A0A3Q0KIF8_SCHMA Loading...

AcidPPc domain-containing protein

AlphaFold DB (A0A5K4EI77), UniProt , Accession A0A3Q0KIF8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 795 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	33.4	Very low	235 Å²	235	154 Å²	154	100%	1.158	83%	0.828	S	S	*	*				0	112.5	0	-82.5	170.1	167.9	0	0	108
2	N	34.7	Very low	32.9	Very low	144 Å²	144	151.3 Å²	151.3	77%	0.77	82%	0.821	S	S	*	*			trans	52.5	96.8	156.8	-50.4	-5.3	0	0	0	118.2
3	T	32.5	Very low	32.7	Very low	118 Å²	118	155.9 Å²	155.9	72%	0.724	83%	0.829	S	S	*	*				56.5	108.7	78.5	67	0	0	0	0	116.2
4	L	37.9	Very low	32.5	Very low	170 Å²	170	156.4 Å²	156.4	89%	0.89	83%	0.832	S	S	*	*				164.6	156.9	113.2	-84.6	164.5	0	0	0	112.9
5	P	35.6	Very low	32.7	Very low	110 Å²	110	150.8 Å²	150.8	71%	0.714	83%	0.826	S	S	*	*			trans	-129.1	177.2	-150	41.8	-24.6	0	0	0	116.7
6	A	35.2	Very low	32.6	Very low	86 Å²	86	151.3 Å²	151.3	71%	0.711	83%	0.827	S	S	*	*			trans	74.8	138.7	142.9	0	0	0	0	0	123.3
7	N	32.9	Very low	32.8	Very low	155 Å²	155	151.7 Å²	151.7	83%	0.829	83%	0.829	S	S	*	*			trans	80.4	108	152.6	-74.7	-11.9	0	0	0	120.5
8	R	33.8	Very low	32.7	Very low	246 Å²	246	150.5 Å²	150.5	93%	0.928	83%	0.827	S	S	*	*				-177.4	130.4	100.6	-99.2	175.7	179.6	178.5	0.4	112.6
9	T	30	Very low	32.7	Very low	129 Å²	129	156.3 Å²	156.3	79%	0.791	84%	0.835	S	S	*	*			trans	-66.9	138	165.6	45.4	0	0	0	0	112
10	L	32.6	Very low	32.5	Very low	167 Å²	167	160.3 Å²	160.3	87%	0.874	84%	0.838	S	S	*	*			trans	-160.9	109.7	145.1	-133.4	106	0	0	0	112.6
11	N	30.7	Very low	32.5	Very low	134 Å²	134	158 Å²	158	72%	0.717	84%	0.835	S	S	*	*			trans	23.5	116.8	138.3	-61.7	-10.5	0	0	0	120.7
12	T	27.1	Very low	32.4	Very low	121 Å²	121	151.6 Å²	151.6	74%	0.742	81%	0.814	S	S	*	*				33.4	117.8	129.4	56.8	0	0	0	0	118.6
13	F	30.5	Very low	32.4	Very low	212 Å²	212	152.5 Å²	152.5	93%	0.93	82%	0.817	S	S	*	*			trans	-156.6	134	131.5	-119.1	-83.7	0	0	0	112
14	N	30.2	Very low	32.4	Very low	163 Å²	163	151.9 Å²	151.9	87%	0.872	82%	0.818	S	S	*	*			trans	-55.9	143.4	173	-104.5	-23.6	0	0	0	112.3
15	G	35.1	Very low	32.1	Very low	72 Å²	72	148.1 Å²	148.1	74%	0.742	81%	0.811	S	S	*	*			trans	-166.4	86.5	171	0	0	0	0	0	111.9	N17	G15-N17 PolarHBondContact O-N 3.48Å
16	N	31.2	Very low	31.9	Very low	158 Å²	158	151.4 Å²	151.4	85%	0.845	82%	0.821	S	S	*	*			trans	-47.9	130.9	164.1	-82.5	-29.5	0	0	0	110.8
17	N	36	Very low	31.6	Very low	159 Å²	159	158 Å²	158	85%	0.85	83%	0.827	S	S	*	*			trans	-164.2	114.3	131.2	-96.1	-27.5	0	0	0	112.6	G15	G15-N17 PolarHBondContact O-N 3.48Å
18	T	30.5	Very low	31.4	Very low	130 Å²	130	162.1 Å²	162.1	80%	0.798	83%	0.833	S	S	*	*			trans	-47.7	136	162.8	43.5	0	0	0	0	114.1
19	R	32.7	Very low	31.4	Very low	260 Å²	260	155.3 Å²	155.3	98%	0.981	83%	0.829	S	S	*	*			trans	-150.4	134	134.9	-110.1	178.7	-165.3	-155.8	4	111.9
20	R	28	Very low	31.3	Very low	237 Å²	237	161.1 Å²	161.1	89%	0.894	84%	0.837	S	S	*	*			trans	-93.9	145.3	-167.7	-124.6	179.6	-168.1	174.9	3	110.5
21	S	34.2	Very low	31.4	Very low	111 Å²	111	158.2 Å²	158.2	78%	0.776	83%	0.83	S	S	*	*			trans	179.9	89.4	138	36.9	0	0	0	0	109.1
22	S	29.9	Very low	31.5	Very low	102 Å²	102	157.8 Å²	157.8	71%	0.713	83%	0.832	S	S	*	*				58.8	116.4	80.7	70.6	0	0	0	0	116.1
23	I	33.3	Very low	31.6	Very low	162 Å²	162	156.9 Å²	156.9	83%	0.831	83%	0.831	S	S	*	*			trans	179.4	93.6	145.5	-89.2	151.8	0	0	0	105.6
24	S	33.2	Very low	31.5	Very low	106 Å²	106	153 Å²	153	74%	0.741	82%	0.82	S	S	*	*				63.1	143.4	102.3	69.4	0	0	0	0	116.3
25	A	30.5	Very low	31.5	Very low	91 Å²	91	154.8 Å²	154.8	75%	0.752	82%	0.815	S	S	*	*			cis	170.4	124.6	-20	0	0	0	0	0	105.3
26	I	31.7	Very low	31.4	Very low	178 Å²	178	159.4 Å²	159.4	91%	0.913	82%	0.815	S	S	*	*			trans	-149.2	128.6	149	-61.3	-169.5	0	0	0	108.9
27	R	28.7	Very low	31.5	Very low	226 Å²	226	156.4 Å²	156.4	85%	0.853	81%	0.805	S	S	*	*			trans	-82.4	158.9	-172.5	-66	173.8	-170.9	173	2.6	113.9
28	Y	29.8	Very low	31.1	Very low	241 Å²	241	155.8 Å²	155.8	95%	0.945	80%	0.801	S	S	*	*				-147.8	160.7	120.2	-93.3	-75.4	0	0	0	110.5
29	A	33.9	Very low	31.2	Very low	103 Å²	103	155.5 Å²	155.5	85%	0.851	80%	0.799	S	S	*	*			trans	-87.5	159.2	-140.1	0	0	0	0	0	118.6
30	R	27.9	Very low	31	Very low	251 Å²	251	149.4 Å²	149.4	95%	0.947	79%	0.786	S	S	*	*			trans	-133.6	144.9	176.6	-155	-177.7	-162.4	-175	5.1	109.4
31	S	33.9	Very low	31.3	Very low	106 Å²	106	143.5 Å²	143.5	74%	0.741	78%	0.777	S	S	*	*			trans	-116.8	106.5	166.1	37.1	0	0	0	0	109.6
32	T	33.2	Very low	31.2	Very low	124 Å²	124	144.8 Å²	144.8	76%	0.761	78%	0.775	S	S	*	*				55.5	104.5	112.8	58.4	0	0	0	0	114.7
33	S	29.4	Very low	31.3	Very low	102 Å²	102	147.9 Å²	147.9	71%	0.713	78%	0.778	S	S	*	*				48.6	135.8	69.1	106.7	0	0	0	0	113.9
34	L	28.4	Very low	31.2	Very low	132 Å²	132	148.1 Å²	148.1	69%	0.691	78%	0.775	S	S	*	*				175.9	167.1	54.6	-126.2	162.6	0	0	0	111.6
35	Y	30.7	Very low	31.2	Very low	199 Å²	199	148 Å²	148	78%	0.78	78%	0.775	S	S	*	*			trans	89.3	106.8	165.7	-87.9	-95.9	0	0	0	119.8
36	F	31.8	Very low	31.2	Very low	170 Å²	170	154.5 Å²	154.5	75%	0.746	78%	0.78	S	S	*	*				98.5	154.4	64.2	-94.2	-63.1	0	0	0	113.2
37	P	33.4	Very low	31	Very low	95 Å²	95	150.3 Å²	150.3	62%	0.617	77%	0.766	S	S	*	*				-130.9	179.5	-126.1	36.4	-13.5	0	0	0	117.2
38	N	28.5	Very low	31.2	Very low	145 Å²	145	147.7 Å²	147.7	78%	0.775	76%	0.764	S	S	*	*			trans	77	149.9	152.2	-78	1.7	0	0	0	122.5
39	T	32.6	Very low	31.3	Very low	124 Å²	124	142.5 Å²	142.5	76%	0.761	75%	0.752	S	S	*	*			trans	69.9	145.1	166.9	68	0	0	0	0	116.1
40	D	29	Very low	31.1	Very low	133 Å²	133	145.2 Å²	145.2	71%	0.711	75%	0.751	S	S	*	*			cis	-176.6	164	-22.3	-110.8	-36.3	0	0	0	102.9
41	T	32.7	Very low	31.4	Very low	112 Å²	112	137 Å²	137	69%	0.687	74%	0.737	S	S	*	*			trans	66.7	113.5	151.8	51.2	0	0	0	0	120.8
42	D	32.3	Very low	31.3	Very low	138 Å²	138	136.6 Å²	136.6	74%	0.738	73%	0.734	S	S	*	*				98.4	127.8	121.1	-58.5	-15.5	0	0	0	122.7
43	E	32.7	Very low	31.3	Very low	167 Å²	167	139.1 Å²	139.1	78%	0.78	74%	0.737	S	S	*	*			trans	65.8	109.9	142.8	-72.3	-176.6	167.6	0	0	119.5
44	E	31.1	Very low	31.3	Very low	167 Å²	167	138.8 Å²	138.8	78%	0.78	74%	0.735	S	S	*	*				72.8	104.5	80.6	-166.9	177.3	-169	0	0	112.1
45	S	33.4	Very low	31.6	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	74%	0.742	S	S	*	*				159	122.5	120.1	51.4	0	0	0	0	113.4
46	R	29.6	Very low	31.6	Very low	228 Å²	228	134.6 Å²	134.6	86%	0.86	74%	0.736	S	S	*	*			trans	48.6	105.8	133.6	-76.1	174.3	126.8	150.2	-2.9	117.8
47	S	28.7	Very low	31.7	Very low	90 Å²	90	135 Å²	135	63%	0.629	74%	0.739	S	S	*	*				56.8	113.5	91.2	73.6	0	0	0	0	113.6
48	Q	32.7	Very low	31.7	Very low	171 Å²	171	135.4 Å²	135.4	80%	0.799	74%	0.74	S	S	*	*			trans	176.4	142.8	132.4	-99.7	170.9	19.1	0	0	112
49	L	30.9	Very low	32	Very low	131 Å²	131	139.7 Å²	139.7	69%	0.686	75%	0.746	S	S	*	*			trans	77.8	106.6	152.4	-64.2	143.4	0	0	0	115.7
50	L	29.5	Very low	31.9	Very low	161 Å²	161	144.7 Å²	144.7	84%	0.843	75%	0.751	S	S	*	*				63.6	128.9	84.1	-71.5	161.5	0	0	0	110.2
51	A	34.9	Very low	31.9	Very low	78 Å²	78	142.7 Å²	142.7	65%	0.645	75%	0.753	S	S	*	*			cis	-166.1	173.2	17.8	0	0	0	0	0	108.7
52	S	31.5	Very low	32	Very low	97 Å²	97	146.3 Å²	146.3	68%	0.678	76%	0.762	S	S	*	*			trans	33.9	133.9	140	61.1	0	0	0	0	118.8
53	E	34.2	Very low	32.1	Very low	177 Å²	177	147 Å²	147	83%	0.827	77%	0.771	S	S	*	*				176.3	157.7	51.8	-140.3	161.5	-172	0	0	109.2
54	S	29.8	Very low	32.1	Very low	95 Å²	95	147.5 Å²	147.5	66%	0.664	78%	0.776	S	S	*	*			trans	-55.7	158.2	169.3	51.6	0	0	0	0	114.5
55	I	34	Very low	32.2	Very low	167 Å²	167	146.7 Å²	146.7	86%	0.856	78%	0.777	S	S	*	*				-172.2	139.4	129.4	-91	145.7	0	0	0	110
56	A	30.2	Very low	32.3	Very low	77 Å²	77	152.8 Å²	152.8	64%	0.636	78%	0.784	S	S	*	*			trans	-84.2	-177.9	-178.2	0	0	0	0	0	113.4
57	E	34	Very low	32.5	Very low	177 Å²	177	148.6 Å²	148.6	83%	0.827	78%	0.778	S	S	*	*			trans	93.1	108.2	149.5	-71.5	171.4	154.1	0	0	121.3
58	T	32.9	Very low	32.9	Very low	104 Å²	104	150.5 Å²	150.5	64%	0.638	78%	0.781	S	S	*	*				69.8	117.5	116.7	-40.4	0	0	0	0	120.8
59	R	34.9	Very low	32.7	Very low	236 Å²	236	153.3 Å²	153.3	89%	0.891	78%	0.784	S	S	*	*			trans	171.5	105.8	132.8	-98.2	-178.4	-84.9	-179.6	-5.4	110.1
60	R	31	Very low	32.9	Very low	228 Å²	228	154.4 Å²	154.4	86%	0.86	79%	0.789	S	S	*	*				41.7	116.9	91.6	-86.5	-168.3	-178.2	98.9	-0	117.3
61	A	28.6	Very low	33.1	Very low	92 Å²	92	153.9 Å²	153.9	76%	0.76	79%	0.787	S	S	*	*			trans	34.8	124.5	138.1	0	0	0	0	0	121.2
62	E	34.5	Very low	32.8	Very low	188 Å²	188	156.1 Å²	156.1	88%	0.879	79%	0.793	S	S	*	*				152.1	118.4	127.5	-88.7	179.7	169.3	0	0	110.6
63	T	36.1	Very low	32.9	Very low	152 Å²	152	161.7 Å²	161.7	93%	0.933	81%	0.805	S	S	*	*			trans	-163.9	95.8	142.2	25.6	0	0	0	0	109
64	M	32	Very low	32.6	Very low	178 Å²	178	160.4 Å²	160.4	88%	0.877	80%	0.804	S	S	*	*			trans	-77.8	162.9	159.6	-89.9	-154.4	-100.7	0	0	110.9
65	N	33.3	Very low	32.8	Very low	150 Å²	150	165.5 Å²	165.5	80%	0.802	82%	0.817	S	S	*	*			trans	83.9	103	158	-76.2	-18.4	0	0	0	120.1
66	R	34.8	Very low	32.7	Very low	231 Å²	231	160.9 Å²	160.9	87%	0.872	81%	0.81	S	S	*	*			trans	-159.4	102.1	131.9	-104.3	163.5	-170.8	-122.4	3.9	108.1
67	L	34.8	Very low	32.5	Very low	140 Å²	140	162.4 Å²	162.4	73%	0.733	82%	0.816	S	S	*	*				67.6	130.4	102.9	-77.6	142.1	0	0	0	112.3
68	N	36.7	Very low	32.4	Very low	131 Å²	131	165.1 Å²	165.1	70%	0.701	82%	0.819	S	S	*	*			cis	-168.6	133.2	6.6	-104.9	-19.9	0	0	0	105.5
69	R	28.2	Very low	32.1	Very low	229 Å²	229	167.3 Å²	167.3	86%	0.864	83%	0.827	S	S	*	*				70	142.3	95.9	-138.5	-174.3	-131.1	-152.2	4.7	116.9
70	I	34.8	Very low	31.9	Very low	154 Å²	154	162.9 Å²	162.9	79%	0.79	82%	0.82	S	S	*	*			trans	110.5	125.6	173.3	-58.7	160.7	0	0	0	111.8
71	D	33.5	Very low	32	Very low	150 Å²	150	158 Å²	158	80%	0.802	82%	0.815	S	S	*	*			cis	-161.5	149.7	-16.6	-104.5	-25.6	0	0	0	107.6
72	V	29	Very low	31.9	Very low	126 Å²	126	161.1 Å²	161.1	76%	0.764	82%	0.82	S	S	*	*			trans	-100.4	140.3	177	169.6	0	0	0	0	109.7
73	K	34.3	Very low	31.8	Very low	213 Å²	213	157.2 Å²	157.2	93%	0.926	81%	0.81	S	S	*	*			trans	-134.9	121.1	152.7	-95.8	-172.3	177.1	-178.6	0	111.9
74	N	27.4	Very low	31.4	Very low	150 Å²	150	157.2 Å²	157.2	80%	0.802	80%	0.804	S	S	*	*			trans	-77.3	146.3	168.5	-98.7	-19.5	0	0	0	111.3
75	E	34.3	Very low	31.1	Very low	203 Å²	203	157.6 Å²	157.6	95%	0.949	80%	0.801	S	S	*	*			trans	178.8	137.5	143.8	-103	177.9	-169.9	0	0	105.6
76	G	31.3	Very low	30.9	Very low	69 Å²	69	157.3 Å²	157.3	71%	0.711	80%	0.8	S	S	*	*			cis	159.7	116.4	8.2	0	0	0	0	0	106.7
77	S	27.1	Very low	30.4	Very low	109 Å²	109	151.2 Å²	151.2	76%	0.762	79%	0.792	S	S	*	*			trans	39.2	120.2	147.5	-158.8	0	0	0	0	121
