Very low	96 Å²	96	140 Å²	140	79%	0.793	81%	0.805	S	S	*	*			trans	-132.3	125.5	-174	0	0	0	0	0	111.6
351	S	37.8	Very low	28.1	Very low	137 Å²	137	142.8 Å²	142.8	96%	0.958	81%	0.806	S	S	*	*			trans	-83.6	128	176.9	-59.3	0	0	0	0	111.5
352	G	26.9	Very low	28.3	Very low	75 Å²	75	136.7 Å²	136.7	77%	0.773	80%	0.802	S	S	*	*			trans	-151.3	147	175.4	0	0	0	0	0	110.8
353	I	31.8	Very low	28.3	Very low	162 Å²	162	132.4 Å²	132.4	83%	0.831	80%	0.799	S	S	*	*			trans	-104.8	162	-167.5	-69.5	171.4	0	0	0	111.2
354	Q	29.1	Very low	28.5	Very low	170 Å²	170	131 Å²	131	79%	0.794	80%	0.795	S	S	*	*			trans	102.3	98.5	152.1	-110.4	162.2	60.9	0	0	120.5
355	S	27.1	Very low	28.7	Very low	89 Å²	89	133.9 Å²	133.9	62%	0.622	80%	0.799	S	S	*	*				68.9	151.6	122.4	67.2	0	0	0	0	123.4
356	T	25.2	Very low	28.7	Very low	136 Å²	136	134 Å²	134	83%	0.834	81%	0.806	S	S	*	*			trans	69.9	155.7	169.7	71.8	0	0	0	0	116.9
357	S	28.2	Very low	28.7	Very low	89 Å²	89	125.8 Å²	125.8	62%	0.622	80%	0.798	S	S	*	*			cis	-159.3	159.7	-43.4	61.5	0	0	0	0	108.4
358	D	29.1	Very low	28.6	Very low	158 Å²	158	123.2 Å²	123.2	85%	0.845	80%	0.797	S	S	*	*			trans	64.4	160	169.6	-45.2	-65.8	0	0	0	115.9
359	G	27.9	Very low	28.5	Very low	73 Å²	73	128 Å²	128	75%	0.753	80%	0.796	S	S	*	*			cis	-158.3	163.2	-1.5	0	0	0	0	0	113
360	L	27.6	Very low	29.7	Very low	158 Å²	158	124 Å²	124	83%	0.827	79%	0.787	S	S	*	*			trans	-64.9	168.4	-165.8	-158.5	72.4	0	0	0	117.8
361	Q	28.4	Very low	29.7	Very low	168 Å²	168	126.4 Å²	126.4	79%	0.785	79%	0.792	S	S	*	*			trans	84.2	159.6	160.1	-52.2	-175.7	15.2	0	0	118.3
362	S	29.3	Very low	29.2	Very low	121 Å²	121	122.5 Å²	122.5	85%	0.846	77%	0.773	S	S	*	*			cis	157.5	123.4	-43.7	-86.9	0	0	0	0	110.5
363	G	28.5	Very low	29.3	Very low	80 Å²	80	128.8 Å²	128.8	83%	0.825	78%	0.779	S	S	*	*			trans	97.9	161.9	160.1	0	0	0	0	0	117.9
364	A	31.1	Very low	29.1	Very low	90 Å²	90	127.5 Å²	127.5	74%	0.744	78%	0.779	S	S	*	*			cis	-171.8	174.4	-26	0	0	0	0	0	112.1
365	V	29.1	Very low	29.3	Very low	129 Å²	129	124.8 Å²	124.8	78%	0.782	78%	0.779	S	S	*	*			trans	80.3	144.2	154.3	-136.6	0	0	0	0	121.3
366	L	27.8	Very low	29.4	Very low	171 Å²	171	125.7 Å²	125.7	90%	0.895	79%	0.785	S	S	*	*			trans	74.3	144.1	166.5	-52.3	179.6	0	0	0	117.5
367	G	26	Very low	29.7	Very low	72 Å²	72	124.6 Å²	124.6	74%	0.742	78%	0.783	S	S	*	*			cis	-169.5	170.5	-2.2	0	0	0	0	0	111
368	N	27.9	Very low	30	Very low	136 Å²	136	125 Å²	125	73%	0.727	79%	0.791	S	S	*	*			trans	-139	145.8	-162.8	-144.7	10.5	0	0	0	115
369	F	25.3	Very low	30.2	Very low	180 Å²	180	128.6 Å²	128.6	79%	0.789	79%	0.793	S	S	*	*			trans	64.6	171.6	162.6	-70.9	-51.1	0	0	0	120.1
370	P	52.8	Low	30.5	Very low	113 Å²	113	131.9 Å²	131.9	73%	0.734	80%	0.799	S	S	*	*			cis	-133.7	-172.2	-21.5	29.6	-7.6	0	0	0	114.5
371	V	27.7	Very low	30.5	Very low	148 Å²	148	128 Å²	128	90%	0.897	80%	0.798	S	S	*	*				172.6	161.7	129.7	152.4	0	0	0	0	111.1
372	G	26.2	Very low	30.6	Very low	54 Å²	54	129 Å²	129	56%	0.557	80%	0.802	S	S	*	*			trans	-158.6	-146.4	-177.5	0	0	0	0	0	115.4
373	F	30.5	Very low	30.7	Very low	207 Å²	207	129.2 Å²	129.2	91%	0.908	80%	0.804	S	S	*	*			trans	87.4	155.6	-171.4	-64.6	-77.4	0	0	0	115.8
374	T	27.1	Very low	31.1	Very low	135 Å²	135	130.4 Å²	130.4	83%	0.828	80%	0.799	S	S	*	*			cis	-146.5	179.4	10.4	-22	0	0	0	0	112.3
375	S	31.9	Very low	31.2	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	80%	0.802	S	S	*	*			trans	-144.9	164.6	175.7	-176.7	0	0	0	0	112.6
376	S	31	Very low	31.2	Very low	108 Å²	108	132 Å²	132	76%	0.755	81%	0.805	S	S	*	*			trans	-171.9	158.6	178.8	-122	0	0	0	0	110.6
377	S	31.1	Very low	31.6	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	80%	0.796	S	S	*	*			cis	-147.8	-172.8	-6.9	-52	0	0	0	0	108.9
378	A	34.8	Very low	31.9	Very low	97 Å²	97	130.8 Å²	130.8	80%	0.802	80%	0.799	S	S	*	*			trans	-146.1	157.2	177.1	0	0	0	0	0	115.2
379	R	33	Very low	32	Very low	235 Å²	235	130.9 Å²	130.9	89%	0.887	81%	0.805	S	S	*	*			trans	-153.8	122.8	166	-73.5	-163.2	178	-174.5	-1.7	108
380	T	33.8	Very low	32.3	Very low	141 Å²	141	126 Å²	126	87%	0.865	81%	0.805	S	S	*	*				91.1	122.7	50.3	59.2	0	0	0	0	114.8
381	G	27.6	Very low	31.4	Very low	78 Å²	78	130.3 Å²	130.3	80%	0.804	82%	0.815	S	S	*	*			trans	172.4	126.1	170.5	0	0	0	0	0	111.8
382	E	31.1	Very low	31.7	Very low	188 Å²	188	128.9 Å²	128.9	88%	0.879	81%	0.812	S	S	*	*			trans	-130.3	154.6	-170	-65	178.1	104	0	0	113.2
383	S	31.3	Very low	32.1	Very low	126 Å²	126	136 Å²	136	88%	0.881	83%	0.827	S	S	*	*			trans	-167.6	156.7	155.6	-81.6	0	0	0	0	110.3
384	S	35.3	Very low	32.6	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	83%	0.826	S	S	*	*			trans	-130.6	161.1	-146	-57.2	0	0	0	0	117.2
385	S	34.1	Very low	33	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	82%	0.819	S	S	*	*			trans	67.6	149.6	161.9	45.2	0	0	0	0	117.6
386	T	29.6	Very low	33.7	Very low	138 Å²	138	128.2 Å²	128.2	85%	0.847	83%	0.825	S	S	*	*			cis	-139.3	166.8	22.2	-42	0	0	0	0	113
387	A	35.4	Very low	34.6	Very low	84 Å²	84	131.3 Å²	131.3	69%	0.694	83%	0.828	S	S	*	*			trans	-73.3	-179.4	-179.1	0	0	0	0	0	113.4
388	V	32.3	Very low	35.9	Very low	133 Å²	133	130 Å²	130	81%	0.806	82%	0.824	S	S	*	*			cis	-153.4	157	25.1	-134.9	0	0	0	0	107.2
389	T	30	Very low	37.6	Very low	139 Å²	139	132.7 Å²	132.7	85%	0.853	82%	0.819	S	S	*	*			cis	-163.2	164.5	41.4	44.4	0	0	0	0	110.8
390	G	31.2	Very low	40.1	Very low	77 Å²	77	128 Å²	128	79%	0.794	81%	0.805	S	S	*	*			trans	138.1	105.3	159.8	0	0	0	0	0	114.6
391	Q	35.1	Very low	43	Very low	204 Å²	204	126.3 Å²	126.3	95%	0.953	79%	0.79	S	S	*	*			trans	-81.7	129.8	-178.5	-67.5	-179.4	-5.9	0	0	112.8
392	S	33.2	Very low	46.3	Very low	117 Å²	117	122.6 Å²	122.6	82%	0.818	75%	0.752	S	S	*	*			trans	-154.2	141.5	149.9	58.2	0	0	0	0	110.3
393	K	34.8	Very low	49.3	Very low	205 Å²	205	118.9 Å²	118.9	89%	0.891	74%	0.737	S	S	*	*			trans	-83.1	133.6	177.9	-78.9	-177	174.4	178.9	0	110.4	G395	K393-G395 PolarHBondContact O-N 2.96Å
394	P	41	Very low	52.4	Low	136 Å²	136	112.9 Å²	112.9	88%	0.883	70%	0.695	S	S	*	*			trans	-77.2	116.7	174.2	30.5	-32.6	0	0	0	111
395	G	35.5	Very low	55.3	Low	66 Å²	66	107.9 Å²	107.9	68%	0.68	66%	0.66	S	S	*	*			trans	-115.3	111.1	163.7	0	0	0	0	0	108.5	K393 Q397	K393-G395 PolarHBondContact O-N 2.96Å; G395-Q397 PolarHBondContact O-N 3.11Å
396	G	46.6	Very low	58.2	Low	88 Å²	88	106.5 Å²	106.5	91%	0.907	65%	0.65	S	S	*	*			trans	-59.6	98.6	-161.3	0	0	0	0	0	115.4
397	Q	50.9	Low	61.3	Low	174 Å²	174	101 Å²	101	81%	0.813	62%	0.616	S	S	*	*			trans	-83.2	119.9	156.6	-61.9	-169.2	26.2	0	0	107.8	G395 H399	G395-Q397 PolarHBondContact O-N 3.11Å; Q397-H399 PolarHBondContact O-N 3.33Å
398	A	57.5	Low	64.2	Low	86 Å²	86	102.5 Å²	102.5	71%	0.711	61%	0.609	S	S	*	*			trans	-60.2	114	170.6	0	0	0	0	0	109	K400	A398-K400 WeakPolarHBondContact O-CG 3.38Å; A398-K400 PolarHBondContact O-N 3.23Å
399	H	70.1	Confident	67.2	Low	152 Å²	152	96.8 Å²	96.8	70%	0.704	58%	0.575	S	S	*	*			trans	-58.1	110.1	-175.4	-70	-91.2	0	0	0	110.3	Q397 E408	Q397-H399 PolarHBondContact O-N 3.33Å; H399-E408 IonicContact CE1-OE1 3.58Å; H399-E408 IonicContact CG-OE1 3.43Å; H399-E408 IonicContact ND1-OE1 2.77Å; H399-E408 PolarHBondContact ND1-OE1 3.14Å
400	K	85.3	Confident	70.1	Confident	138 Å²	138	93.9 Å²	93.9	60%	0.6	56%	0.56	S	S	*	*			trans	-79.7	131	-178	-64.9	-177.8	-178.1	174.8	0	108.9	A398 A409 V417	A398-K400 WeakPolarHBondContact O-CG 3.38Å; A398-K400 PolarHBondContact O-N 3.23Å; K400-A409 HydrophobicContact CB-CB 4.08Å; K400-A409 WeakPolarHBondContact O-CB 3.43Å; K400-A409 PolarHBondContact O-N 2.97Å; K400-V417 HydrophobicContact CB-CG1 4Å
401	I	94.4	Very high	73	Confident	105 Å²	105	91.5 Å²	91.5	54%	0.538	54%	0.536	S	S	.	.	B	Isolated β-bridge	trans	-98.1	137.7	-176.2	-61.9	177.7	0	0	0	109.8	L403	I401-L403 PolarHBondContact O-N 2.68Å
402	C	96.8	Very high	75.7	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	51%	0.514	C	S	.	.			trans	-71.8	113.2	-179.7	174.2	0	0	0	0	111.3	V404 C405 S406 D407 A409 C419	C402-V404 PolarHBondContact O-N 2.82Å; C402-C405 PolarHBondContact O-N 2.88Å; C402-C405 VanDerWaalsContact O-N 3.14Å; C402-S406 WeakPolarHBondContact O-CA 3.08Å; C402-S406 PolarHBondContact O-N 2.7Å; C402-D407 WeakPolarHBondContact CB-O 3.46Å; C402-D407 PolarHBondContact N-O 2.81Å; C402-A409 HydrophobicContact CB-CB 4.43Å; C402-C419 HydrophobicContact CB-CB 3.89Å; C402-C419 PolarHBondContact SG-N 2.75Å; C402-C419 VanDerWaalsContact SG-SG 3.62Å
403	L	94.8	Very high	78.5	Confident	109 Å²	109	81 Å²	81	57%	0.571	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.5	-175.6	-59.1	-179.9	0	0	0	114.1	I401 V416 V417 A474	I401-L403 PolarHBondContact O-N 2.68Å; L403-V416 HydrophobicContact CB-CG1 4.25Å; L403-V416 HydrophobicContact CD1-CG1 3.98Å; L403-V417 PolarHBondContact N-O 3.17Å; L403-V417 VanDerWaalsContact N-O 3.11Å; L403-A474 HydrophobicContact CB-CB 4.48Å
404	V	96.3	Very high	81.3	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-39.1	177.3	179.4	0	0	0	0	113.2	C402 T418 C422 I455 R467 K470 A474 M476	C402-V404 PolarHBondContact O-N 2.82Å; V404-T418 HydrophobicContact CG2-CG2 3.98Å; V404-C422 HydrophobicContact CB-CB 4.46Å; V404-I455 HydrophobicContact CG1-CG2 4.37Å; V404-I455 WeakPolarHBondContact O-CG2 3.4Å; V404-R467 HydrophobicContact CG1-CG 4.42Å; V404-K470 HydrophobicContact CG1-CB 4.43Å; V404-K470 HydrophobicContact CG1-CG 4.43Å; V404-K470 WeakPolarHBondContact O-CD 2.98Å; V404-K470 WeakPolarHBondContact O-CE 3.08Å; V404-K470 PolarHBondContact O-NZ 3.17Å; V404-A474 HydrophobicContact CG2-CB 3.97Å; V404-M476 HydrophobicContact CG2-SD 4.08Å
405	C	96	Very high	83.5	Confident	0 Å²	0	68 Å²	68	0%	0	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.9	13.9	-169.8	67.1	0	0	0	0	115.8	C402 D407 C422 I455 D456 K457 R460	C402-C405 PolarHBondContact O-N 2.88Å; C402-C405 VanDerWaalsContact O-N 3.14Å; C405-D407 PolarHBondContact O-N 3.29Å; C405-C422 PolarHBondContact SG-SG 3Å; C405-I455 HydrophobicContact CB-CG2 3.89Å; C405-D456 CarbonylContact O-C 3.39Å; C405-D456 VanDerWaalsContact O-C 3.22Å; C405-D456 VanDerWaalsContact O-CA 3.25Å; C405-D456 WeakPolarHBondContact O-CA 3.21Å; C405-K457 PolarHBondContact O-N 3.31Å; C405-R460 HydrophobicContact CB-CB 4.31Å; C405-R460 PolarHBondContact SG-NH1 2.96Å
406	S	94.6	Very high	86.2	Confident	85 Å²	85	65.2 Å²	65.2	59%	0.594	39%	0.394	S	S	*	.	S	Bend	trans	56	10.6	176.7	-48.4	0	0	0	0	116.6	C402	C402-S406 WeakPolarHBondContact O-CA 3.08Å; C402-S406 PolarHBondContact O-N 2.7Å
407	D	95.1	Very high	88.4	Confident	22 Å²	22	63.3 Å²	63.3	12%	0.118	37%	0.365	C	S	.	.	S	Bend	trans	-75	166.7	167.8	-166	14.1	0	0	0	111	C402 C405 A409 C419 K457 R460	C402-D407 WeakPolarHBondContact CB-O 3.46Å; C402-D407 PolarHBondContact N-O 2.81Å; C405-D407 PolarHBondContact O-N 3.29Å; D407-A409 PolarHBondContact O-N 2.87Å; D407-C419 HydrophobicContact CB-CB 4.12Å; D407-K457 HydrophobicContact CB-CB 4.14Å; D407-K457 HydrophobicContact CB-CD 4.28Å; D407-K457 HydrophobicContact CB-CG 4.08Å; D407-K457 WeakPolarHBondContact OD1-CD 3.38Å; D407-K457 WeakPolarHBondContact OD1-CE 3.31Å; D407-K457 IonicContact OD1-NZ 3.88Å; D407-K457 PolarHBondContact OD1-NZ 3.36Å; D407-R460 IonicContact OD2-CZ 3.75Å; D407-R460 IonicContact OD2-NH1 2.99Å; D407-R460 PolarHBondContact OD2-NH1 3.05Å; D407-R460 IonicContact OD2-NH2 2.99Å; D407-R460 PolarHBondContact OD2-NH2 3.42Å
408	E	96.1	Very high	90.6	Very high	117 Å²	117	55 Å²	55	55%	0.547	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-63.4	128.9	180	-172.6	164.2	-137.8	0	0	111.7	H399 C419	H399-E408 IonicContact CE1-OE1 3.58Å; H399-E408 IonicContact CG-OE1 3.43Å; H399-E408 IonicContact ND1-OE1 2.77Å; H399-E408 PolarHBondContact ND1-OE1 3.14Å; E408-C419 WeakPolarHBondContact O-CA 3.42Å; E408-C419 WeakPolarHBondContact O-CB 3.36Å
409	A	95.2	Very high	92.5	Very high	13 Å²	13	51 Å²	51	11%	0.107	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-88.7	119.5	-175.9	0	0	0	0	0	111.5	K400 C402 D407 G411 V417 T418	K400-A409 HydrophobicContact CB-CB 4.08Å; K400-A409 WeakPolarHBondContact O-CB 3.43Å; K400-A409 PolarHBondContact O-N 2.97Å; C402-A409 HydrophobicContact CB-CB 4.43Å; D407-A409 PolarHBondContact O-N 2.87Å; A409-G411 PolarHBondContact O-N 3.13Å; A409-G411 VanDerWaalsContact O-N 3.09Å; A409-V417 HydrophobicContact CB-CG1 3.56Å; A409-T418 WeakPolarHBondContact CA-O 3.49Å
410	S	92.6	Very high	93.7	Very high	77 Å²	77	45.4 Å²	45.4	54%	0.538	28%	0.276	S	S	.	.			trans	-81.9	23	176.4	60.5	0	0	0	0	113.3	H413 T418 G420	S410-H413 PolarHBondContact O-NE2 3.38Å; S410-H413 PolarHBondContact OG-NE2 2.88Å; S410-T418 PolarHBondContact N-O 3.14Å; S410-T418 VanDerWaalsContact N-O 3.15Å; S410-G420 PolarHBondContact OG-N 2.75Å
411	G	90.9	Very high	94.2	Very high	27 Å²	27	41 Å²	41	28%	0.278	26%	0.263	S	S	.	.	S	Bend	trans	121.9	-167.1	178.5	0	0	0	0	0	114.5	A409 V417 T418	A409-G411 PolarHBondContact O-N 3.13Å; A409-G411 VanDerWaalsContact O-N 3.09Å; G411-V417 WeakPolarHBondContact O-CA 3.47Å; G411-T418 PolarHBondContact O-N 2.91Å
412	C	92.1	Very high	94.3	Very high	73 Å²	73	36 Å²	36	49%	0.493	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.1	174.1	174.3	0	0	0	0	109.9	V416	C412-V416 WeakPolarHBondContact CA-O 3.33Å
413	H	93	Very high	94.2	Very high	28 Å²	28	40.1 Å²	40.1	13%	0.13	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.6	176.4	-48.3	-77.7	0	0	0	108.8	S410 G415 V416 T418 K423	S410-H413 PolarHBondContact O-NE2 3.38Å; S410-H413 PolarHBondContact OG-NE2 2.88Å; H413-G415 PolarHBondContact O-N 2.96Å; H413-V416 PolarHBondContact N-O 2.95Å; H413-V416 PolarHBondContact O-N 3.19Å; H413-V416 VanDerWaalsContact O-O 3.07Å; H413-T418 PolarHBondContact CD2-O 3.3Å; H413-T418 PolarHBondContact CD2-OG1 3.18Å; H413-K423 HydrophobicContact CB-CB 4.01Å; H413-K423 HydrophobicContact CB-CD 4.35Å; H413-K423 HydrophobicContact CB-CG 3.87Å; H413-K423 WeakPolarHBondContact ND1-CD 3.44Å; H413-K423 WeakPolarHBondContact ND1-CE 3.49Å
414	Y	91.8	Very high	94.2	Very high	19 Å²	19	38.2 Å²	38.2	8%	0.075	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	30.4	179.3	-56	-78	0	0	0	114.4	K423 F426 K427 M476 N477 L478 R481	Y414-K423 HydrophobicContact CD2-CG 4.47Å; Y414-K423 HydrophobicContact CE2-CG 3.83Å; Y414-K423 WeakPolarHBondContact CE2-O 3.41Å; Y414-F426 AromaticContact CD1-CD1 3.95Å; Y414-F426 HydrophobicContact CD1-CD1 3.95Å; Y414-F426 AromaticContact CD1-CE1 3.96Å; Y414-F426 HydrophobicContact CD1-CE1 3.96Å; Y414-F426 AromaticContact CD2-CD1 3.83Å; Y414-F426 HydrophobicContact CD2-CD1 3.83Å; Y414-F426 HydrophobicContact CE1-CD1 4.34Å; Y414-F426 HydrophobicContact CE2-CD1 4.25Å; Y414-F426 AromaticContact CG-CD1 3.67Å; Y414-F426 HydrophobicContact CG-CD1 3.67Å; Y414-F426 AromaticContact CG-CE1 3.93Å; Y414-F426 HydrophobicContact CG-CE1 3.93Å; Y414-K427 WeakPolarHBondContact OH-CB 3.04Å; Y414-K427 WeakPolarHBondContact OH-CG 3.22Å; Y414-M476 HydrophobicContact CD2-CE 3.67Å; Y414-M476 HydrophobicContact CG-CE 4.17Å; Y414-M476 WeakPolarHBondContact O-CA 3.5Å; Y414-N477 WeakPolarHBondContact CA-O 3.42Å; Y414-N477 WeakPolarHBondContact CB-O 3.48Å; Y414-N477 WeakPolarHBondContact CD1-O 3.49Å; Y414-N477 PolarHBondContact O-N 3.24Å; Y414-L478 HydrophobicContact CD1-CD2 4.37Å; Y414-L478 HydrophobicContact CD1-CG 4.3Å; Y414-L478 HydrophobicContact CE1-CD2 3.71Å; Y414-L478 HydrophobicContact CE1-CG 4Å; Y414-R481 VanDerWaalsContact CE1-NH2 3.29Å; Y414-R481 PolarHBondContact OH-NH2 3.07Å
415	G	87.5	Confident	94.2	Very high	50 Å²	50	39.7 Å²	39.7	52%	0.515	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	-12.5	-175.7	0	0	0	0	0	115.2	H413	H413-G415 PolarHBondContact O-N 2.96Å
416	V	92.1	Very high	94	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.1	-165.7	-168.9	0	0	0	0	112.8	L403 C412 H413 T418 A474 G475 M476	L403-V416 HydrophobicContact CB-CG1 4.25Å; L403-V416 HydrophobicContact CD1-CG1 3.98Å; C412-V416 WeakPolarHBondContact CA-O 3.33Å; H413-V416 PolarHBondContact N-O 2.95Å; H413-V416 PolarHBondContact O-N 3.19Å; H413-V416 VanDerWaalsContact O-O 3.07Å; V416-T418 HydrophobicContact CB-CG2 4.07Å; V416-T418 HydrophobicContact CG1-CG2 3.9Å; V416-T418 PolarHBondContact O-N 3.42Å; V416-T418 VanDerWaalsContact O-N 3.09Å; V416-T418 PolarHBondContact O-OG1 3.47Å; V416-A474 HydrophobicContact CG1-CB 3.98Å; V416-A474 WeakPolarHBondContact CG1-O 3.38Å; V416-A474 WeakPolarHBondContact CG2-O 3.35Å; V416-G475 WeakPolarHBondContact CG2-O 3.43Å; V416-M476 HydrophobicContact CB-CG 3.82Å; V416-M476 HydrophobicContact CG1-CG 4.45Å; V416-M476 HydrophobicContact CG2-CB 4.21Å; V416-M476 HydrophobicContact CG2-CG 3.51Å
417	V	94.1	Very high	93.9	Very high	48 Å²	48	39.9 Å²	39.9	29%	0.291	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	107.3	172.3	179	0	0	0	0	109.9	K400 L403 A409 G411	K400-V417 HydrophobicContact CB-CG1 4Å; L403-V417 PolarHBondContact N-O 3.17Å; L403-V417 VanDerWaalsContact N-O 3.11Å; A409-V417 HydrophobicContact CB-CG1 3.56Å; G411-V417 WeakPolarHBondContact O-CA 3.47Å
418	T	96.3	Very high	93.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.271	C	S	.	.			trans	-145.8	152.9	-168.8	46.2	0	0	0	0	113.6	V404 A409 S410 G411 H413 V416 M476	V404-T418 HydrophobicContact CG2-CG2 3.98Å; A409-T418 WeakPolarHBondContact CA-O 3.49Å; S410-T418 PolarHBondContact N-O 3.14Å; S410-T418 VanDerWaalsContact N-O 3.15Å; G411-T418 PolarHBondContact O-N 2.91Å; H413-T418 PolarHBondContact CD2-O 3.3Å; H413-T418 PolarHBondContact CD2-OG1 3.18Å; V416-T418 HydrophobicContact CB-CG2 4.07Å; V416-T418 HydrophobicContact CG1-CG2 3.9Å; V416-T418 PolarHBondContact O-N 3.42Å; V416-T418 VanDerWaalsContact O-N 3.09Å; V416-T418 PolarHBondContact O-OG1 3.47Å; T418-M476 HydrophobicContact CG2-CE 4.25Å; T418-M476 HydrophobicContact CG2-SD 3.94Å
419	C	97	Very high	93.1	Very high	2 Å²	2	42 Å²	42	1%	0.014	25%	0.246	C	C	.	.			trans	-74.3	157.2	172.4	73.3	0	0	0	0	111.7	C402 D407 E408 S421 C422 K423 R460	C402-C419 HydrophobicContact CB-CB 3.89Å; C402-C419 PolarHBondContact SG-N 2.75Å; C402-C419 VanDerWaalsContact SG-SG 3.62Å; D407-C419 HydrophobicContact CB-CB 4.12Å; E408-C419 WeakPolarHBondContact O-CA 3.42Å; E408-C419 WeakPolarHBondContact O-CB 3.36Å; C419-S421 PolarHBondContact O-N 2.78Å; C419-S421 VanDerWaalsContact O-N 3.13Å; C419-S421 PolarHBondContact SG-OG 2.64Å; C419-S421 VanDerWaalsContact SG-OG 3.42Å; C419-C422 PolarHBondContact O-N 2.99Å; C419-C422 VanDerWaalsContact SG-SG 3.68Å; C419-K423 PolarHBondContact O-N 2.86Å; C419-K423 VanDerWaalsContact O-N 3.14Å; C419-R460 PolarHBondContact SG-NH1 2.92Å
420	G	95.8	Very high	92.5	Very high	33 Å²	33	42 Å²	42	34%	0.34	25%	0.245	S	C	.	.	H	α-helix	trans	-56	-31.9	-179.5	0	0	0	0	0	114.3	S410 K423 V424	S410-G420 PolarHBondContact OG-N 2.75Å; G420-K423 WeakPolarHBondContact O-CB 3.15Å; G420-V424 WeakPolarHBondContact O-CG2 3.48Å; G420-V424 PolarHBondContact O-N 3.49Å
421	S	95.4	Very high	91.7	Very high	46 Å²	46	42.2 Å²	42.2	32%	0.322	24%	0.237	S	C	.	.	H	α-helix	trans	-72.2	-35.4	178	84.3	0	0	0	0	112.9	C419 F425 R460 R467	C419-S421 PolarHBondContact O-N 2.78Å; C419-S421 VanDerWaalsContact O-N 3.13Å; C419-S421 PolarHBondContact SG-OG 2.64Å; C419-S421 VanDerWaalsContact SG-OG 3.42Å; S421-F425 WeakPolarHBondContact O-CB 3.25Å; S421-F425 PolarHBondContact O-N 2.84Å; S421-R460 PolarHBondContact OG-NH1 2.95Å; S421-R467 VanDerWaalsContact C-NH2 3.33Å; S421-R467 PolarHBondContact O-NH2 3.46Å; S421-R467 PolarHBondContact OG-NH2 2.86Å
422	C	96.4	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-72.7	-35.2	175.2	-70.5	0	0	0	0	112.1	V404 C405 C419 F426 R467	V404-C422 HydrophobicContact CB-CB 4.46Å; C405-C422 PolarHBondContact SG-SG 3Å; C419-C422 PolarHBondContact O-N 2.99Å; C419-C422 VanDerWaalsContact SG-SG 3.68Å; C422-F426 VanDerWaalsContact O-CB 3.25Å; C422-F426 WeakPolarHBondContact O-CB 3.49Å; C422-F426 PolarHBondContact O-N 3.06Å; C422-R467 PolarHBondContact SG-NH2 3.37Å
423	K	95.3	Very high	89.3	Confident	86 Å²	86	44.5 Å²	44.5	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-53.3	-54.8	169.3	175	-164.5	-169.6	172.9	0	111.7	H413 Y414 C419 G420 K427	H413-K423 HydrophobicContact CB-CB 4.01Å; H413-K423 HydrophobicContact CB-CD 4.35Å; H413-K423 HydrophobicContact CB-CG 3.87Å; H413-K423 WeakPolarHBondContact ND1-CD 3.44Å; H413-K423 WeakPolarHBondContact ND1-CE 3.49Å; Y414-K423 HydrophobicContact CD2-CG 4.47Å; Y414-K423 HydrophobicContact CE2-CG 3.83Å; Y414-K423 WeakPolarHBondContact CE2-O 3.41Å; C419-K423 PolarHBondContact O-N 2.86Å; C419-K423 VanDerWaalsContact O-N 3.14Å; G420-K423 WeakPolarHBondContact O-CB 3.15Å; K423-K427 PolarHBondContact O-N 3.13Å
424	V	94.8	Very high	87.7	Confident	70 Å²	70	48.9 Å²	48.9	42%	0.424	25%	0.251	S	S	.	.	H	α-helix	trans	-70.7	-39.6	-176.6	176.2	0	0	0	0	111.6	G420 K427 R428	G420-V424 WeakPolarHBondContact O-CG2 3.48Å; G420-V424 PolarHBondContact O-N 3.49Å; V424-K427 PolarHBondContact O-N 2.83Å; V424-R428 WeakPolarHBondContact O-CG 3.34Å; V424-R428 PolarHBondContact O-N 3.32Å; V424-R428 VanDerWaalsContact O-N 3.17Å
425	F	95.2	Very high	86	Confident	31 Å²	31	52 Å²	52	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-50.4	175.2	172.7	-99.2	0	0	0	111.9	S421 K427 R428 A429 P464 R467 F468	S421-F425 WeakPolarHBondContact O-CB 3.25Å; S421-F425 PolarHBondContact O-N 2.84Å; F425-K427 PolarHBondContact O-N 3.45Å; F425-R428 PolarHBondContact O-N 3.38Å; F425-A429 HydrophobicContact CZ-CB 4.48Å; F425-A429 VanDerWaalsContact O-CB 3.32Å; F425-A429 WeakPolarHBondContact O-CB 3.37Å; F425-A429 PolarHBondContact O-N 3.27Å; F425-P464 HydrophobicContact CE2-CB 3.94Å; F425-P464 HydrophobicContact CZ-CB 4.09Å; F425-P464 WeakPolarHBondContact CZ-O 3.44Å; F425-R467 HydrophobicContact CD1-CG 3.84Å; F425-R467 HydrophobicContact CE1-CB 3.92Å; F425-R467 HydrophobicContact CE1-CG 3.56Å; F425-R467 HydrophobicContact CZ-CB 4.1Å; F425-R467 HydrophobicContact CZ-CG 4.12Å; F425-F468 HydrophobicContact CE1-CB 3.92Å; F425-F468 HydrophobicContact CE1-CD2 4.45Å; F425-F468 HydrophobicContact CZ-CB 4.01Å
426	F	93.6	Very high	84.4	Confident	3 Å²	3	57.2 Å²	57.2	1%	0.013	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-42.7	179.6	-177.5	-103.8	0	0	0	112.2	Y414 C422 R428 A429 V430 F468 C471 L472 M476	Y414-F426 AromaticContact CD1-CD1 3.95Å; Y414-F426 HydrophobicContact CD1-CD1 3.95Å; Y414-F426 AromaticContact CD1-CE1 3.96Å; Y414-F426 HydrophobicContact CD1-CE1 3.96Å; Y414-F426 AromaticContact CD2-CD1 3.83Å; Y414-F426 HydrophobicContact CD2-CD1 3.83Å; Y414-F426 HydrophobicContact CE1-CD1 4.34Å; Y414-F426 HydrophobicContact CE2-CD1 4.25Å; Y414-F426 AromaticContact CG-CD1 3.67Å; Y414-F426 HydrophobicContact CG-CD1 3.67Å; Y414-F426 AromaticContact CG-CE1 3.93Å; Y414-F426 HydrophobicContact CG-CE1 3.93Å; C422-F426 VanDerWaalsContact O-CB 3.25Å; C422-F426 WeakPolarHBondContact O-CB 3.49Å; C422-F426 PolarHBondContact O-N 3.06Å; F426-R428 PolarHBondContact O-N 2.91Å; F426-A429 PolarHBondContact O-N 3.33Å; F426-V430 HydrophobicContact CD1-CG2 4.47Å; F426-V430 HydrophobicContact CD2-CG2 4.19Å; F426-V430 HydrophobicContact CE1-CG2 4.01Å; F426-V430 HydrophobicContact CE2-CG2 3.7Å; F426-V430 HydrophobicContact CZ-CG2 3.59Å; F426-V430 PolarHBondContact O-N 3.27Å; F426-F468 HydrophobicContact CD2-CD2 4.17Å; F426-F468 AromaticContact CD2-CE2 3.86Å; F426-F468 HydrophobicContact CD2-CE2 3.86Å; F426-F468 HydrophobicContact CE2-CD2 4.5Å; F426-F468 AromaticContact CE2-CE2 3.86Å; F426-F468 HydrophobicContact CE2-CE2 3.86Å; F426-C471 HydrophobicContact CD2-CB 3.61Å; F426-C471 HydrophobicContact CE2-CB 4.23Å; F426-C471 HydrophobicContact CG-CB 4.45Å; F426-L472 HydrophobicContact CE2-CD2 3.87Å; F426-L472 HydrophobicContact CE2-CG 4.44Å; F426-L472 HydrophobicContact CZ-CD2 4.37Å; F426-M476 HydrophobicContact CB-CE 3.6Å; F426-M476 HydrophobicContact CB-SD 4.16Å; F426-M476 HydrophobicContact CD1-CB 4.09Å; F426-M476 HydrophobicContact CD1-CE 3.89Å; F426-M476 HydrophobicContact CD2-CB 3.93Å; F426-M476 HydrophobicContact CD2-CE 4.49Å; F426-M476 HydrophobicContact CD2-SD 4.33Å; F426-M476 HydrophobicContact CE1-CB 3.89Å; F426-M476 HydrophobicContact CE2-CB 3.72Å; F426-M476 HydrophobicContact CG-CB 4.1Å; F426-M476 HydrophobicContact CG-CE 3.73Å; F426-M476 HydrophobicContact CG-SD 4.13Å; F426-M476 VanDerWaalsContact CZ-C 3.49Å; F426-M476 HydrophobicContact CZ-CB 3.7Å; F426-M476 WeakPolarHBondContact CZ-O 3.5Å
427	K	90.8	Very high	82.2	Confident	86 Å²	86	62.6 Å²	62.6	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-53.1	-57	174.6	-167.8	-172.5	-178.7	-85.5	0	111.2	Y414 K423 V424 F425 A429 V430 E431	Y414-K427 WeakPolarHBondContact OH-CB 3.04Å; Y414-K427 WeakPolarHBondContact OH-CG 3.22Å; K423-K427 PolarHBondContact O-N 3.13Å; V424-K427 PolarHBondContact O-N 2.83Å; F425-K427 PolarHBondContact O-N 3.45Å; K427-A429 VanDerWaalsContact C-N 3.31Å; K427-A429 PolarHBondContact O-N 3.06Å; K427-V430 PolarHBondContact O-N 3.35Å; K427-E431 WeakPolarHBondContact CE-OE1 3.28Å; K427-E431 WeakPolarHBondContact CG-OE1 3.42Å; K427-E431 WeakPolarHBondContact CG-OE2 3.09Å; K427-E431 IonicContact NZ-OE1 2.78Å; K427-E431 PolarHBondContact NZ-OE1 3.05Å; K427-E431 IonicContact NZ-OE2 3.66Å; K427-E431 PolarHBondContact NZ-OE2 3.39Å; K427-E431 WeakPolarHBondContact O-CB 3.41Å; K427-E431 VanDerWaalsContact O-CG 3.31Å; K427-E431 WeakPolarHBondContact O-CG 3.11Å; K427-E431 PolarHBondContact O-N 2.86Å
428	R	89.8	Confident	80	Confident	180 Å²	180	67.8 Å²	67.8	68%	0.679	34%	0.335	S	S	*	.	H	α-helix	trans	-62.7	-36.9	-178.2	-69.4	178	178	-176.1	-1.7	112.5	V424 F425 F426 G432	V424-R428 WeakPolarHBondContact O-CG 3.34Å; V424-R428 PolarHBondContact O-N 3.32Å; V424-R428 VanDerWaalsContact O-N 3.17Å; F425-R428 PolarHBondContact O-N 3.38Å; F426-R428 PolarHBondContact O-N 2.91Å; R428-G432 PolarHBondContact O-N 3.32Å
429	A	86.2	Confident	77.5	Confident	2 Å²	2	72.6 Å²	72.6	2%	0.017	37%	0.365	C	S	.	.	H	α-helix	trans	-67.5	-43.4	-179.6	0	0	0	0	0	112.4	F425 F426 K427 W433 Y445 F468	F425-A429 HydrophobicContact CZ-CB 4.48Å; F425-A429 VanDerWaalsContact O-CB 3.32Å; F425-A429 WeakPolarHBondContact O-CB 3.37Å; F425-A429 PolarHBondContact O-N 3.27Å; F426-A429 PolarHBondContact O-N 3.33Å; K427-A429 VanDerWaalsContact C-N 3.31Å; K427-A429 PolarHBondContact O-N 3.06Å; A429-W433 VanDerWaalsContact O-CB 3.31Å; A429-W433 WeakPolarHBondContact O-CB 3.14Å; A429-W433 PolarHBondContact O-N 3.1Å; A429-Y445 HydrophobicContact CB-CE2 3.78Å; A429-F468 HydrophobicContact CB-CD2 3.41Å; A429-F468 VanDerWaalsContact CB-CD2 3.41Å; A429-F468 HydrophobicContact CB-CE2 3.55Å; A429-F468 HydrophobicContact CB-CG 4.1Å; A429-F468 HydrophobicContact CB-CZ 4.31Å
430	V	82.3	Confident	75	Confident	15 Å²	15	79.9 Å²	79.9	9%	0.091	40%	0.404	C	S	.	.	H	α-helix	trans	-76.8	-36.9	177.1	-170.7	0	0	0	0	112.1	F426 K427 G432 W433 R434 F468 L478	F426-V430 HydrophobicContact CD1-CG2 4.47Å; F426-V430 HydrophobicContact CD2-CG2 4.19Å; F426-V430 HydrophobicContact CE1-CG2 4.01Å; F426-V430 HydrophobicContact CE2-CG2 3.7Å; F426-V430 HydrophobicContact CZ-CG2 3.59Å; F426-V430 PolarHBondContact O-N 3.27Å; K427-V430 PolarHBondContact O-N 3.35Å; V430-G432 VanDerWaalsContact C-N 3.35Å; V430-G432 PolarHBondContact O-N 2.83Å; V430-W433 WeakPolarHBondContact O-CB 3.25Å; V430-W433 PolarHBondContact O-N 3.03Å; V430-W433 VanDerWaalsContact O-N 3.11Å; V430-R434 HydrophobicContact CG1-CG 4.23Å; V430-R434 PolarHBondContact O-N 3.03Å; V430-F468 HydrophobicContact CG2-CE2 3.7Å; V430-F468 HydrophobicContact CG2-CZ 3.89Å; V430-L478 HydrophobicContact CB-CD1 3.67Å; V430-L478 HydrophobicContact CG1-CD1 3.58Å; V430-L478 HydrophobicContact CG2-CD1 4.32Å
431	E	75.8	Confident	72.8	Confident	80 Å²	80	81.8 Å²	81.8	37%	0.374	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-43.1	174.9	-73.1	172.2	166.8	0	0	111.2	K427 W433 A435	K427-E431 WeakPolarHBondContact CE-OE1 3.28Å; K427-E431 WeakPolarHBondContact CG-OE1 3.42Å; K427-E431 WeakPolarHBondContact CG-OE2 3.09Å; K427-E431 IonicContact NZ-OE1 2.78Å; K427-E431 PolarHBondContact NZ-OE1 3.05Å; K427-E431 IonicContact NZ-OE2 3.66Å; K427-E431 PolarHBondContact NZ-OE2 3.39Å; K427-E431 WeakPolarHBondContact O-CB 3.41Å; K427-E431 VanDerWaalsContact O-CG 3.31Å; K427-E431 WeakPolarHBondContact O-CG 3.11Å; K427-E431 PolarHBondContact O-N 2.86Å; E431-W433 PolarHBondContact O-N 3.32Å; E431-A435 VanDerWaalsContact O-CB 3.29Å; E431-A435 WeakPolarHBondContact O-CB 3.47Å; E431-A435 PolarHBondContact O-N 3.42Å; E431-A435 VanDerWaalsContact O-N 3.12Å
432	G	69.3	Low	70.3	Confident	26 Å²	26	87.3 Å²	87.3	27%	0.268	44%	0.444	S	S	.	.	H	α-helix	trans	-72	-9.6	173.8	0	0	0	0	0	115.4	R428 V430 R436	R428-G432 PolarHBondContact O-N 3.32Å; V430-G432 VanDerWaalsContact C-N 3.35Å; V430-G432 PolarHBondContact O-N 2.83Å; G432-R436 PolarHBondContact O-NH1 2.91Å
433	W	63.8	Low	68.2	Low	122 Å²	122	93.7 Å²	93.7	46%	0.462	47%	0.473	S	S	.	.	H	α-helix	trans	-93.3	-49.6	174.3	-177.1	87.9	0	0	0	110.9	A429 V430 E431 A435 R436 Q437	A429-W433 VanDerWaalsContact O-CB 3.31Å; A429-W433 WeakPolarHBondContact O-CB 3.14Å; A429-W433 PolarHBondContact O-N 3.1Å; V430-W433 WeakPolarHBondContact O-CB 3.25Å; V430-W433 PolarHBondContact O-N 3.03Å; V430-W433 VanDerWaalsContact O-N 3.11Å; E431-W433 PolarHBondContact O-N 3.32Å; W433-A435 VanDerWaalsContact C-N 3.35Å; W433-A435 PolarHBondContact O-N 3.48Å; W433-R436 PolarHBondContact O-N 3.3Å; W433-Q437 VanDerWaalsContact CZ3-OE1 3.26Å
434	R	59.6	Low	66.3	Low	120 Å²	120	96.5 Å²	96.5	45%	0.453	49%	0.492	S	S	.	.	H	α-helix	trans	-59.7	-41.8	175.7	-74.9	-174.8	172.3	166.9	-0.8	112.1	V430 R436 Q437 E479	V430-R434 HydrophobicContact CG1-CG 4.23Å; V430-R434 PolarHBondContact O-N 3.03Å; R434-R436 PolarHBondContact O-N 2.99Å; R434-Q437 PolarHBondContact O-N 3.14Å; R434-E479 IonicContact CZ-OE1 2.64Å; R434-E479 VanDerWaalsContact CZ-OE1 3.29Å; R434-E479 IonicContact NH1-OE1 2.63Å; R434-E479 PolarHBondContact NH1-OE1 3.17Å; R434-E479 IonicContact NH2-OE1 2.68Å; R434-E479 PolarHBondContact NH2-OE1 3.04Å
435	A	54.3	Low	65.2	Low	84 Å²	84	97.8 Å²	97.8	69%	0.694	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	7.6	179.5	0	0	0	0	0	115.2	E431 W433	E431-A435 VanDerWaalsContact O-CB 3.29Å; E431-A435 WeakPolarHBondContact O-CB 3.47Å; E431-A435 PolarHBondContact O-N 3.42Å; E431-A435 VanDerWaalsContact O-N 3.12Å; W433-A435 VanDerWaalsContact C-N 3.35Å; W433-A435 PolarHBondContact O-N 3.48Å
436	R	53.7	Low	64.4	Low	161 Å²	161	103 Å²	103	61%	0.608	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.7	21.6	-178.8	-63.1	-171.4	178.9	90.6	-0.6	113.6	G432 W433 R434 N438	G432-R436 PolarHBondContact O-NH1 2.91Å; W433-R436 PolarHBondContact O-N 3.3Å; R434-R436 PolarHBondContact O-N 2.99Å; R436-N438 VanDerWaalsContact C-N 3.27Å
437	Q	47.8	Very low	64	Low	120 Å²	120	103.9 Å²	103.9	56%	0.561	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-14	172.9	-70.5	-171.1	-108.8	0	0	113.2	W433 R434	W433-Q437 VanDerWaalsContact CZ3-OE1 3.26Å; R434-Q437 PolarHBondContact O-N 3.14Å