78	R	30.4	Very low	30.2	Very low	235 Å²	235	153.5 Å²	153.5	89%	0.887	80%	0.802	S	S	*	*				160.6	99.3	127.8	-84.5	159	-170.4	-168.7	4.6	108.9
79	N	27.6	Very low	29.8	Very low	150 Å²	150	152.5 Å²	152.5	80%	0.802	81%	0.805	S	S	*	*				53.6	126.8	88.4	-99.2	1.8	0	0	0	115.9
80	L	30.1	Very low	29.7	Very low	143 Å²	143	146.2 Å²	146.2	75%	0.749	80%	0.796	S	S	*	*			trans	99.4	117.1	159.8	-82.3	79.6	0	0	0	120.5
81	T	33.4	Very low	29.5	Very low	124 Å²	124	145.6 Å²	145.6	76%	0.761	79%	0.793	S	S	*	*			trans	80.8	104.6	135.2	56.9	0	0	0	0	121.7
82	N	26.8	Very low	29.5	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	79%	0.793	S	S	*	*			trans	6.2	169.4	134.6	-69.5	-13.5	0	0	0	120.5
83	P	33.3	Very low	29.5	Very low	105 Å²	105	147.7 Å²	147.7	68%	0.682	79%	0.794	S	S	*	*				-132.1	-164.9	-56.7	38.6	-18.8	0	0	0	110.7
84	L	26.2	Very low	29.2	Very low	152 Å²	152	142.9 Å²	142.9	80%	0.796	78%	0.784	S	S	*	*			trans	86.7	119.2	162.2	-72.5	152.4	0	0	0	120
85	F	26.3	Very low	29.3	Very low	186 Å²	186	147.5 Å²	147.5	82%	0.816	79%	0.791	S	S	*	*			trans	16	116.6	142.5	-84.8	-96.8	0	0	0	118.9
86	D	28.2	Very low	29	Very low	145 Å²	145	145.9 Å²	145.9	78%	0.775	79%	0.788	S	S	*	*				-177.7	117	117.1	-98.5	-23	0	0	0	109.6
87	S	25.5	Very low	28.8	Very low	103 Å²	103	154.9 Å²	154.9	72%	0.72	80%	0.8	S	S	*	*				82.8	113	110	80.1	0	0	0	0	114.5
88	M	30.3	Very low	28.9	Very low	188 Å²	188	152.9 Å²	152.9	93%	0.926	80%	0.797	S	S	*	*			trans	-150.2	103.7	143.5	-146.2	102.7	93.8	0	0	109.4
89	S	27.8	Very low	29	Very low	110 Å²	110	152.2 Å²	152.2	77%	0.769	80%	0.796	S	S	*	*			trans	-51.4	153.9	161.8	47.6	0	0	0	0	113.5
90	S	26.9	Very low	28.9	Very low	96 Å²	96	148.8 Å²	148.8	67%	0.671	80%	0.796	S	S	*	*				172.3	126	121	-167.2	0	0	0	0	113.4
91	I	30.1	Very low	28.9	Very low	142 Å²	142	149.8 Å²	149.8	73%	0.728	80%	0.797	S	S	*	*			trans	73.8	127.3	147.4	-69.6	164.2	0	0	0	118.1
92	D	32.7	Very low	28.6	Very low	150 Å²	150	150.8 Å²	150.8	80%	0.802	80%	0.804	S	S	*	*			cis	-164	144.3	-3.2	-99	-24.5	0	0	0	108.1
93	Q	30.6	Very low	28.7	Very low	170 Å²	170	148.4 Å²	148.4	79%	0.794	79%	0.794	S	S	*	*			trans	-107.8	158	165.6	-80.5	-159.1	-22	0	0	109.8
94	P	28	Very low	28.4	Very low	111 Å²	111	150 Å²	150	72%	0.721	80%	0.802	S	S	*	*				-152.3	129.1	113.4	33.4	-15.3	0	0	0	114.5
95	W	29.4	Very low	28.6	Very low	247 Å²	247	150.1 Å²	150.1	94%	0.936	80%	0.803	S	S	*	*			trans	-174.8	74.8	139	-79.6	109	0	0	0	108.8
96	L	26.7	Very low	28.7	Very low	170 Å²	170	146.2 Å²	146.2	89%	0.89	80%	0.798	S	S	*	*			trans	-165.7	90.6	158.8	-109.3	136.1	0	0	0	109.6
97	R	27.5	Very low	29	Very low	257 Å²	257	144.8 Å²	144.8	97%	0.97	80%	0.797	S	S	*	*			trans	-154.5	118.8	158.9	-110.3	-171.1	-164	-160.5	5.6	108.7
98	G	29.8	Very low	29.2	Very low	68 Å²	68	145.6 Å²	145.6	70%	0.701	80%	0.8	S	S	*	*			trans	163.3	79.7	169.2	0	0	0	0	0	114.9
99	Y	31.5	Very low	29.1	Very low	220 Å²	220	146.2 Å²	146.2	86%	0.863	80%	0.797	S	S	*	*			trans	75.1	101	150.3	-67.4	-85.1	0	0	0	120.1
100	G	26.2	Very low	29.3	Very low	78 Å²	78	148.2 Å²	148.2	80%	0.804	80%	0.798	S	S	*	*			trans	-69	130.3	138.3	0	0	0	0	0	110.2
101	Q	30.4	Very low	29.3	Very low	165 Å²	165	150.7 Å²	150.7	77%	0.771	80%	0.803	S	S	*	*			trans	-145.9	120.9	154.9	-103.5	-178.9	-6.3	0	0	107.8	V103	Q101-V103 PolarHBondContact O-N 3.2Å
102	T	26.1	Very low	29.3	Very low	145 Å²	145	151.5 Å²	151.5	89%	0.89	81%	0.809	S	S	*	*			trans	-67.8	112.3	170.6	45	0	0	0	0	109.1
103	V	29.6	Very low	29.2	Very low	108 Å²	108	150.3 Å²	150.3	66%	0.655	81%	0.809	S	S	*	*			trans	-115.1	108.7	169.6	-176.9	0	0	0	0	108.6	Q101 L105	Q101-V103 PolarHBondContact O-N 3.2Å; V103-L105 HydrophobicContact CB-CD1 4.45Å; V103-L105 HydrophobicContact CG1-CD1 3.76Å; V103-L105 HydrophobicContact CG1-CG 4.38Å; V103-L105 PolarHBondContact O-N 3.41Å
104	V	26.7	Very low	29.2	Very low	140 Å²	140	150.1 Å²	150.1	85%	0.848	81%	0.812	S	S	*	*			trans	-67.7	115.5	167.5	176.1	0	0	0	0	107.3
105	L	29.7	Very low	29.2	Very low	154 Å²	154	152.8 Å²	152.8	81%	0.806	81%	0.814	S	S	*	*			trans	-109.7	121.2	170.8	-91.4	118.3	0	0	0	110.5	V103	V103-L105 HydrophobicContact CB-CD1 4.45Å; V103-L105 HydrophobicContact CG1-CD1 3.76Å; V103-L105 HydrophobicContact CG1-CG 4.38Å; V103-L105 PolarHBondContact O-N 3.41Å
106	S	29.8	Very low	29.4	Very low	103 Å²	103	150.5 Å²	150.5	72%	0.72	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-59.6	151.3	178.6	-45	0	0	0	0	113
107	P	33.3	Very low	29.4	Very low	116 Å²	116	150.3 Å²	150.3	75%	0.753	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.2	139.2	178.1	30.8	-32.3	0	0	0	110.7	K109	P107-K109 PolarHBondContact O-N 3.3Å
108	P	31.5	Very low	29.6	Very low	120 Å²	120	146 Å²	146	78%	0.779	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-74.8	127.5	177.7	29.5	-30.6	0	0	0	110.6
109	K	27.1	Very low	29.5	Very low	200 Å²	200	146.9 Å²	146.9	87%	0.87	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.2	127.5	168.2	-72.6	175.8	175.9	177.4	0	109.2	P107	P107-K109 PolarHBondContact O-N 3.3Å
110	I	31.5	Very low	29.6	Very low	152 Å²	152	143.6 Å²	143.6	78%	0.779	79%	0.793	S	S	*	*			trans	-110.5	115.8	167.1	-63.1	174.6	0	0	0	108
111	N	28.6	Very low	29.7	Very low	148 Å²	148	147.8 Å²	147.8	79%	0.791	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-75.7	126.6	172.9	-68.9	-36.2	0	0	0	109.5
112	L	28.9	Very low	29.6	Very low	160 Å²	160	144.2 Å²	144.2	84%	0.838	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-85.4	132.5	165.4	-78.4	114.1	0	0	0	109.7
113	P	31.3	Very low	29.9	Very low	125 Å²	125	146 Å²	146	81%	0.812	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-82.4	141.1	169.7	31.6	-28.7	0	0	0	111.4
114	I	29.9	Very low	30	Very low	165 Å²	165	149.3 Å²	149.3	85%	0.846	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-75.7	145.7	-173.3	-68.7	161.6	0	0	0	111.4
115	Q	27.3	Very low	30.4	Very low	167 Å²	167	147.8 Å²	147.8	78%	0.78	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-55.9	141.1	171.6	-74	-177	-40.5	0	0	113.1
116	Q	33.7	Very low	30.2	Very low	199 Å²	199	145.8 Å²	145.8	93%	0.93	78%	0.783	S	S	*	*			trans	-126.8	113.3	146.3	-89.3	-173.2	-20	0	0	109.7
117	Q	27.2	Very low	30	Very low	166 Å²	166	146 Å²	146	78%	0.776	78%	0.784	S	S	*	*			trans	-62.9	143.2	160.2	-79.4	164.9	-65.9	0	0	109.7
118	N	31.8	Very low	29.8	Very low	167 Å²	167	148.8 Å²	148.8	89%	0.893	79%	0.789	S	S	*	*				-157.2	140.4	127.5	-96.1	-19.2	0	0	0	111.6
119	S	27.4	Very low	29.5	Very low	87 Å²	87	150.7 Å²	150.7	61%	0.608	79%	0.788	S	S	*	*			trans	-95.6	170.9	-166.8	41.3	0	0	0	0	114
120	H	33	Very low	29.5	Very low	150 Å²	150	148.3 Å²	148.3	69%	0.694	78%	0.78	S	S	*	*			trans	126.6	100.5	148.3	-69.5	-68.9	0	0	0	112.9
121	Q	29.9	Very low	29.3	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	78%	0.779	S	S	*	*				77.5	135.6	91.4	-92.8	178.5	-25.1	0	0	112.4
122	S	27.7	Very low	29.4	Very low	89 Å²	89	148 Å²	148	62%	0.622	79%	0.785	S	S	*	*			cis	179.2	164.1	-8.6	32.9	0	0	0	0	108.3
123	Q	32.5	Very low	29.4	Very low	184 Å²	184	145.2 Å²	145.2	86%	0.86	79%	0.785	S	S	*	*			trans	84.3	145.1	163.9	-60.1	171	-19.8	0	0	119.1
124	Q	31.9	Very low	29.5	Very low	177 Å²	177	144.6 Å²	144.6	83%	0.827	78%	0.784	S	S	*	*			cis	-172.3	176.4	-37	-141.8	-174.6	-13.2	0	0	106.1
125	P	34.3	Very low	29.6	Very low	108 Å²	108	142.1 Å²	142.1	70%	0.701	78%	0.776	S	S	*	*				-121.1	166.1	-93.1	40.6	-25.1	0	0	0	116.4
126	S	26.1	Very low	29.9	Very low	112 Å²	112	141 Å²	141	78%	0.783	77%	0.774	S	S	*	*			trans	-174	138.7	141.3	41.8	0	0	0	0	113.5
127	S	25.9	Very low	29.8	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	76%	0.764	S	S	*	*			trans	57.8	107.3	163	63.8	0	0	0	0	121.4
128	M	28	Very low	29.8	Very low	174 Å²	174	136.7 Å²	136.7	86%	0.857	76%	0.758	S	S	*	*			trans	161.1	141.5	131.5	-92.3	-176.3	-144.2	0	0	111.3
129	E	24.9	Very low	29.9	Very low	161 Å²	161	137.6 Å²	137.6	75%	0.752	76%	0.759	S	S	*	*			trans	39.6	139.5	151.6	-84.9	175.6	122.2	0	0	124.6
130	H	28.5	Very low	29.9	Very low	150 Å²	150	141.3 Å²	141.3	69%	0.694	77%	0.767	S	S	*	*			trans	80.6	127.3	147.3	-89.2	-69.3	0	0	0	122.7
131	D	27	Very low	29.8	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	77%	0.771	S	S	*	*			trans	66.6	105.3	149.7	-60.9	-7.8	0	0	0	120.8
132	T	30.9	Very low	29.7	Very low	151 Å²	151	139 Å²	139	93%	0.926	77%	0.767	S	S	*	*			trans	-82.8	111.2	161.1	38.3	0	0	0	0	111
133	A	28.8	Very low	29.7	Very low	100 Å²	100	142.5 Å²	142.5	83%	0.826	78%	0.777	S	S	*	*			trans	-110	132.5	151.3	0	0	0	0	0	108.9
134	S	32.8	Very low	29.4	Very low	113 Å²	113	145.3 Å²	145.3	79%	0.79	78%	0.78	S	S	*	*			trans	-164.4	140	165.6	84.9	0	0	0	0	105.8
135	T	33.3	Very low	29.3	Very low	112 Å²	112	144.9 Å²	144.9	69%	0.687	78%	0.782	S	S	*	*			cis	-173.4	142.5	20.6	-42.9	0	0	0	0	106.8
136	I	33.2	Very low	29.1	Very low	143 Å²	143	145.5 Å²	145.5	73%	0.733	79%	0.786	S	S	*	*				140	107.5	112.9	-69.9	-178.7	0	0	0	106
137	Q	30.6	Very low	29.5	Very low	154 Å²	154	146.3 Å²	146.3	72%	0.72	79%	0.787	S	S	*	*				83.9	123.4	78.5	-107	-177.5	-48.1	0	0	116.4
138	D	28.5	Very low	29.9	Very low	122 Å²	122	146.4 Å²	146.4	65%	0.652	79%	0.785	S	S	*	*			trans	76.9	108	145.5	-56.5	-26.6	0	0	0	121.8
139	M	32.2	Very low	30.1	Very low	186 Å²	186	149.7 Å²	149.7	92%	0.916	79%	0.788	S	S	*	*				164.3	123.5	102.5	-86.4	-170.7	-78.4	0	0	112.6
140	Q	28.3	Very low	30.4	Very low	165 Å²	165	147.1 Å²	147.1	77%	0.771	79%	0.787	S	S	*	*			trans	-74.9	149	164.5	-76.6	157.3	-73.5	0	0	111.1
141	H	31.1	Very low	30.8	Very low	170 Å²	170	145 Å²	145	79%	0.787	79%	0.787	S	S	*	*				160.6	133.8	118.4	-84.5	-69.8	0	0	0	114.8
142	S	27.2	Very low	31.1	Very low	99 Å²	99	144.8 Å²	144.8	69%	0.692	79%	0.786	S	S	*	*			trans	66.9	109.8	140.5	61.9	0	0	0	0	123.8
143	I	28.2	Very low	31.1	Very low	161 Å²	161	144 Å²	144	83%	0.826	78%	0.775	S	S	*	*				45.8	119.7	118.3	-53.2	164.8	0	0	0	119.3
144	R	27	Very low	31.3	Very low	243 Å²	243	147.6 Å²	147.6	92%	0.917	78%	0.776	S	S	*	*				179	128.9	120.2	-97.5	-178.3	-159.9	-157.6	5.4	113.1
145	L	27.8	Very low	31.3	Very low	168 Å²	168	150.9 Å²	150.9	88%	0.88	78%	0.779	S	S	*	*			trans	-90.3	159.6	160.6	-87.2	119.7	0	0	0	110.4
146	P	31.9	Very low	31.2	Very low	121 Å²	121	149.5 Å²	149.5	79%	0.786	79%	0.787	S	S	*	*			trans	-116.7	131.7	156.1	33.6	-19.6	0	0	0	112.8
147	T	34.3	Very low	31.2	Very low	129 Å²	129	146.3 Å²	146.3	79%	0.791	79%	0.789	S	S	*	*			trans	-101.6	163.7	151.6	53.4	0	0	0	0	108.2
148	P	34.4	Very low	31.1	Very low	110 Å²	110	150.8 Å²	150.8	71%	0.714	80%	0.801	S	S	*	*				-156.2	150.8	98.3	34.8	-13.5	0	0	0	118.7
149	R	31.9	Very low	31.2	Very low	242 Å²	242	148.4 Å²	148.4	91%	0.913	81%	0.806	S	S	*	*			trans	75.5	116.1	133.6	-71.2	173.1	-177.1	168.7	0.2	123.5
150	S	31.6	Very low	31.2	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	80%	0.803	S	S	*	*			trans	-75.6	165.8	142.7	66.1	0	0	0	0	111.1