438	N	46.5	Very low	63.7	Low	156 Å²	156	105.5 Å²	105.5	83%	0.834	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	8.7	-172.7	-58	24.4	0	0	0	113.5	R436	R436-N438 VanDerWaalsContact C-N 3.27Å
439	T	44.3	Very low	63.3	Low	102 Å²	102	98.8 Å²	98.8	63%	0.626	54%	0.542	S	S	*	.	S	Bend	trans	-145.4	153.4	176.2	41.4	0	0	0	0	111	G441	T439-G441 PolarHBondContact O-N 2.87Å
440	D	44.3	Very low	63.2	Low	155 Å²	155	109.4 Å²	109.4	83%	0.829	58%	0.581	S	S	*	*			trans	-54.8	101.5	-157.3	-60.1	-75.1	0	0	0	117.3	Q442	D440-Q442 VanDerWaalsContact C-N 3.26Å; D440-Q442 PolarHBondContact O-N 3.49Å
441	G	50.3	Low	63.3	Low	72 Å²	72	113.1 Å²	113.1	74%	0.742	60%	0.6	S	S	*	*			trans	67.1	-13.5	131.1	0	0	0	0	0	120.5	T439 H443	T439-G441 PolarHBondContact O-N 2.87Å; G441-H443 PolarHBondContact O-N 3.11Å
442	Q	42.2	Very low	63.9	Low	163 Å²	163	114.2 Å²	114.2	76%	0.762	61%	0.609	S	S	*	*			trans	-90.1	98.1	-169.5	-64.6	-158.1	14.6	0	0	114.2	D440 N444	D440-Q442 VanDerWaalsContact C-N 3.26Å; D440-Q442 PolarHBondContact O-N 3.49Å; Q442-N444 PolarHBondContact O-N 2.94Å
443	H	53.2	Low	65	Low	134 Å²	134	115 Å²	115	62%	0.62	61%	0.61	S	S	*	*			trans	-70.6	102.7	173.8	-68.9	-44.3	0	0	0	113.5	G441 Y445	G441-H443 PolarHBondContact O-N 3.11Å; H443-Y445 PolarHBondContact O-N 3.32Å
444	N	55.5	Low	66.3	Low	144 Å²	144	114.4 Å²	114.4	77%	0.77	62%	0.615	S	S	*	*	S	Bend	trans	-82.4	36.3	172.8	-89.4	-64	0	0	0	115	Q442	Q442-N444 PolarHBondContact O-N 2.94Å
445	Y	71.1	Confident	68	Low	97 Å²	97	109 Å²	109	38%	0.38	60%	0.595	S	S	.	*			trans	-135.9	63.4	163.9	-74.1	-38.9	0	0	0	110.3	A429 H443 P464 A465	A429-Y445 HydrophobicContact CB-CE2 3.78Å; H443-Y445 PolarHBondContact O-N 3.32Å; Y445-P464 HydrophobicContact CD1-CB 3.71Å; Y445-P464 HydrophobicContact CD1-CG 3.76Å; Y445-P464 HydrophobicContact CE1-CB 3.68Å; Y445-P464 HydrophobicContact CE1-CG 4.03Å; Y445-A465 WeakPolarHBondContact O-CB 3.36Å
446	L	77.6	Confident	70	Confident	142 Å²	142	106.7 Å²	106.7	74%	0.743	57%	0.571	S	S	*	*			trans	-77.8	150.7	167.8	-57.8	178.4	0	0	0	110.7
447	C	86.1	Confident	71.9	Confident	21 Å²	21	104.8 Å²	104.8	14%	0.142	57%	0.567	C	S	.	*			trans	-94.2	129	168.9	-174.9	0	0	0	0	109.5	G449 N451 A465	C447-G449 PolarHBondContact O-N 3.45Å; C447-G449 PolarHBondContact SG-O 3.12Å; C447-G449 VanDerWaalsContact SG-O 3.36Å; C447-N451 HydrophobicContact CB-CB 4.5Å; C447-N451 WeakPolarHBondContact CB-OD1 3.27Å; C447-A465 HydrophobicContact CB-CB 4.17Å
448	A	83.9	Confident	74	Confident	119 Å²	119	105.7 Å²	105.7	98%	0.983	57%	0.574	S	S	*	*	S	Bend	trans	-77.2	28.5	173.2	0	0	0	0	0	113.1
449	G	82.4	Confident	76.2	Confident	40 Å²	40	103.4 Å²	103.4	41%	0.412	55%	0.554	S	S	.	*	S	Bend	trans	-170.6	-167.4	-170.3	0	0	0	0	0	110.2	C447 N451	C447-G449 PolarHBondContact O-N 3.45Å; C447-G449 PolarHBondContact SG-O 3.12Å; C447-G449 VanDerWaalsContact SG-O 3.36Å; G449-N451 PolarHBondContact O-N 2.73Å
450	R	82.9	Confident	78.5	Confident	225 Å²	225	100.2 Å²	100.2	85%	0.849	53%	0.53	S	S	*	.	S	Bend	trans	-79	29.3	-167.9	-62.2	179.3	178.4	153.1	-2.4	115.3	D452	R450-D452 PolarHBondContact O-N 2.73Å
451	N	84.2	Confident	80.8	Confident	92 Å²	92	101.7 Å²	101.7	49%	0.492	53%	0.529	S	S	.	.	S	Bend	trans	55.8	18.2	-176	-70.1	-69	0	0	0	115.3	C447 G449 C466 R469	C447-N451 HydrophobicContact CB-CB 4.5Å; C447-N451 WeakPolarHBondContact CB-OD1 3.27Å; G449-N451 PolarHBondContact O-N 2.73Å; N451-C466 PolarHBondContact O-SG 3.13Å; N451-R469 VanDerWaalsContact O-CZ 3.31Å; N451-R469 PolarHBondContact O-NE 3.41Å; N451-R469 VanDerWaalsContact O-NE 3.14Å; N451-R469 PolarHBondContact O-NH2 3.47Å
452	D	87.9	Confident	82.8	Confident	103 Å²	103	104.2 Å²	104.2	55%	0.551	53%	0.526	S	S	*	.			trans	-110.8	-2.1	-170.3	61.4	-18.5	0	0	0	114	R450 I454	R450-D452 PolarHBondContact O-N 2.73Å; D452-I454 PolarHBondContact O-N 3.24Å
453	C	92.7	Very high	85.3	Confident	44 Å²	44	96.9 Å²	96.9	30%	0.297	49%	0.492	S	S	.	.			trans	-53.2	129.3	-167.7	-55.9	0	0	0	0	114.1	I455 C463 C466	C453-I455 WeakPolarHBondContact O-CG1 3.29Å; C453-I455 PolarHBondContact O-N 2.79Å; C453-C463 HydrophobicContact CB-CB 3.76Å; C453-C466 HydrophobicContact CB-CB 3.97Å; C453-C466 PolarHBondContact N-SG 3.29Å
454	I	91.6	Very high	87.1	Confident	109 Å²	109	92.6 Å²	92.6	56%	0.559	48%	0.477	S	S	*	.			trans	-67.2	120.9	-178.3	-56.2	169	0	0	0	110.9	D452 R459	D452-I454 PolarHBondContact O-N 3.24Å; I454-R459 WeakPolarHBondContact O-CB 3.41Å
455	I	95.9	Very high	88.7	Confident	7 Å²	7	86.2 Å²	86.2	4%	0.036	44%	0.444	C	S	.	.			trans	-103	108	-178.9	-54.6	-55.7	0	0	0	110.5	V404 C405 C453 R460 C466 R467 K470	V404-I455 HydrophobicContact CG1-CG2 4.37Å; V404-I455 WeakPolarHBondContact O-CG2 3.4Å; C405-I455 HydrophobicContact CB-CG2 3.89Å; C453-I455 WeakPolarHBondContact O-CG1 3.29Å; C453-I455 PolarHBondContact O-N 2.79Å; I455-R460 HydrophobicContact CG2-CB 3.88Å; I455-C466 HydrophobicContact CD1-CB 3.98Å; I455-C466 HydrophobicContact CG1-CB 4.28Å; I455-R467 HydrophobicContact CD1-CB 4.05Å; I455-R467 HydrophobicContact CG1-CB 4.38Å; I455-R467 HydrophobicContact CG2-CB 4.36Å; I455-R467 HydrophobicContact CG2-CG 4.12Å; I455-K470 HydrophobicContact CB-CD 3.99Å; I455-K470 HydrophobicContact CG1-CD 4.33Å; I455-K470 PolarHBondContact O-NZ 2.68Å
456	D	95.4	Very high	89.8	Confident	35 Å²	35	81.7 Å²	81.7	19%	0.187	43%	0.426	C	S	.	.			trans	-130.7	-175.3	173.3	64.3	45.2	0	0	0	111.9	C405 I458 R459 R460	C405-D456 CarbonylContact O-C 3.39Å; C405-D456 VanDerWaalsContact O-C 3.22Å; C405-D456 VanDerWaalsContact O-CA 3.25Å; C405-D456 WeakPolarHBondContact O-CA 3.21Å; D456-I458 PolarHBondContact O-N 3.26Å; D456-I458 VanDerWaalsContact O-N 3.13Å; D456-I458 WeakPolarHBondContact OD1-CA 3.5Å; D456-I458 PolarHBondContact OD1-N 3.32Å; D456-R459 PolarHBondContact OD1-N 3.31Å; D456-R459 IonicContact OD2-CZ 3.52Å; D456-R459 IonicContact OD2-NE 2.7Å; D456-R459 PolarHBondContact OD2-NE 3.08Å; D456-R459 IonicContact OD2-NH2 3.69Å; D456-R459 PolarHBondContact OD2-NH2 2.9Å; D456-R460 WeakPolarHBondContact O-CB 3.07Å; D456-R460 WeakPolarHBondContact O-CD 3.32Å; D456-R460 WeakPolarHBondContact O-CG 3.37Å; D456-R460 PolarHBondContact O-N 2.94Å
457	K	93.6	Very high	90.6	Very high	120 Å²	120	75.8 Å²	75.8	52%	0.522	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.9	-178.6	-175	171	-174.5	145.3	0	114	C405 D407 R460	C405-K457 PolarHBondContact O-N 3.31Å; D407-K457 HydrophobicContact CB-CB 4.14Å; D407-K457 HydrophobicContact CB-CD 4.28Å; D407-K457 HydrophobicContact CB-CG 4.08Å; D407-K457 WeakPolarHBondContact OD1-CD 3.38Å; D407-K457 WeakPolarHBondContact OD1-CE 3.31Å; D407-K457 IonicContact OD1-NZ 3.88Å; D407-K457 PolarHBondContact OD1-NZ 3.36Å; K457-R460 PolarHBondContact O-NE 3.33Å; K457-R460 PolarHBondContact O-NH2 2.94Å
458	I	93.1	Very high	91	Very high	140 Å²	140	76.2 Å²	76.2	72%	0.718	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-58.3	-176.6	-54.1	174.4	0	0	0	109.2	D456 R460	D456-I458 PolarHBondContact O-N 3.26Å; D456-I458 VanDerWaalsContact O-N 3.13Å; D456-I458 WeakPolarHBondContact OD1-CA 3.5Å; D456-I458 PolarHBondContact OD1-N 3.32Å; I458-R460 VanDerWaalsContact C-N 3.3Å; I458-R460 PolarHBondContact O-N 3.3Å
459	R	91.9	Very high	91.3	Very high	107 Å²	107	75 Å²	75	40%	0.404	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-74.5	-9.8	-171.2	-69.4	-177.4	-72.8	-172.7	-4.7	115.1	I454 D456 K461 N462	I454-R459 WeakPolarHBondContact O-CB 3.41Å; D456-R459 PolarHBondContact OD1-N 3.31Å; D456-R459 IonicContact OD2-CZ 3.52Å; D456-R459 IonicContact OD2-NE 2.7Å; D456-R459 PolarHBondContact OD2-NE 3.08Å; D456-R459 IonicContact OD2-NH2 3.69Å; D456-R459 PolarHBondContact OD2-NH2 2.9Å; R459-K461 PolarHBondContact O-N 3.27Å; R459-N462 WeakPolarHBondContact CA-OD1 3.29Å; R459-N462 WeakPolarHBondContact O-CB 3.45Å; R459-N462 PolarHBondContact O-N 3.42Å; R459-N462 PolarHBondContact O-OD1 3.18Å
460	R	93.1	Very high	91.8	Very high	35 Å²	35	75.9 Å²	75.9	13%	0.132	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-61	-1	173.5	65.5	-172.8	174.9	179.8	-4.2	116	C405 D407 C419 S421 I455 D456 K457 I458 R467	C405-R460 HydrophobicContact CB-CB 4.31Å; C405-R460 PolarHBondContact SG-NH1 2.96Å; D407-R460 IonicContact OD2-CZ 3.75Å; D407-R460 IonicContact OD2-NH1 2.99Å; D407-R460 PolarHBondContact OD2-NH1 3.05Å; D407-R460 IonicContact OD2-NH2 2.99Å; D407-R460 PolarHBondContact OD2-NH2 3.42Å; C419-R460 PolarHBondContact SG-NH1 2.92Å; S421-R460 PolarHBondContact OG-NH1 2.95Å; I455-R460 HydrophobicContact CG2-CB 3.88Å; D456-R460 WeakPolarHBondContact O-CB 3.07Å; D456-R460 WeakPolarHBondContact O-CD 3.32Å; D456-R460 WeakPolarHBondContact O-CG 3.37Å; D456-R460 PolarHBondContact O-N 2.94Å; K457-R460 PolarHBondContact O-NE 3.33Å; K457-R460 PolarHBondContact O-NH2 2.94Å; I458-R460 VanDerWaalsContact C-N 3.3Å; I458-R460 PolarHBondContact O-N 3.3Å; R460-R467 VanDerWaalsContact O-CD 3.3Å; R460-R467 WeakPolarHBondContact O-CD 3.3Å; R460-R467 PolarHBondContact O-NH1 2.96Å
461	K	92.1	Very high	92.3	Very high	186 Å²	186	65.2 Å²	65.2	81%	0.809	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-93.7	-28.3	167.5	-69.3	-174.4	178.9	-178.8	0	112.5	R459	R459-K461 PolarHBondContact O-N 3.27Å
462	N	93	Very high	92.7	Very high	126 Å²	126	65 Å²	65	67%	0.674	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-34.7	-166.5	-56.2	39	0	0	0	113	R459	R459-N462 WeakPolarHBondContact CA-OD1 3.29Å; R459-N462 WeakPolarHBondContact O-CB 3.45Å; R459-N462 PolarHBondContact O-N 3.42Å; R459-N462 PolarHBondContact O-OD1 3.18Å
463	C	93.6	Very high	92.7	Very high	8 Å²	8	66.6 Å²	66.6	5%	0.054	32%	0.318	C	S	.	.			trans	-134.7	96.7	176.5	-172.5	0	0	0	0	110.9	C453 A465 C466 R467	C453-C463 HydrophobicContact CB-CB 3.76Å; C463-A465 VanDerWaalsContact C-N 3.29Å; C463-A465 PolarHBondContact O-N 2.93Å; C463-C466 HydrophobicContact CB-CB 4.17Å; C463-C466 PolarHBondContact SG-N 2.84Å; C463-C466 VanDerWaalsContact SG-N 3.41Å; C463-C466 PolarHBondContact SG-SG 3.2Å; C463-R467 WeakPolarHBondContact O-CB 3.49Å; C463-R467 PolarHBondContact O-N 3.42Å
464	P	91.5	Very high	92.6	Very high	45 Å²	45	65.9 Å²	65.9	29%	0.292	32%	0.316	S	S	.	.	H	α-helix	trans	-66.6	-30.8	176.3	27.5	-34	0	0	0	112	F425 Y445 R467 F468	F425-P464 HydrophobicContact CE2-CB 3.94Å; F425-P464 HydrophobicContact CZ-CB 4.09Å; F425-P464 WeakPolarHBondContact CZ-O 3.44Å; Y445-P464 HydrophobicContact CD1-CB 3.71Å; Y445-P464 HydrophobicContact CD1-CG 3.76Å; Y445-P464 HydrophobicContact CE1-CB 3.68Å; Y445-P464 HydrophobicContact CE1-CG 4.03Å; P464-R467 WeakPolarHBondContact O-CB 3.3Å; P464-R467 PolarHBondContact O-N 3.21Å; P464-F468 WeakPolarHBondContact O-CB 3.45Å; P464-F468 PolarHBondContact O-N 2.71Å
465	A	89.8	Confident	92.4	Very high	10 Å²	10	63 Å²	63	8%	0.083	31%	0.312	C	S	.	.	H	α-helix	trans	-58.4	-57.5	176.1	0	0	0	0	0	112.3	Y445 C447 C463 R467 F468 R469	Y445-A465 WeakPolarHBondContact O-CB 3.36Å; C447-A465 HydrophobicContact CB-CB 4.17Å; C463-A465 VanDerWaalsContact C-N 3.29Å; C463-A465 PolarHBondContact O-N 2.93Å; A465-R467 PolarHBondContact O-N 2.83Å; A465-F468 PolarHBondContact O-N 3.14Å; A465-F468 VanDerWaalsContact O-N 3.13Å; A465-R469 WeakPolarHBondContact O-CB 3.48Å; A465-R469 PolarHBondContact O-N 3.27Å
466	C	92.8	Very high	92.2	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.007	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-33.2	177.4	-68.3	0	0	0	0	112.1	N451 C453 I455 C463 K470	N451-C466 PolarHBondContact O-SG 3.13Å; C453-C466 HydrophobicContact CB-CB 3.97Å; C453-C466 PolarHBondContact N-SG 3.29Å; I455-C466 HydrophobicContact CD1-CB 3.98Å; I455-C466 HydrophobicContact CG1-CB 4.28Å; C463-C466 HydrophobicContact CB-CB 4.17Å; C463-C466 PolarHBondContact SG-N 2.84Å; C463-C466 VanDerWaalsContact SG-N 3.41Å; C463-C466 PolarHBondContact SG-SG 3.2Å; C466-K470 VanDerWaalsContact O-CB 3.3Å; C466-K470 WeakPolarHBondContact O-CB 3.41Å; C466-K470 PolarHBondContact O-N 3.03Å
467	R	95.5	Very high	91.7	Very high	18 Å²	18	65 Å²	65	7%	0.068	32%	0.323	C	S	.	.	H	α-helix	trans	-65.1	-44	173.6	-172.9	-178.2	-175.7	167.4	-2.4	112.4	V404 S421 C422 F425 I455 R460 C463 P464 A465 K470 C471	V404-R467 HydrophobicContact CG1-CG 4.42Å; S421-R467 VanDerWaalsContact C-NH2 3.33Å; S421-R467 PolarHBondContact O-NH2 3.46Å; S421-R467 PolarHBondContact OG-NH2 2.86Å; C422-R467 PolarHBondContact SG-NH2 3.37Å; F425-R467 HydrophobicContact CD1-CG 3.84Å; F425-R467 HydrophobicContact CE1-CB 3.92Å; F425-R467 HydrophobicContact CE1-CG 3.56Å; F425-R467 HydrophobicContact CZ-CB 4.1Å; F425-R467 HydrophobicContact CZ-CG 4.12Å; I455-R467 HydrophobicContact CD1-CB 4.05Å; I455-R467 HydrophobicContact CG1-CB 4.38Å; I455-R467 HydrophobicContact CG2-CB 4.36Å; I455-R467 HydrophobicContact CG2-CG 4.12Å; R460-R467 VanDerWaalsContact O-CD 3.3Å; R460-R467 WeakPolarHBondContact O-CD 3.3Å; R460-R467 PolarHBondContact O-NH1 2.96Å; C463-R467 WeakPolarHBondContact O-CB 3.49Å; C463-R467 PolarHBondContact O-N 3.42Å; P464-R467 WeakPolarHBondContact O-CB 3.3Å; P464-R467 PolarHBondContact O-N 3.21Å; A465-R467 PolarHBondContact O-N 2.83Å; R467-K470 PolarHBondContact O-N 3.06Å; R467-C471 PolarHBondContact O-N 2.96Å; R467-C471 PolarHBondContact O-SG 3.43Å
468	F	93.5	Very high	91	Very high	30 Å²	30	60.8 Å²	60.8	13%	0.132	31%	0.306	C	S	.	.	H	α-helix	trans	-68.3	-44.4	178.9	-175.4	-122.5	0	0	0	111.3	F425 F426 A429 V430 P464 A465 K470 C471 L472	F425-F468 HydrophobicContact CE1-CB 3.92Å; F425-F468 HydrophobicContact CE1-CD2 4.45Å; F425-F468 HydrophobicContact CZ-CB 4.01Å; F426-F468 HydrophobicContact CD2-CD2 4.17Å; F426-F468 AromaticContact CD2-CE2 3.86Å; F426-F468 HydrophobicContact CD2-CE2 3.86Å; F426-F468 HydrophobicContact CE2-CD2 4.5Å; F426-F468 AromaticContact CE2-CE2 3.86Å; F426-F468 HydrophobicContact CE2-CE2 3.86Å; A429-F468 HydrophobicContact CB-CD2 3.41Å; A429-F468 VanDerWaalsContact CB-CD2 3.41Å; A429-F468 HydrophobicContact CB-CE2 3.55Å; A429-F468 HydrophobicContact CB-CG 4.1Å; A429-F468 HydrophobicContact CB-CZ 4.31Å; V430-F468 HydrophobicContact CG2-CE2 3.7Å; V430-F468 HydrophobicContact CG2-CZ 3.89Å; P464-F468 WeakPolarHBondContact O-CB 3.45Å; P464-F468 PolarHBondContact O-N 2.71Å; A465-F468 PolarHBondContact O-N 3.14Å; A465-F468 VanDerWaalsContact O-N 3.13Å; F468-K470 VanDerWaalsContact C-N 3.27Å; F468-K470 PolarHBondContact O-N 3.26Å; F468-C471 WeakPolarHBondContact O-CB 3.34Å; F468-C471 PolarHBondContact O-N 3.32Å; F468-C471 VanDerWaalsContact O-N 3.08Å; F468-L472 HydrophobicContact CD1-CD1 4.19Å; F468-L472 HydrophobicContact CE1-CD1 3.83Å; F468-L472 HydrophobicContact CE2-CG 4.46Å; F468-L472 HydrophobicContact CZ-CD1 4.01Å; F468-L472 HydrophobicContact CZ-CD2 4.49Å; F468-L472 HydrophobicContact CZ-CG 4.38Å; F468-L472 PolarHBondContact O-N 3.2Å
469	R	90.4	Very high	89.8	Confident	93 Å²	93	58.1 Å²	58.1	35%	0.351	29%	0.291	S	S	.	.	H	α-helix	trans	-52	-45.6	169.8	-170.7	179.5	59.5	61.5	-5.4	111.6	N451 A465 L472 Q473	N451-R469 VanDerWaalsContact O-CZ 3.31Å; N451-R469 PolarHBondContact O-NE 3.41Å; N451-R469 VanDerWaalsContact O-NE 3.14Å; N451-R469 PolarHBondContact O-NH2 3.47Å; A465-R469 WeakPolarHBondContact O-CB 3.48Å; A465-R469 PolarHBondContact O-N 3.27Å; R469-L472 PolarHBondContact O-N 3.48Å; R469-Q473 VanDerWaalsContact NH1-CD 3.3Å; R469-Q473 WeakPolarHBondContact O-CB 3.31Å; R469-Q473 WeakPolarHBondContact O-CG 3.41Å; R469-Q473 PolarHBondContact O-N 2.8Å
470	K	93.4	Very high	88.2	Confident	60 Å²	60	55.3 Å²	55.3	26%	0.261	29%	0.29	S	S	.	.	H	α-helix	trans	-73	-27.4	178.4	-164.3	175.1	175.6	-164.7	0	113.9	V404 I455 C466 R467 F468 A474	V404-K470 HydrophobicContact CG1-CB 4.43Å; V404-K470 HydrophobicContact CG1-CG 4.43Å; V404-K470 WeakPolarHBondContact O-CD 2.98Å; V404-K470 WeakPolarHBondContact O-CE 3.08Å; V404-K470 PolarHBondContact O-NZ 3.17Å; I455-K470 HydrophobicContact CB-CD 3.99Å; I455-K470 HydrophobicContact CG1-CD 4.33Å; I455-K470 PolarHBondContact O-NZ 2.68Å; C466-K470 VanDerWaalsContact O-CB 3.3Å; C466-K470 WeakPolarHBondContact O-CB 3.41Å; C466-K470 PolarHBondContact O-N 3.03Å; R467-K470 PolarHBondContact O-N 3.06Å; F468-K470 VanDerWaalsContact C-N 3.27Å; F468-K470 PolarHBondContact O-N 3.26Å; K470-A474 VanDerWaalsContact O-CB 3.28Å; K470-A474 WeakPolarHBondContact O-CB 3.48Å; K470-A474 PolarHBondContact O-N 2.96Å
471	C	93.9	Very high	86.3	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.9	-47.5	167.9	-71.3	0	0	0	0	111.3	F426 R467 F468 A474 M476	F426-C471 HydrophobicContact CD2-CB 3.61Å; F426-C471 HydrophobicContact CE2-CB 4.23Å; F426-C471 HydrophobicContact CG-CB 4.45Å; R467-C471 PolarHBondContact O-N 2.96Å; R467-C471 PolarHBondContact O-SG 3.43Å; F468-C471 WeakPolarHBondContact O-CB 3.34Å; F468-C471 PolarHBondContact O-N 3.32Å; F468-C471 VanDerWaalsContact O-N 3.08Å; C471-A474 PolarHBondContact O-N 2.74Å; C471-M476 HydrophobicContact CB-CB 4.39Å; C471-M476 HydrophobicContact CB-CG 4.31Å; C471-M476 HydrophobicContact CB-SD 3.6Å; C471-M476 VanDerWaalsContact O-CB 3.27Å; C471-M476 WeakPolarHBondContact O-CB 3.46Å; C471-M476 VanDerWaalsContact O-CG 3.29Å; C471-M476 WeakPolarHBondContact O-CG 3.38Å; C471-M476 PolarHBondContact O-N 2.83Å; C471-M476 VanDerWaalsContact O-N 3.1Å
472	L	91.1	Very high	84.2	Confident	88 Å²	88	60.5 Å²	60.5	46%	0.461	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-47.2	178.5	-66.8	168.8	0	0	0	111.4	F426 F468 R469 A474 G475	F426-L472 HydrophobicContact CE2-CD2 3.87Å; F426-L472 HydrophobicContact CE2-CG 4.44Å; F426-L472 HydrophobicContact CZ-CD2 4.37Å; F468-L472 HydrophobicContact CD1-CD1 4.19Å; F468-L472 HydrophobicContact CE1-CD1 3.83Å; F468-L472 HydrophobicContact CE2-CG 4.46Å; F468-L472 HydrophobicContact CZ-CD1 4.01Å; F468-L472 HydrophobicContact CZ-CD2 4.49Å; F468-L472 HydrophobicContact CZ-CG 4.38Å; F468-L472 PolarHBondContact O-N 3.2Å; R469-L472 PolarHBondContact O-N 3.48Å; L472-A474 PolarHBondContact O-N 3.06Å; L472-G475 WeakPolarHBondContact O-CA 3.49Å; L472-G475 PolarHBondContact O-N 3.3Å
473	Q	88.7	Confident	82	Confident	137 Å²	137	62 Å²	62	64%	0.64	32%	0.318	S	S	*	.	H	α-helix	trans	-61.3	-29	176.1	-74.5	177.4	-24.3	0	0	113.8	R469 G475	R469-Q473 VanDerWaalsContact NH1-CD 3.3Å; R469-Q473 WeakPolarHBondContact O-CB 3.31Å; R469-Q473 WeakPolarHBondContact O-CG 3.41Å; R469-Q473 PolarHBondContact O-N 2.8Å; Q473-G475 PolarHBondContact O-N 3.19Å
474	A	89.8	Confident	79.5	Confident	29 Å²	29	69.3 Å²	69.3	24%	0.24	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-2.1	173.7	0	0	0	0	0	113.4	L403 V404 V416 K470 C471 L472	L403-A474 HydrophobicContact CB-CB 4.48Å; V404-A474 HydrophobicContact CG2-CB 3.97Å; V416-A474 HydrophobicContact CG1-CB 3.98Å; V416-A474 WeakPolarHBondContact CG1-O 3.38Å; V416-A474 WeakPolarHBondContact CG2-O 3.35Å; K470-A474 VanDerWaalsContact O-CB 3.28Å; K470-A474 WeakPolarHBondContact O-CB 3.48Å; K470-A474 PolarHBondContact O-N 2.96Å; C471-A474 PolarHBondContact O-N 2.74Å; L472-A474 PolarHBondContact O-N 3.06Å
475	G	87.6	Confident	77	Confident	47 Å²	47	77 Å²	77	49%	0.485	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	18.1	178.1	0	0	0	0	0	115.3	V416 L472 Q473 N477	V416-G475 WeakPolarHBondContact CG2-O 3.43Å; L472-G475 WeakPolarHBondContact O-CA 3.49Å; L472-G475 PolarHBondContact O-N 3.3Å; Q473-G475 PolarHBondContact O-N 3.19Å; G475-N477 PolarHBondContact O-N 3.24Å
476	M	92.2	Very high	74.8	Confident	6 Å²	6	84 Å²	84	3%	0.03	41%	0.412	C	S	.	.			trans	-72	123.3	-177.8	-65.1	-173.7	76.9	0	0	111.4	V404 Y414 V416 T418 F426 C471	V404-M476 HydrophobicContact CG2-SD 4.08Å; Y414-M476 HydrophobicContact CD2-CE 3.67Å; Y414-M476 HydrophobicContact CG-CE 4.17Å; Y414-M476 WeakPolarHBondContact O-CA 3.5Å; V416-M476 HydrophobicContact CB-CG 3.82Å; V416-M476 HydrophobicContact CG1-CG 4.45Å; V416-M476 HydrophobicContact CG2-CB 4.21Å; V416-M476 HydrophobicContact CG2-CG 3.51Å; T418-M476 HydrophobicContact CG2-CE 4.25Å; T418-M476 HydrophobicContact CG2-SD 3.94Å; F426-M476 HydrophobicContact CB-CE 3.6Å; F426-M476 HydrophobicContact CB-SD 4.16Å; F426-M476 HydrophobicContact CD1-CB 4.09Å; F426-M476 HydrophobicContact CD1-CE 3.89Å; F426-M476 HydrophobicContact CD2-CB 3.93Å; F426-M476 HydrophobicContact CD2-CE 4.49Å; F426-M476 HydrophobicContact CD2-SD 4.33Å; F426-M476 HydrophobicContact CE1-CB 3.89Å; F426-M476 HydrophobicContact CE2-CB 3.72Å; F426-M476 HydrophobicContact CG-CB 4.1Å; F426-M476 HydrophobicContact CG-CE 3.73Å; F426-M476 HydrophobicContact CG-SD 4.13Å; F426-M476 VanDerWaalsContact CZ-C 3.49Å; F426-M476 HydrophobicContact CZ-CB 3.7Å; F426-M476 WeakPolarHBondContact CZ-O 3.5Å; C471-M476 HydrophobicContact CB-CB 4.39Å; C471-M476 HydrophobicContact CB-CG 4.31Å; C471-M476 HydrophobicContact CB-SD 3.6Å; C471-M476 VanDerWaalsContact O-CB 3.27Å; C471-M476 WeakPolarHBondContact O-CB 3.46Å; C471-M476 VanDerWaalsContact O-CG 3.29Å; C471-M476 WeakPolarHBondContact O-CG 3.38Å; C471-M476 PolarHBondContact O-N 2.83Å; C471-M476 VanDerWaalsContact O-N 3.1Å
477	N	85.5	Confident	72.2	Confident	79 Å²	79	91.6 Å²	91.6	42%	0.422	45%	0.453	S	S	.	.			trans	-136.8	140	177.7	-172.3	-7.6	0	0	0	111.6	Y414 G475 E479 A480	Y414-N477 WeakPolarHBondContact CA-O 3.42Å; Y414-N477 WeakPolarHBondContact CB-O 3.48Å; Y414-N477 WeakPolarHBondContact CD1-O 3.49Å; Y414-N477 PolarHBondContact O-N 3.24Å; G475-N477 PolarHBondContact O-N 3.24Å; N477-E479 PolarHBondContact OD1-N 2.93Å; N477-A480 HydrophobicContact CB-CB 4.27Å
478	L	78.5	Confident	69.3	Low	31 Å²	31	100.7 Å²	100.7	16%	0.162	49%	0.493	C	S	.	.	S	Bend	trans	-65.8	-39.7	172.9	-101.3	156.8	0	0	0	112.6	Y414 V430 A480	Y414-L478 HydrophobicContact CD1-CD2 4.37Å; Y414-L478 HydrophobicContact CD1-CG 4.3Å; Y414-L478 HydrophobicContact CE1-CD2 3.71Å; Y414-L478 HydrophobicContact CE1-CG 4Å; V430-L478 HydrophobicContact CB-CD1 3.67Å; V430-L478 HydrophobicContact CG1-CD1 3.58Å; V430-L478 HydrophobicContact CG2-CD1 4.32Å; L478-A480 PolarHBondContact O-N 3.15Å
479	E	68.8	Low	66.8	Low	85 Å²	85	106.2 Å²	106.2	40%	0.397	52%	0.522	S	S	.	.	S	Bend	trans	-75	-14.6	-173.8	-47.9	-42.4	136.9	0	0	113.1	R434 N477 R481 K482	R434-E479 IonicContact CZ-OE1 2.64Å; R434-E479 VanDerWaalsContact CZ-OE1 3.29Å; R434-E479 IonicContact NH1-OE1 2.63Å; R434-E479 PolarHBondContact NH1-OE1 3.17Å; R434-E479 IonicContact NH2-OE1 2.68Å; R434-E479 PolarHBondContact NH2-OE1 3.04Å; N477-E479 PolarHBondContact OD1-N 2.93Å; E479-R481 PolarHBondContact O-N 2.99Å; E479-K482 PolarHBondContact O-N 2.9Å
480	A	57.7	Low	63.9	Low	48 Å²	48	111.4 Å²	111.4	40%	0.397	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	15.6	173.1	0	0	0	0	0	114.6	N477 L478	N477-A480 HydrophobicContact CB-CB 4.27Å; L478-A480 PolarHBondContact O-N 3.15Å
481	R	52.9	Low	61	Low	154 Å²	154	113.9 Å²	113.9	58%	0.581	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	-17.5	175.8	-146.8	-175.1	-63	-174.1	1.5	113.9	Y414 E479	Y414-R481 VanDerWaalsContact CE1-NH2 3.29Å; Y414-R481 PolarHBondContact OH-NH2 3.07Å; E479-R481 PolarHBondContact O-N 2.99Å
482	K	48.7	Very low	57.9	Low	176 Å²	176	122.3 Å²	122.3	77%	0.765	61%	0.607	S	S	*	*	S	Bend	trans	-69.7	-37.2	178.3	-78.6	-175.9	175	178.7	0	112.8	E479 K484	E479-K482 PolarHBondContact O-N 2.9Å; K482-K484 PolarHBondContact O-N 2.99Å
483	N	46.4	Very low	54.8	Low	158 Å²	158	124.2 Å²	124.2	85%	0.845	62%	0.622	S	S	*	*			trans	-82.8	47.8	-173	-63.1	17	0	0	0	114
484	K	40.3	Very low	52.8	Low	161 Å²	161	123.5 Å²	123.5	70%	0.7	63%	0.629	S	S	*	*			trans	-117.2	36.4	178.9	-77.5	-162.5	171.7	-170.1	0	114.3	K482	K482-K484 PolarHBondContact O-N 2.99Å
485	K	39.8	Very low	49.6	Very low	207 Å²	207	128.2 Å²	128.2	90%	0.9	66%	0.661	S	S	*	*	S	Bend	trans	-103.2	17.7	174.7	-100	-170.4	177.2	-176.3	0	115.9
486	L	44	Very low	46.9	Very low	156 Å²	156	136.7 Å²	136.7	82%	0.817	68%	0.678	S	S	*	*	S	Bend	trans	-144	117.5	154.8	-154.1	70.3	0	0	0	111.1
487	N	38.1	Very low	44.8	Very low	160 Å²	160	141.6 Å²	141.6	86%	0.856	71%	0.71	S	S	*	*			trans	149.6	82	161.7	-85.1	-38.6	0	0	0	110.8
488	K	33.7	Very low	42.1	Very low	209 Å²	209	143.6 Å²	143.6	91%	0.909	73%	0.73	S	S	*	*			trans	-122.7	87.5	161.8	-108.6	-170	175.7	-175.1	0	109.7
489	I	41.3	Very low	39.8	Very low	147 Å²	147	150.1 Å²	150.1	75%	0.754	76%	0.76	S	S	*	*			trans	20.6	122.4	142.5	-53	166.4	0	0	0	116.1	V491	I489-V491 HydrophobicContact CG2-CG2 3.67Å
490	K	29.1	Very low	38.5	Very low	202 Å²	202	152.1 Å²	152.1	88%	0.878	78%	0.781	S	S	*	*			trans	-122.4	131.3	138.5	-161.7	166.5	-174.3	176.8	0	109.1
491	V	33.7	Very low	37.2	Very low	111 Å²	111	154.9 Å²	154.9	67%	0.673	80%	0.803	S	S	*	*			trans	-88.3	140.5	-178.8	177	0	0	0	0	109.3	I489	I489-V491 HydrophobicContact CG2-CG2 3.67Å
492	Q	28.9	Very low	36.2	Very low	177 Å²	177	152.8 Å²	152.8	83%	0.827	81%	0.812	S	S	*	*			trans	-153.4	144.4	159.5	-113.1	173.2	39.3	0	0	111.6
493	T	25.1	Very low	35.9	Very low	128 Å²	128	148.9 Å²	148.9	79%	0.785	81%	0.807	S	S	*	*			trans	-162	157.3	175.7	31.1	0	0	0	0	107.9
494	P	45.9	Very low	35.4	Very low	122 Å²	122	149.8 Å²	149.8	79%	0.792	81%	0.811	S	S	*	*			cis	-130.4	154.6	-39.6	37	-23.4	0	0	0	112
495	S	24.4	Very low	35.3	Very low	129 Å²	129	146.8 Å²	146.8	90%	0.902	82%	0.816	S	S	*	*			trans	-151.6	151.5	163.8	57.5	0	0	0	0	113.4
496	R	29.4	Very low	35.2	Very low	225 Å²	225	144 Å²	144	85%	0.849	81%	0.809	S	S	*	*			trans	-140.2	165.5	171.5	-128.9	-170.3	167.8	-166.1	-5.5	104.8
497	P	48.3	Very low	34.9	Very low	108 Å²	108	141.5 Å²	141.5	70%	0.701	80%	0.803	S	S	*	*			cis	-135.8	156.7	-1	40.1	-23.7	0	0	0	116.1
498	S	28.2	Very low	34.9	Very low	121 Å²	121	141.4 Å²	141.4	85%	0.846	80%	0.801	S	S	*	*			trans	-171.7	149.8	143.2	49.9	0	0	0	0	111.4
499	E	30.5	Very low	35.4	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	79%	0.793	S	S	*	*			trans	-120.3	171.9	167.7	-67.5	-179.1	176.3	0	0	108.3
500	P	41.6	Very low	35.3	Very low	127 Å²	127	136.5 Å²	136.5	83%	0.825	79%	0.79	S	S	*	*			cis	-121.4	170.4	-21.7	23.7	-3.1	0	0	0	112.3
501	A	31.3	Very low	35.8	Very low	105 Å²	105	138.5 Å²	138.5	87%	0.868	79%	0.792	S	S	*	*			trans	-137.8	143.3	165.2	0	0	0	0	0	110.3
502	S	32.1	Very low	36.2	Very low	111 Å²	111	138.8 Å²	138.8	78%	0.776	80%	0.799	S	S	*	*			trans	-85.6	142.6	-169.2	-165.4	0	0	0	0	113.6
503	S	42.1	Very low	36.8	Very low	94 Å²	94	138 Å²	138	66%	0.657	80%	0.797	S	S	*	*			trans	34.4	111.6	145.1	62.4	0	0	0	0	120
504	L	36.3	Very low	37.8	Very low	177 Å²	177	136.8 Å²	136.8	93%	0.927	79%	0.792	S	S	*	*				-145.7	155.9	120.1	-86.5	-168	0	0	0	109.7
505	A	37.9	Very low	37.8	Very low	97 Å²	97	140 Å²	140	80%	0.802	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.3	141.5	-168.3	0	0	0	0	0	113.6
506	I	37.5	Very low	39.4	Very low	149 Å²	149	141 Å²	141	76%	0.764	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-84.9	124.5	168.7	-60.7	173.1	0	0	0	108.2	I508	I506-I508 PolarHBondContact O-N 3.36Å
507	P	38.4	Very low	41.4	Very low	104 Å²	104	136.4 Å²	136.4	68%	0.675	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.4	119.8	170.2	27.7	-32.6	0	0	0	109.6	I509	P507-I509 VanDerWaalsContact C-N 3.32Å; P507-I509 PolarHBondContact O-N 3.49Å
508	I	37.9	Very low	43	Very low	158 Å²	158	135.3 Å²	135.3	81%	0.81	78%	0.78	S	S	*	*			trans	-73.5	89.7	173.7	-57.5	175.7	0	0	0	107.7	I506 P510	I506-I508 PolarHBondContact O-N 3.36Å; I508-P510 VanDerWaalsContact O-CD 3.24Å; I508-P510 WeakPolarHBondContact O-CD 3.41Å
509	I	44.2	Very low	45.9	Very low	145 Å²	145	134 Å²	134	74%	0.744	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64.5	117.8	169.8	-58.4	176.7	0	0	0	107.4	P507 R511	P507-I509 VanDerWaalsContact C-N 3.32Å; P507-I509 PolarHBondContact O-N 3.49Å; I509-R511 PolarHBondContact O-N 3.05Å
510	P	38.8	Very low	48.9	Very low	108 Å²	108	128 Å²	128	70%	0.701	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-60	140.9	175.9	-22.2	34.5	0	0	0	109.8	I508 S512	I508-P510 VanDerWaalsContact O-CD 3.24Å; I508-P510 WeakPolarHBondContact O-CD 3.41Å; P510-S512 PolarHBondContact O-N 2.9Å; P510-S512 VanDerWaalsContact O-N 3.1Å
511	R	40.4	Very low	51.4	Low	243 Å²	243	123.1 Å²	123.1	92%	0.917	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-59.9	120.5	170.1	-66.1	-176.9	-179.3	109.8	1.8	107.4	I509 M513	I509-R511 PolarHBondContact O-N 3.05Å; R511-M513 PolarHBondContact O-N 3.2Å
512	S	41.5	Very low	54.3	Low	118 Å²	118	120.5 Å²	120.5	83%	0.825	68%	0.681	S	S	*	*			trans	-56.4	110.9	173.2	52.8	0	0	0	0	108.6	P510	P510-S512 PolarHBondContact O-N 2.9Å; P510-S512 VanDerWaalsContact O-N 3.1Å
513	M	40.8	Very low	57.4	Low	160 Å²	160	117 Å²	117	79%	0.788	66%	0.655	S	S	*	*			trans	-54.2	148.1	170.5	-74.8	-76.3	-78.8	0	0	108.9	R511 Q515	R511-M513 PolarHBondContact O-N 3.2Å; M513-Q515 PolarHBondContact O-N 3.14Å; M513-Q515 VanDerWaalsContact O-N 3.17Å
514	P	47.4	Very low	60	Low	102 Å²	102	112.6 Å²	112.6	66%	0.662	62%	0.624	S	S	*	*			trans	-53.7	126.2	161.8	-17.7	30.5	0	0	0	107.5	L516	P514-L516 VanDerWaalsContact C-N 3.31Å; P514-L516 PolarHBondContact O-N 2.87Å
515	Q	43.9	Very low	62.7	Low	191 Å²	191	108.3 Å²	108.3	89%	0.893	60%	0.598	S	S	*	*			trans	-62.7	100.8	167.1	-83.2	178.7	-36.1	0	0	107	M513 V517	M513-Q515 PolarHBondContact O-N 3.14Å; M513-Q515 VanDerWaalsContact O-N 3.17Å; Q515-V517 PolarHBondContact O-N 3.24Å
516	L	58.8	Low	65.4	Low	149 Å²	149	107.9 Å²	107.9	78%	0.78	60%	0.595	S	S	*	*			trans	-65	103.8	165.8	-113.1	70.7	0	0	0	106	P514 P518	P514-L516 VanDerWaalsContact C-N 3.31Å; P514-L516 PolarHBondContact O-N 2.87Å; L516-P518 WeakPolarHBondContact O-CD 3.11Å
517	V	72.4	Confident	68.2	Low	129 Å²	129	102.5 Å²	102.5	78%	0.782	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-56.8	122.1	164.5	-179.7	0	0	0	0	106.3	Q515 T519	Q515-V517 PolarHBondContact O-N 3.24Å; V517-T519 PolarHBondContact O-N 3.28Å
518	P	80.9	Confident	70.8	Confident	85 Å²	85	99.5 Å²	99.5	55%	0.552	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-54.7	137.2	179.6	-27.6	36.3	0	0	0	110.8	L516 S522 V523	L516-P518 WeakPolarHBondContact O-CD 3.11Å; P518-S522 WeakPolarHBondContact CB-OG 3.46Å; P518-V523 HydrophobicContact CB-CG2 3.83Å
519	T	90.1	Very high	73.3	Confident	92 Å²	92	94.1 Å²	94.1	56%	0.564	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-70	150.2	171.7	62.3	0	0	0	0	109.2	V517 L521 S522 V523	V517-T519 PolarHBondContact O-N 3.28Å; T519-L521 PolarHBondContact O-N 2.92Å; T519-S522 PolarHBondContact N-OG 3.16Å; T519-S522 WeakPolarHBondContact O-CA 3.23Å; T519-S522 WeakPolarHBondContact O-CB 3.48Å; T519-S522 PolarHBondContact O-N 3.48Å; T519-S522 PolarHBondContact O-OG 2.9Å; T519-S522 WeakPolarHBondContact OG1-CB 3.37Å; T519-S522 PolarHBondContact OG1-N 3.28Å; T519-S522 PolarHBondContact OG1-OG 2.62Å; T519-V523 PolarHBondContact O-N 3.18Å