151	P	36.7	Very low	31.3	Very low	107 Å²	107	144.3 Å²	144.3	70%	0.695	81%	0.807	S	S	*	*				-155.8	162.6	77.5	39.1	-17.2	0	0	0	118.7
152	N	32.8	Very low	31.5	Very low	137 Å²	137	141.4 Å²	141.4	73%	0.733	80%	0.803	S	S	*	*			trans	74.3	116.4	140.6	-66.3	-14.1	0	0	0	125.9
153	I	30.4	Very low	32	Very low	135 Å²	135	141.7 Å²	141.7	69%	0.692	80%	0.802	S	S	*	*				62.4	110	119.6	-52.8	163.9	0	0	0	119.4
154	M	34.1	Very low	32.1	Very low	175 Å²	175	141.2 Å²	141.2	86%	0.862	80%	0.801	S	S	*	*				-174.4	114.9	115.3	-110.2	-172.5	167.3	0	0	113.8
155	H	31.4	Very low	32.4	Very low	182 Å²	182	137.6 Å²	137.6	84%	0.843	80%	0.799	S	S	*	*			trans	26.3	132.9	143.6	-78.8	-76.4	0	0	0	125.7
156	G	32.5	Very low	32.3	Very low	84 Å²	84	140.4 Å²	140.4	87%	0.866	80%	0.8	S	S	*	*			trans	97.9	131	132	0	0	0	0	0	115.7
157	G	32.9	Very low	32.3	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	79%	0.79	S	S	*	*			cis	179.4	159	9.1	0	0	0	0	0	109.3
158	Y	28.8	Very low	32.2	Very low	248 Å²	248	138.1 Å²	138.1	97%	0.973	80%	0.795	S	S	*	*			trans	-67.7	159.5	-172.6	-72.5	-104.6	0	0	0	115.2
159	G	29.8	Very low	32	Very low	72 Å²	72	137.6 Å²	137.6	74%	0.742	79%	0.794	S	S	*	*			trans	149.6	99.7	145.9	0	0	0	0	0	118.8
160	A	31.8	Very low	32	Very low	104 Å²	104	133.2 Å²	133.2	86%	0.86	79%	0.787	S	S	*	*			trans	58.6	128	131.5	0	0	0	0	0	124
161	L	30.2	Very low	32.1	Very low	162 Å²	162	138.6 Å²	138.6	85%	0.848	79%	0.791	S	S	*	*			trans	-40.1	179.4	149.1	-80.6	130.2	0	0	0	115.5
162	P	35.6	Very low	32	Very low	109 Å²	109	140.5 Å²	140.5	71%	0.708	80%	0.796	S	S	*	*			cis	-135.5	-136.4	-27.7	31.4	-6.6	0	0	0	111
163	P	37.4	Very low	32	Very low	105 Å²	105	137 Å²	137	68%	0.682	79%	0.792	S	S	*	*				-116.7	177.8	-79.7	33.6	-14.3	0	0	0	115.8
164	L	29.8	Very low	32.1	Very low	151 Å²	151	141.3 Å²	141.3	79%	0.791	80%	0.801	S	S	*	*			trans	42	120.2	150.3	-77.9	156	0	0	0	120.9
165	N	33.3	Very low	32.1	Very low	166 Å²	166	137 Å²	137	89%	0.888	79%	0.793	S	S	*	*				-164.8	148.6	125.6	-113.6	-21.8	0	0	0	116.5
166	Y	27.1	Very low	32.2	Very low	227 Å²	227	133.9 Å²	133.9	89%	0.89	79%	0.792	S	S	*	*			trans	-67	159.7	173.7	-103.6	-109	0	0	0	113.8
167	G	31.4	Very low	32.2	Very low	57 Å²	57	134.5 Å²	134.5	59%	0.588	78%	0.783	S	S	*	*			trans	129.3	113.3	146.8	0	0	0	0	0	117.1
168	T	31.9	Very low	32.2	Very low	146 Å²	146	138.9 Å²	138.9	90%	0.896	79%	0.787	S	S	*	*			trans	44.1	149.9	131.7	61.8	0	0	0	0	120.5
169	S	29.9	Very low	32.6	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	78%	0.779	S	S	*	*			cis	170.5	160.8	-10	-178.4	0	0	0	0	103.9
170	I	33.2	Very low	33	Very low	150 Å²	150	130.7 Å²	130.7	77%	0.769	78%	0.777	S	S	*	*			trans	75	141.3	160.9	-45.9	-165.7	0	0	0	115.6
171	R	32.2	Very low	33.1	Very low	219 Å²	219	133.2 Å²	133.2	83%	0.826	78%	0.782	S	S	*	*			cis	178.4	177.3	-17.5	-169.8	177.3	-178.9	175.1	-0.9	104.8
172	D	35	Very low	33.4	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	77%	0.771	S	S	*	*			trans	101.4	127.9	164.3	-49.8	-21.4	0	0	0	113.6
173	G	32.4	Very low	33.4	Very low	63 Å²	63	130.7 Å²	130.7	65%	0.649	78%	0.783	S	S	*	*			cis	136.6	142.7	10.3	0	0	0	0	0	109.5
174	Y	33.9	Very low	33.3	Very low	227 Å²	227	129 Å²	129	89%	0.89	79%	0.785	S	S	*	*			trans	98.6	96.1	163.7	-61.3	-80.3	0	0	0	121.8
175	A	33.5	Very low	33.5	Very low	84 Å²	84	127.2 Å²	127.2	69%	0.694	79%	0.791	S	S	*	*				56.9	142.9	106	0	0	0	0	0	124.8
176	S	34.1	Very low	33.5	Very low	117 Å²	117	123.2 Å²	123.2	82%	0.818	79%	0.789	S	S	*	*			trans	92.4	150.5	149.2	-24.8	0	0	0	0	117.5
177	S	32.1	Very low	33.8	Very low	96 Å²	96	115.9 Å²	115.9	67%	0.671	78%	0.783	S	S	*	*			cis	178.1	150.7	-35.6	68.5	0	0	0	0	106.7
178	I	33.7	Very low	33.8	Very low	168 Å²	168	120.3 Å²	120.3	86%	0.862	80%	0.798	S	S	*	*			trans	88	129.2	151.8	-57.4	162.4	0	0	0	121.1
179	G	36	Very low	33.9	Very low	78 Å²	78	118.8 Å²	118.8	80%	0.804	79%	0.794	S	S	*	*			trans	113	128.2	148.7	0	0	0	0	0	115.2
180	G	37.8	Very low	33.9	Very low	69 Å²	69	122 Å²	122	71%	0.711	80%	0.803	S	S	*	*			cis	161.1	149.2	1.1	0	0	0	0	0	110.1
181	V	35.4	Very low	33.8	Very low	157 Å²	157	118 Å²	118	95%	0.952	80%	0.799	S	S	*	*			trans	73.3	138.3	153.7	-164.4	0	0	0	0	118.4
182	G	36.1	Very low	33.9	Very low	61 Å²	61	116 Å²	116	63%	0.629	80%	0.803	S	S	*	*			cis	-170.3	146	4.7	0	0	0	0	0	111
183	V	34.6	Very low	33.7	Very low	158 Å²	158	112.8 Å²	112.8	96%	0.958	80%	0.804	S	S	*	*				84.2	127	95.3	-176.8	0	0	0	0	117
184	G	35.3	Very low	33.7	Very low	69 Å²	69	113.5 Å²	113.5	71%	0.711	81%	0.812	S	S	*	*			trans	137.2	87.3	158.1	0	0	0	0	0	113.8
185	A	34.7	Very low	33.5	Very low	113 Å²	113	106.5 Å²	106.5	93%	0.934	81%	0.809	S	S	*	*				89.6	123.3	69.8	0	0	0	0	0	115.2
186	G	33.1	Very low	33.4	Very low	82 Å²	82	114.4 Å²	114.4	85%	0.845	82%	0.821	S	S	*	*			trans	136.6	105.3	146.6	0	0	0	0	0	120.4
187	G	33.9	Very low	33.4	Very low	74 Å²	74	118.3 Å²	118.3	76%	0.763	82%	0.823	S	S	*	*			trans	80.1	103.9	146.8	0	0	0	0	0	118.5
188	V	30.7	Very low	33.4	Very low	149 Å²	149	123.3 Å²	123.3	90%	0.903	83%	0.833	S	S	*	*				59.8	104.9	65.7	-170.1	0	0	0	0	115
189	S	34	Very low	33.4	Very low	114 Å²	114	121.4 Å²	121.4	80%	0.797	83%	0.829	S	S	*	*				177	137.1	109.6	-165.9	0	0	0	0	112.6
190	N	29.6	Very low	33.4	Very low	167 Å²	167	127.1 Å²	127.1	89%	0.893	83%	0.832	S	S	*	*			trans	-80.1	150.9	174.3	-86.9	-27.9	0	0	0	111.5
191	G	32.4	Very low	33.1	Very low	67 Å²	67	133.3 Å²	133.3	69%	0.691	84%	0.839	S	S	*	*			trans	174.5	80.7	168.9	0	0	0	0	0	116.2
192	I	33.4	Very low	33	Very low	176 Å²	176	135.3 Å²	135.3	90%	0.903	84%	0.835	S	S	*	*			trans	51.1	117.8	132.8	-55.5	169.8	0	0	0	119.1
193	G	30.2	Very low	32.9	Very low	79 Å²	79	140.7 Å²	140.7	81%	0.814	85%	0.849	S	S	*	*			trans	91.9	111.3	130.1	0	0	0	0	0	117.6
194	G	32.7	Very low	32.8	Very low	79 Å²	79	136.8 Å²	136.8	81%	0.814	83%	0.828	S	S	*	*			trans	158.4	84.3	163.6	0	0	0	0	0	113.8	R196	G194-R196 PolarHBondContact O-N 3.1Å
195	G	29.3	Very low	32.6	Very low	80 Å²	80	139.3 Å²	139.3	83%	0.825	83%	0.834	S	S	*	*			trans	-62.7	132	171	0	0	0	0	0	111.8
196	R	32.2	Very low	32.5	Very low	249 Å²	249	141.7 Å²	141.7	94%	0.94	83%	0.83	S	S	*	*			trans	-154.5	120.8	148.8	-115.7	169.6	-176.1	169.5	0.9	111.5	G194	G194-R196 PolarHBondContact O-N 3.1Å
197	K	33	Very low	32.7	Very low	199 Å²	199	143 Å²	143	87%	0.865	83%	0.827	S	S	*	*			trans	-35.1	123.1	178.5	-64.1	169.6	176.5	178.6	0	114.3	T199	K197-T199 PolarHBondContact O-N 3.11Å
198	K	34	Very low	32.7	Very low	201 Å²	201	145.3 Å²	145.3	87%	0.874	83%	0.829	S	S	*	*			trans	-82.6	100.1	160.6	-81.3	-177.3	178.3	173	0	109.6	K200	K198-K200 PolarHBondContact O-N 3.09Å
199	T	33	Very low	32.9	Very low	129 Å²	129	145.1 Å²	145.1	79%	0.791	82%	0.822	S	S	*	*			trans	-72	98.4	162.5	47.9	0	0	0	0	109.4	K197	K197-T199 PolarHBondContact O-N 3.11Å
200	K	35.6	Very low	32.9	Very low	197 Å²	197	149.3 Å²	149.3	86%	0.857	83%	0.829	S	S	*	*			trans	-85.9	102.3	159.8	-85.3	-174.4	175.5	179.9	0	107.9	K198 K202	K198-K200 PolarHBondContact O-N 3.09Å; K200-K202 PolarHBondContact O-N 3.33Å; K200-K202 VanDerWaalsContact O-N 3.1Å
201	K	32.1	Very low	33.1	Very low	199 Å²	199	144.9 Å²	144.9	87%	0.865	82%	0.822	S	S	*	*			trans	-59.1	108.4	169.2	-79.3	179.6	174.1	179.1	0	109.1
202	K	33.7	Very low	33	Very low	199 Å²	199	147 Å²	147	87%	0.865	82%	0.822	S	S	*	*			trans	-74.7	112.7	155.5	-100.7	178	173	178	0	106.3	K200 S204	K200-K202 PolarHBondContact O-N 3.33Å; K200-K202 VanDerWaalsContact O-N 3.1Å; K202-S204 PolarHBondContact O-N 3.18Å
203	L	32.4	Very low	33	Very low	175 Å²	175	146 Å²	146	92%	0.916	82%	0.819	S	S	*	*			trans	-81.5	99.6	163.6	-147.7	74.2	0	0	0	106.3
204	S	33.6	Very low	32.8	Very low	76 Å²	76	149.2 Å²	149.2	53%	0.531	82%	0.817	S	S	.	*			trans	-69.3	138.6	176.9	31.2	0	0	0	0	110.6	K202 L206	K202-S204 PolarHBondContact O-N 3.18Å; S204-L206 PolarHBondContact O-N 2.94Å
205	C	31.5	Very low	32.8	Very low	122 Å²	122	152.7 Å²	152.7	82%	0.824	82%	0.822	S	S	*	*			trans	-59.8	107.7	157.8	-66.4	0	0	0	0	107.6	S207	C205-S207 PolarHBondContact O-N 3.1Å
206	L	33	Very low	32.8	Very low	162 Å²	162	157.6 Å²	157.6	85%	0.848	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	88.8	179.9	-137.9	94.7	0	0	0	108.1	S204	S204-L206 PolarHBondContact O-N 2.94Å
207	S	36.5	Very low	32.6	Very low	111 Å²	111	150.5 Å²	150.5	78%	0.776	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.4	-4.8	162.2	44	0	0	0	0	116.1	C205	C205-S207 PolarHBondContact O-N 3.1Å
208	C	33.7	Very low	32.3	Very low	121 Å²	121	145.7 Å²	145.7	82%	0.818	80%	0.804	S	S	*	*			trans	-129.5	48.6	-175.2	-62.6	0	0	0	0	114.6
209	L	34.7	Very low	32.2	Very low	145 Å²	145	142.6 Å²	142.6	76%	0.759	80%	0.802	S	S	*	*			trans	-127.9	90.2	175.1	-99.8	139.4	0	0	0	110.7
210	H	35.3	Very low	31.8	Very low	203 Å²	203	143.6 Å²	143.6	94%	0.94	80%	0.802	S	S	*	*			trans	-136.3	120.1	152.5	-124.3	-96.1	0	0	0	106.1
211	G	32.4	Very low	31.5	Very low	73 Å²	73	142 Å²	142	75%	0.753	80%	0.802	S	S	*	*			trans	120.6	63.4	-177.2	0	0	0	0	0	113
212	T	29.8	Very low	31.1	Very low	113 Å²	113	143.5 Å²	143.5	69%	0.693	80%	0.804	S	S	*	*			trans	-74.8	130.6	158.6	46.3	0	0	0	0	108.3
213	D	33.6	Very low	31	Very low	154 Å²	154	139.4 Å²	139.4	82%	0.824	80%	0.801	S	S	*	*			trans	-158	134.1	130.6	-87.8	-29	0	0	0	111.4
214	N	27.5	Very low	30.9	Very low	147 Å²	147	136 Å²	136	79%	0.786	79%	0.792	S	S	*	*			trans	-49.5	134	-174.5	-52.1	-56.9	0	0	0	115.7
215	V	31.5	Very low	30.7	Very low	151 Å²	151	137 Å²	137	92%	0.915	80%	0.799	S	S	*	*			trans	-151.6	133.2	130.7	-179.3	0	0	0	0	109.3
216	E	28.8	Very low	30.8	Very low	184 Å²	184	138 Å²	138	86%	0.86	80%	0.795	S	S	*	*			trans	-98	168.8	-168.7	-166.4	168.6	-159.8	0	0	111.8
217	S	29.4	Very low	30.9	Very low	99 Å²	99	138 Å²	138	69%	0.692	80%	0.796	S	S	*	*			trans	90.9	105.9	157.6	-153.2	0	0	0	0	117.6
218	S	26.7	Very low	30.8	Very low	99 Å²	99	140.6 Å²	140.6	69%	0.692	80%	0.801	S	S	*	*				77.3	129.7	97.7	-44.1	0	0	0	0	111.6
219	T	30.6	Very low	30.8	Very low	135 Å²	135	142 Å²	142	83%	0.828	80%	0.8	S	S	*	*				-171.9	144.4	57.1	31	0	0	0	0	110.2
220	N	24.7	Very low	30.8	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	81%	0.805	S	S	*	*			trans	-74.7	143.8	155.2	-59.4	-60.3	0	0	0	109
221	L	29.3	Very low	31	Very low	163 Å²	163	138 Å²	138	85%	0.853	78%	0.784	S	S	*	*				157.7	136.8	119.9	-115.3	72.5	0	0	0	110.4
222	Y	25	Very low	31.4	Very low	232 Å²	232	142.4 Å²	142.4	91%	0.91	79%	0.791	S	S	*	*			trans	-35	134.3	157	-94.9	-112.7	0	0	0	113.6
223	S	30.2	Very low	32.1	Very low	113 Å²	113	144.1 Å²	144.1	79%	0.79	80%	0.796	S	S	*	*				-177.2	139	123.3	-168.4	0	0	0	0	111.2
224	S	30.4	Very low	32.3	Very low	104 Å²	104	144 Å²	144	73%	0.727	79%	0.794	S	S	*	*			trans	71.4	114.8	152.3	-141.5	0	0	0	0	120.2
225	S	30.3	Very low	32.6	Very low	97 Å²	97	144.5 Å²	144.5	68%	0.678	80%	0.797	S	S	*	*			trans	-32.3	130.5	141.5	-41.9	0	0	0	0	112.3