520	M	92.9	Very high	75.3	Confident	44 Å²	44	95.8 Å²	95.8	22%	0.217	52%	0.524	C	S	.	.	H	α-helix	trans	-51.3	-46.9	179.8	-168.9	68.9	85	0	0	111.5	S522 V523 L524 P570 T680 Y681 E684	M520-S522 VanDerWaalsContact C-N 3.29Å; M520-S522 PolarHBondContact O-N 2.73Å; M520-V523 WeakPolarHBondContact O-CA 3.45Å; M520-V523 WeakPolarHBondContact O-CB 3.08Å; M520-V523 PolarHBondContact O-N 2.86Å; M520-L524 WeakPolarHBondContact O-CG 3.21Å; M520-L524 PolarHBondContact O-N 3.35Å; M520-P570 HydrophobicContact CE-CB 3.89Å; M520-P570 HydrophobicContact CE-CG 4.45Å; M520-P570 HydrophobicContact SD-CB 3.67Å; M520-P570 HydrophobicContact SD-CG 3.58Å; M520-P570 VanDerWaalsContact SD-CG 3.58Å; M520-T680 HydrophobicContact CE-CG2 4.05Å; M520-Y681 HydrophobicContact CE-CE1 4.44Å; M520-Y681 HydrophobicContact CG-CE1 3.85Å; M520-Y681 HydrophobicContact SD-CE1 4.02Å; M520-E684 HydrophobicContact CB-CG 3.9Å; M520-E684 HydrophobicContact CG-CG 3.91Å
521	L	93.3	Very high	77.6	Confident	25 Å²	25	96.5 Å²	96.5	13%	0.131	52%	0.521	C	S	.	.	H	α-helix	trans	-57.9	-33.1	174.5	177.1	62.2	0	0	0	114.2	T519 K525 D649 L652	T519-L521 PolarHBondContact O-N 2.92Å; L521-K525 WeakPolarHBondContact O-CG 3.47Å; L521-K525 PolarHBondContact O-N 3.01Å; L521-D649 HydrophobicContact CD1-CB 3.93Å; L521-D649 HydrophobicContact CD2-CB 4.1Å; L521-L652 HydrophobicContact CD1-CD1 4.43Å
522	S	93.2	Very high	79.9	Confident	49 Å²	49	86.8 Å²	86.8	34%	0.343	49%	0.487	S	S	.	.	H	α-helix	trans	-74.4	-31.7	173.7	67.8	0	0	0	0	112.8	P518 T519 M520 A526	P518-S522 WeakPolarHBondContact CB-OG 3.46Å; T519-S522 PolarHBondContact N-OG 3.16Å; T519-S522 WeakPolarHBondContact O-CA 3.23Å; T519-S522 WeakPolarHBondContact O-CB 3.48Å; T519-S522 PolarHBondContact O-N 3.48Å; T519-S522 PolarHBondContact O-OG 2.9Å; T519-S522 WeakPolarHBondContact OG1-CB 3.37Å; T519-S522 PolarHBondContact OG1-N 3.28Å; T519-S522 PolarHBondContact OG1-OG 2.62Å; M520-S522 VanDerWaalsContact C-N 3.29Å; M520-S522 PolarHBondContact O-N 2.73Å; S522-A526 WeakPolarHBondContact O-CB 3.33Å; S522-A526 PolarHBondContact O-N 2.83Å
523	V	95.7	Very high	82.3	Confident	37 Å²	37	88 Å²	88	22%	0.224	47%	0.474	C	S	.	.	H	α-helix	trans	-67.2	-49.1	170.9	-178.2	0	0	0	0	110	P518 T519 M520 K525 A526 I527 P570	P518-V523 HydrophobicContact CB-CG2 3.83Å; T519-V523 PolarHBondContact O-N 3.18Å; M520-V523 WeakPolarHBondContact O-CA 3.45Å; M520-V523 WeakPolarHBondContact O-CB 3.08Å; M520-V523 PolarHBondContact O-N 2.86Å; V523-K525 PolarHBondContact O-N 2.97Å; V523-K525 VanDerWaalsContact O-N 3.14Å; V523-A526 PolarHBondContact O-N 2.84Å; V523-I527 HydrophobicContact CG1-CG2 4.18Å; V523-I527 WeakPolarHBondContact O-CG1 3.47Å; V523-I527 PolarHBondContact O-N 3.45Å; V523-P570 HydrophobicContact CG1-CG 3.93Å
524	L	96.6	Very high	84.7	Confident	2 Å²	2	80.5 Å²	80.5	1%	0.01	44%	0.437	C	S	.	.	H	α-helix	trans	-54.5	-34.3	177.6	-67.9	-177.9	0	0	0	113.1	M520 I527 E528 L569 L652 V656 Y681	M520-L524 WeakPolarHBondContact O-CG 3.21Å; M520-L524 PolarHBondContact O-N 3.35Å; L524-I527 HydrophobicContact CD2-CD1 4.27Å; L524-E528 PolarHBondContact O-N 3.08Å; L524-L569 HydrophobicContact CD2-CD2 3.39Å; L524-L652 HydrophobicContact CB-CB 4.23Å; L524-L652 HydrophobicContact CB-CD1 4.38Å; L524-L652 HydrophobicContact CD1-CB 4.33Å; L524-V656 HydrophobicContact CD2-CG2 3.87Å; L524-Y681 HydrophobicContact CD1-CD1 4.41Å; L524-Y681 HydrophobicContact CD1-CE1 4.21Å; L524-Y681 HydrophobicContact CD2-CE1 4.03Å; L524-Y681 HydrophobicContact CG-CE1 4.49Å
525	K	94.3	Very high	86.6	Confident	88 Å²	88	78.4 Å²	78.4	38%	0.383	43%	0.434	S	S	.	.	H	α-helix	trans	-74.5	-32.3	174.1	-74.3	-177.4	-179.1	-159.9	0	114.3	L521 V523 Y648 D649 L652	L521-K525 WeakPolarHBondContact O-CG 3.47Å; L521-K525 PolarHBondContact O-N 3.01Å; V523-K525 PolarHBondContact O-N 2.97Å; V523-K525 VanDerWaalsContact O-N 3.14Å; K525-Y648 HydrophobicContact CD-CE1 4.36Å; K525-Y648 HydrophobicContact CG-CE1 4.03Å; K525-D649 WeakPolarHBondContact CE-OD1 3.31Å; K525-D649 IonicContact NZ-OD1 3.37Å; K525-D649 PolarHBondContact NZ-OD1 2.95Å; K525-L652 HydrophobicContact CB-CD1 4.44Å; K525-L652 HydrophobicContact CD-CD1 4.42Å; K525-L652 HydrophobicContact CG-CD1 3.39Å
526	A	94.1	Very high	88.8	Confident	87 Å²	87	70 Å²	70	72%	0.719	39%	0.394	S	S	*	.	H	α-helix	trans	-80.9	-20	-178.3	0	0	0	0	0	113.2	S522 V523	S522-A526 WeakPolarHBondContact O-CB 3.33Å; S522-A526 PolarHBondContact O-N 2.83Å; V523-A526 PolarHBondContact O-N 2.84Å
527	I	95.7	Very high	90.1	Very high	36 Å²	36	65.9 Å²	65.9	19%	0.185	37%	0.373	C	S	.	.	S	Bend	trans	-101.8	-5.8	179.3	69.8	176.2	0	0	0	114.1	V523 L524 L569	V523-I527 HydrophobicContact CG1-CG2 4.18Å; V523-I527 WeakPolarHBondContact O-CG1 3.47Å; V523-I527 PolarHBondContact O-N 3.45Å; L524-I527 HydrophobicContact CD2-CD1 4.27Å; I527-L569 HydrophobicContact CD1-CD2 3.71Å; I527-L569 HydrophobicContact CD1-CG 4.2Å
528	E	94.5	Very high	90.8	Very high	42 Å²	42	64.1 Å²	64.1	20%	0.196	37%	0.366	C	S	.	.	S	Bend	trans	-60.5	132.5	-177.9	-176.8	69.6	170.4	0	0	110	L524 W565 Y651 L652 K655	L524-E528 PolarHBondContact O-N 3.08Å; E528-W565 PolarHBondContact OE2-NE1 3.29Å; E528-Y651 PolarHBondContact OE1-OH 2.94Å; E528-L652 HydrophobicContact CB-CD2 4.3Å; E528-L652 HydrophobicContact CG-CD2 4.27Å; E528-K655 IonicContact OE1-NZ 3.47Å; E528-K655 PolarHBondContact OE1-NZ 2.81Å; E528-K655 IonicContact OE2-NZ 3.55Å; E528-K655 PolarHBondContact OE2-NZ 3.03Å
529	P	89.9	Confident	91.1	Very high	45 Å²	45	65.8 Å²	65.8	29%	0.292	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-57.7	146.6	-173.9	-28.6	36.6	0	0	0	114.5	W565	P529-W565 HydrophobicContact CG-CB 3.99Å; P529-W565 HydrophobicContact CG-CG 4.3Å
530	E	86.6	Confident	91	Very high	180 Å²	180	65.6 Å²	65.6	84%	0.841	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-60.4	158.7	168.8	-63	-170.5	161.6	0	0	112	I532	E530-I532 PolarHBondContact O-N 3.05Å
531	I	86.4	Confident	90.8	Very high	123 Å²	123	68.2 Å²	68.2	63%	0.631	39%	0.391	S	S	*	.			trans	-70.9	113.9	-176.5	-60.6	176.3	0	0	0	110.1	Y533 P613	I531-Y533 HydrophobicContact CG2-CE2 4.22Å; I531-P613 HydrophobicContact CG2-CG 3.35Å
532	I	89.3	Confident	90.7	Very high	39 Å²	39	69.9 Å²	69.9	20%	0.2	40%	0.4	C	S	.	.			trans	-87.2	133.7	177.3	-55.7	176.8	0	0	0	110.1	E530 L554 Q557 Q558 S561 P613	E530-I532 PolarHBondContact O-N 3.05Å; I532-L554 HydrophobicContact CB-CD1 4.48Å; I532-L554 HydrophobicContact CG2-CD1 3.8Å; I532-Q557 HydrophobicContact CG2-CB 4.09Å; I532-Q558 HydrophobicContact CD1-CG 3.94Å; I532-S561 WeakPolarHBondContact CD1-OG 3.43Å; I532-P613 WeakPolarHBondContact O-CD 3.32Å
533	Y	90.7	Very high	90.6	Very high	144 Å²	144	70.4 Å²	70.4	57%	0.565	40%	0.401	S	S	*	.			trans	-100.4	142.2	172.9	-65.8	-102	0	0	0	109.3	I531 Q557 P613 D614	I531-Y533 HydrophobicContact CG2-CE2 4.22Å; Y533-Q557 PolarHBondContact O-OE1 3.33Å; Y533-P613 HydrophobicContact CD1-CB 4.14Å; Y533-P613 HydrophobicContact CD1-CG 4.15Å; Y533-P613 HydrophobicContact CE1-CB 3.73Å; Y533-P613 HydrophobicContact CE1-CG 3.85Å; Y533-D614 HydrophobicContact CD1-CB 4.39Å
534	S	91	Very high	90.4	Very high	2 Å²	2	70 Å²	70	1%	0.014	40%	0.4	C	S	.	.			trans	-81.2	-16.5	-176.1	64.1	0	0	0	0	114.5	Y536 D614 L615	S534-Y536 VanDerWaalsContact C-N 3.34Å; S534-Y536 WeakPolarHBondContact OG-CB 3.49Å; S534-Y536 PolarHBondContact OG-N 3.27Å; S534-D614 WeakPolarHBondContact CB-OD1 3.46Å; S534-D614 PolarHBondContact N-OD1 2.78Å; S534-D614 PolarHBondContact N-OD2 3.07Å; S534-D614 VanDerWaalsContact N-OD2 3.07Å; S534-D614 PolarHBondContact OG-OD1 3.13Å; S534-D614 PolarHBondContact OG-OD2 2.71Å; S534-D614 VanDerWaalsContact OG-OD2 3.13Å; S534-L615 VanDerWaalsContact OG-CB 3.3Å; S534-L615 WeakPolarHBondContact OG-CB 3.21Å
535	G	87.6	Confident	90.2	Very high	58 Å²	58	71.6 Å²	71.6	60%	0.598	41%	0.411	S	S	*	.			trans	67.3	35	-169.8	0	0	0	0	0	111.8	D537 D614	G535-D537 PolarHBondContact O-N 2.97Å; G535-D614 WeakPolarHBondContact CA-OD2 3.48Å; G535-D614 PolarHBondContact N-OD2 2.86Å
536	Y	90.1	Very high	90.1	Very high	14 Å²	14	70.3 Å²	70.3	6%	0.055	40%	0.404	C	S	.	.			trans	-79.4	107.2	-177.1	-165.9	-106.3	0	0	0	112.4	S534 S538 D542 R546 L547 T550 D614 L615	S534-Y536 VanDerWaalsContact C-N 3.34Å; S534-Y536 WeakPolarHBondContact OG-CB 3.49Å; S534-Y536 PolarHBondContact OG-N 3.27Å; Y536-S538 PolarHBondContact O-N 2.85Å; Y536-D542 PolarHBondContact OH-OD1 2.96Å; Y536-R546 PolarHBondContact OH-NH1 3.5Å; Y536-L547 HydrophobicContact CE1-CD2 4.25Å; Y536-L547 HydrophobicContact CE2-CD2 3.83Å; Y536-L547 WeakPolarHBondContact OH-CD2 3.38Å; Y536-T550 HydrophobicContact CD2-CG2 3.52Å; Y536-T550 HydrophobicContact CE2-CG2 4.29Å; Y536-T550 HydrophobicContact CG-CG2 4.31Å; Y536-D614 PolarHBondContact N-OD2 3.29Å; Y536-L615 HydrophobicContact CD1-CD1 4.13Å; Y536-L615 HydrophobicContact CD2-CD1 4.27Å; Y536-L615 HydrophobicContact CG-CD1 3.94Å
537	D	87.6	Confident	90.1	Very high	63 Å²	63	66.2 Å²	66.2	34%	0.337	37%	0.37	S	S	.	.			trans	-74.5	108.6	168.4	169.5	23.1	0	0	0	110.5	G535 T539 L540 R546	G535-D537 PolarHBondContact O-N 2.97Å; D537-T539 VanDerWaalsContact OD1-CB 3.31Å; D537-T539 WeakPolarHBondContact OD1-CB 3.36Å; D537-T539 WeakPolarHBondContact OD1-CG2 3.14Å; D537-T539 PolarHBondContact OD1-N 3.09Å; D537-T539 PolarHBondContact OD1-OG1 3.32Å; D537-T539 PolarHBondContact OD2-OG1 2.81Å; D537-L540 VanDerWaalsContact OD2-CD1 3.3Å; D537-L540 WeakPolarHBondContact OD2-CD1 3.43Å; D537-L540 WeakPolarHBondContact OD2-CG 3.41Å; D537-R546 VanDerWaalsContact O-CZ 3.31Å; D537-R546 PolarHBondContact O-NH1 2.99Å; D537-R546 PolarHBondContact O-NH2 2.76Å; D537-R546 IonicContact OD2-NH2 3.43Å
538	S	85.8	Confident	89.9	Confident	91 Å²	91	65.5 Å²	65.5	64%	0.636	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	1.6	177.9	56.3	0	0	0	0	114.6	Y536 L540	Y536-S538 PolarHBondContact O-N 2.85Å; S538-L540 VanDerWaalsContact C-N 3.35Å
539	T	88.6	Confident	89.9	Confident	121 Å²	121	64 Å²	64	74%	0.742	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.3	174.6	70.8	0	0	0	0	112.7	D537	D537-T539 VanDerWaalsContact OD1-CB 3.31Å; D537-T539 WeakPolarHBondContact OD1-CB 3.36Å; D537-T539 WeakPolarHBondContact OD1-CG2 3.14Å; D537-T539 PolarHBondContact OD1-N 3.09Å; D537-T539 PolarHBondContact OD1-OG1 3.32Å; D537-T539 PolarHBondContact OD2-OG1 2.81Å
540	L	87.1	Confident	90.1	Very high	88 Å²	88	62 Å²	62	46%	0.461	35%	0.347	S	S	.	.	S	Bend	trans	-93.1	145.7	175.7	-70.4	174.2	0	0	0	111.2	D537 S538 R546	D537-L540 VanDerWaalsContact OD2-CD1 3.3Å; D537-L540 WeakPolarHBondContact OD2-CD1 3.43Å; D537-L540 WeakPolarHBondContact OD2-CG 3.41Å; S538-L540 VanDerWaalsContact C-N 3.35Å; L540-R546 VanDerWaalsContact CB-CZ 3.49Å; L540-R546 PolarHBondContact O-NH1 3.06Å
541	P	88.5	Confident	90.5	Very high	99 Å²	99	55 Å²	55	64%	0.643	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-62.2	141.6	-171.7	24.9	-34.8	0	0	0	113.2	T543	P541-T543 PolarHBondContact O-N 2.97Å
542	D	90.4	Very high	90.9	Very high	60 Å²	60	49.9 Å²	49.9	32%	0.321	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-69.3	121	173.8	-68.3	-22.7	0	0	0	110.2	Y536 L547 R621 L624	Y536-D542 PolarHBondContact OH-OD1 2.96Å; D542-L547 HydrophobicContact CB-CD1 4.32Å; D542-R621 IonicContact OD1-CZ 2.78Å; D542-R621 IonicContact OD1-NE 2.73Å; D542-R621 IonicContact OD1-NH2 3.16Å; D542-R621 PolarHBondContact OD1-NH2 2.81Å; D542-R621 WeakPolarHBondContact OD2-CG 3.41Å; D542-R621 IonicContact OD2-CZ 2.75Å; D542-R621 IonicContact OD2-NE 2.73Å; D542-R621 PolarHBondContact OD2-NE 3.36Å; D542-R621 IonicContact OD2-NH2 2.64Å; D542-R621 PolarHBondContact OD2-NH2 3.18Å; D542-R621 VanDerWaalsContact OD2-NH2 3.12Å; D542-L624 HydrophobicContact CB-CD1 4.21Å
543	T	92.3	Very high	91.2	Very high	59 Å²	59	52.3 Å²	52.3	36%	0.362	30%	0.296	S	S	.	.			trans	-125.7	156.7	164.4	72.7	0	0	0	0	109.2	P541 S545 R546 L547	P541-T543 PolarHBondContact O-N 2.97Å; T543-S545 PolarHBondContact O-N 3.32Å; T543-S545 PolarHBondContact OG1-OG 3.47Å; T543-S545 VanDerWaalsContact OG1-OG 3.13Å; T543-R546 PolarHBondContact O-N 2.89Å; T543-R546 WeakPolarHBondContact OG1-CB 3.38Å; T543-R546 PolarHBondContact OG1-N 3.35Å; T543-L547 WeakPolarHBondContact O-CB 3.48Å; T543-L547 WeakPolarHBondContact O-CG 3.49Å; T543-L547 PolarHBondContact O-N 3.01Å
544	S	91.4	Very high	91.4	Very high	30 Å²	30	45.5 Å²	45.5	21%	0.21	27%	0.269	C	S	.	.	H	α-helix	trans	-57.3	-48.9	175.9	50.7	0	0	0	0	111.4	R546 L547 M548 P625	S544-R546 PolarHBondContact O-N 2.9Å; S544-L547 PolarHBondContact O-N 3.1Å; S544-M548 WeakPolarHBondContact O-CB 3.4Å; S544-M548 VanDerWaalsContact O-CG 3.23Å; S544-M548 WeakPolarHBondContact O-CG 3.5Å; S544-M548 PolarHBondContact O-N 2.64Å; S544-P625 WeakPolarHBondContact CB-O 3.4Å
545	S	91.9	Very high	91.6	Very high	34 Å²	34	45.8 Å²	45.8	24%	0.238	27%	0.272	C	S	.	.	H	α-helix	trans	-58.1	-47.5	176.7	56.7	0	0	0	0	113	T543 L547 M548 S549 L733	T543-S545 PolarHBondContact O-N 3.32Å; T543-S545 PolarHBondContact OG1-OG 3.47Å; T543-S545 VanDerWaalsContact OG1-OG 3.13Å; S545-L547 PolarHBondContact O-N 2.93Å; S545-M548 PolarHBondContact O-N 3.23Å; S545-S549 WeakPolarHBondContact O-CB 3.45Å; S545-S549 PolarHBondContact O-N 3.43Å; S545-S549 PolarHBondContact O-OG 2.99Å; S545-L733 VanDerWaalsContact CB-O 3.26Å; S545-L733 WeakPolarHBondContact CB-O 3.33Å
546	R	92.8	Very high	91.9	Very high	62 Å²	62	43.3 Å²	43.3	23%	0.234	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-38.8	-179.7	-174.4	174.8	-174.3	-100	-9.7	112.6	Y536 D537 L540 T543 S544 T550	Y536-R546 PolarHBondContact OH-NH1 3.5Å; D537-R546 VanDerWaalsContact O-CZ 3.31Å; D537-R546 PolarHBondContact O-NH1 2.99Å; D537-R546 PolarHBondContact O-NH2 2.76Å; D537-R546 IonicContact OD2-NH2 3.43Å; L540-R546 VanDerWaalsContact CB-CZ 3.49Å; L540-R546 PolarHBondContact O-NH1 3.06Å; T543-R546 PolarHBondContact O-N 2.89Å; T543-R546 WeakPolarHBondContact OG1-CB 3.38Å; T543-R546 PolarHBondContact OG1-N 3.35Å; S544-R546 PolarHBondContact O-N 2.9Å; R546-T550 WeakPolarHBondContact O-CB 3.39Å; R546-T550 PolarHBondContact O-N 3.39Å; R546-T550 VanDerWaalsContact O-N 3.17Å; R546-T550 PolarHBondContact O-OG1 3.21Å
547	L	93.1	Very high	92.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-69.6	-45.4	174.9	-73.8	169.9	0	0	0	111	Y536 D542 T543 S544 S545 T550 L551 L615 I617 R621 L624 M627	Y536-L547 HydrophobicContact CE1-CD2 4.25Å; Y536-L547 HydrophobicContact CE2-CD2 3.83Å; Y536-L547 WeakPolarHBondContact OH-CD2 3.38Å; D542-L547 HydrophobicContact CB-CD1 4.32Å; T543-L547 WeakPolarHBondContact O-CB 3.48Å; T543-L547 WeakPolarHBondContact O-CG 3.49Å; T543-L547 PolarHBondContact O-N 3.01Å; S544-L547 PolarHBondContact O-N 3.1Å; S545-L547 PolarHBondContact O-N 2.93Å; L547-T550 WeakPolarHBondContact O-CB 3.37Å; L547-T550 PolarHBondContact O-N 3.36Å; L547-T550 VanDerWaalsContact O-N 3.14Å; L547-L551 WeakPolarHBondContact O-CB 3.37Å; L547-L551 VanDerWaalsContact O-CG 3.27Å; L547-L551 WeakPolarHBondContact O-CG 3.48Å; L547-L551 PolarHBondContact O-N 3.33Å; L547-L615 HydrophobicContact CD2-CD1 3.94Å; L547-I617 HydrophobicContact CD1-CD1 4.36Å; L547-I617 HydrophobicContact CD2-CD1 4.05Å; L547-R621 HydrophobicContact CD1-CB 4.42Å; L547-R621 HydrophobicContact CD1-CG 4.27Å; L547-L624 HydrophobicContact CD1-CD1 3.46Å; L547-L624 VanDerWaalsContact CD1-CD1 3.46Å; L547-M627 HydrophobicContact CB-CE 3.38Å; L547-M627 HydrophobicContact CD1-CE 4.19Å; L547-M627 HydrophobicContact CG-CE 4.44Å
548	M	93.1	Very high	92.4	Very high	21 Å²	21	44.2 Å²	44.2	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-45.5	177.1	-68.5	179.1	85.9	0	0	112.2	S544 S545 T550 L551 N552 L626 M627 T727 V735	S544-M548 WeakPolarHBondContact O-CB 3.4Å; S544-M548 VanDerWaalsContact O-CG 3.23Å; S544-M548 WeakPolarHBondContact O-CG 3.5Å; S544-M548 PolarHBondContact O-N 2.64Å; S545-M548 PolarHBondContact O-N 3.23Å; M548-T550 VanDerWaalsContact C-N 3.26Å; M548-T550 PolarHBondContact O-N 2.59Å; M548-L551 PolarHBondContact O-N 3.25Å; M548-L551 VanDerWaalsContact O-N 3.16Å; M548-N552 WeakPolarHBondContact O-CB 3.17Å; M548-N552 VanDerWaalsContact O-CG 3.28Å; M548-N552 PolarHBondContact O-N 2.63Å; M548-L626 HydrophobicContact CE-CD2 4.07Å; M548-L626 HydrophobicContact SD-CD2 4.02Å; M548-L626 HydrophobicContact SD-CG 4.49Å; M548-M627 HydrophobicContact CG-CE 3.59Å; M548-M627 HydrophobicContact CG-SD 4.33Å; M548-T727 HydrophobicContact CE-CG2 3.51Å; M548-T727 HydrophobicContact SD-CG2 4.44Å; M548-V735 HydrophobicContact CB-CG1 3.82Å; M548-V735 HydrophobicContact CB-CG2 4.03Å; M548-V735 HydrophobicContact SD-CG2 4.18Å
549	S	94	Very high	92.9	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-36.3	173.6	-60.3	0	0	0	0	112.6	S545 R553 E736	S545-S549 WeakPolarHBondContact O-CB 3.45Å; S545-S549 PolarHBondContact O-N 3.43Å; S545-S549 PolarHBondContact O-OG 2.99Å; S549-R553 WeakPolarHBondContact O-CB 3.34Å; S549-R553 PolarHBondContact O-N 3.19Å; S549-E736 PolarHBondContact OG-N 2.99Å
550	T	94.5	Very high	93.1	Very high	4 Å²	4	37.1 Å²	37.1	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-70.8	-43.4	174.7	-61.1	0	0	0	0	111.6	Y536 R546 L547 M548 N552 R553 L554 L615	Y536-T550 HydrophobicContact CD2-CG2 3.52Å; Y536-T550 HydrophobicContact CE2-CG2 4.29Å; Y536-T550 HydrophobicContact CG-CG2 4.31Å; R546-T550 WeakPolarHBondContact O-CB 3.39Å; R546-T550 PolarHBondContact O-N 3.39Å; R546-T550 VanDerWaalsContact O-N 3.17Å; R546-T550 PolarHBondContact O-OG1 3.21Å; L547-T550 WeakPolarHBondContact O-CB 3.37Å; L547-T550 PolarHBondContact O-N 3.36Å; L547-T550 VanDerWaalsContact O-N 3.14Å; M548-T550 VanDerWaalsContact C-N 3.26Å; M548-T550 PolarHBondContact O-N 2.59Å; T550-N552 VanDerWaalsContact C-N 3.32Å; T550-N552 PolarHBondContact O-N 2.79Å; T550-R553 PolarHBondContact O-N 2.97Å; T550-R553 PolarHBondContact OG1-NH2 3.2Å; T550-L554 WeakPolarHBondContact O-CB 3.47Å; T550-L554 PolarHBondContact O-N 2.68Å; T550-L615 HydrophobicContact CG2-CD2 3.73Å
551	L	94.7	Very high	93.5	Very high	32 Å²	32	34.5 Å²	34.5	17%	0.168	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-40	176.8	-71.4	170.7	0	0	0	111.4	L547 M548 G555 F611 L615 M627	L547-L551 WeakPolarHBondContact O-CB 3.37Å; L547-L551 VanDerWaalsContact O-CG 3.27Å; L547-L551 WeakPolarHBondContact O-CG 3.48Å; L547-L551 PolarHBondContact O-N 3.33Å; M548-L551 PolarHBondContact O-N 3.25Å; M548-L551 VanDerWaalsContact O-N 3.16Å; L551-G555 PolarHBondContact O-N 3.45Å; L551-F611 HydrophobicContact CD2-CB 3.94Å; L551-F611 HydrophobicContact CD2-CD1 3.3Å; L551-F611 HydrophobicContact CD2-CD2 3.86Å; L551-F611 HydrophobicContact CD2-CE1 3.61Å; L551-F611 HydrophobicContact CD2-CE2 4.14Å; L551-F611 HydrophobicContact CD2-CG 3.42Å; L551-F611 VanDerWaalsContact CD2-CG 3.42Å; L551-F611 HydrophobicContact CD2-CZ 4.01Å; L551-L615 HydrophobicContact CD2-CD2 3.71Å; L551-L615 HydrophobicContact CG-CD2 4.32Å; L551-M627 HydrophobicContact CD1-CE 4.37Å
552	N	94.6	Very high	93.9	Very high	16 Å²	16	30.3 Å²	30.3	9%	0.086	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-43.4	173.1	-70.3	-15.4	0	0	0	111.9	M548 T550 G555 G556 V735 E736 F737 P738 L741	M548-N552 WeakPolarHBondContact O-CB 3.17Å; M548-N552 VanDerWaalsContact O-CG 3.28Å; M548-N552 PolarHBondContact O-N 2.63Å; T550-N552 VanDerWaalsContact C-N 3.32Å; T550-N552 PolarHBondContact O-N 2.79Å; N552-G555 PolarHBondContact O-N 3.19Å; N552-G556 PolarHBondContact O-N 2.64Å; N552-V735 VanDerWaalsContact ND2-CG1 3.32Å; N552-V735 WeakPolarHBondContact ND2-CG1 3.49Å; N552-E736 WeakPolarHBondContact CB-O 3.46Å; N552-E736 PolarHBondContact ND2-O 2.93Å; N552-F737 HydrophobicContact CB-CD1 4.41Å; N552-F737 WeakPolarHBondContact ND2-CD1 3.35Å; N552-F737 VanDerWaalsContact ND2-CE1 3.26Å; N552-F737 WeakPolarHBondContact ND2-CE1 3.42Å; N552-F737 WeakPolarHBondContact ND2-CE2 3.14Å; N552-F737 VanDerWaalsContact ND2-CZ 3.3Å; N552-F737 WeakPolarHBondContact ND2-CZ 3.05Å; N552-P738 WeakPolarHBondContact O-CG 3.45Å; N552-L741 HydrophobicContact CB-CD1 4.26Å; N552-L741 WeakPolarHBondContact O-CD1 3.44Å
553	R	95.2	Very high	94.1	Very high	90 Å²	90	27.6 Å²	27.6	34%	0.34	15%	0.148	S	C	.	.	H	α-helix	trans	-61.5	-44.9	175.7	-175.4	172	60.9	-103.7	-3.8	112.3	S549 T550 G555 G556 Q557	S549-R553 WeakPolarHBondContact O-CB 3.34Å; S549-R553 PolarHBondContact O-N 3.19Å; T550-R553 PolarHBondContact O-N 2.97Å; T550-R553 PolarHBondContact OG1-NH2 3.2Å; R553-G555 VanDerWaalsContact C-N 3.34Å; R553-G556 PolarHBondContact O-N 3.24Å; R553-Q557 WeakPolarHBondContact O-CG 3.45Å; R553-Q557 PolarHBondContact O-N 2.88Å
554	L	95.6	Very high	94.2	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-62.5	-40.9	172.4	176.5	65.3	0	0	0	111.4	I532 T550 Q557 Q558 F611 A612 L615	I532-L554 HydrophobicContact CB-CD1 4.48Å; I532-L554 HydrophobicContact CG2-CD1 3.8Å; T550-L554 WeakPolarHBondContact O-CB 3.47Å; T550-L554 PolarHBondContact O-N 2.68Å; L554-Q557 PolarHBondContact O-N 3.41Å; L554-Q558 HydrophobicContact CD1-CG 4.28Å; L554-Q558 HydrophobicContact CG-CG 4.41Å; L554-Q558 WeakPolarHBondContact O-CB 3.32Å; L554-Q558 VanDerWaalsContact O-CG 3.31Å; L554-Q558 WeakPolarHBondContact O-CG 3.31Å; L554-Q558 PolarHBondContact O-N 3.23Å; L554-F611 HydrophobicContact CD2-CB 3.91Å; L554-A612 HydrophobicContact CD1-CB 4.2Å; L554-A612 HydrophobicContact CD2-CB 3.94Å; L554-L615 HydrophobicContact CD2-CD2 4.35Å
555	G	94.8	Very high	94.5	Very high	8 Å²	8	28.3 Å²	28.3	8%	0.082	14%	0.142	C	C	.	.	H	α-helix	trans	-57.9	-48.1	176.1	0	0	0	0	0	112.2	L551 N552 R553 Q557 Q558 V559	L551-G555 PolarHBondContact O-N 3.45Å; N552-G555 PolarHBondContact O-N 3.19Å; R553-G555 VanDerWaalsContact C-N 3.34Å; G555-Q557 PolarHBondContact O-N 3.03Å; G555-Q558 CarbonylContact O-C 3.34Å; G555-Q558 PolarHBondContact O-N 3.42Å; G555-Q558 VanDerWaalsContact O-N 3.13Å; G555-V559 WeakPolarHBondContact O-CG2 3.47Å; G555-V559 PolarHBondContact O-N 3.06Å
556	G	94.4	Very high	94.8	Very high	5 Å²	5	26.7 Å²	26.7	5%	0.052	13%	0.131	C	C	.	.	H	α-helix	trans	-58.7	-44.7	175.2	0	0	0	0	0	113.1	N552 R553 Q558 V559 I560	N552-G556 PolarHBondContact O-N 2.64Å; R553-G556 PolarHBondContact O-N 3.24Å; G556-Q558 VanDerWaalsContact C-N 3.33Å; G556-Q558 PolarHBondContact O-N 2.82Å; G556-V559 PolarHBondContact O-N 3.38Å; G556-I560 PolarHBondContact O-N 3.45Å
557	Q	94.1	Very high	95	Very high	74 Å²	74	26.7 Å²	26.7	35%	0.346	13%	0.132	S	C	.	.	H	α-helix	trans	-61.8	-40	173.9	-67.4	170.9	-16	0	0	112.3	I532 Y533 R553 L554 G555 I560 S561	I532-Q557 HydrophobicContact CG2-CB 4.09Å; Y533-Q557 PolarHBondContact O-OE1 3.33Å; R553-Q557 WeakPolarHBondContact O-CG 3.45Å; R553-Q557 PolarHBondContact O-N 2.88Å; L554-Q557 PolarHBondContact O-N 3.41Å; G555-Q557 PolarHBondContact O-N 3.03Å; Q557-I560 PolarHBondContact O-N 3.48Å; Q557-S561 PolarHBondContact O-N 3.43Å; Q557-S561 PolarHBondContact O-OG 3.5Å
558	Q	94.7	Very high	95.1	Very high	22 Å²	22	29.3 Å²	29.3	10%	0.103	15%	0.151	C	C	.	.	H	α-helix	trans	-67.7	-32.6	175.9	-72	176.5	6.5	0	0	112.1	I532 L554 G555 G556 S561 A562 M592	I532-Q558 HydrophobicContact CD1-CG 3.94Å; L554-Q558 HydrophobicContact CD1-CG 4.28Å; L554-Q558 HydrophobicContact CG-CG 4.41Å; L554-Q558 WeakPolarHBondContact O-CB 3.32Å; L554-Q558 VanDerWaalsContact O-CG 3.31Å; L554-Q558 WeakPolarHBondContact O-CG 3.31Å; L554-Q558 PolarHBondContact O-N 3.23Å; G555-Q558 CarbonylContact O-C 3.34Å; G555-Q558 PolarHBondContact O-N 3.42Å; G555-Q558 VanDerWaalsContact O-N 3.13Å; G556-Q558 VanDerWaalsContact C-N 3.33Å; G556-Q558 PolarHBondContact O-N 2.82Å; Q558-S561 PolarHBondContact O-N 3.39Å; Q558-A562 VanDerWaalsContact O-CB 3.28Å; Q558-A562 WeakPolarHBondContact O-CB 3.19Å; Q558-A562 PolarHBondContact O-N 3.3Å; Q558-M592 VanDerWaalsContact C-CE 3.43Å; Q558-M592 HydrophobicContact CB-CE 3.81Å; Q558-M592 HydrophobicContact CB-CG 4.39Å; Q558-M592 HydrophobicContact CB-SD 3.54Å; Q558-M592 VanDerWaalsContact CB-SD 3.54Å
559	V	95.2	Very high	95.3	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.03	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-47.9	174	174.2	0	0	0	0	111.1	W176 G555 G556 S561 A562 V563 W588 M592 M740 L741 I744	W176-V559 HydrophobicContact CH2-CG1 4.1Å; G555-V559 WeakPolarHBondContact O-CG2 3.47Å; G555-V559 PolarHBondContact O-N 3.06Å; G556-V559 PolarHBondContact O-N 3.38Å; V559-S561 PolarHBondContact O-N 2.93Å; V559-A562 PolarHBondContact O-N 2.99Å; V559-V563 HydrophobicContact CG1-CG2 4.2Å; V559-V563 VanDerWaalsContact O-CG2 3.26Å; V559-V563 WeakPolarHBondContact O-CG2 3.48Å; V559-V563 PolarHBondContact O-N 3.36Å; V559-W588 HydrophobicContact CG2-CB 4.08Å; V559-W588 HydrophobicContact CG2-CE3 4.15Å; V559-M592 HydrophobicContact CB-CE 4.2Å; V559-M592 HydrophobicContact CG2-CE 3.53Å; V559-M740 HydrophobicContact CB-SD 3.87Å; V559-M740 HydrophobicContact CG1-CG 4.18Å; V559-M740 HydrophobicContact CG1-SD 3.53Å; V559-M740 VanDerWaalsContact CG1-SD 3.53Å; V559-L741 HydrophobicContact CG2-CD2 3.87Å; V559-I744 HydrophobicContact CG1-CD1 3.77Å; V559-I744 HydrophobicContact CG2-CD1 4.5Å
560	I	93.7	Very high	95.4	Very high	58 Å²	58	30.4 Å²	30.4	30%	0.297	16%	0.159	S	C	.	.	H	α-helix	trans	-52.6	-45.4	176.7	-62.4	167.2	0	0	0	110.6	L179 G556 Q557 V563 K564 M740	L179-I560 HydrophobicContact CD1-CG2 4.42Å; L179-I560 HydrophobicContact CD2-CG2 4.33Å; G556-I560 PolarHBondContact O-N 3.45Å; Q557-I560 PolarHBondContact O-N 3.48Å; I560-V563 PolarHBondContact O-N 3.09Å; I560-K564 WeakPolarHBondContact O-CG 3.26Å; I560-K564 PolarHBondContact O-N 3.2Å; I560-M740 HydrophobicContact CG1-CE 3.77Å; I560-M740 HydrophobicContact CG1-SD 3.63Å
561	S	94.8	Very high	95.3	Very high	34 Å²	34	31.4 Å²	31.4	24%	0.238	17%	0.17	C	C	.	.	H	α-helix	trans	-72.8	-34.4	179	-64.7	0	0	0	0	113.3	I532 Q557 Q558 V559 V563 K564 W565	I532-S561 WeakPolarHBondContact CD1-OG 3.43Å; Q557-S561 PolarHBondContact O-N 3.43Å; Q557-S561 PolarHBondContact O-OG 3.5Å; Q558-S561 PolarHBondContact O-N 3.39Å; V559-S561 PolarHBondContact O-N 2.93Å; S561-V563 VanDerWaalsContact C-N 3.34Å; S561-K564 PolarHBondContact O-N 3.13Å; S561-W565 WeakPolarHBondContact O-CB 3.47Å; S561-W565 PolarHBondContact O-N 3.03Å
562	A	95.9	Very high	95.4	Very high	11 Å²	11	30 Å²	30	9%	0.091	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-35.1	173.4	0	0	0	0	0	112.1	Q558 V559 W565 A566 L591 M592	Q558-A562 VanDerWaalsContact O-CB 3.28Å; Q558-A562 WeakPolarHBondContact O-CB 3.19Å; Q558-A562 PolarHBondContact O-N 3.3Å; V559-A562 PolarHBondContact O-N 2.99Å; A562-W565 PolarHBondContact O-N 3.07Å; A562-A566 VanDerWaalsContact O-CB 3.29Å; A562-A566 WeakPolarHBondContact O-CB 3.34Å; A562-A566 PolarHBondContact O-N 3.43Å; A562-L591 HydrophobicContact CB-CD1 4.26Å; A562-M592 HydrophobicContact CB-CE 4.07Å
563	V	95.8	Very high	95.5	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-68.8	-42.2	174.4	177.1	0	0	0	0	111	W176 V559 I560 S561 A566 K567 L584	W176-V563 HydrophobicContact CE3-CG1 4.12Å; W176-V563 HydrophobicContact CE3-CG2 4.24Å; W176-V563 HydrophobicContact CH2-CG2 3.97Å; W176-V563 HydrophobicContact CZ3-CB 4.13Å; W176-V563 HydrophobicContact CZ3-CG1 4.03Å; W176-V563 HydrophobicContact CZ3-CG2 3.38Å; V559-V563 HydrophobicContact CG1-CG2 4.2Å; V559-V563 VanDerWaalsContact O-CG2 3.26Å; V559-V563 WeakPolarHBondContact O-CG2 3.48Å; V559-V563 PolarHBondContact O-N 3.36Å; I560-V563 PolarHBondContact O-N 3.09Å; S561-V563 VanDerWaalsContact C-N 3.34Å; V563-A566 PolarHBondContact O-N 3.05Å; V563-K567 HydrophobicContact CG1-CD 4.33Å; V563-K567 HydrophobicContact CG1-CG 4.45Å; V563-K567 WeakPolarHBondContact O-CB 3.29Å; V563-K567 WeakPolarHBondContact O-CG 3.4Å; V563-K567 PolarHBondContact O-N 3.48Å; V563-L584 HydrophobicContact CB-CD1 4.27Å; V563-L584 HydrophobicContact CG1-CD1 4.1Å; V563-L584 HydrophobicContact CG2-CD1 3.84Å; V563-L584 HydrophobicContact CG2-CD2 4.2Å
564	K	94.9	Very high	95.5	Very high	97 Å²	97	39 Å²	39	42%	0.422	20%	0.204	S	C	.	.	H	α-helix	trans	-63.1	-40.1	174.1	-70.3	177.2	179.7	-176.5	0	112.2	I560 S561 S568	I560-K564 WeakPolarHBondContact O-CG 3.26Å; I560-K564 PolarHBondContact O-N 3.2Å; S561-K564 PolarHBondContact O-N 3.13Å; K564-S568 WeakPolarHBondContact O-CB 3.48Å; K564-S568 PolarHBondContact O-N 2.88Å; K564-S568 PolarHBondContact O-OG 3.45Å
565	W	97.8	Very high	95.5	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.027	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-48.1	171.9	170	81.5	0	0	0	112.4	E528 P529 S561 A562 S568 L569 L591 K655 V656 L659	E528-W565 PolarHBondContact OE2-NE1 3.29Å; P529-W565 HydrophobicContact CG-CB 3.99Å; P529-W565 HydrophobicContact CG-CG 4.3Å; S561-W565 WeakPolarHBondContact O-CB 3.47Å; S561-W565 PolarHBondContact O-N 3.03Å; A562-W565 PolarHBondContact O-N 3.07Å; W565-S568 CarbonylContact O-C 3.57Å; W565-S568 WeakPolarHBondContact O-CA 3.47Å; W565-S568 WeakPolarHBondContact O-CB 3.37Å; W565-S568 PolarHBondContact O-N 3.1Å; W565-L569 HydrophobicContact CE3-CD1 4.38Å; W565-L569 HydrophobicContact CH2-CD1 4.08Å; W565-L569 HydrophobicContact CZ2-CD1 4.25Å; W565-L569 HydrophobicContact CZ2-CD2 4.36Å; W565-L569 HydrophobicContact CZ3-CD1 4.15Å; W565-L569 PolarHBondContact O-N 3.16Å; W565-L569 VanDerWaalsContact O-N 3.16Å; W565-L591 HydrophobicContact CH2-CD2 3.92Å; W565-L591 HydrophobicContact CZ3-CD1 3.91Å; W565-L591 HydrophobicContact CZ3-CD2 3.82Å; W565-K655 HydrophobicContact CH2-CD 4.15Å; W565-K655 HydrophobicContact CH2-CG 3.82Å; W565-K655 HydrophobicContact CZ2-CB 4.41Å; W565-K655 HydrophobicContact CZ2-CD 3.71Å; W565-K655 HydrophobicContact CZ2-CG 3.82Å; W565-V656 HydrophobicContact CH2-CG2 4.01Å; W565-V656 HydrophobicContact CZ2-CG2 3.68Å; W565-L659 HydrophobicContact CH2-CB 4.44Å; W565-L659 HydrophobicContact CH2-CD2 4.45Å; W565-L659 HydrophobicContact CZ3-CB 4.25Å; W565-L659 HydrophobicContact CZ3-CD2 3.92Å
566	A	97.8	Very high	95.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-44.2	179.6	0	0	0	0	0	112.1	A562 V563 S568 L569 F572 L584 L659	A562-A566 VanDerWaalsContact O-CB 3.29Å; A562-A566 WeakPolarHBondContact O-CB 3.34Å; A562-A566 PolarHBondContact O-N 3.43Å; V563-A566 PolarHBondContact O-N 3.05Å; A566-S568 PolarHBondContact O-N 3.34Å; A566-L569 WeakPolarHBondContact O-CB 3.29Å; A566-L569 PolarHBondContact O-N 3.36Å; A566-F572 HydrophobicContact CB-CD1 4.11Å; A566-F572 HydrophobicContact CB-CE1 3.79Å; A566-F572 HydrophobicContact CB-CZ 4.04Å; A566-F572 WeakPolarHBondContact O-CB 3.25Å; A566-F572 WeakPolarHBondContact O-CD1 3.26Å; A566-F572 WeakPolarHBondContact O-CG 3.41Å; A566-L584 HydrophobicContact CB-CD1 4.35Å; A566-L584 HydrophobicContact CB-CD2 3.82Å; A566-L584 HydrophobicContact CB-CG 4.42Å; A566-L659 HydrophobicContact CB-CD2 3.9Å
567	K	95.6	Very high	95.6	Very high	61 Å²	61	48.6 Å²	48.6	27%	0.265	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-8.5	168.4	-72.6	-175.1	179.6	-176.5	0	112.8	W176 V563 R573	W176-K567 PolarHBondContact O-NZ 2.98Å; V563-K567 HydrophobicContact CG1-CD 4.33Å; V563-K567 HydrophobicContact CG1-CG 4.45Å; V563-K567 WeakPolarHBondContact O-CB 3.29Å; V563-K567 WeakPolarHBondContact O-CG 3.4Å; V563-K567 PolarHBondContact O-N 3.48Å; K567-R573 VanDerWaalsContact O-CZ 3.29Å; K567-R573 PolarHBondContact O-NE 3.37Å; K567-R573 PolarHBondContact O-NH2 2.84Å