226	D	34.4	Very low	32.8	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	79%	0.793	S	S	*	*				176	164.8	112.7	-76.6	-25.6	0	0	0	107.4
227	D	34.6	Very low	33.1	Very low	162 Å²	162	142.9 Å²	142.9	87%	0.866	79%	0.789	S	S	*	*			trans	83.9	58.7	177.1	-50.6	-26.1	0	0	0	117.6
228	L	34.3	Very low	33.4	Very low	166 Å²	166	146.3 Å²	146.3	87%	0.869	80%	0.799	S	S	*	*			trans	-85.6	101.5	142.1	-141.6	92.4	0	0	0	106.8
229	N	34	Very low	33.7	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	80%	0.8	S	S	*	*			trans	156.3	69.7	156.8	-78.8	-19.9	0	0	0	110.2
230	L	35	Very low	33.7	Very low	162 Å²	162	147.8 Å²	147.8	85%	0.848	80%	0.804	S	S	*	*			trans	-156.8	132.7	155.6	-145.4	71	0	0	0	110
231	I	37.6	Very low	34.2	Very low	100 Å²	100	149.4 Å²	149.4	51%	0.513	81%	0.806	S	S	.	*			trans	85.6	62.6	159.3	-35.7	-176.5	0	0	0	115.2	D233 L234	I231-D233 HydrophobicContact CG2-CB 4.01Å; I231-D233 PolarHBondContact O-N 2.84Å; I231-L234 HydrophobicContact CG2-CB 4.35Å; I231-L234 HydrophobicContact CG2-CD1 3.73Å; I231-L234 HydrophobicContact CG2-CG 3.69Å
232	D	42.1	Very low	34.5	Very low	167 Å²	167	148.8 Å²	148.8	89%	0.893	81%	0.809	S	S	*	*	S	Bend	trans	-71.8	18.4	146.4	-124.1	-14.3	0	0	0	111.9
233	D	43.9	Very low	34.8	Very low	148 Å²	148	144.7 Å²	144.7	79%	0.791	80%	0.803	S	S	*	*			trans	-113.2	7.6	-170.3	-82.1	-37.9	0	0	0	115.1	I231	I231-D233 HydrophobicContact CG2-CB 4.01Å; I231-D233 PolarHBondContact O-N 2.84Å
234	L	38.7	Very low	35.1	Very low	152 Å²	152	149 Å²	149	80%	0.796	81%	0.807	S	S	*	*			trans	-97	15.4	178.2	-79.1	164.7	0	0	0	114.4	I231	I231-L234 HydrophobicContact CG2-CB 4.35Å; I231-L234 HydrophobicContact CG2-CD1 3.73Å; I231-L234 HydrophobicContact CG2-CG 3.69Å
235	N	33.5	Very low	35.3	Very low	158 Å²	158	155.7 Å²	155.7	85%	0.845	82%	0.817	S	S	*	*	S	Bend	trans	-107.4	55.2	176.4	-97	-19.9	0	0	0	112.4
236	K	34.8	Very low	35.6	Very low	191 Å²	191	160.1 Å²	160.1	83%	0.83	83%	0.827	S	S	*	*	S	Bend	trans	-177.9	131.7	158.4	-118.4	166.1	176.3	171.5	0	110
237	S	35	Very low	35.6	Very low	110 Å²	110	162.4 Å²	162.4	77%	0.769	83%	0.833	S	S	*	*			trans	93.4	85.5	172.6	-38	0	0	0	0	113.8
238	D	37.4	Very low	35.4	Very low	171 Å²	171	163.2 Å²	163.2	91%	0.914	83%	0.831	S	S	*	*			trans	166.5	97.5	137.3	-81.7	-13.7	0	0	0	105.5
239	G	33	Very low	35.4	Very low	68 Å²	68	164.6 Å²	164.6	70%	0.701	83%	0.833	S	S	*	*				109.1	49	53.4	0	0	0	0	0	110.1	E241	G239-E241 PolarHBondContact O-N 3.06Å
240	H	28.6	Very low	35.6	Very low	197 Å²	197	166.4 Å²	166.4	91%	0.912	84%	0.837	S	S	*	*	S	Bend	trans	43.6	51.1	135.4	-129.5	-65.3	0	0	0	119.9
241	E	35.2	Very low	36.1	Very low	184 Å²	184	165 Å²	165	86%	0.86	83%	0.826	S	S	*	*			trans	-148.7	14	167.9	-143.5	163.8	176.4	0	0	118.2	G239	G239-E241 PolarHBondContact O-N 3.06Å
242	V	37.5	Very low	36.6	Very low	150 Å²	150	164.1 Å²	164.1	91%	0.909	82%	0.822	S	S	*	*			trans	-119.8	70.6	175	-170.2	0	0	0	0	110.4
243	N	31.3	Very low	37.1	Very low	145 Å²	145	160.1 Å²	160.1	78%	0.775	81%	0.806	S	S	*	*			trans	-143.1	100.6	176.9	-143.1	-1.1	0	0	0	108.2
244	K	36.2	Very low	37.4	Very low	204 Å²	204	157.7 Å²	157.7	89%	0.887	79%	0.786	S	S	*	*	S	Bend	trans	164.9	-4.5	148.5	-94.8	170.1	179	178.1	0	117.9
245	R	33.8	Very low	38.6	Very low	245 Å²	245	154.8 Å²	154.8	93%	0.925	77%	0.77	S	S	*	*	S	Bend	trans	-110.8	-1.6	-172.7	-64.9	-164.7	-167.4	-177.5	6.2	118.3
246	E	37.7	Very low	40.2	Very low	190 Å²	190	151.4 Å²	151.4	89%	0.888	75%	0.751	S	S	*	*	S	Bend	trans	-111.4	9.3	-178.8	-68.3	-172.2	142.5	0	0	115.3
247	Q	33.3	Very low	41.2	Very low	189 Å²	189	144.3 Å²	144.3	88%	0.883	73%	0.725	S	S	*	*	S	Bend	trans	-98.1	13.8	177.5	-79.9	-167.2	-17.6	0	0	115.1
248	Q	30.8	Very low	42.4	Very low	180 Å²	180	140.7 Å²	140.7	84%	0.841	70%	0.697	S	S	*	*	S	Bend	trans	-109.1	118.8	172.2	-75.3	179	-21.8	0	0	109.9
249	Q	35	Very low	43.8	Very low	194 Å²	194	136 Å²	136	91%	0.907	68%	0.678	S	S	*	*			trans	81.5	49.8	167.3	-90.3	163.5	-31.4	0	0	120.1
250	Q	37.6	Very low	45.6	Very low	190 Å²	190	137.2 Å²	137.2	89%	0.888	67%	0.667	S	S	*	*			trans	-112.4	81	155.7	-145.9	148.4	10	0	0	110.2	N252	Q250-N252 PolarHBondContact O-N 3.33Å
251	Q	45.1	Very low	47.3	Very low	132 Å²	132	129.4 Å²	129.4	62%	0.617	63%	0.633	S	S	*	*			trans	-63.7	121.4	173.5	-165.5	129.2	1.9	0	0	108.7	I256	Q251-I256 HydrophobicContact CB-CD1 4.39Å; Q251-I256 HydrophobicContact CG-CG1 4.3Å
252	N	47	Very low	48.6	Very low	81 Å²	81	123 Å²	123	43%	0.433	60%	0.602	S	S	.	*			trans	-51.1	121.8	-175.3	-161.1	-2.7	0	0	0	109.9	Q250 Y254 I255	Q250-N252 PolarHBondContact O-N 3.33Å; N252-Y254 PolarHBondContact O-N 3.02Å; N252-Y254 WeakPolarHBondContact OD1-CD2 3.43Å; N252-I255 HydrophobicContact CB-CD1 4.1Å; N252-I255 HydrophobicContact CB-CG1 4.18Å; N252-I255 WeakPolarHBondContact O-CB 3.41Å; N252-I255 PolarHBondContact O-N 3.42Å
253	P	53.8	Low	50.2	Low	84 Å²	84	117.9 Å²	117.9	55%	0.545	58%	0.577	S	S	.	*	H	α-helix	trans	-54.8	-24.4	-175.9	19.2	-33.1	0	0	0	112.9	I256 C257	P253-I256 PolarHBondContact O-N 3.48Å; P253-C257 PolarHBondContact O-N 2.98Å
254	Y	51	Low	52.1	Low	97 Å²	97	114.6 Å²	114.6	38%	0.38	56%	0.559	S	S	.	*	H	α-helix	trans	-60.8	-41.4	171.6	-61.6	-67.1	0	0	0	113.6	N252 I256 C257 L258 F522	N252-Y254 PolarHBondContact O-N 3.02Å; N252-Y254 WeakPolarHBondContact OD1-CD2 3.43Å; Y254-I256 VanDerWaalsContact C-N 3.34Å; Y254-C257 PolarHBondContact O-N 2.9Å; Y254-L258 VanDerWaalsContact O-CB 3.3Å; Y254-L258 WeakPolarHBondContact O-CB 3.47Å; Y254-L258 WeakPolarHBondContact O-CD1 3.49Å; Y254-L258 PolarHBondContact O-N 2.72Å; Y254-F522 HydrophobicContact CD1-CE2 4.36Å; Y254-F522 AromaticContact CD1-CZ 3.86Å; Y254-F522 HydrophobicContact CD1-CZ 3.86Å; Y254-F522 HydrophobicContact CE1-CZ 4.41Å
255	I	62.8	Low	53.3	Low	91 Å²	91	106.9 Å²	106.9	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-66.8	-39.7	-180	-64	174.9	0	0	0	110.1	N252 S259	N252-I255 HydrophobicContact CB-CD1 4.1Å; N252-I255 HydrophobicContact CB-CG1 4.18Å; N252-I255 WeakPolarHBondContact O-CB 3.41Å; N252-I255 PolarHBondContact O-N 3.42Å; I255-S259 VanDerWaalsContact O-CB 3.28Å; I255-S259 WeakPolarHBondContact O-CB 3.5Å; I255-S259 PolarHBondContact O-N 3.28Å
256	I	67.8	Low	55	Low	87 Å²	87	100 Å²	100	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-47.9	177.5	-59.4	173.6	0	0	0	110.1	Q251 P253 Y254 L258 S259 I260	Q251-I256 HydrophobicContact CB-CD1 4.39Å; Q251-I256 HydrophobicContact CG-CG1 4.3Å; P253-I256 PolarHBondContact O-N 3.48Å; Y254-I256 VanDerWaalsContact C-N 3.34Å; I256-L258 PolarHBondContact O-N 2.97Å; I256-S259 PolarHBondContact O-N 3.38Å; I256-I260 HydrophobicContact CG2-CD1 3.95Å; I256-I260 VanDerWaalsContact O-CG1 3.3Å; I256-I260 WeakPolarHBondContact O-CG1 3.45Å; I256-I260 PolarHBondContact O-N 3.25Å
257	C	55.2	Low	56.6	Low	41 Å²	41	95 Å²	95	28%	0.277	49%	0.487	S	S	.	.	H	α-helix	trans	-61.8	-43.3	176.8	-79.5	0	0	0	0	112.7	P253 Y254 I260 V261	P253-C257 PolarHBondContact O-N 2.98Å; Y254-C257 PolarHBondContact O-N 2.9Å; C257-I260 PolarHBondContact O-N 3.3Å; C257-V261 WeakPolarHBondContact O-CG2 3.49Å; C257-V261 PolarHBondContact O-N 2.9Å
258	L	59.9	Low	58.2	Low	34 Å²	34	88.2 Å²	88.2	18%	0.178	46%	0.456	C	S	.	.	H	α-helix	trans	-61.1	-45.7	174.8	-92.1	145.9	0	0	0	111	Y254 I256 I260 V261 F262 F522	Y254-L258 VanDerWaalsContact O-CB 3.3Å; Y254-L258 WeakPolarHBondContact O-CB 3.47Å; Y254-L258 WeakPolarHBondContact O-CD1 3.49Å; Y254-L258 PolarHBondContact O-N 2.72Å; I256-L258 PolarHBondContact O-N 2.97Å; L258-I260 VanDerWaalsContact C-N 3.31Å; L258-I260 PolarHBondContact O-N 3.06Å; L258-V261 PolarHBondContact O-N 3.38Å; L258-F262 HydrophobicContact CB-CD2 4.37Å; L258-F262 HydrophobicContact CB-CE2 4.05Å; L258-F262 HydrophobicContact CD2-CD2 4.4Å; L258-F262 HydrophobicContact CD2-CE2 3.41Å; L258-F262 VanDerWaalsContact CD2-CE2 3.41Å; L258-F262 HydrophobicContact CD2-CZ 3.69Å; L258-F262 HydrophobicContact CG-CE2 4.37Å; L258-F262 WeakPolarHBondContact O-CD2 3.35Å; L258-F262 WeakPolarHBondContact O-CG 3.2Å; L258-F262 PolarHBondContact O-N 3.3Å; L258-F522 HydrophobicContact CD1-CE2 4.39Å; L258-F522 HydrophobicContact CG-CE2 4.32Å
259	S	66.1	Low	59.9	Low	74 Å²	74	84 Å²	84	52%	0.517	44%	0.439	S	S	.	.	H	α-helix	trans	-59.9	-40.1	176.4	179.7	0	0	0	0	112.3	I255 I256 F262 A263	I255-S259 VanDerWaalsContact O-CB 3.28Å; I255-S259 WeakPolarHBondContact O-CB 3.5Å; I255-S259 PolarHBondContact O-N 3.28Å; I256-S259 PolarHBondContact O-N 3.38Å; S259-F262 PolarHBondContact O-N 3.48Å; S259-A263 VanDerWaalsContact O-CB 3.32Å; S259-A263 WeakPolarHBondContact O-CB 3.35Å; S259-A263 PolarHBondContact O-N 2.95Å
260	I	72.2	Confident	61.7	Low	92 Å²	92	79.7 Å²	79.7	47%	0.472	42%	0.422	S	S	.	.	H	α-helix	trans	-65.6	-45.7	175.1	-66.9	164.4	0	0	0	111	I256 C257 L258 F262 A263 L264	I256-I260 HydrophobicContact CG2-CD1 3.95Å; I256-I260 VanDerWaalsContact O-CG1 3.3Å; I256-I260 WeakPolarHBondContact O-CG1 3.45Å; I256-I260 PolarHBondContact O-N 3.25Å; C257-I260 PolarHBondContact O-N 3.3Å; L258-I260 VanDerWaalsContact C-N 3.31Å; L258-I260 PolarHBondContact O-N 3.06Å; I260-F262 VanDerWaalsContact C-N 3.32Å; I260-F262 PolarHBondContact O-N 2.88Å; I260-A263 PolarHBondContact O-N 2.67Å; I260-L264 HydrophobicContact CG2-CD1 4.02Å; I260-L264 HydrophobicContact CG2-CG 4.37Å; I260-L264 WeakPolarHBondContact O-CB 3.44Å; I260-L264 VanDerWaalsContact O-CG 3.25Å; I260-L264 WeakPolarHBondContact O-CG 3.34Å; I260-L264 PolarHBondContact O-N 3.42Å
261	V	64.3	Low	63.3	Low	34 Å²	34	74.4 Å²	74.4	21%	0.206	40%	0.398	C	S	.	.	H	α-helix	trans	-61.2	-42	177.9	170	0	0	0	0	111.1	C257 L258 L264 L265 A518	C257-V261 WeakPolarHBondContact O-CG2 3.49Å; C257-V261 PolarHBondContact O-N 2.9Å; L258-V261 PolarHBondContact O-N 3.38Å; V261-L264 PolarHBondContact O-N 3.26Å; V261-L265 HydrophobicContact CG1-CD1 4.37Å; V261-L265 WeakPolarHBondContact O-CG 3.47Å; V261-L265 PolarHBondContact O-N 3.36Å; V261-A518 HydrophobicContact CG1-CB 3.83Å; V261-A518 HydrophobicContact CG2-CB 4.36Å
262	F	62.4	Low	64.3	Low	48 Å²	48	69.3 Å²	69.3	21%	0.211	38%	0.382	C	S	.	.	H	α-helix	trans	-66.2	-44.6	175.5	-69.5	-53	0	0	0	112.3	L258 S259 I260 L264 L265 D266 I704	L258-F262 HydrophobicContact CB-CD2 4.37Å; L258-F262 HydrophobicContact CB-CE2 4.05Å; L258-F262 HydrophobicContact CD2-CD2 4.4Å; L258-F262 HydrophobicContact CD2-CE2 3.41Å; L258-F262 VanDerWaalsContact CD2-CE2 3.41Å; L258-F262 HydrophobicContact CD2-CZ 3.69Å; L258-F262 HydrophobicContact CG-CE2 4.37Å; L258-F262 WeakPolarHBondContact O-CD2 3.35Å; L258-F262 WeakPolarHBondContact O-CG 3.2Å; L258-F262 PolarHBondContact O-N 3.3Å; S259-F262 PolarHBondContact O-N 3.48Å; I260-F262 VanDerWaalsContact C-N 3.32Å; I260-F262 PolarHBondContact O-N 2.88Å; F262-L264 PolarHBondContact O-N 3.14Å; F262-L265 HydrophobicContact CD1-CD1 4.09Å; F262-L265 HydrophobicContact CE1-CD1 4.44Å; F262-L265 WeakPolarHBondContact O-CB 3.36Å; F262-L265 PolarHBondContact O-N 3.1Å; F262-L265 VanDerWaalsContact O-N 3.09Å; F262-D266 PolarHBondContact O-N 3.02Å; F262-I704 HydrophobicContact CD1-CG2 4.47Å; F262-I704 HydrophobicContact CE1-CB 4.49Å; F262-I704 HydrophobicContact CE1-CD1 3.86Å; F262-I704 HydrophobicContact CE1-CG1 4.06Å; F262-I704 HydrophobicContact CE1-CG2 3.61Å; F262-I704 HydrophobicContact CE2-CD1 3.87Å; F262-I704 HydrophobicContact CZ-CD1 3.29Å; F262-I704 HydrophobicContact CZ-CG1 3.99Å; F262-I704 HydrophobicContact CZ-CG2 4.18Å