568	S	96.2	Very high	95.6	Very high	56 Å²	56	48.5 Å²	48.5	39%	0.392	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-3.7	176.1	-54.2	0	0	0	0	114	K564 W565 A566	K564-S568 WeakPolarHBondContact O-CB 3.48Å; K564-S568 PolarHBondContact O-N 2.88Å; K564-S568 PolarHBondContact O-OG 3.45Å; W565-S568 CarbonylContact O-C 3.57Å; W565-S568 WeakPolarHBondContact O-CA 3.47Å; W565-S568 WeakPolarHBondContact O-CB 3.37Å; W565-S568 PolarHBondContact O-N 3.1Å; A566-S568 PolarHBondContact O-N 3.34Å
569	L	97.3	Very high	95.6	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	25%	0.247	C	C	.	.	S	Bend	trans	-74.1	128.6	175.8	-75.6	171.8	0	0	0	111.3	L524 I527 W565 A566 G571 F572 V656 L659	L524-L569 HydrophobicContact CD2-CD2 3.39Å; I527-L569 HydrophobicContact CD1-CD2 3.71Å; I527-L569 HydrophobicContact CD1-CG 4.2Å; W565-L569 HydrophobicContact CE3-CD1 4.38Å; W565-L569 HydrophobicContact CH2-CD1 4.08Å; W565-L569 HydrophobicContact CZ2-CD1 4.25Å; W565-L569 HydrophobicContact CZ2-CD2 4.36Å; W565-L569 HydrophobicContact CZ3-CD1 4.15Å; W565-L569 PolarHBondContact O-N 3.16Å; W565-L569 VanDerWaalsContact O-N 3.16Å; A566-L569 WeakPolarHBondContact O-CB 3.29Å; A566-L569 PolarHBondContact O-N 3.36Å; L569-G571 PolarHBondContact O-N 2.85Å; L569-F572 HydrophobicContact CB-CB 3.89Å; L569-F572 WeakPolarHBondContact O-CB 3.35Å; L569-F572 PolarHBondContact O-N 2.88Å; L569-F572 VanDerWaalsContact O-N 3.08Å; L569-V656 HydrophobicContact CD1-CG1 4Å; L569-V656 HydrophobicContact CD1-CG2 4.1Å; L569-V656 HydrophobicContact CD2-CG1 4.33Å; L569-V656 HydrophobicContact CD2-CG2 3.52Å; L569-L659 HydrophobicContact CD1-CD2 3.41Å; L569-L659 VanDerWaalsContact CD1-CD2 3.41Å
570	P	95.3	Very high	95.6	Very high	47 Å²	47	48.4 Å²	48.4	31%	0.305	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	130.2	171	-31	39.2	0	0	0	112.3	M520 V523 F572 Y681	M520-P570 HydrophobicContact CE-CB 3.89Å; M520-P570 HydrophobicContact CE-CG 4.45Å; M520-P570 HydrophobicContact SD-CB 3.67Å; M520-P570 HydrophobicContact SD-CG 3.58Å; M520-P570 VanDerWaalsContact SD-CG 3.58Å; V523-P570 HydrophobicContact CG1-CG 3.93Å; P570-F572 VanDerWaalsContact C-N 3.34Å; P570-F572 PolarHBondContact O-N 3.07Å; P570-Y681 WeakPolarHBondContact CD-OH 3.39Å; P570-Y681 PolarHBondContact O-OH 2.89Å
571	G	94.1	Very high	95.6	Very high	25 Å²	25	48 Å²	48	26%	0.258	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-30.5	-175.6	0	0	0	0	0	115.1	L569 R573 N574 I677	L569-G571 PolarHBondContact O-N 2.85Å; G571-R573 VanDerWaalsContact C-N 3.34Å; G571-R573 PolarHBondContact O-N 2.9Å; G571-N574 VanDerWaalsContact O-CB 3.23Å; G571-N574 WeakPolarHBondContact O-CB 3.37Å; G571-N574 PolarHBondContact O-N 2.86Å; G571-I677 WeakPolarHBondContact O-CD1 3.03Å
572	F	96.9	Very high	95.6	Very high	3 Å²	3	47.7 Å²	47.7	1%	0.013	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-62.5	-36.7	-169.2	-172.2	-97.3	0	0	0	113.8	A566 L569 P570 N574 L575 Q580 L583 L584 L659	A566-F572 HydrophobicContact CB-CD1 4.11Å; A566-F572 HydrophobicContact CB-CE1 3.79Å; A566-F572 HydrophobicContact CB-CZ 4.04Å; A566-F572 WeakPolarHBondContact O-CB 3.25Å; A566-F572 WeakPolarHBondContact O-CD1 3.26Å; A566-F572 WeakPolarHBondContact O-CG 3.41Å; L569-F572 HydrophobicContact CB-CB 3.89Å; L569-F572 WeakPolarHBondContact O-CB 3.35Å; L569-F572 PolarHBondContact O-N 2.88Å; L569-F572 VanDerWaalsContact O-N 3.08Å; P570-F572 VanDerWaalsContact C-N 3.34Å; P570-F572 PolarHBondContact O-N 3.07Å; F572-N574 PolarHBondContact O-N 2.71Å; F572-L575 HydrophobicContact CD2-CD1 3.98Å; F572-L575 HydrophobicContact CE2-CD1 4.18Å; F572-L575 WeakPolarHBondContact O-CB 3.32Å; F572-L575 PolarHBondContact O-N 2.89Å; F572-Q580 HydrophobicContact CD1-CG 4.05Å; F572-Q580 HydrophobicContact CE1-CB 3.62Å; F572-Q580 HydrophobicContact CE1-CG 3.63Å; F572-Q580 HydrophobicContact CZ-CB 3.72Å; F572-Q580 HydrophobicContact CZ-CG 3.94Å; F572-L583 HydrophobicContact CE2-CB 4.49Å; F572-L583 HydrophobicContact CE2-CD1 4.19Å; F572-L584 HydrophobicContact CE1-CD1 4.39Å; F572-L584 HydrophobicContact CZ-CD1 4.26Å; F572-L584 HydrophobicContact CZ-CG 4.26Å; F572-L659 HydrophobicContact CD2-CD2 3.93Å; F572-L659 HydrophobicContact CE2-CD1 4.17Å; F572-L659 HydrophobicContact CE2-CD2 3.74Å; F572-L659 HydrophobicContact CE2-CG 4.1Å; F572-L659 HydrophobicContact CZ-CD1 4.46Å; F572-L659 HydrophobicContact CZ-CD2 4.41Å
573	R	95.2	Very high	95.5	Very high	174 Å²	174	47.2 Å²	47.2	66%	0.657	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-65.2	-13.1	174.7	-65.5	-167.7	-170.9	-159.4	-0.9	114.5	K567 G571 L575	K567-R573 VanDerWaalsContact O-CZ 3.29Å; K567-R573 PolarHBondContact O-NE 3.37Å; K567-R573 PolarHBondContact O-NH2 2.84Å; G571-R573 VanDerWaalsContact C-N 3.34Å; G571-R573 PolarHBondContact O-N 2.9Å; R573-L575 VanDerWaalsContact C-N 3.29Å
574	N	95.1	Very high	95.5	Very high	119 Å²	119	48.1 Å²	48.1	64%	0.636	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-84	-7.1	-179.7	-55.4	12.3	0	0	0	112.2	G571 F572 V673	G571-N574 VanDerWaalsContact O-CB 3.23Å; G571-N574 WeakPolarHBondContact O-CB 3.37Å; G571-N574 PolarHBondContact O-N 2.86Å; F572-N574 PolarHBondContact O-N 2.71Å; N574-V673 HydrophobicContact CB-CG1 3.95Å
575	L	96.3	Very high	95.4	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.037	23%	0.226	C	C	.	.	S	Bend	trans	-80.7	151.3	172.1	-61	171.4	0	0	0	110.4	F572 R573 D579 Q580 L583 V673 F674 I677	F572-L575 HydrophobicContact CD2-CD1 3.98Å; F572-L575 HydrophobicContact CE2-CD1 4.18Å; F572-L575 WeakPolarHBondContact O-CB 3.32Å; F572-L575 PolarHBondContact O-N 2.89Å; R573-L575 VanDerWaalsContact C-N 3.29Å; L575-D579 HydrophobicContact CB-CB 4.26Å; L575-Q580 HydrophobicContact CB-CG 3.83Å; L575-Q580 PolarHBondContact O-NE2 3.27Å; L575-L583 HydrophobicContact CD1-CD1 3.71Å; L575-V673 HydrophobicContact CD2-CB 4.06Å; L575-V673 HydrophobicContact CD2-CG1 3.89Å; L575-F674 HydrophobicContact CD2-CB 3.89Å; L575-I677 HydrophobicContact CD1-CD1 4.2Å; L575-I677 HydrophobicContact CD2-CD1 4.02Å; L575-I677 HydrophobicContact CG-CD1 3.92Å
576	H	96	Very high	95.2	Very high	80 Å²	80	43.9 Å²	43.9	37%	0.37	23%	0.228	S	C	.	.			trans	-52.5	145	168.7	-163.3	-71.3	0	0	0	110.6	D578 D579 Q580 K669 S670	H576-D578 VanDerWaalsContact C-N 3.32Å; H576-D578 IonicContact CE1-OD1 2.71Å; H576-D578 PolarHBondContact CE1-OD1 2.96Å; H576-D578 IonicContact CE1-OD2 3.92Å; H576-D578 PolarHBondContact CE1-OD2 2.78Å; H576-D578 VanDerWaalsContact ND1-CG 3.28Å; H576-D578 PolarHBondContact ND1-N 3.19Å; H576-D578 IonicContact ND1-OD1 3.46Å; H576-D578 PolarHBondContact ND1-OD1 2.93Å; H576-D578 IonicContact ND1-OD2 3.66Å; H576-D578 PolarHBondContact O-N 2.9Å; H576-D579 HydrophobicContact CB-CB 4.31Å; H576-D579 WeakPolarHBondContact CB-OD2 3.21Å; H576-D579 WeakPolarHBondContact O-CA 3.43Å; H576-D579 WeakPolarHBondContact O-CB 3.43Å; H576-D579 PolarHBondContact O-N 2.84Å; H576-Q580 PolarHBondContact O-N 3.46Å; H576-K669 HydrophobicContact CB-CB 4.14Å; H576-K669 HydrophobicContact CB-CD 4.43Å; H576-S670 WeakPolarHBondContact CB-OG 3.12Å; H576-S670 PolarHBondContact N-OG 3.3Å
577	L	94.9	Very high	95	Very high	131 Å²	131	44 Å²	44	69%	0.686	23%	0.228	S	C	*	.	H	α-helix	trans	-56.9	-45.6	-176.7	-66.2	174.4	0	0	0	111.9	D579 Q580 M581	L577-D579 VanDerWaalsContact C-N 3.28Å; L577-D579 PolarHBondContact O-N 2.84Å; L577-Q580 WeakPolarHBondContact O-CB 3.33Å; L577-Q580 PolarHBondContact O-N 3.17Å; L577-Q580 VanDerWaalsContact O-N 3.09Å; L577-M581 WeakPolarHBondContact O-CB 3.49Å; L577-M581 PolarHBondContact O-N 2.8Å
578	D	94	Very high	95	Very high	71 Å²	71	41.6 Å²	41.6	38%	0.38	22%	0.218	S	C	.	.	H	α-helix	trans	-57.4	-36.2	173.8	-44.2	20.1	0	0	0	113	H576 T582 K669	H576-D578 VanDerWaalsContact C-N 3.32Å; H576-D578 IonicContact CE1-OD1 2.71Å; H576-D578 PolarHBondContact CE1-OD1 2.96Å; H576-D578 IonicContact CE1-OD2 3.92Å; H576-D578 PolarHBondContact CE1-OD2 2.78Å; H576-D578 VanDerWaalsContact ND1-CG 3.28Å; H576-D578 PolarHBondContact ND1-N 3.19Å; H576-D578 IonicContact ND1-OD1 3.46Å; H576-D578 PolarHBondContact ND1-OD1 2.93Å; H576-D578 IonicContact ND1-OD2 3.66Å; H576-D578 PolarHBondContact O-N 2.9Å; D578-T582 WeakPolarHBondContact O-CB 3.37Å; D578-T582 PolarHBondContact O-N 3.39Å; D578-T582 PolarHBondContact O-OG1 2.66Å; D578-K669 IonicContact OD2-NZ 3.36Å; D578-K669 PolarHBondContact OD2-NZ 2.86Å
579	D	95.3	Very high	94.9	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-70.1	-43.1	175.1	-64.6	-29.7	0	0	0	110	L575 H576 L577 T582 L583 L668 K669 S670	L575-D579 HydrophobicContact CB-CB 4.26Å; H576-D579 HydrophobicContact CB-CB 4.31Å; H576-D579 WeakPolarHBondContact CB-OD2 3.21Å; H576-D579 WeakPolarHBondContact O-CA 3.43Å; H576-D579 WeakPolarHBondContact O-CB 3.43Å; H576-D579 PolarHBondContact O-N 2.84Å; L577-D579 VanDerWaalsContact C-N 3.28Å; L577-D579 PolarHBondContact O-N 2.84Å; D579-T582 PolarHBondContact O-N 2.98Å; D579-L583 WeakPolarHBondContact O-CB 3.43Å; D579-L583 WeakPolarHBondContact O-CG 3.31Å; D579-L583 PolarHBondContact O-N 2.86Å; D579-L668 HydrophobicContact CB-CD2 4.18Å; D579-K669 PolarHBondContact OD1-N 2.98Å; D579-K669 PolarHBondContact OD2-N 3.08Å; D579-S670 WeakPolarHBondContact OD2-CB 3.3Å; D579-S670 PolarHBondContact OD2-N 3.17Å; D579-S670 PolarHBondContact OD2-OG 2.8Å
580	Q	95.9	Very high	94.9	Very high	18 Å²	18	40 Å²	40	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-46.7	175.8	-65.2	-179.3	49.6	0	0	111.2	F572 L575 H576 L577 L584	F572-Q580 HydrophobicContact CD1-CG 4.05Å; F572-Q580 HydrophobicContact CE1-CB 3.62Å; F572-Q580 HydrophobicContact CE1-CG 3.63Å; F572-Q580 HydrophobicContact CZ-CB 3.72Å; F572-Q580 HydrophobicContact CZ-CG 3.94Å; L575-Q580 HydrophobicContact CB-CG 3.83Å; L575-Q580 PolarHBondContact O-NE2 3.27Å; H576-Q580 PolarHBondContact O-N 3.46Å; L577-Q580 WeakPolarHBondContact O-CB 3.33Å; L577-Q580 PolarHBondContact O-N 3.17Å; L577-Q580 VanDerWaalsContact O-N 3.09Å; Q580-L584 WeakPolarHBondContact O-CB 3.23Å; Q580-L584 WeakPolarHBondContact O-CG 3.36Å; Q580-L584 PolarHBondContact O-N 3.39Å; Q580-L584 VanDerWaalsContact O-N 3.07Å
581	M	93.3	Very high	95	Very high	50 Å²	50	38 Å²	38	25%	0.246	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-44.6	177.1	-175.6	173.4	178.7	0	0	111.3	L577 L584 Q585	L577-M581 WeakPolarHBondContact O-CB 3.49Å; L577-M581 PolarHBondContact O-N 2.8Å; M581-L584 PolarHBondContact O-N 3.35Å; M581-Q585 WeakPolarHBondContact O-CB 3.3Å; M581-Q585 WeakPolarHBondContact O-CG 3.18Å; M581-Q585 PolarHBondContact O-N 2.82Å
582	T	93.4	Very high	95	Very high	28 Å²	28	37.6 Å²	37.6	17%	0.172	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-40	178.7	-64	0	0	0	0	112.2	D578 D579 Q585 C586 P664	D578-T582 WeakPolarHBondContact O-CB 3.37Å; D578-T582 PolarHBondContact O-N 3.39Å; D578-T582 PolarHBondContact O-OG1 2.66Å; D579-T582 PolarHBondContact O-N 2.98Å; T582-Q585 PolarHBondContact O-N 3.25Å; T582-C586 WeakPolarHBondContact O-CB 3.36Å; T582-C586 PolarHBondContact O-N 3.2Å; T582-C586 PolarHBondContact O-SG 3.44Å; T582-P664 HydrophobicContact CG2-CG 3.68Å
583	L	95.4	Very high	95	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-45.4	175.2	-73.3	167.1	0	0	0	111.2	F572 L575 D579 C586 S587 L659 L660 V663 L668 F674	F572-L583 HydrophobicContact CE2-CB 4.49Å; F572-L583 HydrophobicContact CE2-CD1 4.19Å; L575-L583 HydrophobicContact CD1-CD1 3.71Å; D579-L583 WeakPolarHBondContact O-CB 3.43Å; D579-L583 WeakPolarHBondContact O-CG 3.31Å; D579-L583 PolarHBondContact O-N 2.86Å; L583-C586 PolarHBondContact O-N 2.7Å; L583-S587 WeakPolarHBondContact O-CB 3.48Å; L583-S587 PolarHBondContact O-N 3.01Å; L583-S587 PolarHBondContact O-OG 2.71Å; L583-S587 VanDerWaalsContact O-OG 3.05Å; L583-L659 HydrophobicContact CB-CD1 4.39Å; L583-L660 HydrophobicContact CD1-CD2 4.24Å; L583-V663 HydrophobicContact CD2-CG1 4.16Å; L583-L668 HydrophobicContact CD1-CD1 4.33Å; L583-L668 HydrophobicContact CD2-CD1 4.27Å; L583-L668 HydrophobicContact CG-CD1 4.48Å; L583-F674 HydrophobicContact CD1-CD2 3.92Å; L583-F674 HydrophobicContact CD1-CE2 4.15Å; L583-F674 HydrophobicContact CD2-CD2 4.22Å; L583-F674 HydrophobicContact CD2-CE2 3.67Å
584	L	95.4	Very high	95.1	Very high	22 Å²	22	29.6 Å²	29.6	12%	0.115	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-44	175.6	-76.8	164.9	0	0	0	112.4	V563 A566 F572 Q580 M581 S587 W588 L659	V563-L584 HydrophobicContact CB-CD1 4.27Å; V563-L584 HydrophobicContact CG1-CD1 4.1Å; V563-L584 HydrophobicContact CG2-CD1 3.84Å; V563-L584 HydrophobicContact CG2-CD2 4.2Å; A566-L584 HydrophobicContact CB-CD1 4.35Å; A566-L584 HydrophobicContact CB-CD2 3.82Å; A566-L584 HydrophobicContact CB-CG 4.42Å; F572-L584 HydrophobicContact CE1-CD1 4.39Å; F572-L584 HydrophobicContact CZ-CD1 4.26Å; F572-L584 HydrophobicContact CZ-CG 4.26Å; Q580-L584 WeakPolarHBondContact O-CB 3.23Å; Q580-L584 WeakPolarHBondContact O-CG 3.36Å; Q580-L584 PolarHBondContact O-N 3.39Å; Q580-L584 VanDerWaalsContact O-N 3.07Å; M581-L584 PolarHBondContact O-N 3.35Å; L584-S587 PolarHBondContact O-N 3.12Å; L584-W588 PolarHBondContact O-N 3.23Å; L584-L659 HydrophobicContact CD2-CD1 3.87Å; L584-L659 HydrophobicContact CG-CD1 4.19Å
585	Q	93.1	Very high	95.2	Very high	7 Å²	7	24.3 Å²	24.3	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-45.9	172.7	-77.4	-178.3	0.3	0	0	111.2	M581 T582 S587 W588 I744 Q748	M581-Q585 WeakPolarHBondContact O-CB 3.3Å; M581-Q585 WeakPolarHBondContact O-CG 3.18Å; M581-Q585 PolarHBondContact O-N 2.82Å; T582-Q585 PolarHBondContact O-N 3.25Å; Q585-S587 VanDerWaalsContact C-N 3.33Å; Q585-S587 PolarHBondContact O-N 3.37Å; Q585-W588 VanDerWaalsContact O-CD1 3.23Å; Q585-I744 HydrophobicContact CG-CG1 4.47Å; Q585-Q748 PolarHBondContact O-NE2 3.45Å; Q585-Q748 PolarHBondContact O-OE1 2.87Å; Q585-Q748 VanDerWaalsContact O-OE1 3.1Å
586	C	92.4	Very high	95.2	Very high	8 Å²	8	24.1 Å²	24.1	5%	0.054	13%	0.125	C	C	.	.	H	α-helix	trans	-74.6	-17.8	-179.1	-64.4	0	0	0	0	114.2	T582 L583 T662	T582-C586 WeakPolarHBondContact O-CB 3.36Å; T582-C586 PolarHBondContact O-N 3.2Å; T582-C586 PolarHBondContact O-SG 3.44Å; L583-C586 PolarHBondContact O-N 2.7Å; C586-T662 HydrophobicContact CB-CG2 3.92Å
587	S	94.6	Very high	95.2	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.007	11%	0.108	C	C	.	.	H	α-helix	trans	-114.8	-8.8	-171.1	82.6	0	0	0	0	116	L583 L584 Q585 L589 F590 L591 L658 L659	L583-S587 WeakPolarHBondContact O-CB 3.48Å; L583-S587 PolarHBondContact O-N 3.01Å; L583-S587 PolarHBondContact O-OG 2.71Å; L583-S587 VanDerWaalsContact O-OG 3.05Å; L584-S587 PolarHBondContact O-N 3.12Å; Q585-S587 VanDerWaalsContact C-N 3.33Å; Q585-S587 PolarHBondContact O-N 3.37Å; S587-L589 VanDerWaalsContact C-N 3.34Å; S587-L589 PolarHBondContact O-N 2.86Å; S587-F590 WeakPolarHBondContact O-CB 3.29Å; S587-F590 PolarHBondContact O-N 3.44Å; S587-L591 PolarHBondContact O-N 3.13Å; S587-L658 WeakPolarHBondContact CB-O 3.3Å; S587-L659 WeakPolarHBondContact OG-CD1 3.42Å
588	W	94.8	Very high	95.2	Very high	12 Å²	12	15.2 Å²	15.2	5%	0.045	8%	0.079	C	C	.	.	H	α-helix	trans	-50.5	-49.4	-171.4	73.5	-74.7	0	0	0	113.4	V559 L584 Q585 F590 L591 M592 L721 L741 I744	V559-W588 HydrophobicContact CG2-CB 4.08Å; V559-W588 HydrophobicContact CG2-CE3 4.15Å; L584-W588 PolarHBondContact O-N 3.23Å; Q585-W588 VanDerWaalsContact O-CD1 3.23Å; W588-F590 PolarHBondContact O-N 3.3Å; W588-L591 WeakPolarHBondContact O-CB 3.46Å; W588-L591 PolarHBondContact O-N 3.45Å; W588-L591 VanDerWaalsContact O-N 3.17Å; W588-M592 HydrophobicContact CB-CE 4.45Å; W588-M592 HydrophobicContact CE3-CG 4.42Å; W588-M592 VanDerWaalsContact O-CG 3.27Å; W588-M592 WeakPolarHBondContact O-CG 3.45Å; W588-M592 PolarHBondContact O-N 3.5Å; W588-L721 HydrophobicContact CZ2-CD2 4.18Å; W588-L741 HydrophobicContact CE3-CD2 3.96Å; W588-L741 HydrophobicContact CH2-CD2 4.37Å; W588-L741 HydrophobicContact CZ3-CD1 4.28Å; W588-L741 HydrophobicContact CZ3-CD2 3.86Å; W588-I744 HydrophobicContact CG-CG2 4.29Å
589	L	94.9	Very high	95.3	Very high	19 Å²	19	14 Å²	14	10%	0.099	7%	0.069	C	C	.	.	H	α-helix	trans	-73.7	-26.5	-176.5	-166.9	54.7	0	0	0	112.7	S587 S593 V717 L720 L721	S587-L589 VanDerWaalsContact C-N 3.34Å; S587-L589 PolarHBondContact O-N 2.86Å; L589-S593 VanDerWaalsContact O-CB 3.26Å; L589-S593 WeakPolarHBondContact O-CB 3.28Å; L589-S593 PolarHBondContact O-N 3.08Å; L589-S593 PolarHBondContact O-OG 3.08Å; L589-S593 VanDerWaalsContact O-OG 3.09Å; L589-V717 HydrophobicContact CB-CG1 3.93Å; L589-V717 HydrophobicContact CD2-CG1 4.27Å; L589-V717 HydrophobicContact CG-CG1 4.08Å; L589-L720 HydrophobicContact CD2-CB 3.68Å; L589-L720 HydrophobicContact CG-CB 4.43Å; L589-L721 HydrophobicContact CB-CD2 4.49Å; L589-L721 HydrophobicContact CD2-CD2 3.85Å; L589-L721 HydrophobicContact CD2-CG 3.91Å
590	F	96.6	Very high	95.2	Very high	11 Å²	11	13.7 Å²	13.7	5%	0.048	7%	0.068	C	C	.	.	H	α-helix	trans	-62.1	-47.3	167	-71.3	-91.2	0	0	0	111	S587 W588 M592 F594 L658 M713 Q714 V717	S587-F590 WeakPolarHBondContact O-CB 3.29Å; S587-F590 PolarHBondContact O-N 3.44Å; W588-F590 PolarHBondContact O-N 3.3Å; F590-M592 PolarHBondContact O-N 2.64Å; F590-F594 WeakPolarHBondContact O-CB 3.41Å; F590-F594 PolarHBondContact O-N 3.1Å; F590-L658 HydrophobicContact CB-CB 4.16Å; F590-L658 HydrophobicContact CB-CD1 4.43Å; F590-L658 HydrophobicContact CD1-CD2 3.97Å; F590-M713 HydrophobicContact CD1-CB 3.97Å; F590-M713 HydrophobicContact CD1-CE 4.45Å; F590-M713 HydrophobicContact CE1-CB 4.09Å; F590-Q714 HydrophobicContact CE1-CB 4.45Å; F590-Q714 HydrophobicContact CE1-CG 4.16Å; F590-Q714 VanDerWaalsContact CZ-CD 3.5Å; F590-Q714 HydrophobicContact CZ-CG 4.44Å; F590-Q714 VanDerWaalsContact CZ-OE1 3.27Å; F590-V717 HydrophobicContact CD1-CB 4.1Å; F590-V717 HydrophobicContact CD1-CG1 4.35Å; F590-V717 HydrophobicContact CD1-CG2 3.77Å; F590-V717 HydrophobicContact CD2-CB 4.28Å; F590-V717 HydrophobicContact CD2-CG1 3.64Å; F590-V717 HydrophobicContact CD2-CG2 4.44Å; F590-V717 HydrophobicContact CE1-CB 3.86Å; F590-V717 HydrophobicContact CE1-CG1 4.26Å; F590-V717 HydrophobicContact CE1-CG2 3.99Å; F590-V717 HydrophobicContact CE2-CB 4.02Å; F590-V717 HydrophobicContact CE2-CG1 3.52Å; F590-V717 HydrophobicContact CG-CB 4.3Å; F590-V717 HydrophobicContact CG-CG1 4.05Å; F590-V717 HydrophobicContact CG-CG2 4.01Å; F590-V717 HydrophobicContact CZ-CB 3.8Å; F590-V717 HydrophobicContact CZ-CG1 3.84Å; F590-V717 HydrophobicContact CZ-CG2 4.39Å
591	L	96.8	Very high	95.2	Very high	3 Å²	3	15 Å²	15	2%	0.016	7%	0.072	C	C	.	.	H	α-helix	trans	-63.6	-41.1	179.5	-63.7	174.4	0	0	0	111.4	A562 W565 S587 W588 S595 K655 L658 L659	A562-L591 HydrophobicContact CB-CD1 4.26Å; W565-L591 HydrophobicContact CH2-CD2 3.92Å; W565-L591 HydrophobicContact CZ3-CD1 3.91Å; W565-L591 HydrophobicContact CZ3-CD2 3.82Å; S587-L591 PolarHBondContact O-N 3.13Å; W588-L591 WeakPolarHBondContact O-CB 3.46Å; W588-L591 PolarHBondContact O-N 3.45Å; W588-L591 VanDerWaalsContact O-N 3.17Å; L591-S595 VanDerWaalsContact O-CB 3.23Å; L591-S595 WeakPolarHBondContact O-CB 3.35Å; L591-S595 PolarHBondContact O-N 2.86Å; L591-S595 PolarHBondContact O-OG 3.26Å; L591-K655 HydrophobicContact CD2-CG 3.93Å; L591-K655 WeakPolarHBondContact CD2-O 3.31Å; L591-L658 HydrophobicContact CD2-CB 4.48Å; L591-L659 HydrophobicContact CD1-CD1 4.43Å; L591-L659 HydrophobicContact CD2-CB 4.34Å
592	M	95.4	Very high	95	Very high	17 Å²	17	18.9 Å²	18.9	8%	0.084	9%	0.09	C	C	.	.	H	α-helix	trans	-69.9	-48.4	-179.9	-54.4	-25.3	166.2	0	0	111.7	Q558 V559 A562 W588 F590 F594 S595 L596	Q558-M592 VanDerWaalsContact C-CE 3.43Å; Q558-M592 HydrophobicContact CB-CE 3.81Å; Q558-M592 HydrophobicContact CB-CG 4.39Å; Q558-M592 HydrophobicContact CB-SD 3.54Å; Q558-M592 VanDerWaalsContact CB-SD 3.54Å; V559-M592 HydrophobicContact CB-CE 4.2Å; V559-M592 HydrophobicContact CG2-CE 3.53Å; A562-M592 HydrophobicContact CB-CE 4.07Å; W588-M592 HydrophobicContact CB-CE 4.45Å; W588-M592 HydrophobicContact CE3-CG 4.42Å; W588-M592 VanDerWaalsContact O-CG 3.27Å; W588-M592 WeakPolarHBondContact O-CG 3.45Å; W588-M592 PolarHBondContact O-N 3.5Å; F590-M592 PolarHBondContact O-N 2.64Å; M592-F594 PolarHBondContact O-N 3.41Å; M592-S595 PolarHBondContact O-N 3.34Å; M592-L596 VanDerWaalsContact O-CB 3.31Å; M592-L596 WeakPolarHBondContact O-CB 3.49Å; M592-L596 PolarHBondContact O-N 3.28Å
593	S	95.9	Very high	94.6	Very high	9 Å²	9	22.5 Å²	22.5	6%	0.063	11%	0.105	C	C	.	.	H	α-helix	trans	-68.2	-33.6	-179.6	-62.7	0	0	0	0	112.8	L589 L596 G597 L720	L589-S593 VanDerWaalsContact O-CB 3.26Å; L589-S593 WeakPolarHBondContact O-CB 3.28Å; L589-S593 PolarHBondContact O-N 3.08Å; L589-S593 PolarHBondContact O-OG 3.08Å; L589-S593 VanDerWaalsContact O-OG 3.09Å; S593-L596 WeakPolarHBondContact O-CB 3.48Å; S593-G597 PolarHBondContact O-N 2.96Å; S593-L720 WeakPolarHBondContact OG-CD1 3.38Å
594	F	97.5	Very high	94.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-72.9	-38.2	174.8	-165.2	-110.1	0	0	0	112.1	F590 M592 G597 W598 F641 Y651 M654 K655 L658 M713	F590-F594 WeakPolarHBondContact O-CB 3.41Å; F590-F594 PolarHBondContact O-N 3.1Å; M592-F594 PolarHBondContact O-N 3.41Å; F594-G597 PolarHBondContact O-N 3.21Å; F594-W598 PolarHBondContact O-N 3.18Å; F594-F641 HydrophobicContact CD1-CZ 4.33Å; F594-F641 AromaticContact CD2-CE2 3.86Å; F594-F641 HydrophobicContact CD2-CE2 3.86Å; F594-F641 AromaticContact CD2-CZ 3.62Å; F594-F641 HydrophobicContact CD2-CZ 3.62Å; F594-F641 HydrophobicContact CE1-CZ 4.07Å; F594-F641 HydrophobicContact CE2-CE1 4.23Å; F594-F641 AromaticContact CE2-CE2 3.78Å; F594-F641 HydrophobicContact CE2-CE2 3.78Å; F594-F641 AromaticContact CE2-CZ 3.31Å; F594-F641 HydrophobicContact CE2-CZ 3.31Å; F594-F641 HydrophobicContact CG-CZ 4.12Å; F594-F641 HydrophobicContact CZ-CE1 4.1Å; F594-F641 HydrophobicContact CZ-CE2 4.44Å; F594-F641 AromaticContact CZ-CZ 3.54Å; F594-F641 HydrophobicContact CZ-CZ 3.54Å; F594-Y651 AromaticContact CD1-CD2 3.8Å; F594-Y651 HydrophobicContact CD1-CD2 3.8Å; F594-Y651 AromaticContact CD1-CE2 3.66Å; F594-Y651 HydrophobicContact CD1-CE2 3.66Å; F594-Y651 AromaticContact CE1-CD2 3.35Å; F594-Y651 HydrophobicContact CE1-CD2 3.35Å; F594-Y651 AromaticContact CE1-CE2 3.74Å; F594-Y651 HydrophobicContact CE1-CE2 3.74Å; F594-Y651 HydrophobicContact CE1-CG 4.35Å; F594-Y651 HydrophobicContact CZ-CD2 4.13Å; F594-M654 HydrophobicContact CE1-CB 3.79Å; F594-M654 HydrophobicContact CE2-CE 4.11Å; F594-M654 HydrophobicContact CZ-CB 3.53Å; F594-M654 HydrophobicContact CZ-CE 3.86Å; F594-M654 HydrophobicContact CZ-CG 4.46Å; F594-M654 HydrophobicContact CZ-SD 4.25Å; F594-K655 HydrophobicContact CD1-CB 4.08Å; F594-K655 HydrophobicContact CD1-CG 4.45Å; F594-K655 HydrophobicContact CE1-CB 4.14Å; F594-L658 HydrophobicContact CB-CD1 3.49Å; F594-L658 VanDerWaalsContact CB-CD1 3.49Å; F594-L658 HydrophobicContact CD1-CD1 3.82Å; F594-L658 HydrophobicContact CD2-CD1 3.64Å; F594-L658 HydrophobicContact CE1-CD1 4.44Å; F594-L658 HydrophobicContact CE2-CD1 4.29Å; F594-L658 HydrophobicContact CG-CD1 3.38Å; F594-M713 HydrophobicContact CB-CE 3.85Å; F594-M713 HydrophobicContact CD2-CE 4.3Å; F594-M713 HydrophobicContact CD2-CG 4.32Å; F594-M713 HydrophobicContact CD2-SD 3.94Å
595	S	96.5	Very high	93.5	Very high	9 Å²	9	27.2 Å²	27.2	6%	0.063	13%	0.132	C	C	.	.	H	α-helix	trans	-69.6	-34.4	174.5	-53.1	0	0	0	0	111.9	L591 M592 W598 R599	L591-S595 VanDerWaalsContact O-CB 3.23Å; L591-S595 WeakPolarHBondContact O-CB 3.35Å; L591-S595 PolarHBondContact O-N 2.86Å; L591-S595 PolarHBondContact O-OG 3.26Å; M592-S595 PolarHBondContact O-N 3.34Å; S595-W598 PolarHBondContact O-N 3.18Å; S595-R599 WeakPolarHBondContact O-CG 3.39Å; S595-R599 PolarHBondContact O-N 3.35Å; S595-R599 PolarHBondContact O-NH1 3.3Å
596	L	96.3	Very high	93.1	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-45.9	167.4	166.6	67.6	0	0	0	111	M592 S593 W598 R599 S600 L609 F611 M634	M592-L596 VanDerWaalsContact O-CB 3.31Å; M592-L596 WeakPolarHBondContact O-CB 3.49Å; M592-L596 PolarHBondContact O-N 3.28Å; S593-L596 WeakPolarHBondContact O-CB 3.48Å; L596-W598 VanDerWaalsContact C-N 3.34Å; L596-W598 PolarHBondContact O-N 3.31Å; L596-R599 PolarHBondContact O-N 3.17Å; L596-S600 VanDerWaalsContact O-CB 3.25Å; L596-S600 WeakPolarHBondContact O-CB 3.4Å; L596-S600 PolarHBondContact O-N 3.13Å; L596-S600 PolarHBondContact O-OG 2.99Å; L596-L609 HydrophobicContact CD1-CB 4.17Å; L596-L609 HydrophobicContact CD2-CD2 4.37Å; L596-L609 HydrophobicContact CG-CD2 4.49Å; L596-F611 HydrophobicContact CD1-CB 4.44Å; L596-F611 HydrophobicContact CD1-CD1 3.96Å; L596-F611 HydrophobicContact CD1-CD2 3.93Å; L596-F611 HydrophobicContact CD1-CE1 4.19Å; L596-F611 HydrophobicContact CD1-CE2 4.16Å; L596-F611 HydrophobicContact CD1-CG 3.84Å; L596-F611 HydrophobicContact CD1-CZ 4.3Å; L596-F611 HydrophobicContact CD2-CD1 4.06Å; L596-F611 HydrophobicContact CD2-CE1 3.51Å; L596-F611 HydrophobicContact CD2-CE2 4.21Å; L596-F611 HydrophobicContact CD2-CZ 3.6Å; L596-F611 HydrophobicContact CG-CE1 4.42Å; L596-M634 HydrophobicContact CD2-CB 4.29Å; L596-M634 HydrophobicContact CD2-CG 4.25Å; L596-M634 HydrophobicContact CD2-SD 3.51Å; L596-M634 VanDerWaalsContact CD2-SD 3.51Å
597	G	96.3	Very high	92.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-55.4	-47.8	175.8	0	0	0	0	0	112.2	S593 F594 S600 Y601	S593-G597 PolarHBondContact O-N 2.96Å; F594-G597 PolarHBondContact O-N 3.21Å; G597-S600 PolarHBondContact O-N 3.18Å; G597-Y601 VanDerWaalsContact O-CB 3.31Å; G597-Y601 WeakPolarHBondContact O-CB 3.47Å; G597-Y601 PolarHBondContact O-N 2.87Å
598	W	96.1	Very high	92.5	Very high	23 Å²	23	39.7 Å²	39.7	9%	0.087	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-52.6	174.7	179.5	-90.1	0	0	0	112.9	F594 S595 L596 S600 Y601 E602 F641 V646 Y648 Y651	F594-W598 PolarHBondContact O-N 3.18Å; S595-W598 PolarHBondContact O-N 3.18Å; L596-W598 VanDerWaalsContact C-N 3.34Å; L596-W598 PolarHBondContact O-N 3.31Å; W598-S600 VanDerWaalsContact C-N 3.28Å; W598-S600 PolarHBondContact O-N 3.34Å; W598-Y601 HydrophobicContact CE3-CD1 4.18Å; W598-Y601 HydrophobicContact CH2-CD1 4.45Å; W598-Y601 HydrophobicContact CH2-CE1 4.29Å; W598-Y601 HydrophobicContact CZ3-CD1 4.05Å; W598-Y601 HydrophobicContact CZ3-CE1 4.06Å; W598-Y601 WeakPolarHBondContact O-CB 3.5Å; W598-Y601 PolarHBondContact O-N 3.23Å; W598-E602 PolarHBondContact NE1-OE2 3.46Å; W598-E602 WeakPolarHBondContact O-CB 3.4Å; W598-E602 PolarHBondContact O-N 3.06Å; W598-F641 HydrophobicContact CB-CE1 4.31Å; W598-F641 HydrophobicContact CE3-CD1 4.21Å; W598-F641 AromaticContact CE3-CE1 3.96Å; W598-F641 HydrophobicContact CE3-CE1 3.96Å; W598-V646 WeakPolarHBondContact CZ3-O 3.39Å; W598-Y648 AromaticContact CE2-CD2 3.89Å; W598-Y648 HydrophobicContact CH2-CD2 4.15Å; W598-Y648 HydrophobicContact CH2-CG 4.46Å; W598-Y648 AromaticContact CZ2-CD2 3.67Å; W598-Y648 HydrophobicContact CZ2-CD2 3.67Å; W598-Y648 HydrophobicContact CZ2-CG 4.21Å; W598-Y651 HydrophobicContact CB-CD2 3.71Å; W598-Y651 HydrophobicContact CB-CE2 3.42Å; W598-Y651 VanDerWaalsContact CB-CE2 3.42Å; W598-Y651 HydrophobicContact CB-CG 4.39Å; W598-Y651 AromaticContact CD2-CD1 3.98Å; W598-Y651 HydrophobicContact CD2-CD1 3.98Å; W598-Y651 HydrophobicContact CD2-CD2 4.02Å; W598-Y651 HydrophobicContact CD2-CE1 4.35Å; W598-Y651 HydrophobicContact CD2-CE2 4.39Å; W598-Y651 AromaticContact CD2-CG 3.81Å; W598-Y651 HydrophobicContact CD2-CG 3.81Å; W598-Y651 HydrophobicContact CE3-CD1 4.09Å; W598-Y651 AromaticContact CE3-CD2 3.81Å; W598-Y651 HydrophobicContact CE3-CD2 3.81Å; W598-Y651 AromaticContact CE3-CG 3.52Å; W598-Y651 HydrophobicContact CE3-CG 3.52Å; W598-Y651 HydrophobicContact CG-CD1 4.23Å; W598-Y651 AromaticContact CG-CD2 3.97Å; W598-Y651 HydrophobicContact CG-CD2 3.97Å; W598-Y651 HydrophobicContact CG-CE1 4.14Å; W598-Y651 AromaticContact CG-CE2 3.87Å; W598-Y651 HydrophobicContact CG-CE2 3.87Å; W598-Y651 HydrophobicContact CG-CG 4.15Å; W598-Y651 AromaticContact CG-CZ 3.95Å; W598-Y651 HydrophobicContact CZ3-CG 4.21Å
599	R	94.6	Very high	92.5	Very high	45 Å²	45	39.1 Å²	39.1	17%	0.17	18%	0.18	C	C	.	.	H	α-helix	trans	-58.1	-41.8	179.6	-71.6	-174.5	-59.5	-92.5	9.2	111.9	S595 L596 E602 Q603 C610 F611	S595-R599 WeakPolarHBondContact O-CG 3.39Å; S595-R599 PolarHBondContact O-N 3.35Å; S595-R599 PolarHBondContact O-NH1 3.3Å; L596-R599 PolarHBondContact O-N 3.17Å; R599-E602 PolarHBondContact O-N 2.83Å; R599-Q603 VanDerWaalsContact O-CB 3.25Å; R599-Q603 WeakPolarHBondContact O-CB 3.21Å; R599-Q603 VanDerWaalsContact O-CG 3.27Å; R599-Q603 WeakPolarHBondContact O-CG 3.4Å; R599-Q603 PolarHBondContact O-N 3.33Å; R599-C610 HydrophobicContact CB-CB 4.16Å; R599-C610 WeakPolarHBondContact CB-O 3.44Å; R599-C610 PolarHBondContact NE-O 3.46Å; R599-F611 VanDerWaalsContact CZ-O 3.26Å; R599-F611 PolarHBondContact NE-O 3.14Å; R599-F611 PolarHBondContact NH2-O 2.92Å
600	S	94.9	Very high	92.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.8	-37.8	180	-54	0	0	0	0	112	L596 G597 W598 C604 N605 G606 M608 C610 C638	L596-S600 VanDerWaalsContact O-CB 3.25Å; L596-S600 WeakPolarHBondContact O-CB 3.4Å; L596-S600 PolarHBondContact O-N 3.13Å; L596-S600 PolarHBondContact O-OG 2.99Å; G597-S600 PolarHBondContact O-N 3.18Å; W598-S600 VanDerWaalsContact C-N 3.28Å; W598-S600 PolarHBondContact O-N 3.34Å; S600-C604 CarbonylContact O-C 3.59Å; S600-C604 PolarHBondContact O-N 3.05Å; S600-C604 PolarHBondContact O-SG 3.38Å; S600-N605 PolarHBondContact O-N 2.74Å; S600-G606 PolarHBondContact O-N 3.41Å; S600-M608 WeakPolarHBondContact CB-O 3.23Å; S600-C610 PolarHBondContact OG-N 3.42Å; S600-C638 VanDerWaalsContact CB-SG 3.6Å
601	Y	94.8	Very high	92.3	Very high	47 Å²	47	39 Å²	39	18%	0.184	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-53	170.9	168.2	-126.1	0	0	0	111.7	G597 W598 N605 F641 V642 V646	G597-Y601 VanDerWaalsContact O-CB 3.31Å; G597-Y601 WeakPolarHBondContact O-CB 3.47Å; G597-Y601 PolarHBondContact O-N 2.87Å; W598-Y601 HydrophobicContact CE3-CD1 4.18Å; W598-Y601 HydrophobicContact CH2-CD1 4.45Å; W598-Y601 HydrophobicContact CH2-CE1 4.29Å; W598-Y601 HydrophobicContact CZ3-CD1 4.05Å; W598-Y601 HydrophobicContact CZ3-CE1 4.06Å; W598-Y601 WeakPolarHBondContact O-CB 3.5Å; W598-Y601 PolarHBondContact O-N 3.23Å; Y601-N605 VanDerWaalsContact O-CA 3.25Å; Y601-N605 WeakPolarHBondContact O-CA 3.34Å; Y601-N605 PolarHBondContact O-N 3.12Å; Y601-F641 HydrophobicContact CD1-CB 4.24Å; Y601-F641 HydrophobicContact CD1-CD1 4.25Å; Y601-F641 HydrophobicContact CD2-CB 4.29Å; Y601-F641 HydrophobicContact CG-CB 3.85Å; Y601-V642 HydrophobicContact CD2-CB 4.38Å; Y601-V642 HydrophobicContact CD2-CG2 3.7Å; Y601-V642 HydrophobicContact CE2-CG2 4.26Å; Y601-V646 WeakPolarHBondContact CE1-O 3.26Å
602	E	89	Confident	92.1	Very high	131 Å²	131	38.9 Å²	38.9	61%	0.612	18%	0.178	S	C	*	.	H	α-helix	trans	-66.4	-41.3	-175.5	-176.6	167.5	-143.7	0	0	113.2	W598 R599	W598-E602 PolarHBondContact NE1-OE2 3.46Å; W598-E602 WeakPolarHBondContact O-CB 3.4Å; W598-E602 PolarHBondContact O-N 3.06Å; R599-E602 PolarHBondContact O-N 2.83Å