263	A	69.8	Low	65.3	Low	44 Å²	44	69.9 Å²	69.9	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-58.7	-38.7	174.4	0	0	0	0	0	111.6	S259 I260 D266 I267	S259-A263 VanDerWaalsContact O-CB 3.32Å; S259-A263 WeakPolarHBondContact O-CB 3.35Å; S259-A263 PolarHBondContact O-N 2.95Å; I260-A263 PolarHBondContact O-N 2.67Å; A263-D266 PolarHBondContact O-N 3.13Å; A263-I267 WeakPolarHBondContact O-CB 3.38Å; A263-I267 WeakPolarHBondContact O-CD1 3.45Å; A263-I267 WeakPolarHBondContact O-CG1 3.3Å; A263-I267 PolarHBondContact O-N 2.92Å
264	L	71.8	Confident	66.1	Low	76 Å²	76	69.9 Å²	69.9	40%	0.398	38%	0.383	S	S	.	.	H	α-helix	trans	-69.9	-37	175.3	-68	172.1	0	0	0	112.8	I260 V261 F262 I267 L268 F514	I260-L264 HydrophobicContact CG2-CD1 4.02Å; I260-L264 HydrophobicContact CG2-CG 4.37Å; I260-L264 WeakPolarHBondContact O-CB 3.44Å; I260-L264 VanDerWaalsContact O-CG 3.25Å; I260-L264 WeakPolarHBondContact O-CG 3.34Å; I260-L264 PolarHBondContact O-N 3.42Å; V261-L264 PolarHBondContact O-N 3.26Å; F262-L264 PolarHBondContact O-N 3.14Å; L264-I267 PolarHBondContact O-N 3.46Å; L264-L268 WeakPolarHBondContact O-CB 3.45Å; L264-L268 WeakPolarHBondContact O-CG 3.37Å; L264-L268 PolarHBondContact O-N 3.35Å; L264-F514 HydrophobicContact CB-CE1 4.26Å; L264-F514 HydrophobicContact CB-CE2 4.31Å; L264-F514 HydrophobicContact CB-CZ 3.49Å; L264-F514 VanDerWaalsContact CB-CZ 3.49Å; L264-F514 HydrophobicContact CD1-CZ 4.21Å; L264-F514 HydrophobicContact CG-CZ 4.47Å
265	L	60.9	Low	67	Low	42 Å²	42	69.2 Å²	69.2	22%	0.22	39%	0.385	C	S	.	.	H	α-helix	trans	-62.4	-44.8	172.1	-79.7	169.2	0	0	0	111.2	V261 F262 L268 L269 F514	V261-L265 HydrophobicContact CG1-CD1 4.37Å; V261-L265 WeakPolarHBondContact O-CG 3.47Å; V261-L265 PolarHBondContact O-N 3.36Å; F262-L265 HydrophobicContact CD1-CD1 4.09Å; F262-L265 HydrophobicContact CE1-CD1 4.44Å; F262-L265 WeakPolarHBondContact O-CB 3.36Å; F262-L265 PolarHBondContact O-N 3.1Å; F262-L265 VanDerWaalsContact O-N 3.09Å; L265-L268 PolarHBondContact O-N 3.21Å; L265-L269 WeakPolarHBondContact O-CB 3.49Å; L265-L269 PolarHBondContact O-N 3.5Å; L265-F514 HydrophobicContact CD2-CD1 3.5Å; L265-F514 HydrophobicContact CD2-CE1 3.64Å; L265-F514 HydrophobicContact CG-CD1 4.18Å; L265-F514 HydrophobicContact CG-CE1 3.77Å
266	D	69.6	Low	67	Low	99 Å²	99	67.3 Å²	67.3	53%	0.529	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-43.6	177.3	-70	-26	0	0	0	111	F262 A263 L268 L269 L270	F262-D266 PolarHBondContact O-N 3.02Å; A263-D266 PolarHBondContact O-N 3.13Å; D266-L268 VanDerWaalsContact C-N 3.31Å; D266-L268 PolarHBondContact O-N 2.96Å; D266-L269 PolarHBondContact O-N 2.9Å; D266-L270 WeakPolarHBondContact O-CB 3.2Å; D266-L270 VanDerWaalsContact O-CG 3.27Å; D266-L270 WeakPolarHBondContact O-CG 3.29Å; D266-L270 PolarHBondContact O-N 3.09Å
267	I	73	Confident	66.9	Low	87 Å²	87	67.2 Å²	67.2	45%	0.446	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-40.4	173.1	-71.7	164.2	0	0	0	110.7	A263 L264 L270 I271	A263-I267 WeakPolarHBondContact O-CB 3.38Å; A263-I267 WeakPolarHBondContact O-CD1 3.45Å; A263-I267 WeakPolarHBondContact O-CG1 3.3Å; A263-I267 PolarHBondContact O-N 2.92Å; L264-I267 PolarHBondContact O-N 3.46Å; I267-L270 CarbonylContact O-C 3.6Å; I267-L270 WeakPolarHBondContact O-CB 3.47Å; I267-L270 PolarHBondContact O-N 3.33Å; I267-I271 HydrophobicContact CG2-CD1 3.65Å; I267-I271 HydrophobicContact CG2-CG1 4.25Å; I267-I271 WeakPolarHBondContact O-CB 3.16Å; I267-I271 WeakPolarHBondContact O-CG1 3.39Å; I267-I271 PolarHBondContact O-N 3.01Å
268	L	66.8	Low	67.4	Low	46 Å²	46	70.6 Å²	70.6	24%	0.241	39%	0.385	C	S	.	.	H	α-helix	trans	-72.4	-35.1	177.7	-80.8	166.4	0	0	0	113.2	L264 L265 D266 L270 I271 G272 F514	L264-L268 WeakPolarHBondContact O-CB 3.45Å; L264-L268 WeakPolarHBondContact O-CG 3.37Å; L264-L268 PolarHBondContact O-N 3.35Å; L265-L268 PolarHBondContact O-N 3.21Å; D266-L268 VanDerWaalsContact C-N 3.31Å; D266-L268 PolarHBondContact O-N 2.96Å; L268-L270 VanDerWaalsContact C-N 3.31Å; L268-I271 HydrophobicContact CD2-CD1 4.37Å; L268-I271 PolarHBondContact O-N 3.28Å; L268-G272 PolarHBondContact O-N 3.37Å; L268-F514 HydrophobicContact CD1-CB 3.94Å; L268-F514 HydrophobicContact CD1-CD1 3.46Å; L268-F514 VanDerWaalsContact CD1-CD1 3.46Å; L268-F514 HydrophobicContact CD1-CD2 3.05Å; L268-F514 HydrophobicContact CD1-CE1 3.67Å; L268-F514 HydrophobicContact CD1-CE2 3.26Å; L268-F514 HydrophobicContact CD1-CG 3.14Å; L268-F514 HydrophobicContact CD1-CZ 3.58Å; L268-F514 HydrophobicContact CG-CD2 4.48Å
269	L	66.1	Low	67	Low	91 Å²	91	75.8 Å²	75.8	48%	0.476	41%	0.406	S	S	.	.	H	α-helix	trans	-64.9	-41.1	172.2	-164.5	121.8	0	0	0	109.9	L265 D266 G272 L273	L265-L269 WeakPolarHBondContact O-CB 3.49Å; L265-L269 PolarHBondContact O-N 3.5Å; D266-L269 PolarHBondContact O-N 2.9Å; L269-G272 PolarHBondContact O-N 2.74Å; L269-L273 WeakPolarHBondContact O-CB 3.48Å; L269-L273 PolarHBondContact O-N 2.92Å
270	L	72.5	Confident	66.3	Low	104 Å²	104	75.7 Å²	75.7	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-64.8	-43	171.9	-76.1	166.1	0	0	0	112.2	D266 I267 L268 G272 L273 T274	D266-L270 WeakPolarHBondContact O-CB 3.2Å; D266-L270 VanDerWaalsContact O-CG 3.27Å; D266-L270 WeakPolarHBondContact O-CG 3.29Å; D266-L270 PolarHBondContact O-N 3.09Å; I267-L270 CarbonylContact O-C 3.6Å; I267-L270 WeakPolarHBondContact O-CB 3.47Å; I267-L270 PolarHBondContact O-N 3.33Å; L268-L270 VanDerWaalsContact C-N 3.31Å; L270-G272 VanDerWaalsContact C-N 3.33Å; L270-L273 CarbonylContact O-C 3.46Å; L270-L273 PolarHBondContact O-N 3.26Å; L270-T274 VanDerWaalsContact O-CB 3.24Å; L270-T274 WeakPolarHBondContact O-CB 3.47Å; L270-T274 PolarHBondContact O-N 2.88Å; L270-T274 PolarHBondContact O-OG1 3.16Å
271	I	71.3	Confident	65.5	Low	78 Å²	78	77.1 Å²	77.1	40%	0.4	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-41.4	174	-71.5	163.8	0	0	0	109.5	I267 L268 T274 L275	I267-I271 HydrophobicContact CG2-CD1 3.65Å; I267-I271 HydrophobicContact CG2-CG1 4.25Å; I267-I271 WeakPolarHBondContact O-CB 3.16Å; I267-I271 WeakPolarHBondContact O-CG1 3.39Å; I267-I271 PolarHBondContact O-N 3.01Å; L268-I271 HydrophobicContact CD2-CD1 4.37Å; L268-I271 PolarHBondContact O-N 3.28Å; I271-T274 CarbonylContact O-C 3.57Å; I271-T274 PolarHBondContact O-N 2.94Å; I271-L275 HydrophobicContact CG2-CD1 3.79Å; I271-L275 HydrophobicContact CG2-CG 4.04Å; I271-L275 VanDerWaalsContact O-CB 3.26Å; I271-L275 WeakPolarHBondContact O-CB 3.33Å; I271-L275 VanDerWaalsContact O-CG 3.25Å; I271-L275 WeakPolarHBondContact O-CG 3.45Å; I271-L275 PolarHBondContact O-N 3.1Å
272	G	64.9	Low	64.7	Low	26 Å²	26	79.9 Å²	79.9	27%	0.268	42%	0.419	S	S	.	.	H	α-helix	trans	-60.8	-45.4	174.4	0	0	0	0	0	111.5	L268 L269 L270 T274 M276	L268-G272 PolarHBondContact O-N 3.37Å; L269-G272 PolarHBondContact O-N 2.74Å; L270-G272 VanDerWaalsContact C-N 3.33Å; G272-T274 VanDerWaalsContact C-N 3.35Å; G272-M276 WeakPolarHBondContact O-CB 3.38Å; G272-M276 WeakPolarHBondContact O-CG 3.37Å; G272-M276 PolarHBondContact O-N 3.48Å
273	L	68.3	Low	63.7	Low	92 Å²	92	82.4 Å²	82.4	48%	0.482	44%	0.443	S	S	.	.	H	α-helix	trans	-63.1	-41.3	174	-139.2	100.5	0	0	0	111.5	L269 L270 M276 I277	L269-L273 WeakPolarHBondContact O-CB 3.48Å; L269-L273 PolarHBondContact O-N 2.92Å; L270-L273 CarbonylContact O-C 3.46Å; L270-L273 PolarHBondContact O-N 3.26Å; L273-M276 WeakPolarHBondContact O-CB 3.46Å; L273-M276 PolarHBondContact O-N 3.32Å; L273-I277 HydrophobicContact CD2-CD1 4.34Å; L273-I277 WeakPolarHBondContact O-CD1 3.32Å; L273-I277 WeakPolarHBondContact O-CG1 3.12Å; L273-I277 PolarHBondContact O-N 2.91Å
274	T	71.3	Confident	62.1	Low	84 Å²	84	89.6 Å²	89.6	52%	0.515	47%	0.466	S	S	.	.	H	α-helix	trans	-72.5	-38.6	-178.8	-54.7	0	0	0	0	111.3	L270 I271 G272 I277 F278	L270-T274 VanDerWaalsContact O-CB 3.24Å; L270-T274 WeakPolarHBondContact O-CB 3.47Å; L270-T274 PolarHBondContact O-N 2.88Å; L270-T274 PolarHBondContact O-OG1 3.16Å; I271-T274 CarbonylContact O-C 3.57Å; I271-T274 PolarHBondContact O-N 2.94Å; G272-T274 VanDerWaalsContact C-N 3.35Å; T274-I277 CarbonylContact O-C 3.6Å; T274-I277 PolarHBondContact O-N 3.4Å; T274-F278 VanDerWaalsContact O-CB 3.27Å; T274-F278 WeakPolarHBondContact O-CB 3.32Å; T274-F278 PolarHBondContact O-N 3.47Å
275	L	70	Confident	60.4	Low	83 Å²	83	93.5 Å²	93.5	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-67.5	-39.9	172.8	-74.9	176.7	0	0	0	110.1	I271 I277 F278 F279	I271-L275 HydrophobicContact CG2-CD1 3.79Å; I271-L275 HydrophobicContact CG2-CG 4.04Å; I271-L275 VanDerWaalsContact O-CB 3.26Å; I271-L275 WeakPolarHBondContact O-CB 3.33Å; I271-L275 VanDerWaalsContact O-CG 3.25Å; I271-L275 WeakPolarHBondContact O-CG 3.45Å; I271-L275 PolarHBondContact O-N 3.1Å; L275-I277 VanDerWaalsContact C-N 3.35Å; L275-F278 PolarHBondContact O-N 2.8Å; L275-F279 WeakPolarHBondContact O-CB 3.43Å; L275-F279 WeakPolarHBondContact O-CD2 3.37Å; L275-F279 PolarHBondContact O-N 3.31Å
276	M	62.1	Low	59.3	Low	52 Å²	52	97.6 Å²	97.6	26%	0.256	52%	0.516	S	S	.	.	H	α-helix	trans	-55.7	-51.8	168.8	-74.2	-74.4	-67.3	0	0	109.8	G272 L273 F278 F279 F280 C503	G272-M276 WeakPolarHBondContact O-CB 3.38Å; G272-M276 WeakPolarHBondContact O-CG 3.37Å; G272-M276 PolarHBondContact O-N 3.48Å; L273-M276 WeakPolarHBondContact O-CB 3.46Å; L273-M276 PolarHBondContact O-N 3.32Å; M276-F278 VanDerWaalsContact C-N 3.31Å; M276-F278 PolarHBondContact O-N 3.26Å; M276-F279 PolarHBondContact O-N 2.93Å; M276-F280 VanDerWaalsContact C-CD2 3.48Å; M276-F280 HydrophobicContact CB-CD2 4.42Å; M276-F280 HydrophobicContact CB-CE2 4.36Å; M276-F280 HydrophobicContact CE-CE2 3.83Å; M276-F280 HydrophobicContact CE-CZ 4.33Å; M276-F280 WeakPolarHBondContact O-CB 2.95Å; M276-F280 WeakPolarHBondContact O-CD2 3.28Å; M276-F280 WeakPolarHBondContact O-CG 3.27Å; M276-F280 PolarHBondContact O-N 3.45Å; M276-C503 HydrophobicContact SD-CB 4.39Å; M276-C503 PolarHBondContact SD-SG 3.02Å
277	I	67.2	Low	57.5	Low	85 Å²	85	96 Å²	96	44%	0.436	52%	0.523	S	S	.	.	H	α-helix	trans	-59.9	-37.9	176.7	-66.9	161.3	0	0	0	111.9	L273 T274 L275 F280 N281	L273-I277 HydrophobicContact CD2-CD1 4.34Å; L273-I277 WeakPolarHBondContact O-CD1 3.32Å; L273-I277 WeakPolarHBondContact O-CG1 3.12Å; L273-I277 PolarHBondContact O-N 2.91Å; T274-I277 CarbonylContact O-C 3.6Å; T274-I277 PolarHBondContact O-N 3.4Å; L275-I277 VanDerWaalsContact C-N 3.35Å; I277-F280 WeakPolarHBondContact O-CB 3.42Å; I277-F280 PolarHBondContact O-N 3Å; I277-N281 WeakPolarHBondContact O-CB 3.3Å; I277-N281 PolarHBondContact O-N 2.94Å; I277-N281 PolarHBondContact O-ND2 3.28Å
278	F	64.9	Low	55.5	Low	112 Å²	112	100.7 Å²	100.7	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-70.8	-41.7	178.5	-178.7	-90.1	0	0	0	111.8	T274 L275 M276 F280 N281 N282	T274-F278 VanDerWaalsContact O-CB 3.27Å; T274-F278 WeakPolarHBondContact O-CB 3.32Å; T274-F278 PolarHBondContact O-N 3.47Å; L275-F278 PolarHBondContact O-N 2.8Å; M276-F278 VanDerWaalsContact C-N 3.31Å; M276-F278 PolarHBondContact O-N 3.26Å; F278-F280 VanDerWaalsContact C-N 3.32Å; F278-N281 CarbonylContact O-C 3.55Å; F278-N281 PolarHBondContact O-N 3.42Å; F278-N281 VanDerWaalsContact O-N 3.09Å; F278-N282 HydrophobicContact CD1-CB 4.46Å; F278-N282 VanDerWaalsContact CD2-ND2 3.32Å; F278-N282 WeakPolarHBondContact CD2-ND2 3.36Å; F278-N282 HydrophobicContact CE1-CB 4.17Å; F278-N282 WeakPolarHBondContact CE1-ND2 3.44Å; F278-N282 WeakPolarHBondContact CE2-ND2 3.48Å; F278-N282 HydrophobicContact CZ-CB 4.45Å; F278-N282 WeakPolarHBondContact CZ-ND2 3.18Å; F278-N282 WeakPolarHBondContact O-CB 3.25Å; F278-N282 PolarHBondContact O-N 2.81Å; F278-N282 PolarHBondContact O-ND2 3.17Å
279	F	52	Low	53.7	Low	143 Å²	143	105.4 Å²	105.4	63%	0.627	57%	0.574	S	S	*	*	H	α-helix	trans	-67	-35.3	172.6	-84.6	-69.8	0	0	0	111.2	L275 M276 N281 S283	L275-F279 WeakPolarHBondContact O-CB 3.43Å; L275-F279 WeakPolarHBondContact O-CD2 3.37Å; L275-F279 PolarHBondContact O-N 3.31Å; M276-F279 PolarHBondContact O-N 2.93Å; F279-N281 VanDerWaalsContact C-N 3.26Å; F279-N281 PolarHBondContact O-N 3.11Å; F279-S283 PolarHBondContact O-N 3.38Å
280	F	51.5	Low	52	Low	72 Å²	72	106.9 Å²	106.9	32%	0.316	59%	0.592	S	S	.	*	H	α-helix	trans	-59.5	-37.4	167.4	-82	-65.1	0	0	0	111.5	M276 I277 F278 H493 I495	M276-F280 VanDerWaalsContact C-CD2 3.48Å; M276-F280 HydrophobicContact CB-CD2 4.42Å; M276-F280 HydrophobicContact CB-CE2 4.36Å; M276-F280 HydrophobicContact CE-CE2 3.83Å; M276-F280 HydrophobicContact CE-CZ 4.33Å; M276-F280 WeakPolarHBondContact O-CB 2.95Å; M276-F280 WeakPolarHBondContact O-CD2 3.28Å; M276-F280 WeakPolarHBondContact O-CG 3.27Å; M276-F280 PolarHBondContact O-N 3.45Å; I277-F280 WeakPolarHBondContact O-CB 3.42Å; I277-F280 PolarHBondContact O-N 3Å; F278-F280 VanDerWaalsContact C-N 3.32Å; F280-H493 HydrophobicContact CD1-CB 4.11Å; F280-H493 HydrophobicContact CE1-CB 4.43Å; F280-H493 PolarHBondContact O-CD2 3.28Å; F280-H493 PolarHBondContact O-NE2 3.48Å; F280-H493 VanDerWaalsContact O-NE2 3.11Å; F280-I495 HydrophobicContact CE1-CD1 4.19Å; F280-I495 HydrophobicContact CE1-CG1 3.84Å; F280-I495 HydrophobicContact CZ-CD1 3.89Å; F280-I495 HydrophobicContact CZ-CG1 4.02Å
281	N	54.3	Low	49.8	Very low	122 Å²	122	113.5 Å²	113.5	65%	0.652	61%	0.61	S	S	*	*	H	α-helix	trans	-87.1	-18.6	-178.9	-77	-21.4	0	0	0	115.2	I277 F278 F279	I277-N281 WeakPolarHBondContact O-CB 3.3Å; I277-N281 PolarHBondContact O-N 2.94Å; I277-N281 PolarHBondContact O-ND2 3.28Å; F278-N281 CarbonylContact O-C 3.55Å; F278-N281 PolarHBondContact O-N 3.42Å; F278-N281 VanDerWaalsContact O-N 3.09Å; F279-N281 VanDerWaalsContact C-N 3.26Å; F279-N281 PolarHBondContact O-N 3.11Å
282	N	47.9	Very low	47.9	Very low	91 Å²	91	115.4 Å²	115.4	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-119.3	8.2	-170.9	-79.7	-56	0	0	0	116.7	F278 K284	F278-N282 HydrophobicContact CD1-CB 4.46Å; F278-N282 VanDerWaalsContact CD2-ND2 3.32Å; F278-N282 WeakPolarHBondContact CD2-ND2 3.36Å; F278-N282 HydrophobicContact CE1-CB 4.17Å; F278-N282 WeakPolarHBondContact CE1-ND2 3.44Å; F278-N282 WeakPolarHBondContact CE2-ND2 3.48Å; F278-N282 HydrophobicContact CZ-CB 4.45Å; F278-N282 WeakPolarHBondContact CZ-ND2 3.18Å; F278-N282 WeakPolarHBondContact O-CB 3.25Å; F278-N282 PolarHBondContact O-N 2.81Å; F278-N282 PolarHBondContact O-ND2 3.17Å; N282-K284 PolarHBondContact O-N 3.3Å
283	S	41.3	Very low	46.1	Very low	102 Å²	102	122.4 Å²	122.4	71%	0.713	66%	0.657	S	S	*	*			trans	-77.5	66	171.6	-172.3	0	0	0	0	112	F279	F279-S283 PolarHBondContact O-N 3.38Å
284	K	36.8	Very low	44	Very low	194 Å²	194	123.4 Å²	123.4	84%	0.843	67%	0.67	S	S	*	*			trans	-79.8	128.9	163	-104.9	175.7	176.2	174.7	0	109.3	N282	N282-K284 PolarHBondContact O-N 3.3Å
285	N	34.9	Very low	41.9	Very low	158 Å²	158	130.3 Å²	130.3	85%	0.845	69%	0.687	S	S	*	*			trans	-11.6	131.6	170.8	-62.7	-27.6	0	0	0	117.7
286	P	37.9	Very low	39.7	Very low	128 Å²	128	133.6 Å²	133.6	83%	0.831	70%	0.704	S	S	*	*				-128.1	129.5	112.5	34.4	-24.5	0	0	0	109.2
287	G	32.7	Very low	38	Very low	65 Å²	65	139.2 Å²	139.2	67%	0.67	73%	0.729	S	S	*	*				85.7	79.9	72.5	0	0	0	0	0	109.2
288	E	29.9	Very low	36.2	Very low	187 Å²	187	142.3 Å²	142.3	87%	0.874	75%	0.746	S	S	*	*			trans	33.5	109	134.9	-154.6	162.4	-147.2	0	0	117.8
289	T	30.6	Very low	34.3	Very low	145 Å²	145	142.7 Å²	142.7	89%	0.89	76%	0.758	S	S	*	*			trans	-177.9	91.9	135.7	31.7	0	0	0	0	110.7
290	S	29	Very low	33.3	Very low	122 Å²	122	145.2 Å²	145.2	85%	0.853	77%	0.769	S	S	*	*			trans	-83.4	126.1	169	-41.5	0	0	0	0	109.8
291	R	27.3	Very low	32	Very low	243 Å²	243	152.2 Å²	152.2	92%	0.917	79%	0.793	S	S	*	*			trans	-131.5	119.3	154.4	-77.5	-170.7	179.1	-178.3	0.7	108.4
292	P	30.3	Very low	30.8	Very low	118 Å²	118	153.6 Å²	153.6	77%	0.766	80%	0.801	S	S	*	*			trans	-86.8	127.5	173.6	32.6	-27.6	0	0	0	109.8
293	I	29	Very low	30	Very low	173 Å²	173	155.7 Å²	155.7	89%	0.887	82%	0.816	S	S	*	*			trans	-86.2	112.9	162.7	-65.8	172.5	0	0	0	106.7
294	C	24.1	Very low	29.3	Very low	113 Å²	113	160.8 Å²	160.8	76%	0.764	83%	0.826	S	S	*	*			trans	-66.2	158.3	169.8	-74	0	0	0	0	111.9
295	R	25.3	Very low	28.8	Very low	229 Å²	229	156.8 Å²	156.8	86%	0.864	82%	0.822	S	S	*	*			trans	123.7	107.1	142.3	-162.4	179.3	-95.8	-147.9	-7.8	114
296	L	25.5	Very low	28.6	Very low	152 Å²	152	155.8 Å²	155.8	80%	0.796	82%	0.815	S	S	*	*				-168.2	121.2	107.8	-129.6	94.9	0	0	0	110.4
297	E	25.5	Very low	28.2	Very low	169 Å²	169	157 Å²	157	79%	0.79	81%	0.814	S	S	*	*			trans	-67.8	138.9	164.8	-74	164.9	123.2	0	0	110.4
298	L	29.6	Very low	28	Very low	151 Å²	151	162.7 Å²	162.7	79%	0.791	82%	0.824	S	S	*	*			trans	-135.3	99.4	154.8	-86.5	168.3	0	0	0	107.8
299	T	25.6	Very low	28	Very low	120 Å²	120	160.1 Å²	160.1	74%	0.736	82%	0.824	S	S	*	*			trans	-75.6	115.3	168	48.9	0	0	0	0	109
300	F	30.4	Very low	27.9	Very low	195 Å²	195	157.6 Å²	157.6	86%	0.855	81%	0.813	S	S	*	*			trans	-108.6	99.2	162.5	-107.5	-89.4	0	0	0	108.9
301	R	25.2	Very low	28.1	Very low	219 Å²	219	156.5 Å²	156.5	83%	0.826	81%	0.811	S	S	*	*			trans	-66.3	152.5	158.2	-83.8	179.2	173.1	-178.5	-2.4	108.4
302	D	27.2	Very low	28.3	Very low	152 Å²	152	151.6 Å²	151.6	81%	0.813	80%	0.803	S	S	*	*			trans	88.8	64.9	167	-50.1	-29	0	0	0	118.3
303	V	31.9	Very low	28.4	Very low	135 Å²	135	148.4 Å²	148.4	82%	0.818	79%	0.792	S	S	*	*			trans	-131.3	76.1	150.9	-171.4	0	0	0	0	109.1
304	K	25.9	Very low	28.7	Very low	209 Å²	209	151.8 Å²	151.8	91%	0.909	79%	0.793	S	S	*	*			trans	-117.7	28.5	-179.7	-150	179.2	-177	-180	0	113.6
305	S	27.9	Very low	29.3	Very low	110 Å²	110	153.9 Å²	153.9	77%	0.769	80%	0.796	S	S	*	*			trans	-140.4	24.1	-175.1	91.3	0	0	0	0	118.6
306	I	30.6	Very low	29.7	Very low	137 Å²	137	149.3 Å²	149.3	70%	0.703	78%	0.78	S	S	*	*			trans	-116.7	33.1	176.7	-45.3	180	0	0	0	111.9	H308	I306-H308 PolarHBondContact O-N 2.89Å
307	N	29.4	Very low	30.4	Very low	152 Å²	152	147.9 Å²	147.9	81%	0.813	78%	0.778	S	S	*	*			trans	-94.3	30.2	178.1	-77	-5.4	0	0	0	114.1
308	H	28.2	Very low	31	Very low	186 Å²	186	143.2 Å²	143.2	86%	0.861	76%	0.758	S	S	*	*			trans	-127.1	71.3	174.3	-90.7	-9	0	0	0	111.6	I306	I306-H308 PolarHBondContact O-N 2.89Å
309	C	28.9	Very low	31.7	Very low	132 Å²	132	140.8 Å²	140.8	89%	0.892	75%	0.751	S	S	*	*			trans	-91.5	90.8	151.4	-81.6	0	0	0	0	107.7
310	S	29.6	Very low	32.6	Very low	93 Å²	93	144 Å²	144	65%	0.65	75%	0.75	S	S	*	*			trans	-56.6	139.6	176.4	-160.9	0	0	0	0	111.4	D312	S310-D312 PolarHBondContact O-N 3.43Å
311	A	33.1	Very low	33.4	Very low	99 Å²	99	138.8 Å²	138.8	82%	0.818	73%	0.73	S	S	*	*	S	Bend	trans	-71.4	14.4	-176.7	0	0	0	0	0	115
312	D	30.8	Very low	34	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	72%	0.719	S	S	*	*			trans	-125.9	89.4	-167.3	-56.7	-41	0	0	0	110.7	S310	S310-D312 PolarHBondContact O-N 3.43Å
313	G	33.7	Very low	34.7	Very low	51 Å²	51	131.7 Å²	131.7	53%	0.526	70%	0.703	S	S	.	*			trans	-158.1	100.2	176.9	0	0	0	0	0	111.4	L315	G313-L315 PolarHBondContact O-N 3.42Å
314	W	34.3	Very low	35.3	Very low	244 Å²	244	129.7 Å²	129.7	92%	0.924	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	22.9	-177.4	-74.4	85.5	0	0	0	115.9
315	L	36	Very low	35.7	Very low	158 Å²	158	121.5 Å²	121.5	83%	0.827	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	8.7	-176.6	-142.4	77.8	0	0	0	113.8	G313	G313-L315 PolarHBondContact O-N 3.42Å
316	Y	34.3	Very low	36.4	Very low	132 Å²	132	120.1 Å²	120.1	52%	0.518	64%	0.642	S	S	.	*			trans	-120.1	26.1	-172.5	-99.8	-80.8	0	0	0	114.6	R322 C325	Y316-R322 HydrophobicContact CD1-CB 4.46Å; Y316-C325 HydrophobicContact CE1-CB 4.13Å
317	T	41	Very low	37	Very low	122 Å²	122	117.6 Å²	117.6	75%	0.748	63%	0.633	S	S	*	*			trans	-84.2	-9.5	-176.2	49.2	0	0	0	0	114.6	P319	T317-P319 WeakPolarHBondContact O-CD 3.35Å
318	D	37.3	Very low	37.5	Very low	71 Å²	71	115.7 Å²	115.7	38%	0.38	62%	0.622	S	S	.	*			trans	-93.8	115.7	178.9	-159.6	-35.3	0	0	0	111.5	R320 I321 R322	D318-R320 PolarHBondContact O-N 2.89Å; D318-R320 VanDerWaalsContact O-N 3.12Å; D318-R320 WeakPolarHBondContact OD1-CB 3.33Å; D318-R320 PolarHBondContact OD1-N 2.9Å; D318-I321 HydrophobicContact CB-CB 4.22Å; D318-I321 HydrophobicContact CB-CD1 3.97Å; D318-I321 HydrophobicContact CB-CG1 4Å; D318-I321 PolarHBondContact O-N 3.22Å; D318-I321 VanDerWaalsContact O-N 3.17Å; D318-R322 PolarHBondContact O-N 2.81Å
319	P	44.8	Very low	38.1	Very low	100 Å²	100	116.3 Å²	116.3	65%	0.649	62%	0.617	S	S	*	*	H	α-helix	trans	-60.2	-21.9	179.4	22.5	-31.9	0	0	0	113.3	T317 S323	T317-P319 WeakPolarHBondContact O-CD 3.35Å; P319-S323 PolarHBondContact O-N 3.45Å
320	R	43.5	Very low	38.6	Very low	187 Å²	187	111.1 Å²	111.1	71%	0.706	58%	0.584	S	S	*	*	H	α-helix	trans	-76.9	-41.5	177.1	-57.9	-179.8	-173.8	-171.2	1.9	112	D318 R322 S323 I324	D318-R320 PolarHBondContact O-N 2.89Å; D318-R320 VanDerWaalsContact O-N 3.12Å; D318-R320 WeakPolarHBondContact OD1-CB 3.33Å; D318-R320 PolarHBondContact OD1-N 2.9Å; R320-R322 VanDerWaalsContact C-N 3.33Å; R320-S323 PolarHBondContact O-N 2.95Å; R320-S323 PolarHBondContact O-OG 3.45Å; R320-I324 WeakPolarHBondContact O-CD1 3.19Å; R320-I324 VanDerWaalsContact O-CG1 3.24Å; R320-I324 WeakPolarHBondContact O-CG1 3.5Å; R320-I324 PolarHBondContact O-N 2.83Å; R320-I324 VanDerWaalsContact O-N 3.07Å