603	Q	85.1	Confident	91.7	Very high	104 Å²	104	40.6 Å²	40.6	49%	0.486	19%	0.191	S	C	.	.	H	α-helix	trans	-89.6	-31.9	-172.1	-63.3	176.2	2.7	0	0	114.2	R599	R599-Q603 VanDerWaalsContact O-CB 3.25Å; R599-Q603 WeakPolarHBondContact O-CB 3.21Å; R599-Q603 VanDerWaalsContact O-CG 3.27Å; R599-Q603 WeakPolarHBondContact O-CG 3.4Å; R599-Q603 PolarHBondContact O-N 3.33Å
604	C	84.3	Confident	91.3	Very high	32 Å²	32	42.6 Å²	42.6	22%	0.216	20%	0.201	C	C	.	.	H	α-helix	trans	-139.3	12.1	-173.5	76.3	0	0	0	0	114.8	S600 G606 R607 M608	S600-C604 CarbonylContact O-C 3.59Å; S600-C604 PolarHBondContact O-N 3.05Å; S600-C604 PolarHBondContact O-SG 3.38Å; C604-G606 VanDerWaalsContact C-N 3.26Å; C604-G606 PolarHBondContact O-N 2.93Å; C604-R607 WeakPolarHBondContact O-CG 3.25Å; C604-R607 PolarHBondContact O-N 3.43Å; C604-M608 PolarHBondContact SG-N 3.28Å; C604-M608 PolarHBondContact SG-O 2.86Å
605	N	83.9	Confident	91	Very high	89 Å²	89	42.6 Å²	42.6	48%	0.476	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	45	-177.2	-164.1	100.5	0	0	0	111.8	S600 Y601 R607 V642	S600-N605 PolarHBondContact O-N 2.74Å; Y601-N605 VanDerWaalsContact O-CA 3.25Å; Y601-N605 WeakPolarHBondContact O-CA 3.34Å; Y601-N605 PolarHBondContact O-N 3.12Å; N605-R607 VanDerWaalsContact C-N 3.29Å; N605-R607 PolarHBondContact O-N 2.85Å; N605-V642 WeakPolarHBondContact ND2-CG1 3.27Å; N605-V642 WeakPolarHBondContact O-CG2 3.21Å
606	G	84.2	Confident	90.8	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	13.1	173.1	0	0	0	0	0	116.4	S600 C604 L635	S600-G606 PolarHBondContact O-N 3.41Å; C604-G606 VanDerWaalsContact C-N 3.26Å; C604-G606 PolarHBondContact O-N 2.93Å; G606-L635 WeakPolarHBondContact O-CD2 3.36Å
607	R	83.7	Confident	90.6	Very high	207 Å²	207	44 Å²	44	78%	0.781	21%	0.209	S	C	*	.	S	Bend	trans	-81.2	-23.7	-179.5	-65.2	-178.5	178.8	-174.5	0.4	114.5	C604 N605	C604-R607 WeakPolarHBondContact O-CG 3.25Å; C604-R607 PolarHBondContact O-N 3.43Å; N605-R607 VanDerWaalsContact C-N 3.29Å; N605-R607 PolarHBondContact O-N 2.85Å
608	M	90.6	Very high	90.2	Very high	71 Å²	71	45.9 Å²	45.9	35%	0.35	22%	0.218	S	C	.	.	S	Bend	trans	-142	160.4	-175	-69.4	170.1	54.7	0	0	108.5	S600 C604 V616 N618	S600-M608 WeakPolarHBondContact CB-O 3.23Å; C604-M608 PolarHBondContact SG-N 3.28Å; C604-M608 PolarHBondContact SG-O 2.86Å; M608-V616 HydrophobicContact CB-CG1 4Å; M608-V616 HydrophobicContact CE-CB 4.48Å; M608-V616 HydrophobicContact CE-CG1 3.59Å; M608-N618 HydrophobicContact CE-CB 3.67Å; M608-N618 HydrophobicContact SD-CB 4.49Å
609	L	94.8	Very high	89.9	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.3	-178.2	-65.7	175.5	0	0	0	110.8	L596 F611 V616 I617 M622 C631 M634 L635 C638	L596-L609 HydrophobicContact CD1-CB 4.17Å; L596-L609 HydrophobicContact CD2-CD2 4.37Å; L596-L609 HydrophobicContact CG-CD2 4.49Å; L609-F611 HydrophobicContact CB-CD2 4.05Å; L609-F611 HydrophobicContact CB-CE2 3.62Å; L609-F611 HydrophobicContact CD1-CE2 4.16Å; L609-F611 HydrophobicContact CD1-CZ 4.48Å; L609-F611 PolarHBondContact O-N 3.06Å; L609-V616 WeakPolarHBondContact O-CA 3.39Å; L609-I617 HydrophobicContact CB-CB 4.22Å; L609-I617 PolarHBondContact N-O 3.04Å; L609-I617 VanDerWaalsContact N-O 3.11Å; L609-I617 PolarHBondContact O-N 3.09Å; L609-M622 HydrophobicContact CD1-CE 4.27Å; L609-M622 HydrophobicContact CG-CE 4.06Å; L609-C631 HydrophobicContact CD1-CB 3.78Å; L609-M634 HydrophobicContact CD1-CB 3.87Å; L609-M634 HydrophobicContact CD1-CE 4.26Å; L609-M634 HydrophobicContact CD2-CB 3.92Å; L609-L635 HydrophobicContact CD1-CG 4.4Å; L609-L635 HydrophobicContact CD2-CD2 3.76Å; L609-L635 HydrophobicContact CD2-CG 4.01Å; L609-L635 HydrophobicContact CG-CD2 3.95Å; L609-L635 HydrophobicContact CG-CG 4.09Å; L609-C638 VanDerWaalsContact CD2-SG 3.57Å
610	C	93.8	Very high	89.6	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.02	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	78.3	-175.2	-60	0	0	0	0	111.1	R599 S600	R599-C610 HydrophobicContact CB-CB 4.16Å; R599-C610 WeakPolarHBondContact CB-O 3.44Å; R599-C610 PolarHBondContact NE-O 3.46Å; S600-C610 PolarHBondContact OG-N 3.42Å
611	F	94.1	Very high	89.5	Confident	24 Å²	24	57.4 Å²	57.4	11%	0.105	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	-42.9	-178.1	-75.9	-90.6	0	0	0	112.3	L551 L554 L596 R599 L609 L615 I617 M634	L551-F611 HydrophobicContact CD2-CB 3.94Å; L551-F611 HydrophobicContact CD2-CD1 3.3Å; L551-F611 HydrophobicContact CD2-CD2 3.86Å; L551-F611 HydrophobicContact CD2-CE1 3.61Å; L551-F611 HydrophobicContact CD2-CE2 4.14Å; L551-F611 HydrophobicContact CD2-CG 3.42Å; L551-F611 VanDerWaalsContact CD2-CG 3.42Å; L551-F611 HydrophobicContact CD2-CZ 4.01Å; L554-F611 HydrophobicContact CD2-CB 3.91Å; L596-F611 HydrophobicContact CD1-CB 4.44Å; L596-F611 HydrophobicContact CD1-CD1 3.96Å; L596-F611 HydrophobicContact CD1-CD2 3.93Å; L596-F611 HydrophobicContact CD1-CE1 4.19Å; L596-F611 HydrophobicContact CD1-CE2 4.16Å; L596-F611 HydrophobicContact CD1-CG 3.84Å; L596-F611 HydrophobicContact CD1-CZ 4.3Å; L596-F611 HydrophobicContact CD2-CD1 4.06Å; L596-F611 HydrophobicContact CD2-CE1 3.51Å; L596-F611 HydrophobicContact CD2-CE2 4.21Å; L596-F611 HydrophobicContact CD2-CZ 3.6Å; L596-F611 HydrophobicContact CG-CE1 4.42Å; R599-F611 VanDerWaalsContact CZ-O 3.26Å; R599-F611 PolarHBondContact NE-O 3.14Å; R599-F611 PolarHBondContact NH2-O 2.92Å; L609-F611 HydrophobicContact CB-CD2 4.05Å; L609-F611 HydrophobicContact CB-CE2 3.62Å; L609-F611 HydrophobicContact CD1-CE2 4.16Å; L609-F611 HydrophobicContact CD1-CZ 4.48Å; L609-F611 PolarHBondContact O-N 3.06Å; F611-L615 HydrophobicContact CB-CD2 4.22Å; F611-L615 HydrophobicContact CB-CG 4.24Å; F611-L615 WeakPolarHBondContact CB-O 3.5Å; F611-L615 PolarHBondContact N-O 3.15Å; F611-I617 HydrophobicContact CD2-CB 4.49Å; F611-I617 HydrophobicContact CD2-CG1 3.7Å; F611-I617 HydrophobicContact CE2-CB 4.31Å; F611-I617 HydrophobicContact CE2-CG1 3.65Å; F611-M634 HydrophobicContact CE1-SD 4.24Å; F611-M634 HydrophobicContact CZ-CE 3.93Å; F611-M634 HydrophobicContact CZ-SD 3.84Å
612	A	91.9	Very high	89.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	167.4	171.5	0	0	0	0	0	109.3	L554 D614 L615	L554-A612 HydrophobicContact CD1-CB 4.2Å; L554-A612 HydrophobicContact CD2-CB 3.94Å; A612-D614 WeakPolarHBondContact CB-OD1 3.48Å; A612-D614 PolarHBondContact O-N 3.26Å; A612-D614 VanDerWaalsContact O-N 3.15Å; A612-L615 HydrophobicContact CB-CB 4.26Å; A612-L615 PolarHBondContact N-O 3.33Å; A612-L615 VanDerWaalsContact N-O 3.1Å; A612-L615 CarbonylContact O-C 3.56Å; A612-L615 PolarHBondContact O-N 3.27Å; A612-L615 VanDerWaalsContact O-O 3.08Å
613	P	86.6	Confident	89.4	Confident	54 Å²	54	56.7 Å²	56.7	35%	0.351	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.1	179.7	-20.4	31.8	0	0	0	114	I531 I532 Y533	I531-P613 HydrophobicContact CG2-CG 3.35Å; I532-P613 WeakPolarHBondContact O-CD 3.32Å; Y533-P613 HydrophobicContact CD1-CB 4.14Å; Y533-P613 HydrophobicContact CD1-CG 4.15Å; Y533-P613 HydrophobicContact CE1-CB 3.73Å; Y533-P613 HydrophobicContact CE1-CG 3.85Å
614	D	88.2	Confident	89.7	Confident	51 Å²	51	53.7 Å²	53.7	27%	0.273	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-7	177	62.1	-15.4	0	0	0	113.6	Y533 S534 G535 Y536 A612	Y533-D614 HydrophobicContact CD1-CB 4.39Å; S534-D614 WeakPolarHBondContact CB-OD1 3.46Å; S534-D614 PolarHBondContact N-OD1 2.78Å; S534-D614 PolarHBondContact N-OD2 3.07Å; S534-D614 VanDerWaalsContact N-OD2 3.07Å; S534-D614 PolarHBondContact OG-OD1 3.13Å; S534-D614 PolarHBondContact OG-OD2 2.71Å; S534-D614 VanDerWaalsContact OG-OD2 3.13Å; G535-D614 WeakPolarHBondContact CA-OD2 3.48Å; G535-D614 PolarHBondContact N-OD2 2.86Å; Y536-D614 PolarHBondContact N-OD2 3.29Å; A612-D614 WeakPolarHBondContact CB-OD1 3.48Å; A612-D614 PolarHBondContact O-N 3.26Å; A612-D614 VanDerWaalsContact O-N 3.15Å
615	L	91.7	Very high	89.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	93.4	-179.6	-178.7	63.1	0	0	0	110.9	S534 Y536 L547 T550 L551 L554 F611 A612 I617	S534-L615 VanDerWaalsContact OG-CB 3.3Å; S534-L615 WeakPolarHBondContact OG-CB 3.21Å; Y536-L615 HydrophobicContact CD1-CD1 4.13Å; Y536-L615 HydrophobicContact CD2-CD1 4.27Å; Y536-L615 HydrophobicContact CG-CD1 3.94Å; L547-L615 HydrophobicContact CD2-CD1 3.94Å; T550-L615 HydrophobicContact CG2-CD2 3.73Å; L551-L615 HydrophobicContact CD2-CD2 3.71Å; L551-L615 HydrophobicContact CG-CD2 4.32Å; L554-L615 HydrophobicContact CD2-CD2 4.35Å; F611-L615 HydrophobicContact CB-CD2 4.22Å; F611-L615 HydrophobicContact CB-CG 4.24Å; F611-L615 WeakPolarHBondContact CB-O 3.5Å; F611-L615 PolarHBondContact N-O 3.15Å; A612-L615 HydrophobicContact CB-CB 4.26Å; A612-L615 PolarHBondContact N-O 3.33Å; A612-L615 VanDerWaalsContact N-O 3.1Å; A612-L615 CarbonylContact O-C 3.56Å; A612-L615 PolarHBondContact O-N 3.27Å; A612-L615 VanDerWaalsContact O-O 3.08Å; L615-I617 HydrophobicContact CD1-CD1 4.16Å
616	V	91.5	Very high	89.9	Confident	40 Å²	40	55 Å²	55	24%	0.242	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.3	170.5	-168.3	0	0	0	0	109.2	M608 L609 R621	M608-V616 HydrophobicContact CB-CG1 4Å; M608-V616 HydrophobicContact CE-CB 4.48Å; M608-V616 HydrophobicContact CE-CG1 3.59Å; L609-V616 WeakPolarHBondContact O-CA 3.39Å; V616-R621 PolarHBondContact O-NH1 3.2Å
617	I	92.1	Very high	90.1	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	116.4	174.9	-58.7	-56.3	0	0	0	107.6	L547 L609 F611 L615 R621 M622	L547-I617 HydrophobicContact CD1-CD1 4.36Å; L547-I617 HydrophobicContact CD2-CD1 4.05Å; L609-I617 HydrophobicContact CB-CB 4.22Å; L609-I617 PolarHBondContact N-O 3.04Å; L609-I617 VanDerWaalsContact N-O 3.11Å; L609-I617 PolarHBondContact O-N 3.09Å; F611-I617 HydrophobicContact CD2-CB 4.49Å; F611-I617 HydrophobicContact CD2-CG1 3.7Å; F611-I617 HydrophobicContact CE2-CB 4.31Å; F611-I617 HydrophobicContact CE2-CG1 3.65Å; L615-I617 HydrophobicContact CD1-CD1 4.16Å; I617-R621 HydrophobicContact CB-CB 4.49Å; I617-R621 HydrophobicContact CD1-CB 4.25Å; I617-R621 HydrophobicContact CG2-CB 3.76Å; I617-M622 HydrophobicContact CG2-CE 4.15Å; I617-M622 HydrophobicContact CG2-CG 3.75Å; I617-M622 WeakPolarHBondContact O-CE 3.45Å
618	N	89.3	Confident	90.4	Very high	40 Å²	40	46.9 Å²	46.9	21%	0.214	25%	0.245	C	C	.	.			trans	-94	175.3	175.9	74	-19.7	0	0	0	111.1	M608 E620 R621 M622	M608-N618 HydrophobicContact CE-CB 3.67Å; M608-N618 HydrophobicContact SD-CB 4.49Å; N618-E620 PolarHBondContact ND2-OE2 3.01Å; N618-E620 PolarHBondContact O-N 2.97Å; N618-E620 VanDerWaalsContact O-N 3.11Å; N618-E620 PolarHBondContact OD1-N 3.46Å; N618-R621 PolarHBondContact O-N 3.2Å; N618-R621 VanDerWaalsContact O-N 3.14Å; N618-R621 WeakPolarHBondContact OD1-CB 3.23Å; N618-R621 VanDerWaalsContact OD1-CG 3.26Å; N618-R621 WeakPolarHBondContact OD1-CG 3.3Å; N618-R621 PolarHBondContact OD1-N 3.32Å; N618-M622 VanDerWaalsContact O-CG 3.3Å; N618-M622 WeakPolarHBondContact O-CG 3.39Å; N618-M622 PolarHBondContact O-N 3.1Å
619	E	88.6	Confident	90.3	Very high	129 Å²	129	48 Å²	48	60%	0.603	25%	0.252	S	S	*	.	H	α-helix	trans	-57.3	-26.5	-179.8	-158	-161.4	123.9	0	0	113.6	K623	E619-K623 WeakPolarHBondContact O-CD 3.22Å; E619-K623 VanDerWaalsContact O-CE 3.31Å; E619-K623 WeakPolarHBondContact O-CE 3.33Å; E619-K623 WeakPolarHBondContact O-CG 3.4Å; E619-K623 WeakPolarHBondContact OE1-CE 3.39Å; E619-K623 IonicContact OE1-NZ 2.64Å; E619-K623 PolarHBondContact OE1-NZ 3.02Å
620	E	89.5	Confident	90.1	Very high	142 Å²	142	48.7 Å²	48.7	66%	0.664	26%	0.256	S	S	*	.	H	α-helix	trans	-75.3	-47.2	176.8	-59.4	170.2	139.5	0	0	111.3	N618 M622 K623	N618-E620 PolarHBondContact ND2-OE2 3.01Å; N618-E620 PolarHBondContact O-N 2.97Å; N618-E620 VanDerWaalsContact O-N 3.11Å; N618-E620 PolarHBondContact OD1-N 3.46Å; E620-M622 PolarHBondContact O-N 2.88Å; E620-K623 WeakPolarHBondContact O-CB 3.39Å; E620-K623 PolarHBondContact O-N 3.34Å
621	R	90.9	Very high	90.1	Very high	38 Å²	38	48.7 Å²	48.7	14%	0.143	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-29.2	175.5	-72.2	168.7	168.7	-174	-11.9	112.6	D542 L547 V616 I617 N618 K623 L624	D542-R621 IonicContact OD1-CZ 2.78Å; D542-R621 IonicContact OD1-NE 2.73Å; D542-R621 IonicContact OD1-NH2 3.16Å; D542-R621 PolarHBondContact OD1-NH2 2.81Å; D542-R621 WeakPolarHBondContact OD2-CG 3.41Å; D542-R621 IonicContact OD2-CZ 2.75Å; D542-R621 IonicContact OD2-NE 2.73Å; D542-R621 PolarHBondContact OD2-NE 3.36Å; D542-R621 IonicContact OD2-NH2 2.64Å; D542-R621 PolarHBondContact OD2-NH2 3.18Å; D542-R621 VanDerWaalsContact OD2-NH2 3.12Å; L547-R621 HydrophobicContact CD1-CB 4.42Å; L547-R621 HydrophobicContact CD1-CG 4.27Å; V616-R621 PolarHBondContact O-NH1 3.2Å; I617-R621 HydrophobicContact CB-CB 4.49Å; I617-R621 HydrophobicContact CD1-CB 4.25Å; I617-R621 HydrophobicContact CG2-CB 3.76Å; N618-R621 PolarHBondContact O-N 3.2Å; N618-R621 VanDerWaalsContact O-N 3.14Å; N618-R621 WeakPolarHBondContact OD1-CB 3.23Å; N618-R621 VanDerWaalsContact OD1-CG 3.26Å; N618-R621 WeakPolarHBondContact OD1-CG 3.3Å; N618-R621 PolarHBondContact OD1-N 3.32Å; R621-K623 VanDerWaalsContact C-N 3.28Å; R621-K623 PolarHBondContact O-N 3.29Å; R621-L624 HydrophobicContact CB-CD1 4.45Å; R621-L624 WeakPolarHBondContact O-CB 3.29Å; R621-L624 WeakPolarHBondContact O-CG 3.39Å; R621-L624 PolarHBondContact O-N 3.38Å
622	M	91.1	Very high	90	Very high	23 Å²	23	52.7 Å²	52.7	11%	0.113	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-28	172.1	-64.4	172.4	-169.8	0	0	112.8	L609 I617 N618 E620 L624 G628 C631 L635	L609-M622 HydrophobicContact CD1-CE 4.27Å; L609-M622 HydrophobicContact CG-CE 4.06Å; I617-M622 HydrophobicContact CG2-CE 4.15Å; I617-M622 HydrophobicContact CG2-CG 3.75Å; I617-M622 WeakPolarHBondContact O-CE 3.45Å; N618-M622 VanDerWaalsContact O-CG 3.3Å; N618-M622 WeakPolarHBondContact O-CG 3.39Å; N618-M622 PolarHBondContact O-N 3.1Å; E620-M622 PolarHBondContact O-N 2.88Å; M622-L624 PolarHBondContact O-N 3.36Å; M622-G628 WeakPolarHBondContact O-CA 3.42Å; M622-G628 PolarHBondContact O-N 2.82Å; M622-G628 VanDerWaalsContact O-N 3.12Å; M622-C631 HydrophobicContact CB-CB 4.25Å; M622-C631 HydrophobicContact CG-CB 3.67Å; M622-C631 HydrophobicContact SD-CB 4.25Å; M622-L635 HydrophobicContact CE-CD1 3.82Å; M622-L635 HydrophobicContact CE-CD2 4.36Å; M622-L635 HydrophobicContact CE-CG 4.29Å; M622-L635 HydrophobicContact SD-CD1 3.71Å
623	K	91.1	Very high	90	Very high	141 Å²	141	54 Å²	54	61%	0.613	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.7	179.1	-65.7	161.2	-169.6	169.5	0	113.3	E619 E620 R621	E619-K623 WeakPolarHBondContact O-CD 3.22Å; E619-K623 VanDerWaalsContact O-CE 3.31Å; E619-K623 WeakPolarHBondContact O-CE 3.33Å; E619-K623 WeakPolarHBondContact O-CG 3.4Å; E619-K623 WeakPolarHBondContact OE1-CE 3.39Å; E619-K623 IonicContact OE1-NZ 2.64Å; E619-K623 PolarHBondContact OE1-NZ 3.02Å; E620-K623 WeakPolarHBondContact O-CB 3.39Å; E620-K623 PolarHBondContact O-N 3.34Å; R621-K623 VanDerWaalsContact C-N 3.28Å; R621-K623 PolarHBondContact O-N 3.29Å
624	L	91.8	Very high	90.4	Very high	40 Å²	40	52.3 Å²	52.3	21%	0.209	27%	0.268	C	S	.	.	S	Bend	trans	-68.5	149.3	172.8	-67.1	170.5	0	0	0	110.7	D542 L547 R621 M622 L626 M627	D542-L624 HydrophobicContact CB-CD1 4.21Å; L547-L624 HydrophobicContact CD1-CD1 3.46Å; L547-L624 VanDerWaalsContact CD1-CD1 3.46Å; R621-L624 HydrophobicContact CB-CD1 4.45Å; R621-L624 WeakPolarHBondContact O-CB 3.29Å; R621-L624 WeakPolarHBondContact O-CG 3.39Å; R621-L624 PolarHBondContact O-N 3.38Å; M622-L624 PolarHBondContact O-N 3.36Å; L624-L626 PolarHBondContact O-N 2.88Å; L624-M627 HydrophobicContact CB-CB 4.39Å; L624-M627 HydrophobicContact CB-CG 4.04Å; L624-M627 WeakPolarHBondContact O-CB 3.41Å; L624-M627 PolarHBondContact O-N 2.84Å; L624-M627 VanDerWaalsContact O-N 3.13Å
625	P	88.2	Confident	90.7	Very high	95 Å²	95	51.2 Å²	51.2	62%	0.617	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	139.7	178.3	-26.6	35	0	0	0	112.2	S544 M627	S544-P625 WeakPolarHBondContact CB-O 3.4Å; P625-M627 PolarHBondContact O-N 3.04Å; P625-M627 VanDerWaalsContact O-N 3.1Å
626	L	84.1	Confident	90.7	Very high	55 Å²	55	56.5 Å²	56.5	29%	0.288	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	-6.8	-178.4	-158.9	60	0	0	0	116	M548 L624 I723 T727 L733	M548-L626 HydrophobicContact CE-CD2 4.07Å; M548-L626 HydrophobicContact SD-CD2 4.02Å; M548-L626 HydrophobicContact SD-CG 4.49Å; L624-L626 PolarHBondContact O-N 2.88Å; L626-I723 HydrophobicContact CD1-CD1 3.95Å; L626-I723 HydrophobicContact CD1-CG1 4.06Å; L626-I723 HydrophobicContact CG-CG1 4.41Å; L626-T727 HydrophobicContact CD2-CG2 3.6Å; L626-L733 HydrophobicContact CD2-CD1 4.21Å
627	M	89.5	Confident	90.9	Very high	10 Å²	10	55.1 Å²	55.1	5%	0.049	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-37.6	179.2	-69.7	-64.9	-169.1	0	0	114.3	L547 M548 L551 L624 P625 Q630 C631	L547-M627 HydrophobicContact CB-CE 3.38Å; L547-M627 HydrophobicContact CD1-CE 4.19Å; L547-M627 HydrophobicContact CG-CE 4.44Å; M548-M627 HydrophobicContact CG-CE 3.59Å; M548-M627 HydrophobicContact CG-SD 4.33Å; L551-M627 HydrophobicContact CD1-CE 4.37Å; L624-M627 HydrophobicContact CB-CB 4.39Å; L624-M627 HydrophobicContact CB-CG 4.04Å; L624-M627 WeakPolarHBondContact O-CB 3.41Å; L624-M627 PolarHBondContact O-N 2.84Å; L624-M627 VanDerWaalsContact O-N 3.13Å; P625-M627 PolarHBondContact O-N 3.04Å; P625-M627 VanDerWaalsContact O-N 3.1Å; M627-Q630 PolarHBondContact O-N 3.1Å; M627-C631 WeakPolarHBondContact O-CB 3.12Å; M627-C631 PolarHBondContact O-N 3.19Å; M627-C631 PolarHBondContact O-SG 2.99Å
628	G	89.1	Confident	91	Very high	27 Å²	27	55 Å²	55	28%	0.278	28%	0.276	S	S	.	.	H	α-helix	trans	-51.1	-69	-165.8	0	0	0	0	0	114.5	M622 Q630 C631 E632	M622-G628 WeakPolarHBondContact O-CA 3.42Å; M622-G628 PolarHBondContact O-N 2.82Å; M622-G628 VanDerWaalsContact O-N 3.12Å; G628-Q630 PolarHBondContact O-N 3.36Å; G628-C631 PolarHBondContact O-N 3.35Å; G628-C631 VanDerWaalsContact O-N 3.08Å; G628-E632 PolarHBondContact O-N 3.46Å
629	D	89.4	Confident	91.2	Very high	93 Å²	93	57 Å²	57	50%	0.497	29%	0.287	S	S	.	.	H	α-helix	trans	-56.4	-39.7	-174.7	-41.6	-21.5	0	0	0	112.1	E632 Q633	D629-E632 PolarHBondContact O-N 2.83Å; D629-Q633 WeakPolarHBondContact O-CG 3.27Å; D629-Q633 PolarHBondContact O-N 2.67Å
630	Q	89.6	Confident	91.6	Very high	16 Å²	16	53.5 Å²	53.5	8%	0.075	27%	0.27	C	S	.	.	H	α-helix	trans	-67.7	-43.5	-179.8	-51.4	-57.9	-40.6	0	0	110.8	M627 G628 Q633 M634 L720 I723	M627-Q630 PolarHBondContact O-N 3.1Å; G628-Q630 PolarHBondContact O-N 3.36Å; Q630-Q633 PolarHBondContact O-N 3.19Å; Q630-M634 HydrophobicContact CB-CE 4.31Å; Q630-M634 VanDerWaalsContact O-CE 3.26Å; Q630-M634 WeakPolarHBondContact O-CE 3.49Å; Q630-M634 WeakPolarHBondContact O-CG 3.42Å; Q630-M634 PolarHBondContact O-N 2.81Å; Q630-L720 HydrophobicContact CB-CD2 4.14Å; Q630-I723 HydrophobicContact CG-CB 4.5Å; Q630-I723 HydrophobicContact CG-CG1 4.2Å; Q630-I723 HydrophobicContact CG-CG2 4.17Å
631	C	93.7	Very high	91.9	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.02	24%	0.238	C	C	.	.	H	α-helix	trans	-66.2	-38.4	174.2	-67.1	0	0	0	0	112	L609 M622 M627 G628 M634 L635	L609-C631 HydrophobicContact CD1-CB 3.78Å; M622-C631 HydrophobicContact CB-CB 4.25Å; M622-C631 HydrophobicContact CG-CB 3.67Å; M622-C631 HydrophobicContact SD-CB 4.25Å; M627-C631 WeakPolarHBondContact O-CB 3.12Å; M627-C631 PolarHBondContact O-N 3.19Å; M627-C631 PolarHBondContact O-SG 2.99Å; G628-C631 PolarHBondContact O-N 3.35Å; G628-C631 VanDerWaalsContact O-N 3.08Å; C631-M634 PolarHBondContact O-N 3.48Å; C631-L635 WeakPolarHBondContact O-CB 3.18Å; C631-L635 VanDerWaalsContact O-CG 3.3Å; C631-L635 WeakPolarHBondContact O-CG 3.35Å; C631-L635 PolarHBondContact O-N 3.31Å
632	E	92.6	Very high	92.1	Very high	107 Å²	107	46.5 Å²	46.5	50%	0.5	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-41.4	176.5	-160.2	-161	116.4	0	0	111.5	G628 D629 L635 K636	G628-E632 PolarHBondContact O-N 3.46Å; D629-E632 PolarHBondContact O-N 2.83Å; E632-L635 PolarHBondContact O-N 2.94Å; E632-K636 WeakPolarHBondContact O-CG 3.25Å; E632-K636 PolarHBondContact O-N 3.45Å; E632-K636 WeakPolarHBondContact OE1-CE 3.47Å; E632-K636 IonicContact OE1-NZ 2.62Å; E632-K636 PolarHBondContact OE1-NZ 2.89Å
633	Q	92.3	Very high	92.3	Very high	29 Å²	29	52 Å²	52	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-47	173.9	-69.4	179.7	36.1	0	0	112.1	D629 Q630 L635 K636 I637 M716	D629-Q633 WeakPolarHBondContact O-CG 3.27Å; D629-Q633 PolarHBondContact O-N 2.67Å; Q630-Q633 PolarHBondContact O-N 3.19Å; Q633-L635 VanDerWaalsContact C-N 3.31Å; Q633-L635 PolarHBondContact O-N 2.91Å; Q633-K636 WeakPolarHBondContact O-CB 3.44Å; Q633-K636 PolarHBondContact O-N 2.82Å; Q633-K636 VanDerWaalsContact O-N 3.15Å; Q633-I637 PolarHBondContact O-N 2.87Å; Q633-M716 HydrophobicContact CB-CG 4.09Å
634	M	94.5	Very high	92.5	Very high	18 Å²	18	45.5 Å²	45.5	9%	0.089	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-36.9	175.5	-71.3	-177.2	-79.8	0	0	112.4	L596 L609 F611 Q630 C631 I637 C638 M716 L720	L596-M634 HydrophobicContact CD2-CB 4.29Å; L596-M634 HydrophobicContact CD2-CG 4.25Å; L596-M634 HydrophobicContact CD2-SD 3.51Å; L596-M634 VanDerWaalsContact CD2-SD 3.51Å; L609-M634 HydrophobicContact CD1-CB 3.87Å; L609-M634 HydrophobicContact CD1-CE 4.26Å; L609-M634 HydrophobicContact CD2-CB 3.92Å; F611-M634 HydrophobicContact CE1-SD 4.24Å; F611-M634 HydrophobicContact CZ-CE 3.93Å; F611-M634 HydrophobicContact CZ-SD 3.84Å; Q630-M634 HydrophobicContact CB-CE 4.31Å; Q630-M634 VanDerWaalsContact O-CE 3.26Å; Q630-M634 WeakPolarHBondContact O-CE 3.49Å; Q630-M634 WeakPolarHBondContact O-CG 3.42Å; Q630-M634 PolarHBondContact O-N 2.81Å; C631-M634 PolarHBondContact O-N 3.48Å; M634-I637 PolarHBondContact O-N 3.23Å; M634-C638 PolarHBondContact O-N 2.98Å; M634-C638 VanDerWaalsContact O-N 3.11Å; M634-C638 PolarHBondContact O-SG 3.48Å; M634-M716 HydrophobicContact CB-SD 4.47Å; M634-M716 HydrophobicContact CG-SD 4.03Å; M634-L720 HydrophobicContact CE-CD2 3.95Å; M634-L720 HydrophobicContact CG-CD1 4Å; M634-L720 HydrophobicContact CG-CD2 4.25Å; M634-L720 HydrophobicContact SD-CD1 4.24Å; M634-L720 HydrophobicContact SD-CD2 4.1Å
635	L	93.8	Very high	92.6	Very high	28 Å²	28	49.5 Å²	49.5	15%	0.147	25%	0.25	C	S	.	.	H	α-helix	trans	-66.5	-33.5	174.1	-77.7	174.9	0	0	0	112.9	G606 L609 M622 C631 E632 Q633 I637 C638 N639	G606-L635 WeakPolarHBondContact O-CD2 3.36Å; L609-L635 HydrophobicContact CD1-CG 4.4Å; L609-L635 HydrophobicContact CD2-CD2 3.76Å; L609-L635 HydrophobicContact CD2-CG 4.01Å; L609-L635 HydrophobicContact CG-CD2 3.95Å; L609-L635 HydrophobicContact CG-CG 4.09Å; M622-L635 HydrophobicContact CE-CD1 3.82Å; M622-L635 HydrophobicContact CE-CD2 4.36Å; M622-L635 HydrophobicContact CE-CG 4.29Å; M622-L635 HydrophobicContact SD-CD1 3.71Å; C631-L635 WeakPolarHBondContact O-CB 3.18Å; C631-L635 VanDerWaalsContact O-CG 3.3Å; C631-L635 WeakPolarHBondContact O-CG 3.35Å; C631-L635 PolarHBondContact O-N 3.31Å; E632-L635 PolarHBondContact O-N 2.94Å; Q633-L635 VanDerWaalsContact C-N 3.31Å; Q633-L635 PolarHBondContact O-N 2.91Å; L635-I637 VanDerWaalsContact C-N 3.31Å; L635-I637 PolarHBondContact O-N 3.45Å; L635-C638 WeakPolarHBondContact O-CB 3.18Å; L635-C638 PolarHBondContact O-N 2.8Å; L635-C638 VanDerWaalsContact O-N 3.17Å; L635-N639 PolarHBondContact O-N 2.98Å; L635-N639 PolarHBondContact O-ND2 3.02Å
636	K	93.1	Very high	93	Very high	111 Å²	111	45 Å²	45	48%	0.483	22%	0.221	S	C	.	.	H	α-helix	trans	-59.1	-43.9	175.5	-73.2	162.6	-170.4	164.3	0	111.1	E632 Q633 N639 E640	E632-K636 WeakPolarHBondContact O-CG 3.25Å; E632-K636 PolarHBondContact O-N 3.45Å; E632-K636 WeakPolarHBondContact OE1-CE 3.47Å; E632-K636 IonicContact OE1-NZ 2.62Å; E632-K636 PolarHBondContact OE1-NZ 2.89Å; Q633-K636 WeakPolarHBondContact O-CB 3.44Å; Q633-K636 PolarHBondContact O-N 2.82Å; Q633-K636 VanDerWaalsContact O-N 3.15Å; K636-N639 PolarHBondContact O-N 3.48Å; K636-E640 PolarHBondContact O-N 3.02Å
637	I	94.1	Very high	93.6	Very high	10 Å²	10	43.9 Å²	43.9	5%	0.051	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-43.9	173	-64.3	-57	0	0	0	111.6	Q633 M634 L635 N639 E640 F641 L709 M713 M716	Q633-I637 PolarHBondContact O-N 2.87Å; M634-I637 PolarHBondContact O-N 3.23Å; L635-I637 VanDerWaalsContact C-N 3.31Å; L635-I637 PolarHBondContact O-N 3.45Å; I637-N639 VanDerWaalsContact C-N 3.25Å; I637-N639 PolarHBondContact O-N 3.23Å; I637-E640 WeakPolarHBondContact O-CB 3.44Å; I637-E640 PolarHBondContact O-N 3.03Å; I637-F641 HydrophobicContact CG2-CD2 4.05Å; I637-F641 HydrophobicContact CG2-CE2 3.9Å; I637-F641 WeakPolarHBondContact O-CD2 3.36Å; I637-F641 PolarHBondContact O-N 3.47Å; I637-L709 HydrophobicContact CD1-CD1 3.78Å; I637-L709 HydrophobicContact CG2-CD1 4.37Å; I637-M713 HydrophobicContact CB-SD 4.48Å; I637-M713 HydrophobicContact CD1-SD 4.12Å; I637-M713 HydrophobicContact CG1-SD 4.01Å; I637-M713 HydrophobicContact CG2-SD 3.69Å; I637-M716 HydrophobicContact CB-CE 4.47Å; I637-M716 HydrophobicContact CB-SD 4.18Å; I637-M716 HydrophobicContact CG1-CE 3.74Å; I637-M716 HydrophobicContact CG1-SD 3.45Å; I637-M716 WeakPolarHBondContact CG1-SD 3.5Å
638	C	94.6	Very high	93.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-58	-37.6	175.8	-61.9	0	0	0	0	112.6	S600 L609 M634 L635 F641 V642	S600-C638 VanDerWaalsContact CB-SG 3.6Å; L609-C638 VanDerWaalsContact CD2-SG 3.57Å; M634-C638 PolarHBondContact O-N 2.98Å; M634-C638 VanDerWaalsContact O-N 3.11Å; M634-C638 PolarHBondContact O-SG 3.48Å; L635-C638 WeakPolarHBondContact O-CB 3.18Å; L635-C638 PolarHBondContact O-N 2.8Å; L635-C638 VanDerWaalsContact O-N 3.17Å; C638-F641 WeakPolarHBondContact O-CB 3.18Å; C638-F641 PolarHBondContact O-N 3.2Å; C638-V642 WeakPolarHBondContact O-CG2 3.45Å; C638-V642 PolarHBondContact O-N 3.35Å
639	N	93.8	Very high	94.3	Very high	82 Å²	82	46.9 Å²	46.9	44%	0.439	22%	0.222	S	C	.	.	H	α-helix	trans	-71.4	-31.6	175.6	-77.2	-71.9	0	0	0	112.6	L635 K636 I637 V642 R643	L635-N639 PolarHBondContact O-N 2.98Å; L635-N639 PolarHBondContact O-ND2 3.02Å; K636-N639 PolarHBondContact O-N 3.48Å; I637-N639 VanDerWaalsContact C-N 3.25Å; I637-N639 PolarHBondContact O-N 3.23Å; N639-V642 WeakPolarHBondContact O-CB 3.4Å; N639-V642 PolarHBondContact O-N 3.21Å; N639-R643 WeakPolarHBondContact O-CB 3.35Å; N639-R643 PolarHBondContact O-N 2.89Å
640	E	96.1	Very high	94.7	Very high	54 Å²	54	42.4 Å²	42.4	25%	0.252	20%	0.198	S	C	.	.	H	α-helix	trans	-67.1	-37.4	171.3	-73.7	-65.8	98.1	0	0	112.5	K636 I637 V642 R643 L644 L709	K636-E640 PolarHBondContact O-N 3.02Å; I637-E640 WeakPolarHBondContact O-CB 3.44Å; I637-E640 PolarHBondContact O-N 3.03Å; E640-V642 VanDerWaalsContact C-N 3.33Å; E640-V642 PolarHBondContact O-N 3.44Å; E640-R643 PolarHBondContact O-N 3.19Å; E640-R643 IonicContact OE1-CZ 2.93Å; E640-R643 IonicContact OE1-NE 2.64Å; E640-R643 PolarHBondContact OE1-NE 2.91Å; E640-R643 IonicContact OE1-NH2 2.62Å; E640-R643 IonicContact OE2-CZ 3.56Å; E640-R643 IonicContact OE2-NE 2.71Å; E640-R643 PolarHBondContact OE2-NE 2.96Å; E640-R643 IonicContact OE2-NH2 3.55Å; E640-R643 PolarHBondContact OE2-NH2 3.18Å; E640-L644 WeakPolarHBondContact O-CB 3.28Å; E640-L644 WeakPolarHBondContact O-CG 3.22Å; E640-L644 PolarHBondContact O-N 3Å; E640-L709 HydrophobicContact CB-CD1 3.61Å; E640-L709 HydrophobicContact CB-CD2 4.29Å; E640-L709 HydrophobicContact CG-CD1 4.19Å
641	F	96.3	Very high	95.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57	-46	170.2	-87.7	-90.5	0	0	0	111.6	F594 W598 Y601 I637 C638 Q645 V646 Y651 L709	F594-F641 HydrophobicContact CD1-CZ 4.33Å; F594-F641 AromaticContact CD2-CE2 3.86Å; F594-F641 HydrophobicContact CD2-CE2 3.86Å; F594-F641 AromaticContact CD2-CZ 3.62Å; F594-F641 HydrophobicContact CD2-CZ 3.62Å; F594-F641 HydrophobicContact CE1-CZ 4.07Å; F594-F641 HydrophobicContact CE2-CE1 4.23Å; F594-F641 AromaticContact CE2-CE2 3.78Å; F594-F641 HydrophobicContact CE2-CE2 3.78Å; F594-F641 AromaticContact CE2-CZ 3.31Å; F594-F641 HydrophobicContact CE2-CZ 3.31Å; F594-F641 HydrophobicContact CG-CZ 4.12Å; F594-F641 HydrophobicContact CZ-CE1 4.1Å; F594-F641 HydrophobicContact CZ-CE2 4.44Å; F594-F641 AromaticContact CZ-CZ 3.54Å; F594-F641 HydrophobicContact CZ-CZ 3.54Å; W598-F641 HydrophobicContact CB-CE1 4.31Å; W598-F641 HydrophobicContact CE3-CD1 4.21Å; W598-F641 AromaticContact CE3-CE1 3.96Å; W598-F641 HydrophobicContact CE3-CE1 3.96Å; Y601-F641 HydrophobicContact CD1-CB 4.24Å; Y601-F641 HydrophobicContact CD1-CD1 4.25Å; Y601-F641 HydrophobicContact CD2-CB 4.29Å; Y601-F641 HydrophobicContact CG-CB 3.85Å; I637-F641 HydrophobicContact CG2-CD2 4.05Å; I637-F641 HydrophobicContact CG2-CE2 3.9Å; I637-F641 WeakPolarHBondContact O-CD2 3.36Å; I637-F641 PolarHBondContact O-N 3.47Å; C638-F641 WeakPolarHBondContact O-CB 3.18Å; C638-F641 PolarHBondContact O-N 3.2Å; F641-Q645 WeakPolarHBondContact O-CA 3.36Å; F641-Q645 PolarHBondContact O-N 2.99Å; F641-V646 HydrophobicContact CD1-CB 3.82Å; F641-V646 HydrophobicContact CD1-CG1 4.28Å; F641-V646 HydrophobicContact CD1-CG2 3.83Å; F641-V646 HydrophobicContact CE1-CB 4.3Å; F641-V646 HydrophobicContact CE1-CG1 4.25Å; F641-V646 HydrophobicContact CE1-CG2 4.4Å; F641-V646 HydrophobicContact CG-CG2 4.37Å; F641-V646 PolarHBondContact O-N 3.21Å; F641-Y651 HydrophobicContact CE1-CD2 4.1Å; F641-Y651 HydrophobicContact CZ-CD2 4.31Å; F641-L709 HydrophobicContact CD2-CD2 4.43Å
642	V	95.1	Very high	95.3	Very high	33 Å²	33	41.9 Å²	41.9	20%	0.2	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-49.9	174.9	174.5	0	0	0	0	111.2	Y601 N605 C638 N639 E640 L644 Q645	Y601-V642 HydrophobicContact CD2-CB 4.38Å; Y601-V642 HydrophobicContact CD2-CG2 3.7Å; Y601-V642 HydrophobicContact CE2-CG2 4.26Å; N605-V642 WeakPolarHBondContact ND2-CG1 3.27Å; N605-V642 WeakPolarHBondContact O-CG2 3.21Å; C638-V642 WeakPolarHBondContact O-CG2 3.45Å; C638-V642 PolarHBondContact O-N 3.35Å; N639-V642 WeakPolarHBondContact O-CB 3.4Å; N639-V642 PolarHBondContact O-N 3.21Å; E640-V642 VanDerWaalsContact C-N 3.33Å; E640-V642 PolarHBondContact O-N 3.44Å; V642-L644 PolarHBondContact O-N 3.35Å; V642-Q645 WeakPolarHBondContact O-CG 3.19Å; V642-Q645 PolarHBondContact O-N 3.46Å
643	R	96.1	Very high	95.6	Very high	139 Å²	139	36.9 Å²	36.9	53%	0.525	17%	0.172	S	C	.	.	H	α-helix	trans	-64.9	-36.8	-175.6	-167.8	-171.6	63.5	68.5	-0.3	112.6	N639 E640	N639-R643 WeakPolarHBondContact O-CB 3.35Å; N639-R643 PolarHBondContact O-N 2.89Å; E640-R643 PolarHBondContact O-N 3.19Å; E640-R643 IonicContact OE1-CZ 2.93Å; E640-R643 IonicContact OE1-NE 2.64Å; E640-R643 PolarHBondContact OE1-NE 2.91Å; E640-R643 IonicContact OE1-NH2 2.62Å; E640-R643 IonicContact OE2-CZ 3.56Å; E640-R643 IonicContact OE2-NE 2.71Å; E640-R643 PolarHBondContact OE2-NE 2.96Å; E640-R643 IonicContact OE2-NH2 3.55Å; E640-R643 PolarHBondContact OE2-NH2 3.18Å