321	I	47.2	Very low	39.2	Very low	87 Å²	87	110.4 Å²	110.4	45%	0.446	57%	0.573	S	S	.	*	H	α-helix	trans	-70.6	-36.3	176.1	-59.6	176.9	0	0	0	109.7	D318 I324 C325	D318-I321 HydrophobicContact CB-CB 4.22Å; D318-I321 HydrophobicContact CB-CD1 3.97Å; D318-I321 HydrophobicContact CB-CG1 4Å; D318-I321 PolarHBondContact O-N 3.22Å; D318-I321 VanDerWaalsContact O-N 3.17Å; I321-I324 PolarHBondContact O-N 3.2Å; I321-C325 VanDerWaalsContact O-CB 3.32Å; I321-C325 WeakPolarHBondContact O-CB 3.49Å; I321-C325 PolarHBondContact O-N 2.95Å
322	R	38.9	Very low	39.5	Very low	154 Å²	154	115.8 Å²	115.8	58%	0.581	57%	0.572	S	S	*	*	H	α-helix	trans	-62.8	-42.4	172.4	-170.8	176.8	179.4	-178.4	-0.4	111.9	Y316 D318 R320 V326	Y316-R322 HydrophobicContact CD1-CB 4.46Å; D318-R322 PolarHBondContact O-N 2.81Å; R320-R322 VanDerWaalsContact C-N 3.33Å; R322-V326 HydrophobicContact CG-CG2 4.17Å; R322-V326 WeakPolarHBondContact O-CB 3.33Å; R322-V326 WeakPolarHBondContact O-CG2 2.97Å; R322-V326 PolarHBondContact O-N 2.79Å
323	S	42.2	Very low	39.8	Very low	68 Å²	68	111.3 Å²	111.3	48%	0.476	55%	0.547	S	S	.	.	H	α-helix	trans	-66.7	-40.7	177.6	89.1	0	0	0	0	111.6	P319 R320 T327	P319-S323 PolarHBondContact O-N 3.45Å; R320-S323 PolarHBondContact O-N 2.95Å; R320-S323 PolarHBondContact O-OG 3.45Å; S323-T327 WeakPolarHBondContact O-CB 3.47Å; S323-T327 PolarHBondContact O-N 3.2Å; S323-T327 PolarHBondContact O-OG1 3.17Å
324	I	43.3	Very low	40.1	Very low	93 Å²	93	112.9 Å²	112.9	48%	0.477	55%	0.548	S	S	.	.	H	α-helix	trans	-66.3	-46	177.6	-67.1	164.8	0	0	0	111.5	R320 I321 T327 L328	R320-I324 WeakPolarHBondContact O-CD1 3.19Å; R320-I324 VanDerWaalsContact O-CG1 3.24Å; R320-I324 WeakPolarHBondContact O-CG1 3.5Å; R320-I324 PolarHBondContact O-N 2.83Å; R320-I324 VanDerWaalsContact O-N 3.07Å; I321-I324 PolarHBondContact O-N 3.2Å; I324-T327 WeakPolarHBondContact CA-OG1 3.49Å; I324-T327 PolarHBondContact O-OG1 3.23Å; I324-T327 VanDerWaalsContact O-OG1 3.1Å; I324-L328 HydrophobicContact CG2-CD1 3.56Å; I324-L328 HydrophobicContact CG2-CG 4.42Å; I324-L328 WeakPolarHBondContact O-CB 3.34Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.31Å; I324-L328 PolarHBondContact O-N 3.46Å
325	C	36	Very low	40.3	Very low	36 Å²	36	104.4 Å²	104.4	24%	0.243	52%	0.521	C	S	.	.	H	α-helix	trans	-66.6	-41.4	176.6	-86.8	0	0	0	0	111.7	Y316 I321 W329	Y316-C325 HydrophobicContact CE1-CB 4.13Å; I321-C325 VanDerWaalsContact O-CB 3.32Å; I321-C325 WeakPolarHBondContact O-CB 3.49Å; I321-C325 PolarHBondContact O-N 2.95Å; C325-W329 WeakPolarHBondContact O-CB 3.25Å; C325-W329 PolarHBondContact O-N 3.47Å
326	V	42.2	Very low	40.7	Very low	81 Å²	81	107 Å²	107	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-69.1	-37.9	178.1	172.5	0	0	0	0	111.2	R322 A330	R322-V326 HydrophobicContact CG-CG2 4.17Å; R322-V326 WeakPolarHBondContact O-CB 3.33Å; R322-V326 WeakPolarHBondContact O-CG2 2.97Å; R322-V326 PolarHBondContact O-N 2.79Å; V326-A330 WeakPolarHBondContact O-CA 2.99Å; V326-A330 WeakPolarHBondContact O-CB 3.19Å; V326-A330 PolarHBondContact O-N 3.11Å
327	T	42.4	Very low	40.8	Very low	85 Å²	85	107.4 Å²	107.4	52%	0.521	53%	0.528	S	S	.	.	H	α-helix	trans	-69	-46.2	174.1	38.2	0	0	0	0	111.9	S323 I324 W329	S323-T327 WeakPolarHBondContact O-CB 3.47Å; S323-T327 PolarHBondContact O-N 3.2Å; S323-T327 PolarHBondContact O-OG1 3.17Å; I324-T327 WeakPolarHBondContact CA-OG1 3.49Å; I324-T327 PolarHBondContact O-OG1 3.23Å; I324-T327 VanDerWaalsContact O-OG1 3.1Å; T327-W329 PolarHBondContact O-N 3.38Å
328	L	39.3	Very low	40.9	Very low	111 Å²	111	102.6 Å²	102.6	58%	0.581	50%	0.496	S	S	*	.	H	α-helix	trans	-66.8	-33.5	177.9	-74.4	166.5	0	0	0	113.1	I324	I324-L328 HydrophobicContact CG2-CD1 3.56Å; I324-L328 HydrophobicContact CG2-CG 4.42Å; I324-L328 WeakPolarHBondContact O-CB 3.34Å; I324-L328 VanDerWaalsContact O-CG 3.29Å; I324-L328 WeakPolarHBondContact O-CG 3.31Å; I324-L328 PolarHBondContact O-N 3.46Å
329	W	41.9	Very low	41.1	Very low	199 Å²	199	103.3 Å²	103.3	75%	0.754	50%	0.495	S	S	*	.	H	α-helix	trans	-88.6	-35.1	179	-85.6	63.7	0	0	0	114	C325 T327 D331 W332	C325-W329 WeakPolarHBondContact O-CB 3.25Å; C325-W329 PolarHBondContact O-N 3.47Å; T327-W329 PolarHBondContact O-N 3.38Å; W329-D331 PolarHBondContact O-N 3.27Å; W329-W332 PolarHBondContact O-N 2.99Å
330	A	39.4	Very low	41.2	Very low	24 Å²	24	99.4 Å²	99.4	20%	0.198	47%	0.468	C	S	.	.	H	α-helix	trans	-63.5	-27.4	179.7	0	0	0	0	0	112.1	V326 W332 R338 A634	V326-A330 WeakPolarHBondContact O-CA 2.99Å; V326-A330 WeakPolarHBondContact O-CB 3.19Å; V326-A330 PolarHBondContact O-N 3.11Å; A330-W332 VanDerWaalsContact C-N 3.31Å; A330-W332 PolarHBondContact O-N 3.47Å; A330-R338 PolarHBondContact O-NH2 3.25Å; A330-A634 HydrophobicContact CB-CB 4.26Å
331	D	42.1	Very low	41.5	Very low	78 Å²	78	96.5 Å²	96.5	42%	0.417	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.5	178.9	-81.7	-16.2	0	0	0	114.2	W329 R338	W329-D331 PolarHBondContact O-N 3.27Å; D331-R338 PolarHBondContact O-NH2 3.48Å
332	W	38.6	Very low	41.7	Very low	212 Å²	212	93.8 Å²	93.8	80%	0.803	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	3.6	-176.6	-76.4	80.2	0	0	0	115	W329 A330 P334	W329-W332 PolarHBondContact O-N 2.99Å; A330-W332 VanDerWaalsContact C-N 3.31Å; A330-W332 PolarHBondContact O-N 3.47Å; W332-P334 WeakPolarHBondContact O-CD 3.45Å
333	I	38.4	Very low	42.4	Very low	44 Å²	44	87.3 Å²	87.3	23%	0.226	43%	0.429	C	S	.	.	S	Bend	trans	-78.3	121.6	179.8	-57.2	173.4	0	0	0	109.9	Q337 A634	I333-Q337 HydrophobicContact CG2-CB 3.64Å; I333-A634 HydrophobicContact CD1-CB 4.1Å
334	P	39.3	Very low	42.8	Very low	84 Å²	84	89 Å²	89	55%	0.545	43%	0.433	S	S	.	.			trans	-56.3	144.9	175.8	-22.7	32.3	0	0	0	112.6	W332 Y336 Q337	W332-P334 WeakPolarHBondContact O-CD 3.45Å; P334-Y336 PolarHBondContact O-N 3.37Å; P334-Q337 PolarHBondContact O-N 3.2Å; P334-Q337 VanDerWaalsContact O-N 3.16Å
335	L	39.3	Very low	43.2	Very low	67 Å²	67	85.1 Å²	85.1	35%	0.351	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-38.5	-27.4	-175.7	-96	162.1	0	0	0	117.8	Q337 G572	L335-Q337 PolarHBondContact O-N 3.07Å; L335-G572 WeakPolarHBondContact CD2-O 3.36Å
336	Y	43.2	Very low	43.8	Very low	212 Å²	212	83.9 Å²	83.9	83%	0.831	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-73.4	-4.8	-177.2	-68.5	-78.9	0	0	0	114.6	P334	P334-Y336 PolarHBondContact O-N 3.37Å
337	Q	37.6	Very low	44.1	Very low	141 Å²	141	85.8 Å²	85.8	66%	0.659	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-122.8	4	-178.9	-68.2	-153.7	-15.5	0	0	116.1	I333 P334 L335	I333-Q337 HydrophobicContact CG2-CB 3.64Å; P334-Q337 PolarHBondContact O-N 3.2Å; P334-Q337 VanDerWaalsContact O-N 3.16Å; L335-Q337 PolarHBondContact O-N 3.07Å
338	R	41.7	Very low	44.2	Very low	20 Å²	20	83.1 Å²	83.1	8%	0.075	41%	0.408	C	S	.	.			trans	-89.2	114.3	176.6	-74.7	-177.8	176.3	158.9	4.2	110.5	A330 D331 V571	A330-R338 PolarHBondContact O-NH2 3.25Å; D331-R338 PolarHBondContact O-NH2 3.48Å; R338-V571 PolarHBondContact NH1-O 2.86Å
339	K	41.4	Very low	44.5	Very low	86 Å²	86	79 Å²	79	37%	0.374	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.9	172.4	-60.8	-163.7	-174.4	160.6	0	108.9	V633 T635 G649	K339-V633 PolarHBondContact N-O 3.02Å; K339-V633 PolarHBondContact O-N 3.41Å; K339-T635 HydrophobicContact CB-CG2 4.27Å; K339-T635 HydrophobicContact CD-CG2 3.74Å; K339-T635 VanDerWaalsContact CD-OG1 3.23Å; K339-T635 WeakPolarHBondContact CD-OG1 3.16Å; K339-T635 WeakPolarHBondContact CE-OG1 3.46Å; K339-T635 HydrophobicContact CG-CG2 4.29Å; K339-T635 PolarHBondContact NZ-OG1 3.36Å; K339-G649 VanDerWaalsContact CA-O 3.25Å; K339-G649 WeakPolarHBondContact CA-O 3.29Å; K339-G649 WeakPolarHBondContact CB-O 3.2Å; K339-G649 VanDerWaalsContact CG-O 3.25Å; K339-G649 WeakPolarHBondContact CG-O 3.37Å
340	F	47.8	Very low	44.9	Very low	18 Å²	18	70.4 Å²	70.4	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.4	171.2	-178.3	-93.5	0	0	0	107.5	L574 F578 I579 L630 F651	F340-L574 HydrophobicContact CD2-CD2 4.16Å; F340-L574 HydrophobicContact CE2-CD2 4.39Å; F340-F578 HydrophobicContact CE2-CD1 4.33Å; F340-F578 HydrophobicContact CZ-CD1 4.3Å; F340-F578 HydrophobicContact CZ-CE1 4.47Å; F340-I579 HydrophobicContact CE1-CD1 4.47Å; F340-I579 HydrophobicContact CZ-CD1 4.43Å; F340-L630 HydrophobicContact CE1-CD2 4.49Å; F340-L630 HydrophobicContact CE2-CB 4.23Å; F340-L630 HydrophobicContact CE2-CD1 4.11Å; F340-L630 HydrophobicContact CE2-CD2 3.62Å; F340-L630 HydrophobicContact CE2-CG 4.2Å; F340-L630 HydrophobicContact CZ-CD1 4.19Å; F340-L630 HydrophobicContact CZ-CD2 3.41Å; F340-L630 VanDerWaalsContact CZ-CD2 3.41Å; F340-L630 HydrophobicContact CZ-CG 4.33Å; F340-F651 HydrophobicContact CB-CB 4.05Å; F340-F651 HydrophobicContact CD1-CD2 4.03Å; F340-F651 HydrophobicContact CD1-CE2 4.42Å; F340-F651 HydrophobicContact CD1-CG 4.28Å
341	Q	48.6	Very low	45.2	Very low	127 Å²	127	74.7 Å²	74.7	59%	0.593	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-95.4	130	170.6	-167.1	165	7.7	0	0	107.9
342	C	52.9	Low	45.3	Very low	29 Å²	29	71.5 Å²	71.5	20%	0.196	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-57.4	134.2	173.2	-43.3	0	0	0	0	107.9	D344 A588 C589	C342-D344 PolarHBondContact O-N 2.9Å; C342-A588 PolarHBondContact SG-O 3.47Å; C342-C589 HydrophobicContact CB-CB 3.88Å; C342-C589 WeakPolarHBondContact CB-SG 3.44Å; C342-C589 VanDerWaalsContact SG-CA 3.56Å; C342-C589 WeakPolarHBondContact SG-CB 3.26Å; C342-C589 CovalentContact SG-SG 2.03Å; C342-C589 PolarHBondContact SG-SG 3.42Å
343	P	52.6	Low	45.7	Very low	19 Å²	19	62.4 Å²	62.4	12%	0.123	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-65.2	132.1	-178.5	25.3	-30.7	0	0	0	109.2	I345 W592 L630	P343-I345 PolarHBondContact O-N 3.07Å; P343-W592 HydrophobicContact CG-CZ2 3.67Å; P343-W592 PolarHBondContact O-NE1 3.27Å; P343-L630 HydrophobicContact CB-CD2 4.15Å; P343-L630 VanDerWaalsContact CD-CD2 3.45Å; P343-L630 HydrophobicContact CG-CD2 3.54Å
344	D	50.1	Low	46.2	Very low	104 Å²	104	63.3 Å²	63.3	56%	0.556	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-60.3	119.1	178.4	-68.3	-30.4	0	0	0	110	C342	C342-D344 PolarHBondContact O-N 2.9Å
345	I	53.4	Low	46.5	Very low	10 Å²	10	63.8 Å²	63.8	5%	0.051	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-71.3	130.8	172.8	-64.5	151	0	0	0	107.5	P343 V350 Q591 W592 I595	P343-I345 PolarHBondContact O-N 3.07Å; I345-V350 HydrophobicContact CB-CG2 3.67Å; I345-V350 HydrophobicContact CD1-CG2 4.34Å; I345-V350 HydrophobicContact CG2-CG2 3.43Å; I345-V350 VanDerWaalsContact CG2-CG2 3.43Å; I345-Q591 HydrophobicContact CD1-CB 3.39Å; I345-Q591 HydrophobicContact CD1-CG 4.48Å; I345-W592 HydrophobicContact CD1-CD2 4.38Å; I345-W592 HydrophobicContact CD1-CG 4.2Å; I345-W592 HydrophobicContact CG1-CZ2 4.35Å; I345-I595 HydrophobicContact CD1-CD1 3.56Å; I345-I595 HydrophobicContact CG1-CD1 4.24Å; I345-I595 HydrophobicContact CG2-CD1 4.5Å