644	L	95.3	Very high	95.9	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-88.3	-10.8	178.8	-65.5	-179.9	0	0	0	113.6	E640 V642 V646 R702 Q705 L706 L709	E640-L644 WeakPolarHBondContact O-CB 3.28Å; E640-L644 WeakPolarHBondContact O-CG 3.22Å; E640-L644 PolarHBondContact O-N 3Å; V642-L644 PolarHBondContact O-N 3.35Å; L644-V646 VanDerWaalsContact C-N 3.29Å; L644-V646 HydrophobicContact CB-CG2 3.96Å; L644-V646 PolarHBondContact O-N 3.17Å; L644-R702 PolarHBondContact O-NH1 3.24Å; L644-R702 PolarHBondContact O-NH2 3.27Å; L644-Q705 HydrophobicContact CD1-CB 4.41Å; L644-Q705 HydrophobicContact CD2-CB 3.75Å; L644-Q705 HydrophobicContact CD2-CG 4.09Å; L644-L706 HydrophobicContact CD1-CD2 4.25Å; L644-L709 HydrophobicContact CD1-CB 4.23Å; L644-L709 HydrophobicContact CD1-CD2 4.14Å
645	Q	94.4	Very high	96	Very high	125 Å²	125	35.1 Å²	35.1	58%	0.584	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.8	56.5	-173	-61.8	-179.1	-4	0	0	110.8	F641 V642 S647 R692 R702	F641-Q645 WeakPolarHBondContact O-CA 3.36Å; F641-Q645 PolarHBondContact O-N 2.99Å; V642-Q645 WeakPolarHBondContact O-CG 3.19Å; V642-Q645 PolarHBondContact O-N 3.46Å; Q645-S647 PolarHBondContact O-N 3.47Å; Q645-R692 PolarHBondContact O-NH2 3.49Å; Q645-R702 PolarHBondContact O-NH2 2.93Å
646	V	95.9	Very high	96.2	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	16%	0.157	C	C	.	.			trans	-59.2	125.4	-176.9	-176.5	0	0	0	0	108.5	W598 Y601 F641 L644 E650 M654 L706 L709	W598-V646 WeakPolarHBondContact CZ3-O 3.39Å; Y601-V646 WeakPolarHBondContact CE1-O 3.26Å; F641-V646 HydrophobicContact CD1-CB 3.82Å; F641-V646 HydrophobicContact CD1-CG1 4.28Å; F641-V646 HydrophobicContact CD1-CG2 3.83Å; F641-V646 HydrophobicContact CE1-CB 4.3Å; F641-V646 HydrophobicContact CE1-CG1 4.25Å; F641-V646 HydrophobicContact CE1-CG2 4.4Å; F641-V646 HydrophobicContact CG-CG2 4.37Å; F641-V646 PolarHBondContact O-N 3.21Å; L644-V646 VanDerWaalsContact C-N 3.29Å; L644-V646 HydrophobicContact CB-CG2 3.96Å; L644-V646 PolarHBondContact O-N 3.17Å; V646-E650 HydrophobicContact CG1-CB 4.12Å; V646-M654 HydrophobicContact CG1-SD 4.2Å; V646-L706 HydrophobicContact CG1-CD2 4.39Å; V646-L706 HydrophobicContact CG2-CD2 3.89Å; V646-L709 HydrophobicContact CG2-CD2 4.43Å
647	S	95.8	Very high	96.5	Very high	30 Å²	30	28.6 Å²	28.6	21%	0.21	13%	0.134	C	C	.	.			trans	-82.2	155.1	175.1	66.8	0	0	0	0	110.8	Q645 D649 E650 Y651	Q645-S647 PolarHBondContact O-N 3.47Å; S647-D649 PolarHBondContact O-N 3.38Å; S647-E650 WeakPolarHBondContact CB-OE2 3.23Å; S647-E650 PolarHBondContact N-OE2 2.79Å; S647-E650 WeakPolarHBondContact O-CB 3.4Å; S647-E650 PolarHBondContact O-N 3.03Å; S647-E650 WeakPolarHBondContact OG-CG 3.46Å; S647-E650 PolarHBondContact OG-OE2 3.12Å; S647-Y651 PolarHBondContact O-N 3.07Å
648	Y	96.6	Very high	96.7	Very high	79 Å²	79	28.1 Å²	28.1	31%	0.31	13%	0.132	S	C	.	.	H	α-helix	trans	-58	-32.7	178.8	-172.8	-125.9	0	0	0	112.7	K525 W598 E650 Y651 L652	K525-Y648 HydrophobicContact CD-CE1 4.36Å; K525-Y648 HydrophobicContact CG-CE1 4.03Å; W598-Y648 AromaticContact CE2-CD2 3.89Å; W598-Y648 HydrophobicContact CH2-CD2 4.15Å; W598-Y648 HydrophobicContact CH2-CG 4.46Å; W598-Y648 AromaticContact CZ2-CD2 3.67Å; W598-Y648 HydrophobicContact CZ2-CD2 3.67Å; W598-Y648 HydrophobicContact CZ2-CG 4.21Å; Y648-E650 VanDerWaalsContact C-N 3.31Å; Y648-E650 PolarHBondContact O-N 2.87Å; Y648-Y651 AromaticContact CD2-CD1 3.7Å; Y648-Y651 HydrophobicContact CD2-CD1 3.7Å; Y648-Y651 HydrophobicContact CD2-CE1 4.25Å; Y648-Y651 AromaticContact CE2-CD1 3.82Å; Y648-Y651 HydrophobicContact CE2-CD1 3.82Å; Y648-Y651 AromaticContact CE2-CE1 3.92Å; Y648-Y651 HydrophobicContact CE2-CE1 3.92Å; Y648-L652 HydrophobicContact CD1-CD1 4.09Å; Y648-L652 HydrophobicContact CD2-CG 4.44Å; Y648-L652 HydrophobicContact CE1-CD1 3.81Å; Y648-L652 HydrophobicContact CE2-CD1 4.33Å; Y648-L652 HydrophobicContact CE2-CD2 4.18Å; Y648-L652 HydrophobicContact CE2-CG 4.16Å; Y648-L652 HydrophobicContact CG-CD1 4.48Å; Y648-L652 VanDerWaalsContact O-CG 3.32Å; Y648-L652 WeakPolarHBondContact O-CG 3.47Å; Y648-L652 PolarHBondContact O-N 3.05Å; Y648-L652 VanDerWaalsContact O-N 3.12Å
649	D	96.8	Very high	96.8	Very high	21 Å²	21	28.1 Å²	28.1	11%	0.112	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-33.3	175.3	-69.1	2.9	0	0	0	112.8	L521 K525 S647 A688 K691	L521-D649 HydrophobicContact CD1-CB 3.93Å; L521-D649 HydrophobicContact CD2-CB 4.1Å; K525-D649 WeakPolarHBondContact CE-OD1 3.31Å; K525-D649 IonicContact NZ-OD1 3.37Å; K525-D649 PolarHBondContact NZ-OD1 2.95Å; S647-D649 PolarHBondContact O-N 3.38Å; D649-A688 HydrophobicContact CB-CB 4.16Å; D649-K691 IonicContact OD2-NZ 2.7Å; D649-K691 PolarHBondContact OD2-NZ 3.37Å
650	E	97.6	Very high	96.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-81.1	-44	177.6	-66.8	159.2	145.3	0	0	110.8	V646 S647 Y648 L652 C653 M654 L685 A688 I689 R692 R702 L706	V646-E650 HydrophobicContact CG1-CB 4.12Å; S647-E650 WeakPolarHBondContact CB-OE2 3.23Å; S647-E650 PolarHBondContact N-OE2 2.79Å; S647-E650 WeakPolarHBondContact O-CB 3.4Å; S647-E650 PolarHBondContact O-N 3.03Å; S647-E650 WeakPolarHBondContact OG-CG 3.46Å; S647-E650 PolarHBondContact OG-OE2 3.12Å; Y648-E650 VanDerWaalsContact C-N 3.31Å; Y648-E650 PolarHBondContact O-N 2.87Å; E650-L652 VanDerWaalsContact C-N 3.32Å; E650-L652 PolarHBondContact O-N 3.22Å; E650-C653 PolarHBondContact O-N 2.87Å; E650-M654 WeakPolarHBondContact O-CB 3.37Å; E650-M654 VanDerWaalsContact O-CG 3.23Å; E650-M654 WeakPolarHBondContact O-CG 3.48Å; E650-M654 PolarHBondContact O-N 3.49Å; E650-L685 HydrophobicContact CB-CD1 4.15Å; E650-L685 HydrophobicContact CG-CD1 4.32Å; E650-A688 HydrophobicContact CG-CB 4.09Å; E650-I689 HydrophobicContact CG-CG1 4.35Å; E650-R692 WeakPolarHBondContact OE1-CD 3.5Å; E650-R692 VanDerWaalsContact OE2-CD 3.3Å; E650-R692 WeakPolarHBondContact OE2-CD 3.26Å; E650-R692 IonicContact OE2-NE 2.72Å; E650-R702 IonicContact OE1-CZ 3.13Å; E650-R702 IonicContact OE1-NE 2.68Å; E650-R702 PolarHBondContact OE1-NE 3.1Å; E650-R702 IonicContact OE1-NH2 2.75Å; E650-R702 PolarHBondContact OE1-NH2 3.01Å; E650-R702 IonicContact OE2-CZ 3.12Å; E650-R702 IonicContact OE2-NE 3.54Å; E650-R702 IonicContact OE2-NH2 2.79Å; E650-R702 PolarHBondContact OE2-NH2 3.31Å; E650-L706 HydrophobicContact CB-CD1 4.15Å; E650-L706 HydrophobicContact CG-CD1 4.02Å
651	Y	98.3	Very high	96.8	Very high	5 Å²	5	21.9 Å²	21.9	2%	0.02	10%	0.1	C	C	.	.	H	α-helix	trans	-52.5	-46.7	175.4	158.4	-99.4	0	0	0	112	E528 F594 W598 F641 S647 Y648 C653 M654 K655	E528-Y651 PolarHBondContact OE1-OH 2.94Å; F594-Y651 AromaticContact CD1-CD2 3.8Å; F594-Y651 HydrophobicContact CD1-CD2 3.8Å; F594-Y651 AromaticContact CD1-CE2 3.66Å; F594-Y651 HydrophobicContact CD1-CE2 3.66Å; F594-Y651 AromaticContact CE1-CD2 3.35Å; F594-Y651 HydrophobicContact CE1-CD2 3.35Å; F594-Y651 AromaticContact CE1-CE2 3.74Å; F594-Y651 HydrophobicContact CE1-CE2 3.74Å; F594-Y651 HydrophobicContact CE1-CG 4.35Å; F594-Y651 HydrophobicContact CZ-CD2 4.13Å; W598-Y651 HydrophobicContact CB-CD2 3.71Å; W598-Y651 HydrophobicContact CB-CE2 3.42Å; W598-Y651 VanDerWaalsContact CB-CE2 3.42Å; W598-Y651 HydrophobicContact CB-CG 4.39Å; W598-Y651 AromaticContact CD2-CD1 3.98Å; W598-Y651 HydrophobicContact CD2-CD1 3.98Å; W598-Y651 HydrophobicContact CD2-CD2 4.02Å; W598-Y651 HydrophobicContact CD2-CE1 4.35Å; W598-Y651 HydrophobicContact CD2-CE2 4.39Å; W598-Y651 AromaticContact CD2-CG 3.81Å; W598-Y651 HydrophobicContact CD2-CG 3.81Å; W598-Y651 HydrophobicContact CE3-CD1 4.09Å; W598-Y651 AromaticContact CE3-CD2 3.81Å; W598-Y651 HydrophobicContact CE3-CD2 3.81Å; W598-Y651 AromaticContact CE3-CG 3.52Å; W598-Y651 HydrophobicContact CE3-CG 3.52Å; W598-Y651 HydrophobicContact CG-CD1 4.23Å; W598-Y651 AromaticContact CG-CD2 3.97Å; W598-Y651 HydrophobicContact CG-CD2 3.97Å; W598-Y651 HydrophobicContact CG-CE1 4.14Å; W598-Y651 AromaticContact CG-CE2 3.87Å; W598-Y651 HydrophobicContact CG-CE2 3.87Å; W598-Y651 HydrophobicContact CG-CG 4.15Å; W598-Y651 AromaticContact CG-CZ 3.95Å; W598-Y651 HydrophobicContact CZ3-CG 4.21Å; F641-Y651 HydrophobicContact CE1-CD2 4.1Å; F641-Y651 HydrophobicContact CZ-CD2 4.31Å; S647-Y651 PolarHBondContact O-N 3.07Å; Y648-Y651 AromaticContact CD2-CD1 3.7Å; Y648-Y651 HydrophobicContact CD2-CD1 3.7Å; Y648-Y651 HydrophobicContact CD2-CE1 4.25Å; Y648-Y651 AromaticContact CE2-CD1 3.82Å; Y648-Y651 HydrophobicContact CE2-CD1 3.82Å; Y648-Y651 AromaticContact CE2-CE1 3.92Å; Y648-Y651 HydrophobicContact CE2-CE1 3.92Å; Y651-C653 PolarHBondContact O-N 2.77Å; Y651-M654 PolarHBondContact O-N 2.8Å; Y651-K655 HydrophobicContact CE1-CD 4.41Å; Y651-K655 HydrophobicContact CE2-CD 4.5Å; Y651-K655 VanDerWaalsContact O-CB 3.31Å; Y651-K655 WeakPolarHBondContact O-CB 3.49Å; Y651-K655 PolarHBondContact O-N 2.67Å
652	L	98.2	Very high	96.5	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.016	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-44.4	179.7	-71.5	168.6	0	0	0	112.4	L521 L524 K525 E528 Y648 E650 V656	L521-L652 HydrophobicContact CD1-CD1 4.43Å; L524-L652 HydrophobicContact CB-CB 4.23Å; L524-L652 HydrophobicContact CB-CD1 4.38Å; L524-L652 HydrophobicContact CD1-CB 4.33Å; K525-L652 HydrophobicContact CB-CD1 4.44Å; K525-L652 HydrophobicContact CD-CD1 4.42Å; K525-L652 HydrophobicContact CG-CD1 3.39Å; E528-L652 HydrophobicContact CB-CD2 4.3Å; E528-L652 HydrophobicContact CG-CD2 4.27Å; Y648-L652 HydrophobicContact CD1-CD1 4.09Å; Y648-L652 HydrophobicContact CD2-CG 4.44Å; Y648-L652 HydrophobicContact CE1-CD1 3.81Å; Y648-L652 HydrophobicContact CE2-CD1 4.33Å; Y648-L652 HydrophobicContact CE2-CD2 4.18Å; Y648-L652 HydrophobicContact CE2-CG 4.16Å; Y648-L652 HydrophobicContact CG-CD1 4.48Å; Y648-L652 VanDerWaalsContact O-CG 3.32Å; Y648-L652 WeakPolarHBondContact O-CG 3.47Å; Y648-L652 PolarHBondContact O-N 3.05Å; Y648-L652 VanDerWaalsContact O-N 3.12Å; E650-L652 VanDerWaalsContact C-N 3.32Å; E650-L652 PolarHBondContact O-N 3.22Å; L652-V656 WeakPolarHBondContact O-CG2 3.25Å; L652-V656 PolarHBondContact O-N 3.42Å
653	C	98.3	Very high	96.4	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.007	10%	0.096	C	C	.	.	H	α-helix	trans	-66.4	-41.8	175.8	-66.3	0	0	0	0	111.8	E650 Y651 V656 L657 L685	E650-C653 PolarHBondContact O-N 2.87Å; Y651-C653 PolarHBondContact O-N 2.77Å; C653-V656 PolarHBondContact O-N 2.92Å; C653-L657 WeakPolarHBondContact O-CG 3.45Å; C653-L657 PolarHBondContact O-N 3.36Å; C653-L657 VanDerWaalsContact O-N 3.1Å; C653-L685 HydrophobicContact CB-CB 3.91Å; C653-L685 HydrophobicContact CB-CD1 4.13Å
654	M	98.5	Very high	96.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.4	-41.4	177.5	-74.6	175.2	76.7	0	0	112.5	F594 V646 E650 Y651 V656 L657 L658 L685 L706 L709 L710	F594-M654 HydrophobicContact CE1-CB 3.79Å; F594-M654 HydrophobicContact CE2-CE 4.11Å; F594-M654 HydrophobicContact CZ-CB 3.53Å; F594-M654 HydrophobicContact CZ-CE 3.86Å; F594-M654 HydrophobicContact CZ-CG 4.46Å; F594-M654 HydrophobicContact CZ-SD 4.25Å; V646-M654 HydrophobicContact CG1-SD 4.2Å; E650-M654 WeakPolarHBondContact O-CB 3.37Å; E650-M654 VanDerWaalsContact O-CG 3.23Å; E650-M654 WeakPolarHBondContact O-CG 3.48Å; E650-M654 PolarHBondContact O-N 3.49Å; Y651-M654 PolarHBondContact O-N 2.8Å; M654-V656 VanDerWaalsContact C-N 3.32Å; M654-V656 PolarHBondContact O-N 3.32Å; M654-L657 PolarHBondContact O-N 2.92Å; M654-L657 VanDerWaalsContact O-N 3.08Å; M654-L658 PolarHBondContact O-N 3.27Å; M654-L658 VanDerWaalsContact O-N 3.08Å; M654-L685 HydrophobicContact CG-CD1 4.04Å; M654-L685 HydrophobicContact CG-CD2 4.21Å; M654-L706 HydrophobicContact CE-CB 4.06Å; M654-L706 HydrophobicContact CE-CD2 4.23Å; M654-L706 VanDerWaalsContact CE-O 3.25Å; M654-L706 WeakPolarHBondContact CE-O 3.28Å; M654-L706 HydrophobicContact SD-CB 3.92Å; M654-L706 HydrophobicContact SD-CD1 4.47Å; M654-L706 HydrophobicContact SD-CD2 3.8Å; M654-L706 HydrophobicContact SD-CG 4.26Å; M654-L709 HydrophobicContact CE-CB 4.24Å; M654-L709 HydrophobicContact CE-CD2 4.14Å; M654-L709 HydrophobicContact CE-CG 4.31Å; M654-L710 HydrophobicContact CB-CD2 3.94Å; M654-L710 HydrophobicContact CE-CD2 3.86Å; M654-L710 HydrophobicContact CE-CG 4Å; M654-L710 HydrophobicContact CG-CD1 4.47Å; M654-L710 HydrophobicContact CG-CD2 4.29Å
655	K	98.1	Very high	95.8	Very high	10 Å²	10	22 Å²	22	4%	0.043	11%	0.105	C	C	.	.	H	α-helix	trans	-59.1	-41.3	176.4	-171.7	-173.6	-177.8	-176.7	0	111.9	E528 W565 L591 F594 Y651 L658 L659	E528-K655 IonicContact OE1-NZ 3.47Å; E528-K655 PolarHBondContact OE1-NZ 2.81Å; E528-K655 IonicContact OE2-NZ 3.55Å; E528-K655 PolarHBondContact OE2-NZ 3.03Å; W565-K655 HydrophobicContact CH2-CD 4.15Å; W565-K655 HydrophobicContact CH2-CG 3.82Å; W565-K655 HydrophobicContact CZ2-CB 4.41Å; W565-K655 HydrophobicContact CZ2-CD 3.71Å; W565-K655 HydrophobicContact CZ2-CG 3.82Å; L591-K655 HydrophobicContact CD2-CG 3.93Å; L591-K655 WeakPolarHBondContact CD2-O 3.31Å; F594-K655 HydrophobicContact CD1-CB 4.08Å; F594-K655 HydrophobicContact CD1-CG 4.45Å; F594-K655 HydrophobicContact CE1-CB 4.14Å; Y651-K655 HydrophobicContact CE1-CD 4.41Å; Y651-K655 HydrophobicContact CE2-CD 4.5Å; Y651-K655 VanDerWaalsContact O-CB 3.31Å; Y651-K655 WeakPolarHBondContact O-CB 3.49Å; Y651-K655 PolarHBondContact O-N 2.67Å; K655-L658 PolarHBondContact O-N 3.13Å; K655-L659 PolarHBondContact O-N 3.33Å
656	V	98.3	Very high	95.4	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-68.7	-35.9	174.2	-178.4	0	0	0	0	111.8	L524 W565 L569 L652 C653 M654 L658 L659 L660 Y681	L524-V656 HydrophobicContact CD2-CG2 3.87Å; W565-V656 HydrophobicContact CH2-CG2 4.01Å; W565-V656 HydrophobicContact CZ2-CG2 3.68Å; L569-V656 HydrophobicContact CD1-CG1 4Å; L569-V656 HydrophobicContact CD1-CG2 4.1Å; L569-V656 HydrophobicContact CD2-CG1 4.33Å; L569-V656 HydrophobicContact CD2-CG2 3.52Å; L652-V656 WeakPolarHBondContact O-CG2 3.25Å; L652-V656 PolarHBondContact O-N 3.42Å; C653-V656 PolarHBondContact O-N 2.92Å; M654-V656 VanDerWaalsContact C-N 3.32Å; M654-V656 PolarHBondContact O-N 3.32Å; V656-L658 PolarHBondContact O-N 2.76Å; V656-L659 WeakPolarHBondContact O-CB 3.4Å; V656-L659 PolarHBondContact O-N 2.63Å; V656-L660 HydrophobicContact CG1-CD1 4.11Å; V656-L660 WeakPolarHBondContact O-CG 3.31Å; V656-L660 PolarHBondContact O-N 3.41Å; V656-Y681 HydrophobicContact CB-CD1 4.18Å; V656-Y681 HydrophobicContact CB-CG 4.19Å; V656-Y681 HydrophobicContact CG1-CD1 3.82Å; V656-Y681 HydrophobicContact CG1-CD2 3.43Å; V656-Y681 VanDerWaalsContact CG1-CD2 3.43Å; V656-Y681 HydrophobicContact CG1-CE1 4.04Å; V656-Y681 HydrophobicContact CG1-CE2 3.66Å; V656-Y681 HydrophobicContact CG1-CG 3.53Å; V656-Y681 HydrophobicContact CG2-CD1 4.47Å; V656-Y681 HydrophobicContact CG2-CE1 4.46Å
657	L	98.3	Very high	95.1	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-68.5	-19.8	176	-66.9	172	0	0	0	113.7	C653 M654 L660 S661 R678 I682 L685 L710 F762	C653-L657 WeakPolarHBondContact O-CG 3.45Å; C653-L657 PolarHBondContact O-N 3.36Å; C653-L657 VanDerWaalsContact O-N 3.1Å; M654-L657 PolarHBondContact O-N 2.92Å; M654-L657 VanDerWaalsContact O-N 3.08Å; L657-L660 CarbonylContact O-C 3.22Å; L657-S661 WeakPolarHBondContact O-CB 3.39Å; L657-S661 PolarHBondContact O-N 3.1Å; L657-R678 HydrophobicContact CD2-CG 4.34Å; L657-R678 PolarHBondContact O-NH1 3.28Å; L657-I682 HydrophobicContact CD1-CG1 4.29Å; L657-I682 HydrophobicContact CD2-CG1 3.73Å; L657-L685 HydrophobicContact CD1-CB 4.37Å; L657-L685 HydrophobicContact CD1-CD2 3.85Å; L657-L710 HydrophobicContact CB-CD1 3.96Å; L657-L710 HydrophobicContact CD1-CD1 4.16Å; L657-F762 HydrophobicContact CB-CZ 4.44Å; L657-F762 HydrophobicContact CD1-CZ 4.19Å
658	L	97.7	Very high	94.9	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-79.8	-37.1	169.7	-69.1	177.9	0	0	0	113.5	S587 F590 L591 F594 M654 K655 V656 L660 S661 L710 M713	S587-L658 WeakPolarHBondContact CB-O 3.3Å; F590-L658 HydrophobicContact CB-CB 4.16Å; F590-L658 HydrophobicContact CB-CD1 4.43Å; F590-L658 HydrophobicContact CD1-CD2 3.97Å; L591-L658 HydrophobicContact CD2-CB 4.48Å; F594-L658 HydrophobicContact CB-CD1 3.49Å; F594-L658 VanDerWaalsContact CB-CD1 3.49Å; F594-L658 HydrophobicContact CD1-CD1 3.82Å; F594-L658 HydrophobicContact CD2-CD1 3.64Å; F594-L658 HydrophobicContact CE1-CD1 4.44Å; F594-L658 HydrophobicContact CE2-CD1 4.29Å; F594-L658 HydrophobicContact CG-CD1 3.38Å; M654-L658 PolarHBondContact O-N 3.27Å; M654-L658 VanDerWaalsContact O-N 3.08Å; K655-L658 PolarHBondContact O-N 3.13Å; V656-L658 PolarHBondContact O-N 2.76Å; L658-L660 PolarHBondContact O-N 2.75Å; L658-S661 PolarHBondContact O-N 3.04Å; L658-S661 PolarHBondContact O-OG 3.27Å; L658-L710 HydrophobicContact CD1-CD2 4.24Å; L658-L710 HydrophobicContact CD2-CB 4.47Å; L658-L710 HydrophobicContact CD2-CD2 3.73Å; L658-L710 HydrophobicContact CG-CD2 3.75Å; L658-M713 HydrophobicContact CD1-CE 4.31Å; L658-M713 HydrophobicContact CD1-CG 4.43Å; L658-M713 HydrophobicContact CD2-CB 4.32Å; L658-M713 HydrophobicContact CD2-CG 4.4Å
659	L	97.5	Very high	94.8	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-56.1	-30	166.9	173.6	63	0	0	0	111.3	W565 A566 L569 F572 L583 L584 S587 L591 K655 V656	W565-L659 HydrophobicContact CH2-CB 4.44Å; W565-L659 HydrophobicContact CH2-CD2 4.45Å; W565-L659 HydrophobicContact CZ3-CB 4.25Å; W565-L659 HydrophobicContact CZ3-CD2 3.92Å; A566-L659 HydrophobicContact CB-CD2 3.9Å; L569-L659 HydrophobicContact CD1-CD2 3.41Å; L569-L659 VanDerWaalsContact CD1-CD2 3.41Å; F572-L659 HydrophobicContact CD2-CD2 3.93Å; F572-L659 HydrophobicContact CE2-CD1 4.17Å; F572-L659 HydrophobicContact CE2-CD2 3.74Å; F572-L659 HydrophobicContact CE2-CG 4.1Å; F572-L659 HydrophobicContact CZ-CD1 4.46Å; F572-L659 HydrophobicContact CZ-CD2 4.41Å; L583-L659 HydrophobicContact CB-CD1 4.39Å; L584-L659 HydrophobicContact CD2-CD1 3.87Å; L584-L659 HydrophobicContact CG-CD1 4.19Å; S587-L659 WeakPolarHBondContact OG-CD1 3.42Å; L591-L659 HydrophobicContact CD1-CD1 4.43Å; L591-L659 HydrophobicContact CD2-CB 4.34Å; K655-L659 PolarHBondContact O-N 3.33Å; V656-L659 WeakPolarHBondContact O-CB 3.4Å; V656-L659 PolarHBondContact O-N 2.63Å
660	L	96.4	Very high	94.7	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	17.4	-177.9	-54.4	171.9	0	0	0	113.1	L583 V656 L657 L658 F674 I677 R678 Y681	L583-L660 HydrophobicContact CD1-CD2 4.24Å; V656-L660 HydrophobicContact CG1-CD1 4.11Å; V656-L660 WeakPolarHBondContact O-CG 3.31Å; V656-L660 PolarHBondContact O-N 3.41Å; L657-L660 CarbonylContact O-C 3.22Å; L658-L660 PolarHBondContact O-N 2.75Å; L660-F674 HydrophobicContact CB-CE2 3.9Å; L660-F674 HydrophobicContact CB-CZ 4.23Å; L660-F674 HydrophobicContact CD2-CD2 3.9Å; L660-F674 HydrophobicContact CD2-CE2 3.65Å; L660-F674 HydrophobicContact CG-CE2 4.37Å; L660-F674 WeakPolarHBondContact O-CZ 3.42Å; L660-I677 HydrophobicContact CD1-CG2 3.8Å; L660-R678 HydrophobicContact CB-CB 4.43Å; L660-R678 HydrophobicContact CB-CG 4.36Å; L660-R678 HydrophobicContact CD1-CB 4.14Å; L660-R678 PolarHBondContact O-NH1 2.85Å; L660-Y681 HydrophobicContact CD1-CD2 4.13Å
661	S	92.6	Very high	94.6	Very high	4 Å²	4	31 Å²	31	3%	0.028	15%	0.153	C	C	.	.	S	Bend	trans	-94.8	-9.1	-174.4	66.4	0	0	0	0	116	L657 L658 Q714 L760	L657-S661 WeakPolarHBondContact O-CB 3.39Å; L657-S661 PolarHBondContact O-N 3.1Å; L658-S661 PolarHBondContact O-N 3.04Å; L658-S661 PolarHBondContact O-OG 3.27Å; S661-Q714 PolarHBondContact OG-NE2 2.68Å; S661-L760 WeakPolarHBondContact O-CB 3.49Å; S661-L760 PolarHBondContact O-N 2.87Å
662	T	91.4	Very high	94.5	Very high	11 Å²	11	34.6 Å²	34.6	7%	0.067	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	126.4	-171.6	-48.9	0	0	0	0	109.6	C586 V757	C586-T662 HydrophobicContact CB-CG2 3.92Å; T662-V757 HydrophobicContact CG2-CB 4.3Å
663	V	92.2	Very high	94.4	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	161.2	-174.3	-62.3	0	0	0	0	111.3	L583 L668 F674 V757 K758 L760	L583-V663 HydrophobicContact CD2-CG1 4.16Å; V663-L668 HydrophobicContact CB-CG 4.42Å; V663-L668 HydrophobicContact CG1-CD1 3.9Å; V663-L668 HydrophobicContact CG1-CG 4.25Å; V663-F674 HydrophobicContact CG1-CE1 4.06Å; V663-F674 HydrophobicContact CG1-CE2 4.04Å; V663-F674 HydrophobicContact CG1-CZ 3.59Å; V663-V757 CarbonylContact O-C 3.57Å; V663-K758 PolarHBondContact N-O 3.25Å; V663-K758 PolarHBondContact O-N 3.26Å; V663-L760 HydrophobicContact CG1-CD1 3.82Å; V663-L760 HydrophobicContact CG1-CG 4.48Å; V663-L760 HydrophobicContact CG2-CD1 4.03Å; V663-L760 HydrophobicContact CG2-CD2 3.9Å; V663-L760 HydrophobicContact CG2-CG 3.98Å
664	P	90.4	Very high	94.4	Very high	17 Å²	17	36.7 Å²	36.7	11%	0.11	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	150.8	169.8	-22.1	34.8	0	0	0	112.5	T582 E666 G667 L668	T582-P664 HydrophobicContact CG2-CG 3.68Å; P664-E666 VanDerWaalsContact C-N 3.25Å; P664-E666 HydrophobicContact CB-CG 3.72Å; P664-E666 PolarHBondContact O-N 3.04Å; P664-G667 PolarHBondContact O-N 3.31Å; P664-G667 VanDerWaalsContact O-N 3.09Å; P664-L668 HydrophobicContact CG-CD2 4.29Å
665	K	87.6	Confident	94.3	Very high	143 Å²	143	40.2 Å²	40.2	62%	0.622	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.9	172.9	-83.3	-178.5	173.9	164.5	0	112.9	G667 G755 S756 K758	K665-G667 PolarHBondContact O-N 3.07Å; K665-G755 VanDerWaalsContact CD-O 3.26Å; K665-G755 WeakPolarHBondContact CD-O 3.46Å; K665-G755 WeakPolarHBondContact CE-O 3.31Å; K665-G755 PolarHBondContact NZ-O 3.38Å; K665-S756 WeakPolarHBondContact CB-O 3.35Å; K665-S756 WeakPolarHBondContact CG-O 3.35Å; K665-S756 PolarHBondContact N-O 2.94Å; K665-K758 HydrophobicContact CG-CB 4.17Å
666	E	86.9	Confident	94.2	Very high	183 Å²	183	46.1 Å²	46.1	86%	0.855	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.4	173.3	62.4	-163.2	155.5	0	0	113.5	P664	P664-E666 VanDerWaalsContact C-N 3.25Å; P664-E666 HydrophobicContact CB-CG 3.72Å; P664-E666 PolarHBondContact O-N 3.04Å
667	G	89.5	Confident	94.2	Very high	26 Å²	26	46.7 Å²	46.7	27%	0.268	25%	0.246	S	C	.	.			trans	92.1	-173.8	-176.3	0	0	0	0	0	113.3	P664 K665	P664-G667 PolarHBondContact O-N 3.31Å; P664-G667 VanDerWaalsContact O-N 3.09Å; K665-G667 PolarHBondContact O-N 3.07Å
668	L	92.7	Very high	94.1	Very high	15 Å²	15	47.7 Å²	47.7	8%	0.079	25%	0.25	C	S	.	.			trans	-106.8	150.1	172.8	-65.4	172.9	0	0	0	110.3	D579 L583 V663 P664 S670 Q671 F674	D579-L668 HydrophobicContact CB-CD2 4.18Å; L583-L668 HydrophobicContact CD1-CD1 4.33Å; L583-L668 HydrophobicContact CD2-CD1 4.27Å; L583-L668 HydrophobicContact CG-CD1 4.48Å; V663-L668 HydrophobicContact CB-CG 4.42Å; V663-L668 HydrophobicContact CG1-CD1 3.9Å; V663-L668 HydrophobicContact CG1-CG 4.25Å; P664-L668 HydrophobicContact CG-CD2 4.29Å; L668-S670 PolarHBondContact O-N 3.21Å; L668-Q671 PolarHBondContact O-N 2.88Å; L668-F674 HydrophobicContact CD1-CB 3.78Å; L668-F674 HydrophobicContact CD1-CD1 4Å; L668-F674 HydrophobicContact CD1-CD2 3.4Å; L668-F674 VanDerWaalsContact CD1-CD2 3.4Å; L668-F674 HydrophobicContact CD1-CE1 4.45Å; L668-F674 HydrophobicContact CD1-CE2 3.91Å; L668-F674 HydrophobicContact CD1-CG 3.44Å; L668-F674 VanDerWaalsContact CD1-CG 3.44Å; L668-F674 HydrophobicContact CD1-CZ 4.4Å
669	K	94.6	Very high	94.1	Very high	137 Å²	137	51.9 Å²	51.9	60%	0.596	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-33.1	176.4	-64.7	-178.5	172	-174.6	0	111.5	H576 D578 D579	H576-K669 HydrophobicContact CB-CB 4.14Å; H576-K669 HydrophobicContact CB-CD 4.43Å; D578-K669 IonicContact OD2-NZ 3.36Å; D578-K669 PolarHBondContact OD2-NZ 2.86Å; D579-K669 PolarHBondContact OD1-N 2.98Å; D579-K669 PolarHBondContact OD2-N 3.08Å
670	S	93.8	Very high	94.1	Very high	21 Å²	21	53.8 Å²	53.8	15%	0.147	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	32.9	-177.2	-36.5	0	0	0	0	112.7	H576 D579 L668 A672 V673 F674	H576-S670 WeakPolarHBondContact CB-OG 3.12Å; H576-S670 PolarHBondContact N-OG 3.3Å; D579-S670 WeakPolarHBondContact OD2-CB 3.3Å; D579-S670 PolarHBondContact OD2-N 3.17Å; D579-S670 PolarHBondContact OD2-OG 2.8Å; L668-S670 PolarHBondContact O-N 3.21Å; S670-A672 VanDerWaalsContact C-N 3.31Å; S670-A672 PolarHBondContact O-N 3.29Å; S670-A672 VanDerWaalsContact O-N 3.1Å; S670-V673 WeakPolarHBondContact O-CA 3.25Å; S670-V673 WeakPolarHBondContact O-CB 3.36Å; S670-V673 PolarHBondContact O-N 3.3Å; S670-F674 PolarHBondContact O-N 2.95Å
671	Q	95.5	Very high	94.2	Very high	62 Å²	62	53.8 Å²	53.8	29%	0.29	28%	0.283	S	S	.	.	H	α-helix	trans	-45.7	-47	-169.4	-172.2	59.3	51.8	0	0	114.5	L668 V673 F674 D675	L668-Q671 PolarHBondContact O-N 2.88Å; Q671-V673 VanDerWaalsContact C-N 3.35Å; Q671-V673 PolarHBondContact O-N 2.91Å; Q671-F674 WeakPolarHBondContact O-CB 3.45Å; Q671-F674 PolarHBondContact O-N 3.48Å; Q671-D675 VanDerWaalsContact NE2-CG 3.33Å; Q671-D675 PolarHBondContact NE2-OD1 3.43Å; Q671-D675 PolarHBondContact NE2-OD2 3.24Å; Q671-D675 PolarHBondContact O-N 2.89Å
672	A	95.7	Very high	94.4	Very high	81 Å²	81	55.5 Å²	55.5	67%	0.669	29%	0.291	S	S	*	.	H	α-helix	trans	-62.6	-37.7	179.4	0	0	0	0	0	113.5	S670 D675 E676	S670-A672 VanDerWaalsContact C-N 3.31Å; S670-A672 PolarHBondContact O-N 3.29Å; S670-A672 VanDerWaalsContact O-N 3.1Å; A672-D675 PolarHBondContact O-N 3.05Å; A672-E676 PolarHBondContact O-N 2.94Å
673	V	96.4	Very high	94.7	Very high	48 Å²	48	60.5 Å²	60.5	29%	0.291	31%	0.312	S	S	.	.	H	α-helix	trans	-70.3	-41.7	176.4	179.7	0	0	0	0	110	N574 L575 S670 Q671 D675 E676 I677	N574-V673 HydrophobicContact CB-CG1 3.95Å; L575-V673 HydrophobicContact CD2-CB 4.06Å; L575-V673 HydrophobicContact CD2-CG1 3.89Å; S670-V673 WeakPolarHBondContact O-CA 3.25Å; S670-V673 WeakPolarHBondContact O-CB 3.36Å; S670-V673 PolarHBondContact O-N 3.3Å; Q671-V673 VanDerWaalsContact C-N 3.35Å; Q671-V673 PolarHBondContact O-N 2.91Å; V673-D675 PolarHBondContact O-N 2.94Å; V673-E676 PolarHBondContact O-N 2.7Å; V673-I677 HydrophobicContact CG1-CD1 3.81Å; V673-I677 HydrophobicContact CG1-CG1 4.46Å; V673-I677 WeakPolarHBondContact O-CB 3.47Å; V673-I677 WeakPolarHBondContact O-CD1 3.44Å; V673-I677 WeakPolarHBondContact O-CG1 3.31Å; V673-I677 PolarHBondContact O-N 3.26Å
674	F	97.4	Very high	94.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.5	-45.3	173.5	168.2	-90.8	0	0	0	112.1	L575 L583 L660 V663 L668 S670 Q671 I677 R678 L760	L575-F674 HydrophobicContact CD2-CB 3.89Å; L583-F674 HydrophobicContact CD1-CD2 3.92Å; L583-F674 HydrophobicContact CD1-CE2 4.15Å; L583-F674 HydrophobicContact CD2-CD2 4.22Å; L583-F674 HydrophobicContact CD2-CE2 3.67Å; L660-F674 HydrophobicContact CB-CE2 3.9Å; L660-F674 HydrophobicContact CB-CZ 4.23Å; L660-F674 HydrophobicContact CD2-CD2 3.9Å; L660-F674 HydrophobicContact CD2-CE2 3.65Å; L660-F674 HydrophobicContact CG-CE2 4.37Å; L660-F674 WeakPolarHBondContact O-CZ 3.42Å; V663-F674 HydrophobicContact CG1-CE1 4.06Å; V663-F674 HydrophobicContact CG1-CE2 4.04Å; V663-F674 HydrophobicContact CG1-CZ 3.59Å; L668-F674 HydrophobicContact CD1-CB 3.78Å; L668-F674 HydrophobicContact CD1-CD1 4Å; L668-F674 HydrophobicContact CD1-CD2 3.4Å; L668-F674 VanDerWaalsContact CD1-CD2 3.4Å; L668-F674 HydrophobicContact CD1-CE1 4.45Å; L668-F674 HydrophobicContact CD1-CE2 3.91Å; L668-F674 HydrophobicContact CD1-CG 3.44Å; L668-F674 VanDerWaalsContact CD1-CG 3.44Å; L668-F674 HydrophobicContact CD1-CZ 4.4Å; S670-F674 PolarHBondContact O-N 2.95Å; Q671-F674 WeakPolarHBondContact O-CB 3.45Å; Q671-F674 PolarHBondContact O-N 3.48Å; F674-I677 PolarHBondContact O-N 3.01Å; F674-R678 WeakPolarHBondContact O-CB 3.45Å; F674-R678 PolarHBondContact O-N 3.46Å; F674-L760 HydrophobicContact CE1-CD1 3.69Å; F674-L760 HydrophobicContact CZ-CD1 3.64Å
675	D	96.6	Very high	95.3	Very high	75 Å²	75	60.6 Å²	60.6	40%	0.401	31%	0.31	S	S	.	.	H	α-helix	trans	-67.5	-36.8	179.9	-72.1	-41.8	0	0	0	111.9	Q671 A672 V673 M679	Q671-D675 VanDerWaalsContact NE2-CG 3.33Å; Q671-D675 PolarHBondContact NE2-OD1 3.43Å; Q671-D675 PolarHBondContact NE2-OD2 3.24Å; Q671-D675 PolarHBondContact O-N 2.89Å; A672-D675 PolarHBondContact O-N 3.05Å; V673-D675 PolarHBondContact O-N 2.94Å; D675-M679 WeakPolarHBondContact O-CB 3.31Å; D675-M679 PolarHBondContact O-N 2.93Å
676	E	97.4	Very high	95.7	Very high	134 Å²	134	55 Å²	55	63%	0.626	29%	0.292	S	S	*	.	H	α-helix	trans	-62.2	-45.6	171.3	-173.5	-178.7	179.1	0	0	112	A672 V673 T680	A672-E676 PolarHBondContact O-N 2.94Å; V673-E676 PolarHBondContact O-N 2.7Å; E676-T680 WeakPolarHBondContact O-CB 3.4Å; E676-T680 PolarHBondContact O-N 3.29Å; E676-T680 PolarHBondContact O-OG1 3.05Å
677	I	97.3	Very high	96	Very high	12 Å²	12	52 Å²	52	6%	0.062	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-51.7	178.6	-67.1	165.2	0	0	0	110.1	G571 L575 L660 V673 F674 M679 T680 Y681	G571-I677 WeakPolarHBondContact O-CD1 3.03Å; L575-I677 HydrophobicContact CD1-CD1 4.2Å; L575-I677 HydrophobicContact CD2-CD1 4.02Å; L575-I677 HydrophobicContact CG-CD1 3.92Å; L660-I677 HydrophobicContact CD1-CG2 3.8Å; V673-I677 HydrophobicContact CG1-CD1 3.81Å; V673-I677 HydrophobicContact CG1-CG1 4.46Å; V673-I677 WeakPolarHBondContact O-CB 3.47Å; V673-I677 WeakPolarHBondContact O-CD1 3.44Å; V673-I677 WeakPolarHBondContact O-CG1 3.31Å; V673-I677 PolarHBondContact O-N 3.26Å; F674-I677 PolarHBondContact O-N 3.01Å; I677-M679 PolarHBondContact O-N 3.44Å; I677-T680 WeakPolarHBondContact O-CB 3.48Å; I677-T680 PolarHBondContact O-N 2.9Å; I677-Y681 HydrophobicContact CG2-CD2 3.89Å; I677-Y681 HydrophobicContact CG2-CE2 3.7Å; I677-Y681 VanDerWaalsContact O-CD2 3.25Å; I677-Y681 WeakPolarHBondContact O-CD2 3.33Å; I677-Y681 PolarHBondContact O-N 3.33Å
678	R	97.4	Very high	96.3	Very high	22 Å²	22	51 Å²	51	8%	0.083	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-44.9	179.2	-176.9	172.4	167	84	0.9	111.2	L657 L660 F674 T680 Y681 I682 L760	L657-R678 HydrophobicContact CD2-CG 4.34Å; L657-R678 PolarHBondContact O-NH1 3.28Å; L660-R678 HydrophobicContact CB-CB 4.43Å; L660-R678 HydrophobicContact CB-CG 4.36Å; L660-R678 HydrophobicContact CD1-CB 4.14Å; L660-R678 PolarHBondContact O-NH1 2.85Å; F674-R678 WeakPolarHBondContact O-CB 3.45Å; F674-R678 PolarHBondContact O-N 3.46Å; R678-T680 VanDerWaalsContact C-N 3.27Å; R678-T680 PolarHBondContact O-N 3.06Å; R678-Y681 PolarHBondContact O-N 3.03Å; R678-I682 HydrophobicContact CG-CD1 4.21Å; R678-I682 VanDerWaalsContact O-CG1 3.29Å; R678-I682 WeakPolarHBondContact O-CG1 3.45Å; R678-I682 PolarHBondContact O-N 3.17Å; R678-L760 PolarHBondContact NH2-O 3.16Å
679	M	97.3	Very high	96.4	Very high	90 Å²	90	50.3 Å²	50.3	44%	0.443	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-32.2	174.6	179.4	55.8	62.8	0	0	112.6	D675 I677 K683	D675-M679 WeakPolarHBondContact O-CB 3.31Å; D675-M679 PolarHBondContact O-N 2.93Å; I677-M679 PolarHBondContact O-N 3.44Å; M679-K683 HydrophobicContact CG-CD 4.41Å; M679-K683 WeakPolarHBondContact O-CD 3.41Å; M679-K683 VanDerWaalsContact O-CG 3.26Å; M679-K683 WeakPolarHBondContact O-CG 3.49Å; M679-K683 PolarHBondContact O-N 3.16Å; M679-K683 VanDerWaalsContact O-N 3.16Å
680	T	97.3	Very high	96.3	Very high	40 Å²	40	48 Å²	48	25%	0.245	26%	0.26	C	S	.	.	H	α-helix	trans	-68.8	-47.9	175.6	-65.5	0	0	0	0	111.5	M520 E676 I677 R678 I682 K683 E684	M520-T680 HydrophobicContact CE-CG2 4.05Å; E676-T680 WeakPolarHBondContact O-CB 3.4Å; E676-T680 PolarHBondContact O-N 3.29Å; E676-T680 PolarHBondContact O-OG1 3.05Å; I677-T680 WeakPolarHBondContact O-CB 3.48Å; I677-T680 PolarHBondContact O-N 2.9Å; R678-T680 VanDerWaalsContact C-N 3.27Å; R678-T680 PolarHBondContact O-N 3.06Å; T680-I682 VanDerWaalsContact C-N 3.33Å; T680-I682 PolarHBondContact O-N 2.85Å; T680-K683 WeakPolarHBondContact O-CB 3.4Å; T680-K683 PolarHBondContact O-N 2.82Å; T680-K683 VanDerWaalsContact O-N 3.1Å; T680-E684 PolarHBondContact O-N 3.3Å
681	Y	98.1	Very high	96.1	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-28.7	177.2	-69.8	-70.4	0	0	0	113.3	M520 L524 P570 V656 L660 I677 R678 E684 L685	M520-Y681 HydrophobicContact CE-CE1 4.44Å; M520-Y681 HydrophobicContact CG-CE1 3.85Å; M520-Y681 HydrophobicContact SD-CE1 4.02Å; L524-Y681 HydrophobicContact CD1-CD1 4.41Å; L524-Y681 HydrophobicContact CD1-CE1 4.21Å; L524-Y681 HydrophobicContact CD2-CE1 4.03Å; L524-Y681 HydrophobicContact CG-CE1 4.49Å; P570-Y681 WeakPolarHBondContact CD-OH 3.39Å; P570-Y681 PolarHBondContact O-OH 2.89Å; V656-Y681 HydrophobicContact CB-CD1 4.18Å; V656-Y681 HydrophobicContact CB-CG 4.19Å; V656-Y681 HydrophobicContact CG1-CD1 3.82Å; V656-Y681 HydrophobicContact CG1-CD2 3.43Å; V656-Y681 VanDerWaalsContact CG1-CD2 3.43Å; V656-Y681 HydrophobicContact CG1-CE1 4.04Å; V656-Y681 HydrophobicContact CG1-CE2 3.66Å; V656-Y681 HydrophobicContact CG1-CG 3.53Å; V656-Y681 HydrophobicContact CG2-CD1 4.47Å; V656-Y681 HydrophobicContact CG2-CE1 4.46Å; L660-Y681 HydrophobicContact CD1-CD2 4.13Å; I677-Y681 HydrophobicContact CG2-CD2 3.89Å; I677-Y681 HydrophobicContact CG2-CE2 3.7Å; I677-Y681 VanDerWaalsContact O-CD2 3.25Å; I677-Y681 WeakPolarHBondContact O-CD2 3.33Å; I677-Y681 PolarHBondContact O-N 3.33Å; R678-Y681 PolarHBondContact O-N 3.03Å; Y681-E684 PolarHBondContact O-N 3.14Å; Y681-L685 PolarHBondContact O-N 3.07Å
682	I	97.8	Very high	95.6	Very high	39 Å²	39	54.9 Å²	54.9	20%	0.2	28%	0.283	C	S	.	.	H	α-helix	trans	-59.9	-44.7	167.3	-73	169.8	0	0	0	111.1	L657 R678 T680 E684 L685 G686 F703 F762	L657-I682 HydrophobicContact CD1-CG1 4.29Å; L657-I682 HydrophobicContact CD2-CG1 3.73Å; R678-I682 HydrophobicContact CG-CD1 4.21Å; R678-I682 VanDerWaalsContact O-CG1 3.29Å; R678-I682 WeakPolarHBondContact O-CG1 3.45Å; R678-I682 PolarHBondContact O-N 3.17Å; T680-I682 VanDerWaalsContact C-N 3.33Å; T680-I682 PolarHBondContact O-N 2.85Å; I682-E684 PolarHBondContact O-N 2.88Å; I682-L685 PolarHBondContact O-N 3.44Å; I682-G686 PolarHBondContact O-N 3.2Å; I682-G686 VanDerWaalsContact O-N 3.09Å; I682-F703 HydrophobicContact CG2-CE2 4.34Å; I682-F703 HydrophobicContact CG2-CZ 4.05Å; I682-F762 HydrophobicContact CD1-CE1 3.89Å; I682-F762 HydrophobicContact CG1-CE1 4.02Å; I682-F762 HydrophobicContact CG1-CZ 4.46Å
683	K	96.9	Very high	94.9	Very high	117 Å²	117	52.6 Å²	52.6	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-35.7	176.5	-68.6	160.4	-175.1	166.1	0	112	M679 T680 G686 K687	M679-K683 HydrophobicContact CG-CD 4.41Å; M679-K683 WeakPolarHBondContact O-CD 3.41Å; M679-K683 VanDerWaalsContact O-CG 3.26Å; M679-K683 WeakPolarHBondContact O-CG 3.49Å; M679-K683 PolarHBondContact O-N 3.16Å; M679-K683 VanDerWaalsContact O-N 3.16Å; T680-K683 WeakPolarHBondContact O-CB 3.4Å; T680-K683 PolarHBondContact O-N 2.82Å; T680-K683 VanDerWaalsContact O-N 3.1Å; K683-G686 PolarHBondContact O-N 2.87Å; K683-K687 WeakPolarHBondContact O-CG 3.48Å; K683-K687 PolarHBondContact O-N 2.85Å
684	E	96.9	Very high	93.8	Very high	26 Å²	26	59.7 Å²	59.7	12%	0.121	29%	0.289	C	S	.	.	H	α-helix	trans	-70.3	-37.8	174.9	-64.3	-53.7	127.3	0	0	113	M520 T680 Y681 I682 G686 K687 A688	M520-E684 HydrophobicContact CB-CG 3.9Å; M520-E684 HydrophobicContact CG-CG 3.91Å; T680-E684 PolarHBondContact O-N 3.3Å; Y681-E684 PolarHBondContact O-N 3.14Å; I682-E684 PolarHBondContact O-N 2.88Å; E684-G686 VanDerWaalsContact C-N 3.31Å; E684-G686 PolarHBondContact O-N 3.29Å; E684-K687 WeakPolarHBondContact O-CB 3.27Å; E684-K687 PolarHBondContact O-N 3.09Å; E684-K687 VanDerWaalsContact O-N 3.13Å; E684-K687 WeakPolarHBondContact OE1-CE 3.22Å; E684-K687 IonicContact OE1-NZ 3.45Å; E684-K687 PolarHBondContact OE1-NZ 3.15Å; E684-K687 WeakPolarHBondContact OE2-CD 3.46Å; E684-K687 IonicContact OE2-NZ 2.71Å; E684-A688 PolarHBondContact O-N 3.36Å
685	L	97.4	Very high	92.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-44.1	170.6	179.8	58.4	0	0	0	110.8	E650 C653 M654 L657 Y681 I682 K687 A688 I689 F703 L706 T707	E650-L685 HydrophobicContact CB-CD1 4.15Å; E650-L685 HydrophobicContact CG-CD1 4.32Å; C653-L685 HydrophobicContact CB-CB 3.91Å; C653-L685 HydrophobicContact CB-CD1 4.13Å; M654-L685 HydrophobicContact CG-CD1 4.04Å; M654-L685 HydrophobicContact CG-CD2 4.21Å; L657-L685 HydrophobicContact CD1-CB 4.37Å; L657-L685 HydrophobicContact CD1-CD2 3.85Å; Y681-L685 PolarHBondContact O-N 3.07Å; I682-L685 PolarHBondContact O-N 3.44Å; L685-K687 VanDerWaalsContact C-N 3.31Å; L685-K687 PolarHBondContact O-N 3.22Å; L685-A688 PolarHBondContact O-N 2.92Å; L685-I689 HydrophobicContact CD1-CD1 4.22Å; L685-I689 HydrophobicContact CD1-CG1 4.47Å; L685-I689 HydrophobicContact CG-CD1 4.04Å; L685-I689 WeakPolarHBondContact O-CD1 3.46Å; L685-I689 WeakPolarHBondContact O-CG1 3.46Å; L685-I689 PolarHBondContact O-N 3.31Å; L685-F703 HydrophobicContact CD2-CD2 4.43Å; L685-F703 HydrophobicContact CD2-CE2 4.12Å; L685-F703 HydrophobicContact CG-CD2 4.43Å; L685-F703 HydrophobicContact CG-CE2 4.32Å; L685-L706 HydrophobicContact CD1-CD1 4.31Å; L685-T707 HydrophobicContact CD2-CG2 4.43Å
686	G	95.9	Very high	91.9	Very high	24 Å²	24	65.1 Å²	65.1	25%	0.247	32%	0.322	C	S	.	.	H	α-helix	trans	-57.4	-40.3	172.8	0	0	0	0	0	113.3	I682 K683 E684 V690	I682-G686 PolarHBondContact O-N 3.2Å; I682-G686 VanDerWaalsContact O-N 3.09Å; K683-G686 PolarHBondContact O-N 2.87Å; E684-G686 VanDerWaalsContact C-N 3.31Å; E684-G686 PolarHBondContact O-N 3.29Å; G686-V690 WeakPolarHBondContact O-CB 3.37Å; G686-V690 WeakPolarHBondContact O-CG2 3.16Å; G686-V690 PolarHBondContact O-N 2.91Å
687	K	94.3	Very high	90.9	Very high	121 Å²	121	62.1 Å²	62.1	53%	0.526	32%	0.316	S	S	.	.	H	α-helix	trans	-67.9	-39.2	174.7	-69.7	167.4	-173.3	173.3	0	112.6	K683 E684 L685 V690 K691	K683-K687 WeakPolarHBondContact O-CG 3.48Å; K683-K687 PolarHBondContact O-N 2.85Å; E684-K687 WeakPolarHBondContact O-CB 3.27Å; E684-K687 PolarHBondContact O-N 3.09Å; E684-K687 VanDerWaalsContact O-N 3.13Å; E684-K687 WeakPolarHBondContact OE1-CE 3.22Å; E684-K687 IonicContact OE1-NZ 3.45Å; E684-K687 PolarHBondContact OE1-NZ 3.15Å; E684-K687 WeakPolarHBondContact OE2-CD 3.46Å; E684-K687 IonicContact OE2-NZ 2.71Å; L685-K687 VanDerWaalsContact C-N 3.31Å; L685-K687 PolarHBondContact O-N 3.22Å; K687-V690 PolarHBondContact O-N 3.15Å; K687-K691 WeakPolarHBondContact O-CB 3.32Å; K687-K691 PolarHBondContact O-N 3.17Å
688	A	94.8	Very high	90.4	Very high	4 Å²	4	65.7 Å²	65.7	3%	0.033	33%	0.332	C	S	.	.	H	α-helix	trans	-62.2	-43.9	176.4	0	0	0	0	0	111.4	D649 E650 E684 L685 K691 R692	D649-A688 HydrophobicContact CB-CB 4.16Å; E650-A688 HydrophobicContact CG-CB 4.09Å; E684-A688 PolarHBondContact O-N 3.36Å; L685-A688 PolarHBondContact O-N 2.92Å; A688-K691 WeakPolarHBondContact O-CB 3.3Å; A688-K691 PolarHBondContact O-N 3.37Å; A688-R692 PolarHBondContact O-N 3.03Å; A688-R692 VanDerWaalsContact O-N 3.08Å
689	I	95.4	Very high	90.1	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-62.9	-48.6	175	-65.3	159.3	0	0	0	110.9	E650 L685 K691 R692 E693 N699 R702 F703 L706	E650-I689 HydrophobicContact CG-CG1 4.35Å; L685-I689 HydrophobicContact CD1-CD1 4.22Å; L685-I689 HydrophobicContact CD1-CG1 4.47Å; L685-I689 HydrophobicContact CG-CD1 4.04Å; L685-I689 WeakPolarHBondContact O-CD1 3.46Å; L685-I689 WeakPolarHBondContact O-CG1 3.46Å; L685-I689 PolarHBondContact O-N 3.31Å; I689-K691 PolarHBondContact O-N 3.02Å; I689-R692 PolarHBondContact O-N 2.71Å; I689-E693 PolarHBondContact O-N 3.13Å; I689-N699 HydrophobicContact CG2-CB 3.87Å; I689-R702 HydrophobicContact CG1-CG 4.35Å; I689-R702 HydrophobicContact CG2-CB 4.05Å; I689-R702 HydrophobicContact CG2-CG 4.13Å; I689-F703 HydrophobicContact CD1-CB 3.83Å; I689-F703 HydrophobicContact CD1-CD2 3.78Å; I689-F703 HydrophobicContact CD1-CG 4.27Å; I689-L706 HydrophobicContact CD1-CD1 3.97Å; I689-L706 HydrophobicContact CG1-CD1 3.93Å
690	V	92.9	Very high	89.9	Confident	89 Å²	89	69.3 Å²	69.3	54%	0.539	34%	0.342	S	S	.	.	H	α-helix	trans	-60.4	-26.7	176.8	171.2	0	0	0	0	112.9	G686 K687 N699	G686-V690 WeakPolarHBondContact O-CB 3.37Å; G686-V690 WeakPolarHBondContact O-CG2 3.16Å; G686-V690 PolarHBondContact O-N 2.91Å; K687-V690 PolarHBondContact O-N 3.15Å; V690-N699 WeakPolarHBondContact CA-ND2 3.26Å; V690-N699 VanDerWaalsContact CG2-ND2 3.31Å; V690-N699 WeakPolarHBondContact CG2-ND2 3.36Å
691	K	88.6	Confident	89.7	Confident	137 Å²	137	71 Å²	71	60%	0.596	35%	0.347	S	S	*	.	H	α-helix	trans	-79	-28.3	174.3	-177.2	-167.7	169.9	-161.3	0	112.7	D649 K687 A688 I689	D649-K691 IonicContact OD2-NZ 2.7Å; D649-K691 PolarHBondContact OD2-NZ 3.37Å; K687-K691 WeakPolarHBondContact O-CB 3.32Å; K687-K691 PolarHBondContact O-N 3.17Å; A688-K691 WeakPolarHBondContact O-CB 3.3Å; A688-K691 PolarHBondContact O-N 3.37Å; I689-K691 PolarHBondContact O-N 3.02Å
692	R	85.4	Confident	89.6	Confident	89 Å²	89	71.4 Å²	71.4	34%	0.336	35%	0.349	S	S	.	.	H	α-helix	trans	-87.6	-40.1	-179.2	-173.9	-172.5	179.8	-75.1	6.7	112.8	Q645 E650 A688 I689 R702	Q645-R692 PolarHBondContact O-NH2 3.49Å; E650-R692 WeakPolarHBondContact OE1-CD 3.5Å; E650-R692 VanDerWaalsContact OE2-CD 3.3Å; E650-R692 WeakPolarHBondContact OE2-CD 3.26Å; E650-R692 IonicContact OE2-NE 2.72Å; A688-R692 PolarHBondContact O-N 3.03Å; A688-R692 VanDerWaalsContact O-N 3.08Å; I689-R692 PolarHBondContact O-N 2.71Å; R692-R702 VanDerWaalsContact CZ-NH2 3.29Å
693	E	81.8	Confident	89.5	Confident	34 Å²	34	72.4 Å²	72.4	16%	0.159	35%	0.352	C	S	.	.			trans	-103.3	105.8	-179.6	-74.1	-179.8	148.9	0	0	111.2	I689 N695 N699 R702	I689-E693 PolarHBondContact O-N 3.13Å; E693-N695 PolarHBondContact O-N 2.9Å; E693-N699 WeakPolarHBondContact OE2-CA 3.24Å; E693-N699 PolarHBondContact OE2-N 2.82Å; E693-R702 WeakPolarHBondContact OE1-CD 3.42Å; E693-R702 WeakPolarHBondContact OE2-CB 3.16Å; E693-R702 WeakPolarHBondContact OE2-CD 3.14Å
694	E	72.6	Confident	89.5	Confident	197 Å²	197	71.7 Å²	71.7	92%	0.921	35%	0.347	S	S	*	.	S	Bend	trans	-61.5	-25.4	171.4	-58.6	-171.7	159.2	0	0	112.3	T696	E694-T696 PolarHBondContact O-N 2.81Å
695	N	78.3	Confident	89.5	Confident	77 Å²	77	73.8 Å²	73.8	41%	0.412	36%	0.357	S	S	.	.			trans	-90.7	92.4	-179.4	178.5	17.4	0	0	0	111.6	E693 S697 Q698 N699	E693-N695 PolarHBondContact O-N 2.9Å; N695-S697 VanDerWaalsContact CG-OG 3.22Å; N695-S697 PolarHBondContact ND2-OG 2.81Å; N695-S697 VanDerWaalsContact ND2-OG 3.1Å; N695-S697 PolarHBondContact O-N 2.74Å; N695-S697 PolarHBondContact OD1-N 3.2Å; N695-S697 PolarHBondContact OD1-OG 3.27Å; N695-Q698 PolarHBondContact ND2-OE1 3.42Å; N695-Q698 PolarHBondContact O-N 3.13Å; N695-N699 PolarHBondContact O-OD1 2.98Å
696	T	76.7	Confident	89.5	Confident	112 Å²	112	73.8 Å²	73.8	69%	0.687	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-17.9	-176.9	-20.1	0	0	0	0	115.1	E694 N699	E694-T696 PolarHBondContact O-N 2.81Å; T696-N699 VanDerWaalsContact CA-OD1 3.29Å; T696-N699 WeakPolarHBondContact CA-OD1 3.32Å
697	S	76.6	Confident	89.5	Confident	71 Å²	71	72.7 Å²	72.7	50%	0.497	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-16.8	178.9	67.8	0	0	0	0	114.8	N695 W700	N695-S697 VanDerWaalsContact CG-OG 3.22Å; N695-S697 PolarHBondContact ND2-OG 2.81Å; N695-S697 VanDerWaalsContact ND2-OG 3.1Å; N695-S697 PolarHBondContact O-N 2.74Å; N695-S697 PolarHBondContact OD1-N 3.2Å; N695-S697 PolarHBondContact OD1-OG 3.27Å; S697-W700 PolarHBondContact O-NE1 2.9Å
698	Q	86.4	Confident	89.6	Confident	86 Å²	86	72.2 Å²	72.2	40%	0.402	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-17.5	-179.6	-66.8	-175	-84.3	0	0	113.6	N695 W700 Q701 R702	N695-Q698 PolarHBondContact ND2-OE1 3.42Å; N695-Q698 PolarHBondContact O-N 3.13Å; Q698-W700 PolarHBondContact O-N 2.68Å; Q698-Q701 WeakPolarHBondContact O-CA 3.34Å; Q698-Q701 VanDerWaalsContact O-CB 3.29Å; Q698-Q701 WeakPolarHBondContact O-CB 3.47Å; Q698-Q701 PolarHBondContact O-N 3Å; Q698-R702 PolarHBondContact O-N 3.47Å
699	N	91.1	Very high	89.7	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-53.5	-33.3	-175.6	-56.9	28.8	0	0	0	113.8	I689 V690 E693 N695 T696 F703	I689-N699 HydrophobicContact CG2-CB 3.87Å; V690-N699 WeakPolarHBondContact CA-ND2 3.26Å; V690-N699 VanDerWaalsContact CG2-ND2 3.31Å; V690-N699 WeakPolarHBondContact CG2-ND2 3.36Å; E693-N699 WeakPolarHBondContact OE2-CA 3.24Å; E693-N699 PolarHBondContact OE2-N 2.82Å; N695-N699 PolarHBondContact O-OD1 2.98Å; T696-N699 VanDerWaalsContact CA-OD1 3.29Å; T696-N699 WeakPolarHBondContact CA-OD1 3.32Å; N699-F703 WeakPolarHBondContact O-CB 3.37Å; N699-F703 PolarHBondContact O-N 3.39Å
700	W	91.9	Very high	89.8	Confident	171 Å²	171	72.2 Å²	72.2	65%	0.648	34%	0.342	S	S	*	.	H	α-helix	trans	-74.4	-35.7	175.8	70.5	-89.1	0	0	0	112.8	S697 Q698 F703 Y704	S697-W700 PolarHBondContact O-NE1 2.9Å; Q698-W700 PolarHBondContact O-N 2.68Å; W700-F703 PolarHBondContact O-N 3.12Å; W700-Y704 WeakPolarHBondContact O-CB 3.47Å; W700-Y704 PolarHBondContact O-N 2.72Å
701	Q	94.3	Very high	89.9	Confident	76 Å²	76	69.3 Å²	69.3	36%	0.355	32%	0.324	S	S	.	.	H	α-helix	trans	-66	-43.4	174.2	-55.2	-174.7	-38.1	0	0	109.7	Q698 Y704 Q705	Q698-Q701 WeakPolarHBondContact O-CA 3.34Å; Q698-Q701 VanDerWaalsContact O-CB 3.29Å; Q698-Q701 WeakPolarHBondContact O-CB 3.47Å; Q698-Q701 PolarHBondContact O-N 3Å; Q701-Y704 PolarHBondContact O-N 2.94Å; Q701-Q705 WeakPolarHBondContact O-CB 3.47Å; Q701-Q705 VanDerWaalsContact O-CG 3.22Å; Q701-Q705 WeakPolarHBondContact O-CG 3.49Å; Q701-Q705 PolarHBondContact O-N 2.83Å
702	R	95.4	Very high	90.2	Very high	11 Å²	11	65 Å²	65	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-40.8	176.6	-174.5	160.1	-174.8	80.8	6.4	112.3	L644 Q645 E650 I689 R692 E693 Q698 Q705 L706	L644-R702 PolarHBondContact O-NH1 3.24Å; L644-R702 PolarHBondContact O-NH2 3.27Å; Q645-R702 PolarHBondContact O-NH2 2.93Å; E650-R702 IonicContact OE1-CZ 3.13Å; E650-R702 IonicContact OE1-NE 2.68Å; E650-R702 PolarHBondContact OE1-NE 3.1Å; E650-R702 IonicContact OE1-NH2 2.75Å; E650-R702 PolarHBondContact OE1-NH2 3.01Å; E650-R702 IonicContact OE2-CZ 3.12Å; E650-R702 IonicContact OE2-NE 3.54Å; E650-R702 IonicContact OE2-NH2 2.79Å; E650-R702 PolarHBondContact OE2-NH2 3.31Å; I689-R702 HydrophobicContact CG1-CG 4.35Å; I689-R702 HydrophobicContact CG2-CB 4.05Å; I689-R702 HydrophobicContact CG2-CG 4.13Å; R692-R702 VanDerWaalsContact CZ-NH2 3.29Å; E693-R702 WeakPolarHBondContact OE1-CD 3.42Å; E693-R702 WeakPolarHBondContact OE2-CB 3.16Å; E693-R702 WeakPolarHBondContact OE2-CD 3.14Å; Q698-R702 PolarHBondContact O-N 3.47Å; R702-Q705 PolarHBondContact O-N 3.38Å; R702-L706 HydrophobicContact CG-CD1 3.96Å; R702-L706 HydrophobicContact CG-CG 4.35Å; R702-L706 VanDerWaalsContact O-CG 3.3Å; R702-L706 WeakPolarHBondContact O-CG 3.31Å; R702-L706 PolarHBondContact O-N 3.31Å
703	F	96.6	Very high	90.6	Very high	59 Å²	59	60.8 Å²	60.8	26%	0.259	30%	0.295	S	S	.	.	H	α-helix	trans	-57.3	-52.8	172.4	-174.1	-87.1	0	0	0	111	I682 L685 I689 N699 W700 Q705 L706 T707	I682-F703 HydrophobicContact CG2-CE2 4.34Å; I682-F703 HydrophobicContact CG2-CZ 4.05Å; L685-F703 HydrophobicContact CD2-CD2 4.43Å; L685-F703 HydrophobicContact CD2-CE2 4.12Å; L685-F703 HydrophobicContact CG-CD2 4.43Å; L685-F703 HydrophobicContact CG-CE2 4.32Å; I689-F703 HydrophobicContact CD1-CB 3.83Å; I689-F703 HydrophobicContact CD1-CD2 3.78Å; I689-F703 HydrophobicContact CD1-CG 4.27Å; N699-F703 WeakPolarHBondContact O-CB 3.37Å; N699-F703 PolarHBondContact O-N 3.39Å; W700-F703 PolarHBondContact O-N 3.12Å; F703-Q705 VanDerWaalsContact C-N 3.33Å; F703-Q705 PolarHBondContact O-N 2.79Å; F703-L706 PolarHBondContact O-N 3.31Å; F703-T707 HydrophobicContact CD1-CG2 4.09Å; F703-T707 HydrophobicContact CE1-CG2 3.61Å; F703-T707 HydrophobicContact CE2-CG2 4.37Å; F703-T707 HydrophobicContact CZ-CG2 3.75Å; F703-T707 PolarHBondContact O-N 3.39Å; F703-T707 PolarHBondContact O-OG1 2.89Å
704	Y	96.1	Very high	91.1	Very high	102 Å²	102	60.5 Å²	60.5	40%	0.4	29%	0.294	S	S	.	.	H	α-helix	trans	-55.5	-43.5	176	173.2	-92.8	0	0	0	112.8	W700 Q701 T707 K708 H763	W700-Y704 WeakPolarHBondContact O-CB 3.47Å; W700-Y704 PolarHBondContact O-N 2.72Å; Q701-Y704 PolarHBondContact O-N 2.94Å; Y704-T707 PolarHBondContact O-OG1 3.11Å; Y704-K708 HydrophobicContact CE1-CD 4Å; Y704-K708 WeakPolarHBondContact O-CB 3.3Å; Y704-K708 PolarHBondContact O-N 2.8Å; Y704-K708 PolarHBondContact OH-NZ 3.17Å; Y704-H763 AromaticContact CD2-CD2 3.71Å; Y704-H763 AromaticContact CD2-CE1 3.79Å; Y704-H763 AromaticContact CD2-NE2 3.16Å; Y704-H763 WeakPolarHBondContact CD2-NE2 3.27Å; Y704-H763 AromaticContact CE2-CD2 3.59Å; Y704-H763 AromaticContact CE2-CE1 3.88Å; Y704-H763 AromaticContact CE2-NE2 3.47Å; Y704-H763 WeakPolarHBondContact CE2-NE2 3.24Å
705	Q	96.7	Very high	92	Very high	71 Å²	71	57 Å²	57	33%	0.332	28%	0.278	S	S	.	.	H	α-helix	trans	-63.1	-42.7	178.1	-78.1	170.8	8	0	0	112.6	L644 Q701 R702 F703 L709	L644-Q705 HydrophobicContact CD1-CB 4.41Å; L644-Q705 HydrophobicContact CD2-CB 3.75Å; L644-Q705 HydrophobicContact CD2-CG 4.09Å; Q701-Q705 WeakPolarHBondContact O-CB 3.47Å; Q701-Q705 VanDerWaalsContact O-CG 3.22Å; Q701-Q705 WeakPolarHBondContact O-CG 3.49Å; Q701-Q705 PolarHBondContact O-N 2.83Å; R702-Q705 PolarHBondContact O-N 3.38Å; F703-Q705 VanDerWaalsContact C-N 3.33Å; F703-Q705 PolarHBondContact O-N 2.79Å; Q705-L709 PolarHBondContact O-N 2.84Å
706	L	97.7	Very high	92.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-72.7	-41.9	179.8	-65.6	172.7	0	0	0	111.4	L644 V646 E650 M654 L685 I689 R702 F703 K708 L709 L710	L644-L706 HydrophobicContact CD1-CD2 4.25Å; V646-L706 HydrophobicContact CG1-CD2 4.39Å; V646-L706 HydrophobicContact CG2-CD2 3.89Å; E650-L706 HydrophobicContact CB-CD1 4.15Å; E650-L706 HydrophobicContact CG-CD1 4.02Å; M654-L706 HydrophobicContact CE-CB 4.06Å; M654-L706 HydrophobicContact CE-CD2 4.23Å; M654-L706 VanDerWaalsContact CE-O 3.25Å; M654-L706 WeakPolarHBondContact CE-O 3.28Å; M654-L706 HydrophobicContact SD-CB 3.92Å; M654-L706 HydrophobicContact SD-CD1 4.47Å; M654-L706 HydrophobicContact SD-CD2 3.8Å; M654-L706 HydrophobicContact SD-CG 4.26Å; L685-L706 HydrophobicContact CD1-CD1 4.31Å; I689-L706 HydrophobicContact CD1-CD1 3.97Å; I689-L706 HydrophobicContact CG1-CD1 3.93Å; R702-L706 HydrophobicContact CG-CD1 3.96Å; R702-L706 HydrophobicContact CG-CG 4.35Å; R702-L706 VanDerWaalsContact O-CG 3.3Å; R702-L706 WeakPolarHBondContact O-CG 3.31Å; R702-L706 PolarHBondContact O-N 3.31Å; F703-L706 PolarHBondContact O-N 3.31Å; L706-K708 VanDerWaalsContact C-N 3.3Å; L706-K708 PolarHBondContact O-N 3.47Å; L706-L709 WeakPolarHBondContact O-CB 3.34Å; L706-L709 PolarHBondContact O-N 3.36Å; L706-L710 PolarHBondContact O-N 2.99Å
707	T	96.9	Very high	93.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-28.5	174.2	51.9	0	0	0	0	112.7	L685 F703 Y704 L709 L710 D711 F762 H763	L685-T707 HydrophobicContact CD2-CG2 4.43Å; F703-T707 HydrophobicContact CD1-CG2 4.09Å; F703-T707 HydrophobicContact CE1-CG2 3.61Å; F703-T707 HydrophobicContact CE2-CG2 4.37Å; F703-T707 HydrophobicContact CZ-CG2 3.75Å; F703-T707 PolarHBondContact O-N 3.39Å; F703-T707 PolarHBondContact O-OG1 2.89Å; Y704-T707 PolarHBondContact O-OG1 3.11Å; T707-L709 VanDerWaalsContact C-N 3.33Å; T707-L710 HydrophobicContact CG2-CD1 4.49Å; T707-L710 WeakPolarHBondContact O-CB 3.44Å; T707-L710 PolarHBondContact O-N 3.41Å; T707-L710 VanDerWaalsContact O-N 3.15Å; T707-D711 PolarHBondContact O-N 3.36Å; T707-F762 HydrophobicContact CG2-CB 4.28Å; T707-F762 HydrophobicContact CG2-CD1 3.58Å; T707-F762 HydrophobicContact CG2-CD2 4.13Å; T707-F762 HydrophobicContact CG2-CE1 3.87Å; T707-F762 HydrophobicContact CG2-CE2 4.39Å; T707-F762 HydrophobicContact CG2-CG 3.72Å; T707-F762 HydrophobicContact CG2-CZ 4.27Å; T707-H763 PolarHBondContact OG1-CE1 3.35Å; T707-H763 PolarHBondContact OG1-NE2 3.42Å
708	K	96.3	Very high	94.2	Very high	112 Å²	112	49.3 Å²	49.3	49%	0.487	22%	0.224	S	C	.	.	H	α-helix	trans	-68.6	-31.6	172.2	-174.3	167.1	-171.6	166.2	0	112.6	Y704 L706 L710 D711 S712	Y704-K708 HydrophobicContact CE1-CD 4Å; Y704-K708 WeakPolarHBondContact O-CB 3.3Å; Y704-K708 PolarHBondContact O-N 2.8Å; Y704-K708 PolarHBondContact OH-NZ 3.17Å; L706-K708 VanDerWaalsContact C-N 3.3Å; L706-K708 PolarHBondContact O-N 3.47Å; K708-L710 VanDerWaalsContact C-N 3.34Å; K708-D711 PolarHBondContact O-N 3.32Å; K708-S712 PolarHBondContact O-N 3.17Å; K708-S712 PolarHBondContact O-OG 3.43Å
709	L	96.7	Very high	94.5	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-35.9	169.1	-179.8	55.7	0	0	0	111.5	I637 E640 F641 L644 V646 M654 Q705 L706 T707 D711 S712 M713	I637-L709 HydrophobicContact CD1-CD1 3.78Å; I637-L709 HydrophobicContact CG2-CD1 4.37Å; E640-L709 HydrophobicContact CB-CD1 3.61Å; E640-L709 HydrophobicContact CB-CD2 4.29Å; E640-L709 HydrophobicContact CG-CD1 4.19Å; F641-L709 HydrophobicContact CD2-CD2 4.43Å; L644-L709 HydrophobicContact CD1-CB 4.23Å; L644-L709 HydrophobicContact CD1-CD2 4.14Å; V646-L709 HydrophobicContact CG2-CD2 4.43Å; M654-L709 HydrophobicContact CE-CB 4.24Å; M654-L709 HydrophobicContact CE-CD2 4.14Å; M654-L709 HydrophobicContact CE-CG 4.31Å; Q705-L709 PolarHBondContact O-N 2.84Å; L706-L709 WeakPolarHBondContact O-CB 3.34Å; L706-L709 PolarHBondContact O-N 3.36Å; T707-L709 VanDerWaalsContact C-N 3.33Å; L709-D711 VanDerWaalsContact C-N 3.34Å; L709-S712 PolarHBondContact O-N 3.34Å; L709-S712 PolarHBondContact O-OG 3.39Å; L709-S712 VanDerWaalsContact O-OG 3.07Å; L709-M713 WeakPolarHBondContact O-CG 3.34Å; L709-M713 PolarHBondContact O-N 3.11Å
710	L	96.9	Very high	94.6	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-37.9	172.6	-61.4	178.6	0	0	0	112.4	M654 L657 L658 L706 T707 K708 M713 F762	M654-L710 HydrophobicContact CB-CD2 3.94Å; M654-L710 HydrophobicContact CE-CD2 3.86Å; M654-L710 HydrophobicContact CE-CG 4Å; M654-L710 HydrophobicContact CG-CD1 4.47Å; M654-L710 HydrophobicContact CG-CD2 4.29Å; L657-L710 HydrophobicContact CB-CD1 3.96Å; L657-L710 HydrophobicContact CD1-CD1 4.16Å; L658-L710 HydrophobicContact CD1-CD2 4.24Å; L658-L710 HydrophobicContact CD2-CB 4.47Å; L658-L710 HydrophobicContact CD2-CD2 3.73Å; L658-L710 HydrophobicContact CG-CD2 3.75Å; L706-L710 PolarHBondContact O-N 2.99Å; T707-L710 HydrophobicContact CG2-CD1 4.49Å; T707-L710 WeakPolarHBondContact O-CB 3.44Å; T707-L710 PolarHBondContact O-N 3.41Å; T707-L710 VanDerWaalsContact O-N 3.15Å; K708-L710 VanDerWaalsContact C-N 3.34Å; L710-M713 WeakPolarHBondContact O-CB 2.93Å; L710-F762 HydrophobicContact CB-CD2 4.17Å; L710-F762 HydrophobicContact CB-CE2 4.07Å; L710-F762 HydrophobicContact CD1-CD2 4.19Å; L710-F762 HydrophobicContact CD1-CE2 3.47Å; L710-F762 VanDerWaalsContact CD1-CE2 3.47Å; L710-F762 HydrophobicContact CD1-CZ 3.96Å; L710-F762 HydrophobicContact CG-CE2 4.42Å
711	D	95.5	Very high	94.6	Very high	28 Å²	28	37.9 Å²	37.9	15%	0.15	18%	0.181	C	C	.	.	H	α-helix	trans	-70	-39	176.7	-65	-25.1	0	0	0	111.9	T707 K708 L709 M713 Q714 L761 F762 H763	T707-D711 PolarHBondContact O-N 3.36Å; K708-D711 PolarHBondContact O-N 3.32Å; L709-D711 VanDerWaalsContact C-N 3.34Å; D711-M713 VanDerWaalsContact C-N 3.27Å; D711-M713 PolarHBondContact O-N 3.48Å; D711-Q714 WeakPolarHBondContact O-CB 3.22Å; D711-Q714 WeakPolarHBondContact O-CG 3.26Å; D711-Q714 PolarHBondContact O-N 3.06Å; D711-Q714 VanDerWaalsContact O-N 3.17Å; D711-L761 HydrophobicContact CB-CD2 4.31Å; D711-L761 VanDerWaalsContact OD1-CA 3.28Å; D711-L761 WeakPolarHBondContact OD1-CA 3.34Å; D711-F762 PolarHBondContact OD1-N 2.67Å; D711-H763 IonicContact OD2-CE1 2.68Å; D711-H763 IonicContact OD2-CG 3.29Å; D711-H763 PolarHBondContact OD2-N 2.87Å; D711-H763 VanDerWaalsContact OD2-N 3.13Å; D711-H763 IonicContact OD2-ND1 2.86Å; D711-H763 PolarHBondContact OD2-ND1 2.89Å
712	S	93.9	Very high	94.4	Very high	47 Å²	47	38.9 Å²	38.9	33%	0.329	19%	0.186	S	C	.	.	H	α-helix	trans	-70.2	-20.7	178.3	65.6	0	0	0	0	114	K708 L709 Q714	K708-S712 PolarHBondContact O-N 3.17Å; K708-S712 PolarHBondContact O-OG 3.43Å; L709-S712 PolarHBondContact O-N 3.34Å; L709-S712 PolarHBondContact O-OG 3.39Å; L709-S712 VanDerWaalsContact O-OG 3.07Å; S712-Q714 PolarHBondContact O-N 3Å
713	M	94.9	Very high	94.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-30	170	-72.8	-70.9	-58.2	0	0	112.6	F590 F594 I637 L658 L709 L710 D711 M716 V717	F590-M713 HydrophobicContact CD1-CB 3.97Å; F590-M713 HydrophobicContact CD1-CE 4.45Å; F590-M713 HydrophobicContact CE1-CB 4.09Å; F594-M713 HydrophobicContact CB-CE 3.85Å; F594-M713 HydrophobicContact CD2-CE 4.3Å; F594-M713 HydrophobicContact CD2-CG 4.32Å; F594-M713 HydrophobicContact CD2-SD 3.94Å; I637-M713 HydrophobicContact CB-SD 4.48Å; I637-M713 HydrophobicContact CD1-SD 4.12Å; I637-M713 HydrophobicContact CG1-SD 4.01Å; I637-M713 HydrophobicContact CG2-SD 3.69Å; L658-M713 HydrophobicContact CD1-CE 4.31Å; L658-M713 HydrophobicContact CD1-CG 4.43Å; L658-M713 HydrophobicContact CD2-CB 4.32Å; L658-M713 HydrophobicContact CD2-CG 4.4Å; L709-M713 WeakPolarHBondContact O-CG 3.34Å; L709-M713 PolarHBondContact O-N 3.11Å; L710-M713 WeakPolarHBondContact O-CB 2.93Å; D711-M713 VanDerWaalsContact C-N 3.27Å; D711-M713 PolarHBondContact O-N 3.48Å; M713-M716 HydrophobicContact CE-CE 3.49Å; M713-M716 VanDerWaalsContact CE-CE 3.49Å; M713-M716 HydrophobicContact SD-CE 3.57Å; M713-M716 VanDerWaalsContact SD-CE 3.57Å; M713-V717 HydrophobicContact CE-CG2 4.05Å; M713-V717 WeakPolarHBondContact O-CB 3.36Å; M713-V717 VanDerWaalsContact O-CG2 3.24Å; M713-V717 WeakPolarHBondContact O-CG2 3.44Å; M713-V717 PolarHBondContact O-N 3.06Å
714	Q	92.6	Very high	94	Very high	28 Å²	28	37.1 Å²	37.1	13%	0.131	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-48.1	-174.8	-61.1	-75.1	-29.7	0	0	111.7	F590 S661 D711 S712 V717 E718 P759 L761	F590-Q714 HydrophobicContact CE1-CB 4.45Å; F590-Q714 HydrophobicContact CE1-CG 4.16Å; F590-Q714 VanDerWaalsContact CZ-CD 3.5Å; F590-Q714 HydrophobicContact CZ-CG 4.44Å; F590-Q714 VanDerWaalsContact CZ-OE1 3.27Å; S661-Q714 PolarHBondContact OG-NE2 2.68Å; D711-Q714 WeakPolarHBondContact O-CB 3.22Å; D711-Q714 WeakPolarHBondContact O-CG 3.26Å; D711-Q714 PolarHBondContact O-N 3.06Å; D711-Q714 VanDerWaalsContact O-N 3.17Å; S712-Q714 PolarHBondContact O-N 3Å; Q714-V717 PolarHBondContact O-N 3.46Å; Q714-E718 VanDerWaalsContact O-CB 3.31Å; Q714-E718 WeakPolarHBondContact O-CB 3.41Å; Q714-E718 PolarHBondContact O-N 3.15Å; Q714-P759 VanDerWaalsContact OE1-CB 3.3Å; Q714-L761 HydrophobicContact CB-CD2 4.5Å; Q714-L761 HydrophobicContact CG-CD2 3.77Å
715	E	90.8	Very high	93.8	Very high	125 Å²	125	33.6 Å²	33.6	58%	0.584	17%	0.167	S	C	*	.	H	α-helix	trans	-67.5	-40.5	-177.3	-164.1	166.8	122.1	0	0	112.1	G719 K765	E715-G719 PolarHBondContact O-N 2.85Å; E715-K765 IonicContact OE2-NZ 3.88Å; E715-K765 PolarHBondContact OE2-NZ 3.33Å
716	M	93.5	Very high	93.5	Very high	10 Å²	10	34.1 Å²	34.1	5%	0.049	17%	0.167	C	C	.	.	H	α-helix	trans	-65.2	-46.6	172.9	174.7	-170.7	69.9	0	0	111.9	Q633 M634 I637 M713 E718 G719 L720	Q633-M716 HydrophobicContact CB-CG 4.09Å; M634-M716 HydrophobicContact CB-SD 4.47Å; M634-M716 HydrophobicContact CG-SD 4.03Å; I637-M716 HydrophobicContact CB-CE 4.47Å; I637-M716 HydrophobicContact CB-SD 4.18Å; I637-M716 HydrophobicContact CG1-CE 3.74Å; I637-M716 HydrophobicContact CG1-SD 3.45Å; I637-M716 WeakPolarHBondContact CG1-SD 3.5Å; M713-M716 HydrophobicContact CE-CE 3.49Å; M713-M716 VanDerWaalsContact CE-CE 3.49Å; M713-M716 HydrophobicContact SD-CE 3.57Å; M713-M716 VanDerWaalsContact SD-CE 3.57Å; M716-E718 VanDerWaalsContact C-N 3.32Å; M716-E718 PolarHBondContact O-N 3.43Å; M716-G719 PolarHBondContact O-N 2.71Å; M716-L720 HydrophobicContact CE-CD1 4.34Å; M716-L720 HydrophobicContact CG-CD1 3.77Å; M716-L720 HydrophobicContact CG-CG 4.29Å; M716-L720 WeakPolarHBondContact O-CG 3.41Å; M716-L720 PolarHBondContact O-N 3.45Å; M716-L720 HydrophobicContact SD-CD1 4.23Å
717	V	94	Very high	93.2	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-70.9	-31.1	-176.2	174.1	0	0	0	0	111.3	L589 F590 M713 Q714 L720 L721	L589-V717 HydrophobicContact CB-CG1 3.93Å; L589-V717 HydrophobicContact CD2-CG1 4.27Å; L589-V717 HydrophobicContact CG-CG1 4.08Å; F590-V717 HydrophobicContact CD1-CB 4.1Å; F590-V717 HydrophobicContact CD1-CG1 4.35Å; F590-V717 HydrophobicContact CD1-CG2 3.77Å; F590-V717 HydrophobicContact CD2-CB 4.28Å; F590-V717 HydrophobicContact CD2-CG1 3.64Å; F590-V717 HydrophobicContact CD2-CG2 4.44Å; F590-V717 HydrophobicContact CE1-CB 3.86Å; F590-V717 HydrophobicContact CE1-CG1 4.26Å; F590-V717 HydrophobicContact CE1-CG2 3.99Å; F590-V717 HydrophobicContact CE2-CB 4.02Å; F590-V717 HydrophobicContact CE2-CG1 3.52Å; F590-V717 HydrophobicContact CG-CB 4.3Å; F590-V717 HydrophobicContact CG-CG1 4.05Å; F590-V717 HydrophobicContact CG-CG2 4.01Å; F590-V717 HydrophobicContact CZ-CB 3.8Å; F590-V717 HydrophobicContact CZ-CG1 3.84Å; F590-V717 HydrophobicContact CZ-CG2 4.39Å; M713-V717 HydrophobicContact CE-CG2 4.05Å; M713-V717 WeakPolarHBondContact O-CB 3.36Å; M713-V717 VanDerWaalsContact O-CG2 3.24Å; M713-V717 WeakPolarHBondContact O-CG2 3.44Å; M713-V717 PolarHBondContact O-N 3.06Å; Q714-V717 PolarHBondContact O-N 3.46Å; V717-L720 PolarHBondContact O-N 3.07Å; V717-L721 HydrophobicContact CG1-CD1 4.28Å; V717-L721 HydrophobicContact CG1-CG 4.31Å; V717-L721 WeakPolarHBondContact O-CB 3.39Å; V717-L721 VanDerWaalsContact O-CG 3.28Å; V717-L721 WeakPolarHBondContact O-CG 3.21Å; V717-L721 PolarHBondContact O-N 3.29Å
718	E	91	Very high	93	Very high	87 Å²	87	35.5 Å²	35.5	41%	0.407	17%	0.173	S	C	.	.	H	α-helix	trans	-58.4	-49.4	166.7	169.6	159.4	-144.3	0	0	111.8	Q714 M716 L720 L721 Q722 F752	Q714-E718 VanDerWaalsContact O-CB 3.31Å; Q714-E718 WeakPolarHBondContact O-CB 3.41Å; Q714-E718 PolarHBondContact O-N 3.15Å; M716-E718 VanDerWaalsContact C-N 3.32Å; M716-E718 PolarHBondContact O-N 3.43Å; E718-L720 PolarHBondContact O-N 3.48Å; E718-L721 PolarHBondContact O-N 3.21Å; E718-Q722 WeakPolarHBondContact O-CG 3.46Å; E718-Q722 PolarHBondContact O-N 3.33Å; E718-F752 HydrophobicContact CB-CZ 4.45Å; E718-F752 HydrophobicContact CG-CZ 3.94Å
719	G	91.8	Very high	92.7	Very high	13 Å²	13	33.7 Å²	33.7	13%	0.134	17%	0.171	C	C	.	.	H	α-helix	trans	-60.2	-43.1	175.1	0	0	0	0	0	113.6	E715 M716 Q722 I723	E715-G719 PolarHBondContact O-N 2.85Å; M716-G719 PolarHBondContact O-N 2.71Å; G719-Q722 PolarHBondContact O-N 3.21Å; G719-I723 PolarHBondContact O-N 3.46Å; G719-I723 VanDerWaalsContact O-N 3.12Å
720	L	92.8	Very high	92.3	Very high	11 Å²	11	35.5 Å²	35.5	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-67.5	-37	176.7	-66.1	167.1	0	0	0	112.2	L589 S593 Q630 M634 M716 V717 E718 I723 C724	L589-L720 HydrophobicContact CD2-CB 3.68Å; L589-L720 HydrophobicContact CG-CB 4.43Å; S593-L720 WeakPolarHBondContact OG-CD1 3.38Å; Q630-L720 HydrophobicContact CB-CD2 4.14Å; M634-L720 HydrophobicContact CE-CD2 3.95Å; M634-L720 HydrophobicContact CG-CD1 4Å; M634-L720 HydrophobicContact CG-CD2 4.25Å; M634-L720 HydrophobicContact SD-CD1 4.24Å; M634-L720 HydrophobicContact SD-CD2 4.1Å; M716-L720 HydrophobicContact CE-CD1 4.34Å; M716-L720 HydrophobicContact CG-CD1 3.77Å; M716-L720 HydrophobicContact CG-CG 4.29Å; M716-L720 WeakPolarHBondContact O-CG 3.41Å; M716-L720 PolarHBondContact O-N 3.45Å; M716-L720 HydrophobicContact SD-CD1 4.23Å; V717-L720 PolarHBondContact O-N 3.07Å; E718-L720 PolarHBondContact O-N 3.48Å; L720-I723 PolarHBondContact O-N 3.44Å; L720-C724 WeakPolarHBondContact O-CB 3.44Å; L720-C724 PolarHBondContact O-N 3.22Å; L720-C724 PolarHBondContact O-SG 3.47Å
721	L	92	Very high	91.7	Very high	9 Å²	9	42 Å²	42	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-63.6	-43.4	173.7	-79.6	173.4	0	0	0	110.9	W588 L589 V717 E718 I723 C724 F725 F752	W588-L721 HydrophobicContact CZ2-CD2 4.18Å; L589-L721 HydrophobicContact CB-CD2 4.49Å; L589-L721 HydrophobicContact CD2-CD2 3.85Å; L589-L721 HydrophobicContact CD2-CG 3.91Å; V717-L721 HydrophobicContact CG1-CD1 4.28Å; V717-L721 HydrophobicContact CG1-CG 4.31Å; V717-L721 WeakPolarHBondContact O-CB 3.39Å; V717-L721 VanDerWaalsContact O-CG 3.28Å; V717-L721 WeakPolarHBondContact O-CG 3.21Å; V717-L721 PolarHBondContact O-N 3.29Å; E718-L721 PolarHBondContact O-N 3.21Å; L721-I723 VanDerWaalsContact C-N 3.33Å; L721-I723 PolarHBondContact O-N 2.92Å; L721-C724 WeakPolarHBondContact O-CB 3.4Å; L721-C724 PolarHBondContact O-N 3.49Å; L721-F725 HydrophobicContact CB-CE2 4.19Å; L721-F725 HydrophobicContact CB-CZ 4.21Å; L721-F725 HydrophobicContact CD2-CE1 4.28Å; L721-F725 HydrophobicContact CD2-CZ 4.12Å; L721-F725 WeakPolarHBondContact O-CD2 3.47Å; L721-F725 WeakPolarHBondContact O-CG 3.33Å; L721-F725 PolarHBondContact O-N 3.21Å; L721-F752 HydrophobicContact CD1-CD2 4.26Å; L721-F752 HydrophobicContact CD1-CE2 4.02Å
722	Q	90.9	Very high	91.2	Very high	98 Å²	98	46.1 Å²	46.1	46%	0.458	24%	0.235	S	C	.	.	H	α-helix	trans	-59.2	-42.4	176.2	-69.4	172.4	21	0	0	111.8	E718 G719 F725 Y726	E718-Q722 WeakPolarHBondContact O-CG 3.46Å; E718-Q722 PolarHBondContact O-N 3.33Å; G719-Q722 PolarHBondContact O-N 3.21Å; Q722-F725 PolarHBondContact O-N 2.96Å; Q722-Y726 WeakPolarHBondContact O-CB 3.44Å; Q722-Y726 PolarHBondContact O-N 3.21Å
723	I	90.7	Very high	90.7	Very high	17 Å²	17	46.5 Å²	46.5	9%	0.087	23%	0.233	C	C	.	.	H	α-helix	trans	-70.1	-34.2	176.7	-132.8	68.1	0	0	0	112.5	L126 L626 Q630 G719 L720 L721 T727	L126-I723 HydrophobicContact CD1-CD1 4.19Å; L626-I723 HydrophobicContact CD1-CD1 3.95Å; L626-I723 HydrophobicContact CD1-CG1 4.06Å; L626-I723 HydrophobicContact CG-CG1 4.41Å; Q630-I723 HydrophobicContact CG-CB 4.5Å; Q630-I723 HydrophobicContact CG-CG1 4.2Å; Q630-I723 HydrophobicContact CG-CG2 4.17Å; G719-I723 PolarHBondContact O-N 3.46Å; G719-I723 VanDerWaalsContact O-N 3.12Å; L720-I723 PolarHBondContact O-N 3.44Å; L721-I723 VanDerWaalsContact C-N 3.33Å; L721-I723 PolarHBondContact O-N 2.92Å; I723-T727 WeakPolarHBondContact O-CB 3.3Å; I723-T727 WeakPolarHBondContact O-CG2 3.36Å; I723-T727 PolarHBondContact O-N 3.37Å; I723-T727 PolarHBondContact O-OG1 2.78Å
724	C	91.8	Very high	90.3	Very high	16 Å²	16	50.7 Å²	50.7	11%	0.108	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-45.7	172.1	-69.2	0	0	0	0	111.3	L720 L721 T727 F728	L720-C724 WeakPolarHBondContact O-CB 3.44Å; L720-C724 PolarHBondContact O-N 3.22Å; L720-C724 PolarHBondContact O-SG 3.47Å; L721-C724 WeakPolarHBondContact O-CB 3.4Å; L721-C724 PolarHBondContact O-N 3.49Å; C724-T727 PolarHBondContact O-N 2.84Å; C724-T727 PolarHBondContact O-OG1 3.48Å; C724-F728 WeakPolarHBondContact O-CB 3.26Å; C724-F728 PolarHBondContact O-N 3.47Å
725	F	92.1	Very high	90.2	Very high	27 Å²	27	50.1 Å²	50.1	12%	0.118	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-44.2	177.6	-59.9	-22.7	0	0	0	111.8	L721 Q722 T727 F728 V729 I745 Q748 I749 F752	L721-F725 HydrophobicContact CB-CE2 4.19Å; L721-F725 HydrophobicContact CB-CZ 4.21Å; L721-F725 HydrophobicContact CD2-CE1 4.28Å; L721-F725 HydrophobicContact CD2-CZ 4.12Å; L721-F725 WeakPolarHBondContact O-CD2 3.47Å; L721-F725 WeakPolarHBondContact O-CG 3.33Å; L721-F725 PolarHBondContact O-N 3.21Å; Q722-F725 PolarHBondContact O-N 2.96Å; F725-T727 PolarHBondContact O-N 3.3Å; F725-F728 PolarHBondContact O-N 3.01Å; F725-V729 WeakPolarHBondContact O-CG2 3.23Å; F725-V729 PolarHBondContact O-N 2.89Å; F725-I745 HydrophobicContact CD1-CG2 3.81Å; F725-I745 HydrophobicContact CE1-CG2 4.09Å; F725-Q748 HydrophobicContact CZ-CB 4.29Å; F725-I749 HydrophobicContact CB-CG1 4.39Å; F725-I749 HydrophobicContact CD1-CD1 4.2Å; F725-I749 HydrophobicContact CD1-CG1 3.64Å; F725-I749 HydrophobicContact CD2-CG1 4.35Å; F725-I749 HydrophobicContact CE1-CG1 3.9Å; F725-I749 HydrophobicContact CG-CG1 3.88Å; F725-I749 HydrophobicContact CZ-CG1 4.38Å; F725-F752 HydrophobicContact CE2-CB 3.95Å; F725-F752 HydrophobicContact CE2-CD1 4.27Å; F725-F752 HydrophobicContact CE2-CD2 4.49Å; F725-F752 AromaticContact CE2-CG 3.97Å; F725-F752 HydrophobicContact CE2-CG 3.97Å; F725-F752 HydrophobicContact CZ-CB 4.36Å
726	Y	91.1	Very high	90.3	Very high	82 Å²	82	50.4 Å²	50.4	32%	0.322	26%	0.263	S	S	.	.	H	α-helix	trans	-58.7	-47.4	176.3	176.1	-104.6	0	0	0	112	L128 Q722 N730 L733	L128-Y726 HydrophobicContact CD2-CD2 4.42Å; Q722-Y726 WeakPolarHBondContact O-CB 3.44Å; Q722-Y726 PolarHBondContact O-N 3.21Å; Y726-N730 WeakPolarHBondContact O-CB 3.47Å; Y726-N730 PolarHBondContact O-N 3.04Å; Y726-N730 PolarHBondContact OH-ND2 2.85Å; Y726-L733 HydrophobicContact CD1-CD1 4.23Å; Y726-L733 HydrophobicContact CE1-CD1 3.77Å
727	T	91.3	Very high	90.4	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-75.9	-26.4	179.9	54.6	0	0	0	0	114	M548 L626 I723 C724 F725 L733	M548-T727 HydrophobicContact CE-CG2 3.51Å; M548-T727 HydrophobicContact SD-CG2 4.44Å; L626-T727 HydrophobicContact CD2-CG2 3.6Å; I723-T727 WeakPolarHBondContact O-CB 3.3Å; I723-T727 WeakPolarHBondContact O-CG2 3.36Å; I723-T727 PolarHBondContact O-N 3.37Å; I723-T727 PolarHBondContact O-OG1 2.78Å; C724-T727 PolarHBondContact O-N 2.84Å; C724-T727 PolarHBondContact O-OG1 3.48Å; F725-T727 PolarHBondContact O-N 3.3Å; T727-L733 HydrophobicContact CG2-CD1 3.63Å
728	F	92.3	Very high	90.4	Very high	26 Å²	26	53.2 Å²	53.2	11%	0.114	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-43.2	171.4	177.5	-102.3	0	0	0	112	C724 F725 K731 F737 T742 I745 I749	C724-F728 WeakPolarHBondContact O-CB 3.26Å; C724-F728 PolarHBondContact O-N 3.47Å; F725-F728 PolarHBondContact O-N 3.01Å; F728-K731 WeakPolarHBondContact O-CE 3.43Å; F728-K731 PolarHBondContact O-NZ 3.41Å; F728-F737 VanDerWaalsContact CA-CE2 3.49Å; F728-F737 HydrophobicContact CB-CE1 4.19Å; F728-F737 HydrophobicContact CB-CE2 3.98Å; F728-F737 HydrophobicContact CB-CZ 3.79Å; F728-F737 HydrophobicContact CD2-CB 4.35Å; F728-F737 HydrophobicContact CD2-CD1 4.12Å; F728-F737 AromaticContact CD2-CD2 3.97Å; F728-F737 HydrophobicContact CD2-CD2 3.97Å; F728-F737 HydrophobicContact CD2-CE1 4.4Å; F728-F737 HydrophobicContact CD2-CE2 4.28Å; F728-F737 AromaticContact CD2-CG 3.89Å; F728-F737 HydrophobicContact CD2-CG 3.89Å; F728-F737 HydrophobicContact CD2-CZ 4.47Å; F728-T742 HydrophobicContact CE2-CG2 3.84Å; F728-T742 HydrophobicContact CZ-CG2 3.93Å; F728-I745 HydrophobicContact CB-CG2 4.14Å; F728-I745 HydrophobicContact CD1-CG2 3.61Å; F728-I745 HydrophobicContact CD2-CD1 4.49Å; F728-I745 HydrophobicContact CD2-CG2 4.15Å; F728-I745 HydrophobicContact CE1-CG2 3.98Å; F728-I745 HydrophobicContact CE2-CG2 4.48Å; F728-I745 HydrophobicContact CG-CG2 3.7Å; F728-I745 HydrophobicContact CZ-CG2 4.4Å; F728-I749 HydrophobicContact CD1-CD1 3.89Å; F728-I749 HydrophobicContact CE1-CD1 4.17Å
729	V	90.1	Very high	90.4	Very high	74 Å²	74	56.8 Å²	56.8	45%	0.448	30%	0.295	S	S	.	.	H	α-helix	trans	-76.5	-44.4	178.6	176.8	0	0	0	0	111.4	L131 F725 K731	L131-V729 HydrophobicContact CD2-CG1 4.13Å; F725-V729 WeakPolarHBondContact O-CG2 3.23Å; F725-V729 PolarHBondContact O-N 2.89Å; V729-K731 PolarHBondContact O-N 3.19Å
730	N	89.1	Confident	90.3	Very high	40 Å²	40	57.4 Å²	57.4	21%	0.214	30%	0.295	C	S	.	.			trans	-79.7	82.4	-175.6	-172.6	3.8	0	0	0	112.9	Y726 T732 L733	Y726-N730 WeakPolarHBondContact O-CB 3.47Å; Y726-N730 PolarHBondContact O-N 3.04Å; Y726-N730 PolarHBondContact OH-ND2 2.85Å; N730-T732 PolarHBondContact ND2-OG1 3.12Å; N730-T732 PolarHBondContact O-N 2.92Å; N730-T732 WeakPolarHBondContact OD1-CB 3.26Å; N730-T732 PolarHBondContact OD1-N 3.4Å; N730-T732 PolarHBondContact OD1-OG1 3.36Å; N730-L733 HydrophobicContact CB-CD1 4.15Å; N730-L733 HydrophobicContact CB-CG 4.42Å; N730-L733 PolarHBondContact O-N 3.4Å
731	K	84	Confident	90.3	Very high	139 Å²	139	56.9 Å²	56.9	60%	0.604	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-59.2	-17.4	179.4	-54.6	-51.1	-173.5	-170.8	0	114.7	F728 V729 L733 S734	F728-K731 WeakPolarHBondContact O-CE 3.43Å; F728-K731 PolarHBondContact O-NZ 3.41Å; V729-K731 PolarHBondContact O-N 3.19Å; K731-L733 PolarHBondContact O-N 2.96Å; K731-S734 PolarHBondContact O-N 3Å
732	T	84.3	Confident	90.4	Very high	115 Å²	115	58.7 Å²	58.7	71%	0.706	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-63.6	-23.1	177.8	69	0	0	0	0	113.2	N730 S734	N730-T732 PolarHBondContact ND2-OG1 3.12Å; N730-T732 PolarHBondContact O-N 2.92Å; N730-T732 WeakPolarHBondContact OD1-CB 3.26Å; N730-T732 PolarHBondContact OD1-N 3.4Å; N730-T732 PolarHBondContact OD1-OG1 3.36Å; T732-S734 PolarHBondContact O-N 3.29Å
733	L	83.5	Confident	90.5	Very high	55 Å²	55	55.6 Å²	55.6	29%	0.288	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-76.2	-7.3	-179.9	-59.3	174.7	0	0	0	113.6	S545 L626 Y726 T727 N730 K731 V735	S545-L733 VanDerWaalsContact CB-O 3.26Å; S545-L733 WeakPolarHBondContact CB-O 3.33Å; L626-L733 HydrophobicContact CD2-CD1 4.21Å; Y726-L733 HydrophobicContact CD1-CD1 4.23Å; Y726-L733 HydrophobicContact CE1-CD1 3.77Å; T727-L733 HydrophobicContact CG2-CD1 3.63Å; N730-L733 HydrophobicContact CB-CD1 4.15Å; N730-L733 HydrophobicContact CB-CG 4.42Å; N730-L733 PolarHBondContact O-N 3.4Å; K731-L733 PolarHBondContact O-N 2.96Å; L733-V735 HydrophobicContact CB-CG2 4.01Å; L733-V735 PolarHBondContact O-N 3.17Å
734	S	86.6	Confident	90.6	Very high	88 Å²	88	54.9 Å²	54.9	62%	0.615	29%	0.286	S	S	*	.			trans	52.9	36.5	-179.2	-53.4	0	0	0	0	113.6	K731 T732	K731-S734 PolarHBondContact O-N 3Å; T732-S734 PolarHBondContact O-N 3.29Å
735	V	91.8	Very high	90.6	Very high	16 Å²	16	54.1 Å²	54.1	10%	0.097	28%	0.28	C	S	.	.			trans	-91.7	124.2	175.2	-179.8	0	0	0	0	109.1	M548 N552 L733 F737	M548-V735 HydrophobicContact CB-CG1 3.82Å; M548-V735 HydrophobicContact CB-CG2 4.03Å; M548-V735 HydrophobicContact SD-CG2 4.18Å; N552-V735 VanDerWaalsContact ND2-CG1 3.32Å; N552-V735 WeakPolarHBondContact ND2-CG1 3.49Å; L733-V735 HydrophobicContact CB-CG2 4.01Å; L733-V735 PolarHBondContact O-N 3.17Å; V735-F737 HydrophobicContact CB-CE2 4.22Å; V735-F737 HydrophobicContact CG1-CD2 4.25Å; V735-F737 HydrophobicContact CG1-CE2 3.62Å; V735-F737 HydrophobicContact CG1-CZ 4.16Å
736	E	92.6	Very high	90.6	Very high	132 Å²	132	56.2 Å²	56.2	62%	0.617	30%	0.296	S	S	*	.			trans	-90.1	147.3	179.5	-58.4	176.3	151.3	0	0	110.7	S549 N552	S549-E736 PolarHBondContact OG-N 2.99Å; N552-E736 WeakPolarHBondContact CB-O 3.46Å; N552-E736 PolarHBondContact ND2-O 2.93Å
737	F	94.3	Very high	90.5	Very high	31 Å²	31	54.8 Å²	54.8	14%	0.136	29%	0.293	C	S	.	.			trans	-131	131.6	176	-72.7	-101.3	0	0	0	108.8	N552 F728 V735 I745	N552-F737 HydrophobicContact CB-CD1 4.41Å; N552-F737 WeakPolarHBondContact ND2-CD1 3.35Å; N552-F737 VanDerWaalsContact ND2-CE1 3.26Å; N552-F737 WeakPolarHBondContact ND2-CE1 3.42Å; N552-F737 WeakPolarHBondContact ND2-CE2 3.14Å; N552-F737 VanDerWaalsContact ND2-CZ 3.3Å; N552-F737 WeakPolarHBondContact ND2-CZ 3.05Å; F728-F737 VanDerWaalsContact CA-CE2 3.49Å; F728-F737 HydrophobicContact CB-CE1 4.19Å; F728-F737 HydrophobicContact CB-CE2 3.98Å; F728-F737 HydrophobicContact CB-CZ 3.79Å; F728-F737 HydrophobicContact CD2-CB 4.35Å; F728-F737 HydrophobicContact CD2-CD1 4.12Å; F728-F737 AromaticContact CD2-CD2 3.97Å; F728-F737 HydrophobicContact CD2-CD2 3.97Å; F728-F737 HydrophobicContact CD2-CE1 4.4Å; F728-F737 HydrophobicContact CD2-CE2 4.28Å; F728-F737 AromaticContact CD2-CG 3.89Å; F728-F737 HydrophobicContact CD2-CG 3.89Å; F728-F737 HydrophobicContact CD2-CZ 4.47Å; V735-F737 HydrophobicContact CB-CE2 4.22Å; V735-F737 HydrophobicContact CG1-CD2 4.25Å; V735-F737 HydrophobicContact CG1-CE2 3.62Å; V735-F737 HydrophobicContact CG1-CZ 4.16Å; F737-I745 HydrophobicContact CD1-CD1 3.64Å; F737-I745 HydrophobicContact CE1-CD1 3.57Å
738	P	94.2	Very high	90.2	Very high	38 Å²	38	55.1 Å²	55.1	25%	0.247	30%	0.295	C	S	.	.			trans	-59.5	156.8	168.8	-23.3	33.8	0	0	0	112	N552 M740 L741 T742	N552-P738 WeakPolarHBondContact O-CG 3.45Å; P738-M740 PolarHBondContact O-N 2.79Å; P738-L741 PolarHBondContact O-N 3.14Å; P738-L741 VanDerWaalsContact O-N 3.13Å; P738-T742 WeakPolarHBondContact O-CB 3.33Å; P738-T742 PolarHBondContact O-N 3.11Å; P738-T742 PolarHBondContact O-OG1 3.4Å
739	E	91.2	Very high	89.9	Confident	162 Å²	162	55.9 Å²	55.9	76%	0.757	30%	0.299	S	S	*	.	H	α-helix	trans	-53	-50	177.1	-174.1	165.6	-140.2	0	0	112.7	L741 T742 E743	E739-L741 VanDerWaalsContact C-N 3.34Å; E739-L741 PolarHBondContact O-N 2.99Å; E739-T742 CarbonylContact O-C 3.45Å; E739-T742 WeakPolarHBondContact O-CA 3.45Å; E739-T742 VanDerWaalsContact O-CB 3.26Å; E739-T742 WeakPolarHBondContact O-CB 3.44Å; E739-T742 PolarHBondContact O-N 3.01Å; E739-E743 PolarHBondContact O-N 3.39Å
740	M	90.3	Very high	89.6	Confident	26 Å²	26	55.3 Å²	55.3	13%	0.128	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-37.2	176.7	178	174	-76	0	0	113.9	W176 V559 I560 P738 I744	W176-M740 HydrophobicContact CH2-CE 3.65Å; W176-M740 HydrophobicContact CH2-CG 4.13Å; W176-M740 HydrophobicContact CH2-SD 3.87Å; W176-M740 HydrophobicContact CZ2-CE 4.34Å; W176-M740 HydrophobicContact CZ2-CG 4.44Å; W176-M740 HydrophobicContact CZ3-CE 3.81Å; W176-M740 HydrophobicContact CZ3-SD 4.4Å; V559-M740 HydrophobicContact CB-SD 3.87Å; V559-M740 HydrophobicContact CG1-CG 4.18Å; V559-M740 HydrophobicContact CG1-SD 3.53Å; V559-M740 VanDerWaalsContact CG1-SD 3.53Å; I560-M740 HydrophobicContact CG1-CE 3.77Å; I560-M740 HydrophobicContact CG1-SD 3.63Å; P738-M740 PolarHBondContact O-N 2.79Å; M740-I744 HydrophobicContact CG-CD1 3.97Å; M740-I744 WeakPolarHBondContact O-CB 3.33Å; M740-I744 WeakPolarHBondContact O-CD1 3.19Å; M740-I744 VanDerWaalsContact O-CG1 3.23Å; M740-I744 WeakPolarHBondContact O-CG1 3.48Å; M740-I744 PolarHBondContact O-N 2.93Å
741	L	93	Very high	89.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-75.1	-32.1	173.8	-68.1	-166.8	0	0	0	111.5	N552 V559 W588 P738 E739 I744 I745	N552-L741 HydrophobicContact CB-CD1 4.26Å; N552-L741 WeakPolarHBondContact O-CD1 3.44Å; V559-L741 HydrophobicContact CG2-CD2 3.87Å; W588-L741 HydrophobicContact CE3-CD2 3.96Å; W588-L741 HydrophobicContact CH2-CD2 4.37Å; W588-L741 HydrophobicContact CZ3-CD1 4.28Å; W588-L741 HydrophobicContact CZ3-CD2 3.86Å; P738-L741 PolarHBondContact O-N 3.14Å; P738-L741 VanDerWaalsContact O-N 3.13Å; E739-L741 VanDerWaalsContact C-N 3.34Å; E739-L741 PolarHBondContact O-N 2.99Å; L741-I744 PolarHBondContact O-N 3.32Å; L741-I745 HydrophobicContact CB-CD1 4.42Å; L741-I745 WeakPolarHBondContact O-CB 3.39Å; L741-I745 WeakPolarHBondContact O-CD1 3.17Å; L741-I745 WeakPolarHBondContact O-CG1 3.41Å; L741-I745 PolarHBondContact O-N 3.4Å
742	T	93.5	Very high	89.1	Confident	48 Å²	48	52.7 Å²	52.7	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175	-63.3	0	0	0	0	110.9	F728 P738 E739 T746	F728-T742 HydrophobicContact CE2-CG2 3.84Å; F728-T742 HydrophobicContact CZ-CG2 3.93Å; P738-T742 WeakPolarHBondContact O-CB 3.33Å; P738-T742 PolarHBondContact O-N 3.11Å; P738-T742 PolarHBondContact O-OG1 3.4Å; E739-T742 CarbonylContact O-C 3.45Å; E739-T742 WeakPolarHBondContact O-CA 3.45Å; E739-T742 VanDerWaalsContact O-CB 3.26Å; E739-T742 WeakPolarHBondContact O-CB 3.44Å; E739-T742 PolarHBondContact O-N 3.01Å; T742-T746 WeakPolarHBondContact O-CB 3.3Å; T742-T746 PolarHBondContact O-N 3.05Å; T742-T746 PolarHBondContact O-OG1 3.1Å
743	E	92.9	Very high	88.8	Confident	32 Å²	32	52.9 Å²	52.9	15%	0.15	28%	0.275	C	S	.	.	H	α-helix	trans	-58.1	-56.9	172.3	-177.1	-152.8	132.2	0	0	111.1	W176 E739 I745 T746 N747	W176-E743 PolarHBondContact NE1-OE1 3.09Å; E739-E743 PolarHBondContact O-N 3.39Å; E743-I745 VanDerWaalsContact C-N 3.32Å; E743-I745 PolarHBondContact O-N 3.36Å; E743-T746 PolarHBondContact O-N 3.13Å; E743-N747 WeakPolarHBondContact O-CB 3.4Å; E743-N747 PolarHBondContact O-N 3.13Å
744	I	92.9	Very high	88.8	Confident	3 Å²	3	56 Å²	56	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-61.6	-37.3	-176.4	-69.3	169.1	0	0	0	112.3	W176 V559 Q585 W588 M740 L741 Q748	W176-I744 HydrophobicContact CH2-CD1 4.31Å; W176-I744 HydrophobicContact CZ2-CD1 4.23Å; W176-I744 HydrophobicContact CZ2-CG1 4.47Å; V559-I744 HydrophobicContact CG1-CD1 3.77Å; V559-I744 HydrophobicContact CG2-CD1 4.5Å; Q585-I744 HydrophobicContact CG-CG1 4.47Å; W588-I744 HydrophobicContact CG-CG2 4.29Å; M740-I744 HydrophobicContact CG-CD1 3.97Å; M740-I744 WeakPolarHBondContact O-CB 3.33Å; M740-I744 WeakPolarHBondContact O-CD1 3.19Å; M740-I744 VanDerWaalsContact O-CG1 3.23Å; M740-I744 WeakPolarHBondContact O-CG1 3.48Å; M740-I744 PolarHBondContact O-N 2.93Å; L741-I744 PolarHBondContact O-N 3.32Å; I744-Q748 VanDerWaalsContact CG2-NE2 3.34Å; I744-Q748 WeakPolarHBondContact O-CB 3.26Å; I744-Q748 WeakPolarHBondContact O-CG 3.4Å; I744-Q748 PolarHBondContact O-N 2.86Å; I744-Q748 PolarHBondContact O-NE2 3.12Å
745	I	92.5	Very high	88.5	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-73.1	-46.4	177.5	-72.8	167.4	0	0	0	110.6	F725 F728 F737 L741 E743 N747 Q748 I749	F725-I745 HydrophobicContact CD1-CG2 3.81Å; F725-I745 HydrophobicContact CE1-CG2 4.09Å; F728-I745 HydrophobicContact CB-CG2 4.14Å; F728-I745 HydrophobicContact CD1-CG2 3.61Å; F728-I745 HydrophobicContact CD2-CD1 4.49Å; F728-I745 HydrophobicContact CD2-CG2 4.15Å; F728-I745 HydrophobicContact CE1-CG2 3.98Å; F728-I745 HydrophobicContact CE2-CG2 4.48Å; F728-I745 HydrophobicContact CG-CG2 3.7Å; F728-I745 HydrophobicContact CZ-CG2 4.4Å; F737-I745 HydrophobicContact CD1-CD1 3.64Å; F737-I745 HydrophobicContact CE1-CD1 3.57Å; L741-I745 HydrophobicContact CB-CD1 4.42Å; L741-I745 WeakPolarHBondContact O-CB 3.39Å; L741-I745 WeakPolarHBondContact O-CD1 3.17Å; L741-I745 WeakPolarHBondContact O-CG1 3.41Å; L741-I745 PolarHBondContact O-N 3.4Å; E743-I745 VanDerWaalsContact C-N 3.32Å; E743-I745 PolarHBondContact O-N 3.36Å; I745-N747 VanDerWaalsContact C-N 3.29Å; I745-N747 PolarHBondContact O-N 3.36Å; I745-Q748 PolarHBondContact O-N 3.08Å; I745-I749 HydrophobicContact CG2-CD1 3.61Å; I745-I749 HydrophobicContact CG2-CG1 4.1Å; I745-I749 WeakPolarHBondContact O-CG1 3.43Å; I745-I749 PolarHBondContact O-N 3.46Å
746	T	91.8	Very high	88.1	Confident	71 Å²	71	54.3 Å²	54.3	44%	0.436	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-41.6	178.8	-57	0	0	0	0	111.1	T742 E743 Q748 P750	T742-T746 WeakPolarHBondContact O-CB 3.3Å; T742-T746 PolarHBondContact O-N 3.05Å; T742-T746 PolarHBondContact O-OG1 3.1Å; E743-T746 PolarHBondContact O-N 3.13Å; T746-Q748 VanDerWaalsContact C-N 3.31Å; T746-Q748 PolarHBondContact O-N 2.92Å; T746-P750 WeakPolarHBondContact O-CD 3.48Å
747	N	88.1	Confident	87.9	Confident	51 Å²	51	49.5 Å²	49.5	27%	0.273	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.2	176.7	-77.2	-26.5	0	0	0	114.4	E743 I745 K751	E743-N747 WeakPolarHBondContact O-CB 3.4Å; E743-N747 PolarHBondContact O-N 3.13Å; I745-N747 VanDerWaalsContact C-N 3.29Å; I745-N747 PolarHBondContact O-N 3.36Å; N747-K751 VanDerWaalsContact O-CD 3.23Å; N747-K751 WeakPolarHBondContact O-CD 3.44Å; N747-K751 WeakPolarHBondContact O-CE 3.35Å; N747-K751 WeakPolarHBondContact O-CG 3.02Å
748	Q	86	Confident	87.6	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.047	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-31	177.1	-83.9	-171.7	96.3	0	0	115.1	Q585 F725 I744 I745 T746 K751 F752	Q585-Q748 PolarHBondContact O-NE2 3.45Å; Q585-Q748 PolarHBondContact O-OE1 2.87Å; Q585-Q748 VanDerWaalsContact O-OE1 3.1Å; F725-Q748 HydrophobicContact CZ-CB 4.29Å; I744-Q748 VanDerWaalsContact CG2-NE2 3.34Å; I744-Q748 WeakPolarHBondContact O-CB 3.26Å; I744-Q748 WeakPolarHBondContact O-CG 3.4Å; I744-Q748 PolarHBondContact O-N 2.86Å; I744-Q748 PolarHBondContact O-NE2 3.12Å; I745-Q748 PolarHBondContact O-N 3.08Å; T746-Q748 VanDerWaalsContact C-N 3.31Å; T746-Q748 PolarHBondContact O-N 2.92Å; Q748-K751 PolarHBondContact O-N 3.41Å; Q748-K751 VanDerWaalsContact O-N 3.1Å; Q748-F752 WeakPolarHBondContact O-CB 3.38Å; Q748-F752 PolarHBondContact O-N 3Å
749	I	85.1	Confident	87.5	Confident	42 Å²	42	54.5 Å²	54.5	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-48.6	-49.8	179.3	-76.5	165.6	0	0	0	113	F725 F728 I745 K753	F725-I749 HydrophobicContact CB-CG1 4.39Å; F725-I749 HydrophobicContact CD1-CD1 4.2Å; F725-I749 HydrophobicContact CD1-CG1 3.64Å; F725-I749 HydrophobicContact CD2-CG1 4.35Å; F725-I749 HydrophobicContact CE1-CG1 3.9Å; F725-I749 HydrophobicContact CG-CG1 3.88Å; F725-I749 HydrophobicContact CZ-CG1 4.38Å; F728-I749 HydrophobicContact CD1-CD1 3.89Å; F728-I749 HydrophobicContact CE1-CD1 4.17Å; I745-I749 HydrophobicContact CG2-CD1 3.61Å; I745-I749 HydrophobicContact CG2-CG1 4.1Å; I745-I749 WeakPolarHBondContact O-CG1 3.43Å; I745-I749 PolarHBondContact O-N 3.46Å; I749-K753 VanDerWaalsContact O-CB 3.22Å; I749-K753 WeakPolarHBondContact O-CB 3.4Å; I749-K753 PolarHBondContact O-N 3.47Å
750	P	83.3	Confident	87.6	Confident	63 Å²	63	48.5 Å²	48.5	41%	0.409	26%	0.261	S	S	.	.	H	α-helix	trans	-67.6	-45.4	176.3	25.7	-32.6	0	0	0	112	T746 F752 K753 D754	T746-P750 WeakPolarHBondContact O-CD 3.48Å; P750-F752 PolarHBondContact O-N 2.62Å; P750-K753 PolarHBondContact O-N 3.27Å; P750-K753 VanDerWaalsContact O-N 3.13Å; P750-D754 PolarHBondContact O-N 3.21Å
751	K	82.9	Confident	87.7	Confident	65 Å²	65	50.2 Å²	50.2	28%	0.283	27%	0.271	S	S	.	.	H	α-helix	trans	-56.8	-36.6	179.1	-61.1	-179.7	-172.6	177.5	0	112.4	N747 Q748 G755 S756	N747-K751 VanDerWaalsContact O-CD 3.23Å; N747-K751 WeakPolarHBondContact O-CD 3.44Å; N747-K751 WeakPolarHBondContact O-CE 3.35Å; N747-K751 WeakPolarHBondContact O-CG 3.02Å; Q748-K751 PolarHBondContact O-N 3.41Å; Q748-K751 VanDerWaalsContact O-N 3.1Å; K751-G755 CarbonylContact O-C 3.59Å; K751-G755 PolarHBondContact O-N 3.22Å; K751-S756 VanDerWaalsContact CA-OG 3.31Å; K751-S756 WeakPolarHBondContact CA-OG 3.12Å; K751-S756 WeakPolarHBondContact CB-OG 3.38Å; K751-S756 PolarHBondContact O-N 2.64Å; K751-S756 PolarHBondContact O-OG 3.32Å; K751-S756 VanDerWaalsContact O-OG 3.13Å
752	F	80.6	Confident	87.7	Confident	58 Å²	58	52.7 Å²	52.7	25%	0.254	28%	0.282	S	S	.	.	H	α-helix	trans	-78.2	-43.1	176.7	-156.2	-82.2	0	0	0	112	E718 L721 F725 Q748 P750 D754 G755 V757	E718-F752 HydrophobicContact CB-CZ 4.45Å; E718-F752 HydrophobicContact CG-CZ 3.94Å; L721-F752 HydrophobicContact CD1-CD2 4.26Å; L721-F752 HydrophobicContact CD1-CE2 4.02Å; F725-F752 HydrophobicContact CE2-CB 3.95Å; F725-F752 HydrophobicContact CE2-CD1 4.27Å; F725-F752 HydrophobicContact CE2-CD2 4.49Å; F725-F752 AromaticContact CE2-CG 3.97Å; F725-F752 HydrophobicContact CE2-CG 3.97Å; F725-F752 HydrophobicContact CZ-CB 4.36Å; Q748-F752 WeakPolarHBondContact O-CB 3.38Å; Q748-F752 PolarHBondContact O-N 3Å; P750-F752 PolarHBondContact O-N 2.62Å; F752-D754 PolarHBondContact O-N 2.63Å; F752-G755 WeakPolarHBondContact O-CA 2.95Å; F752-G755 PolarHBondContact O-N 3.13Å; F752-V757 HydrophobicContact CD2-CG2 4.42Å
753	K	77.4	Confident	87.6	Confident	120 Å²	120	52.8 Å²	52.8	52%	0.522	28%	0.279	S	S	.	.	H	α-helix	trans	-60.7	-42.9	178.9	-179.3	-179.9	177	-178.6	0	112.9	F132 I749 P750 G755	F132-K753 VanDerWaalsContact CD2-NZ 3.25Å; F132-K753 HydrophobicContact CE2-CD 4.12Å; F132-K753 HydrophobicContact CZ-CD 4.48Å; I749-K753 VanDerWaalsContact O-CB 3.22Å; I749-K753 WeakPolarHBondContact O-CB 3.4Å; I749-K753 PolarHBondContact O-N 3.47Å; P750-K753 PolarHBondContact O-N 3.27Å; P750-K753 VanDerWaalsContact O-N 3.13Å; K753-G755 PolarHBondContact O-N 3.16Å
754	D	83.6	Confident	87	Confident	121 Å²	121	60.4 Å²	60.4	65%	0.647	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-2.1	177.1	-56.4	-25	0	0	0	111.6	P750 F752 S756	P750-D754 PolarHBondContact O-N 3.21Å; F752-D754 PolarHBondContact O-N 2.63Å; D754-S756 PolarHBondContact O-N 3.45Å
755	G	81.4	Confident	85.3	Confident	24 Å²	24	71.1 Å²	71.1	25%	0.247	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	56	34.3	-175.5	0	0	0	0	0	112.5	K665 K751 F752 K753 V757	K665-G755 VanDerWaalsContact CD-O 3.26Å; K665-G755 WeakPolarHBondContact CD-O 3.46Å; K665-G755 WeakPolarHBondContact CE-O 3.31Å; K665-G755 PolarHBondContact NZ-O 3.38Å; K751-G755 CarbonylContact O-C 3.59Å; K751-G755 PolarHBondContact O-N 3.22Å; F752-G755 WeakPolarHBondContact O-CA 2.95Å; F752-G755 PolarHBondContact O-N 3.13Å; K753-G755 PolarHBondContact O-N 3.16Å; G755-V757 PolarHBondContact O-N 3.02Å
756	S	83.1	Confident	85	Confident	44 Å²	44	74.7 Å²	74.7	31%	0.308	38%	0.379	S	S	.	.			trans	-73.1	-9.3	-175.7	73	0	0	0	0	113.5	K665 K751 D754	K665-S756 WeakPolarHBondContact CB-O 3.35Å; K665-S756 WeakPolarHBondContact CG-O 3.35Å; K665-S756 PolarHBondContact N-O 2.94Å; K751-S756 VanDerWaalsContact CA-OG 3.31Å; K751-S756 WeakPolarHBondContact CA-OG 3.12Å; K751-S756 WeakPolarHBondContact CB-OG 3.38Å; K751-S756 PolarHBondContact O-N 2.64Å; K751-S756 PolarHBondContact O-OG 3.32Å; K751-S756 VanDerWaalsContact O-OG 3.13Å; D754-S756 PolarHBondContact O-N 3.45Å
757	V	87.3	Confident	84.6	Confident	30 Å²	30	74.8 Å²	74.8	18%	0.182	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	157.1	172.1	-65.9	0	0	0	0	112.7	T662 V663 F752 G755	T662-V757 HydrophobicContact CG2-CB 4.3Å; V663-V757 CarbonylContact O-C 3.57Å; F752-V757 HydrophobicContact CD2-CG2 4.42Å; G755-V757 PolarHBondContact O-N 3.02Å
758	K	89.3	Confident	84.4	Confident	112 Å²	112	76.2 Å²	76.2	49%	0.487	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	123.1	-179.4	-179.6	-177.4	176.3	-175.3	0	110.3	V663 K665	V663-K758 PolarHBondContact N-O 3.25Å; V663-K758 PolarHBondContact O-N 3.26Å; K665-K758 HydrophobicContact CG-CB 4.17Å
759	P	91.8	Very high	84.4	Confident	62 Å²	62	80.1 Å²	80.1	40%	0.403	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	139.7	171.7	31.8	-34.8	0	0	0	111.1	Q714 L761	Q714-P759 VanDerWaalsContact OE1-CB 3.3Å; P759-L761 HydrophobicContact CB-CD2 4.3Å
760	L	92.8	Very high	84.3	Confident	36 Å²	36	82.4 Å²	82.4	19%	0.188	41%	0.413	C	S	.	.			trans	-101.5	73.7	176.8	-59.9	-176.5	0	0	0	110	S661 V663 F674 R678	S661-L760 WeakPolarHBondContact O-CB 3.49Å; S661-L760 PolarHBondContact O-N 2.87Å; V663-L760 HydrophobicContact CG1-CD1 3.82Å; V663-L760 HydrophobicContact CG1-CG 4.48Å; V663-L760 HydrophobicContact CG2-CD1 4.03Å; V663-L760 HydrophobicContact CG2-CD2 3.9Å; V663-L760 HydrophobicContact CG2-CG 3.98Å; F674-L760 HydrophobicContact CE1-CD1 3.69Å; F674-L760 HydrophobicContact CZ-CD1 3.64Å; R678-L760 PolarHBondContact NH2-O 3.16Å
761	L	92.8	Very high	84.4	Confident	63 Å²	63	83.7 Å²	83.7	33%	0.33	41%	0.413	S	S	.	.			trans	-62.2	150	176.8	-54.2	-179.3	0	0	0	111.8	D711 Q714 P759 H763 K765	D711-L761 HydrophobicContact CB-CD2 4.31Å; D711-L761 VanDerWaalsContact OD1-CA 3.28Å; D711-L761 WeakPolarHBondContact OD1-CA 3.34Å; Q714-L761 HydrophobicContact CB-CD2 4.5Å; Q714-L761 HydrophobicContact CG-CD2 3.77Å; P759-L761 HydrophobicContact CB-CD2 4.3Å; L761-H763 VanDerWaalsContact CB-O 3.3Å; L761-H763 WeakPolarHBondContact CB-O 2.99Å; L761-K765 HydrophobicContact CD1-CG 4.41Å
762	F	93.4	Very high	84.5	Confident	51 Å²	51	85.1 Å²	85.1	22%	0.224	42%	0.422	C	S	.	.	S	Bend	trans	-84.3	-25.9	170.4	-71.8	-88.6	0	0	0	112.5	L657 I682 T707 L710 D711	L657-F762 HydrophobicContact CB-CZ 4.44Å; L657-F762 HydrophobicContact CD1-CZ 4.19Å; I682-F762 HydrophobicContact CD1-CE1 3.89Å; I682-F762 HydrophobicContact CG1-CE1 4.02Å; I682-F762 HydrophobicContact CG1-CZ 4.46Å; T707-F762 HydrophobicContact CG2-CB 4.28Å; T707-F762 HydrophobicContact CG2-CD1 3.58Å; T707-F762 HydrophobicContact CG2-CD2 4.13Å; T707-F762 HydrophobicContact CG2-CE1 3.87Å; T707-F762 HydrophobicContact CG2-CE2 4.39Å; T707-F762 HydrophobicContact CG2-CG 3.72Å; T707-F762 HydrophobicContact CG2-CZ 4.27Å; L710-F762 HydrophobicContact CB-CD2 4.17Å; L710-F762 HydrophobicContact CB-CE2 4.07Å; L710-F762 HydrophobicContact CD1-CD2 4.19Å; L710-F762 HydrophobicContact CD1-CE2 3.47Å; L710-F762 VanDerWaalsContact CD1-CE2 3.47Å; L710-F762 HydrophobicContact CD1-CZ 3.96Å; L710-F762 HydrophobicContact CG-CE2 4.42Å; D711-F762 PolarHBondContact OD1-N 2.67Å
763	H	91.9	Very high	84.8	Confident	50 Å²	50	87.2 Å²	87.2	23%	0.231	44%	0.435	C	S	.	.	S	Bend	trans	-126.3	153.9	177.9	-44	102.6	0	0	0	111.3	Y704 T707 D711 L761	Y704-H763 AromaticContact CD2-CD2 3.71Å; Y704-H763 AromaticContact CD2-CE1 3.79Å; Y704-H763 AromaticContact CD2-NE2 3.16Å; Y704-H763 WeakPolarHBondContact CD2-NE2 3.27Å; Y704-H763 AromaticContact CE2-CD2 3.59Å; Y704-H763 AromaticContact CE2-CE1 3.88Å; Y704-H763 AromaticContact CE2-NE2 3.47Å; Y704-H763 WeakPolarHBondContact CE2-NE2 3.24Å; T707-H763 PolarHBondContact OG1-CE1 3.35Å; T707-H763 PolarHBondContact OG1-NE2 3.42Å; D711-H763 IonicContact OD2-CE1 2.68Å; D711-H763 IonicContact OD2-CG 3.29Å; D711-H763 PolarHBondContact OD2-N 2.87Å; D711-H763 VanDerWaalsContact OD2-N 3.13Å; D711-H763 IonicContact OD2-ND1 2.86Å; D711-H763 PolarHBondContact OD2-ND1 2.89Å; L761-H763 VanDerWaalsContact CB-O 3.3Å; L761-H763 WeakPolarHBondContact CB-O 2.99Å
764	Q	79.9	Confident	85.4	Confident	193 Å²	193	84.4 Å²	84.4	90%	0.902	43%	0.428	S	S	*	.			trans	-73.9	145.2	166	-67	173.9	-13	0	0	109
765	K	57.6	Low	85.6	Confident	227 Å²	227	81.1 Å²	81.1	99%	0.987	41%	0.408	S	S	*	.			trans	-72.4	0	173	-72.5	-158.8	176.7	-162.3	0	110.4	E715 L761	E715-K765 IonicContact OE2-NZ 3.88Å; E715-K765 PolarHBondContact OE2-NZ 3.33Å; L761-K765 HydrophobicContact CD1-CG 4.41Å

Retrieved 765 of 765 residues in 837.6 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).