346	P	48.3	Very low	46.7	Very low	11 Å²	11	61 Å²	61	7%	0.071	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-54	136.3	178.9	-27.3	33.6	0	0	0	110.6	G348 Y349 L623	P346-G348 PolarHBondContact O-N 3.3Å; P346-Y349 PolarHBondContact O-N 3.35Å; P346-L623 HydrophobicContact CG-CD2 3.75Å
347	P	47	Very low	46.6	Very low	121 Å²	121	57 Å²	57	79%	0.786	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	135.5	174.3	23.1	-31.6	0	0	0	109.5
348	G	44.6	Very low	46.5	Very low	28 Å²	28	52.5 Å²	52.5	29%	0.289	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.2	-21.2	-174.7	0	0	0	0	0	115.9	P346 S352	P346-G348 PolarHBondContact O-N 3.3Å; G348-S352 WeakPolarHBondContact O-CB 3.47Å; G348-S352 PolarHBondContact O-OG 2.86Å
349	Y	47.5	Very low	46.4	Very low	24 Å²	24	55.6 Å²	55.6	9%	0.094	33%	0.329	C	S	.	.	H	α-helix	trans	-84.1	-35	171.7	-99.5	-91.9	0	0	0	112.7	P346 S352 I353 L372 I619	P346-Y349 PolarHBondContact O-N 3.35Å; Y349-S352 PolarHBondContact O-OG 3.48Å; Y349-I353 HydrophobicContact CD1-CD1 3.86Å; Y349-I353 WeakPolarHBondContact O-CB 3.3Å; Y349-I353 VanDerWaalsContact O-CG1 3.27Å; Y349-I353 WeakPolarHBondContact O-CG1 3.38Å; Y349-I353 PolarHBondContact O-N 3.31Å; Y349-L372 WeakPolarHBondContact OH-CD1 3.48Å; Y349-I619 HydrophobicContact CD1-CG1 4.24Å; Y349-I619 HydrophobicContact CE1-CG1 3.86Å
350	V	48.7	Very low	46.2	Very low	19 Å²	19	58.6 Å²	58.6	12%	0.115	35%	0.349	C	S	.	.	H	α-helix	trans	-69.6	-46	-177.7	-175.9	0	0	0	0	110.1	I345 I354 Q591	I345-V350 HydrophobicContact CB-CG2 3.67Å; I345-V350 HydrophobicContact CD1-CG2 4.34Å; I345-V350 HydrophobicContact CG2-CG2 3.43Å; I345-V350 VanDerWaalsContact CG2-CG2 3.43Å; V350-I354 HydrophobicContact CG1-CD1 3.46Å; V350-I354 VanDerWaalsContact CG1-CD1 3.46Å; V350-I354 WeakPolarHBondContact O-CB 3.27Å; V350-I354 WeakPolarHBondContact O-CD1 3.44Å; V350-I354 WeakPolarHBondContact O-CG1 3.45Å; V350-I354 PolarHBondContact O-N 2.87Å; V350-Q591 HydrophobicContact CG1-CG 4.23Å
351	D	47.2	Very low	45.6	Very low	114 Å²	114	59.3 Å²	59.3	61%	0.61	36%	0.356	S	S	*	.	H	α-helix	trans	-72.7	-36.8	-176.1	-57	-41.2	0	0	0	112.3	S355	D351-S355 WeakPolarHBondContact O-CB 3.29Å; D351-S355 PolarHBondContact O-N 2.88Å; D351-S355 PolarHBondContact O-OG 3.44Å
352	S	44.3	Very low	45.1	Very low	12 Å²	12	55.1 Å²	55.1	8%	0.084	34%	0.337	C	S	.	.	H	α-helix	trans	-73.9	-34.7	-179.7	55.8	0	0	0	0	113.5	G348 Y349 S356 I365	G348-S352 WeakPolarHBondContact O-CB 3.47Å; G348-S352 PolarHBondContact O-OG 2.86Å; Y349-S352 PolarHBondContact O-OG 3.48Å; S352-S356 PolarHBondContact O-OG 3.47Å; S352-I365 WeakPolarHBondContact O-CD1 3.46Å
353	I	47.2	Very low	44.4	Very low	20 Å²	20	55.5 Å²	55.5	10%	0.103	35%	0.346	C	S	.	.	H	α-helix	trans	-83	-27.7	177	-62	174.4	0	0	0	111.2	Y349 S356 I595 K598 I619	Y349-I353 HydrophobicContact CD1-CD1 3.86Å; Y349-I353 WeakPolarHBondContact O-CB 3.3Å; Y349-I353 VanDerWaalsContact O-CG1 3.27Å; Y349-I353 WeakPolarHBondContact O-CG1 3.38Å; Y349-I353 PolarHBondContact O-N 3.31Å; I353-S356 PolarHBondContact O-OG 2.89Å; I353-I595 HydrophobicContact CG2-CG1 4.32Å; I353-K598 HydrophobicContact CG2-CD 3.92Å; I353-K598 WeakPolarHBondContact O-CD 3.37Å; I353-K598 WeakPolarHBondContact O-CE 3.49Å; I353-K598 PolarHBondContact O-NZ 2.96Å; I353-I619 HydrophobicContact CD1-CD1 3.81Å
354	I	48	Very low	43.7	Very low	63 Å²	63	59.7 Å²	59.7	32%	0.323	37%	0.367	S	S	.	.	H	α-helix	trans	-93.7	-27.8	-176.4	-63	168.2	0	0	0	112.6	V350 R594	V350-I354 HydrophobicContact CG1-CD1 3.46Å; V350-I354 VanDerWaalsContact CG1-CD1 3.46Å; V350-I354 WeakPolarHBondContact O-CB 3.27Å; V350-I354 WeakPolarHBondContact O-CD1 3.44Å; V350-I354 WeakPolarHBondContact O-CG1 3.45Å; V350-I354 PolarHBondContact O-N 2.87Å; I354-R594 HydrophobicContact CD1-CB 4.12Å; I354-R594 HydrophobicContact CD1-CG 4.49Å; I354-R594 HydrophobicContact CG1-CB 4.21Å
355	S	44.7	Very low	43.2	Very low	94 Å²	94	55.6 Å²	55.6	66%	0.657	35%	0.345	S	S	*	.	S	Bend	trans	-81.9	-14.2	179.5	62.7	0	0	0	0	115.2	D351 S357	D351-S355 WeakPolarHBondContact O-CB 3.29Å; D351-S355 PolarHBondContact O-N 2.88Å; D351-S355 PolarHBondContact O-OG 3.44Å; S355-S357 PolarHBondContact O-N 2.93Å; S355-S357 VanDerWaalsContact O-N 3.08Å
356	S	43.7	Very low	42.7	Very low	10 Å²	10	55.4 Å²	55.4	7%	0.07	35%	0.346	C	S	.	.			trans	-82.7	81.7	-178.6	41.7	0	0	0	0	111.7	S352 I353 S358 K598	S352-S356 PolarHBondContact O-OG 3.47Å; I353-S356 PolarHBondContact O-OG 2.89Å; S356-S358 PolarHBondContact O-N 3.39Å; S356-K598 PolarHBondContact O-NZ 3.43Å; S356-K598 PolarHBondContact OG-NZ 3.22Å
357	S	41.6	Very low	42.4	Very low	126 Å²	126	61.9 Å²	61.9	88%	0.881	38%	0.375	S	S	*	.			trans	-64	2.8	173.7	51.4	0	0	0	0	114.4	S355	S355-S357 PolarHBondContact O-N 2.93Å; S355-S357 VanDerWaalsContact O-N 3.08Å
358	S	34.8	Very low	42.3	Very low	47 Å²	47	60.2 Å²	60.2	33%	0.329	37%	0.366	S	S	.	.	S	Bend	trans	-142.1	141	175.6	77.7	0	0	0	0	111.3	S356 N360 S361	S356-S358 PolarHBondContact O-N 3.39Å; S358-N360 PolarHBondContact O-N 2.88Å; S358-N360 VanDerWaalsContact O-N 3.13Å; S358-S361 WeakPolarHBondContact O-CB 3.22Å; S358-S361 PolarHBondContact O-N 2.84Å; S358-S361 PolarHBondContact OG-OG 3.49Å
359	V	39.8	Very low	42.3	Very low	86 Å²	86	60.4 Å²	60.4	52%	0.521	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-55.5	-25.5	171.4	-176.1	0	0	0	0	110.9	S361 I362 E610	V359-S361 PolarHBondContact O-N 3.32Å; V359-I362 HydrophobicContact CG1-CD1 4.27Å; V359-I362 WeakPolarHBondContact O-CG1 3.5Å; V359-I362 PolarHBondContact O-N 2.85Å; V359-E610 HydrophobicContact CG1-CG 4.36Å
360	N	38	Very low	42.3	Very low	148 Å²	148	64.2 Å²	64.2	79%	0.791	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-70.3	-12.1	177.2	-65.4	-11.6	0	0	0	114.4	S358	S358-N360 PolarHBondContact O-N 2.88Å; S358-N360 VanDerWaalsContact O-N 3.13Å
361	S	35.2	Very low	42.3	Very low	33 Å²	33	69.5 Å²	69.5	23%	0.231	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-91.4	-0.1	-179.9	-49.7	0	0	0	0	113.7	S358 V359 G363 N364 I365	S358-S361 WeakPolarHBondContact O-CB 3.22Å; S358-S361 PolarHBondContact O-N 2.84Å; S358-S361 PolarHBondContact OG-OG 3.49Å; V359-S361 PolarHBondContact O-N 3.32Å; S361-G363 PolarHBondContact O-N 3.46Å; S361-N364 PolarHBondContact O-N 3.25Å; S361-I365 PolarHBondContact O-N 3.23Å
362	I	38.4	Very low	42.2	Very low	40 Å²	40	64.6 Å²	64.6	21%	0.205	39%	0.39	C	S	.	.	H	α-helix	trans	-60	-31.6	172.2	-62.6	171.5	0	0	0	109.8	V359 N364 I365 L376 E610	V359-I362 HydrophobicContact CG1-CD1 4.27Å; V359-I362 WeakPolarHBondContact O-CG1 3.5Å; V359-I362 PolarHBondContact O-N 2.85Å; I362-N364 PolarHBondContact O-N 2.81Å; I362-N364 VanDerWaalsContact O-N 3.15Å; I362-I365 HydrophobicContact CB-CD1 4.41Å; I362-I365 HydrophobicContact CG1-CD1 4.18Å; I362-I365 WeakPolarHBondContact O-CB 3.47Å; I362-I365 PolarHBondContact O-N 2.9Å; I362-L376 HydrophobicContact CG2-CD1 4.07Å; I362-L376 HydrophobicContact CG2-CD2 3.95Å; I362-L376 HydrophobicContact CG2-CG 4.14Å; I362-L376 WeakPolarHBondContact O-CD2 3.41Å; I362-E610 HydrophobicContact CD1-CG 4.3Å
363	G	37.3	Very low	42.4	Very low	36 Å²	36	68 Å²	68	37%	0.371	40%	0.403	S	S	.	.	H	α-helix	trans	-53.2	-34.4	170.5	0	0	0	0	0	114.7	S361	S361-G363 PolarHBondContact O-N 3.46Å
364	N	38.6	Very low	42.5	Very low	107 Å²	107	70.7 Å²	70.7	57%	0.572	42%	0.422	S	S	*	.	H	α-helix	trans	-86.2	-13.8	-178.6	-65.1	1.4	0	0	0	113	S361 I362 G366 E367	S361-N364 PolarHBondContact O-N 3.25Å; I362-N364 PolarHBondContact O-N 2.81Å; I362-N364 VanDerWaalsContact O-N 3.15Å; N364-G366 PolarHBondContact O-N 3.24Å; N364-E367 PolarHBondContact O-N 2.77Å
365	I	39.8	Very low	42.2	Very low	19 Å²	19	70.6 Å²	70.6	10%	0.097	42%	0.422	C	S	.	.	H	α-helix	trans	-70.1	-24.6	174.4	-60.2	177.8	0	0	0	110.4	S352 S361 I362 L372 L376	S352-I365 WeakPolarHBondContact O-CD1 3.46Å; S361-I365 PolarHBondContact O-N 3.23Å; I362-I365 HydrophobicContact CB-CD1 4.41Å; I362-I365 HydrophobicContact CG1-CD1 4.18Å; I362-I365 WeakPolarHBondContact O-CB 3.47Å; I362-I365 PolarHBondContact O-N 2.9Å; I365-L372 HydrophobicContact CG2-CD2 3.54Å; I365-L376 HydrophobicContact CB-CD2 3.69Å; I365-L376 HydrophobicContact CG2-CD2 3.98Å
366	G	42.2	Very low	42.3	Very low	6 Å²	6	66.5 Å²	66.5	6%	0.062	39%	0.392	C	S	.	.	H	α-helix	trans	-76	-26.6	175	0	0	0	0	0	112.7	N364 K373	N364-G366 PolarHBondContact O-N 3.24Å; G366-K373 VanDerWaalsContact O-CA 3.32Å; G366-K373 WeakPolarHBondContact O-CA 3.24Å; G366-K373 WeakPolarHBondContact O-CB 3.33Å; G366-K373 WeakPolarHBondContact O-CG 3.4Å
367	E	42.1	Very low	42.6	Very low	147 Å²	147	71 Å²	71	69%	0.687	41%	0.412	S	S	*	.	H	α-helix	trans	-83.2	-21.1	-176.9	-76.6	-177.4	149.1	0	0	114.1	N364	N364-E367 PolarHBondContact O-N 2.77Å
368	S	45.6	Very low	42.7	Very low	86 Å²	86	72.6 Å²	72.6	60%	0.601	40%	0.399	S	S	*	.	H	α-helix	trans	-94.7	-13.8	-175.6	51	0	0	0	0	114.8
369	N	42.8	Very low	42.8	Very low	32 Å²	32	73.9 Å²	73.9	17%	0.171	40%	0.4	C	S	.	.			trans	-131.5	105.5	-178.5	-167.1	-22.6	0	0	0	110.2	D371 L372 K373	N369-D371 PolarHBondContact O-N 3.47Å; N369-D371 VanDerWaalsContact O-N 3.16Å; N369-D371 PolarHBondContact OD1-N 2.92Å; N369-L372 HydrophobicContact CB-CB 3.8Å; N369-L372 PolarHBondContact O-N 3.32Å; N369-K373 PolarHBondContact O-N 2.82Å
370	P	48.7	Very low	43.1	Very low	103 Å²	103	71.4 Å²	71.4	67%	0.669	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.9	-173.4	24.5	-33	0	0	0	112.9	P374	P370-P374 WeakPolarHBondContact O-CD 3.38Å
371	D	47.4	Very low	43	Very low	130 Å²	130	69.6 Å²	69.6	70%	0.695	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-25	176.2	-66.2	-26.4	0	0	0	112.6	N369	N369-D371 PolarHBondContact O-N 3.47Å; N369-D371 VanDerWaalsContact O-N 3.16Å; N369-D371 PolarHBondContact OD1-N 2.92Å
372	L	44.9	Very low	43	Very low	12 Å²	12	72.9 Å²	72.9	6%	0.063	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-29.2	-179.1	-160.8	64.7	0	0	0	112	Y349 I365 N369 L375 L376	Y349-L372 WeakPolarHBondContact OH-CD1 3.48Å; I365-L372 HydrophobicContact CG2-CD2 3.54Å; N369-L372 HydrophobicContact CB-CB 3.8Å; N369-L372 PolarHBondContact O-N 3.32Å; L372-L375 CarbonylContact O-C 3.59Å; L372-L375 WeakPolarHBondContact O-CB 3.38Å; L372-L375 PolarHBondContact O-N 3.49Å; L372-L376 WeakPolarHBondContact O-CB 3.02Å; L372-L376 PolarHBondContact O-N 3.39Å
373	K	49	Very low	42.9	Very low	84 Å²	84	71.6 Å²	71.6	37%	0.365	38%	0.381	S	S	.	.	H	α-helix	trans	-44.7	-54.6	177.2	-165.9	168.7	179.6	177.2	0	113.5	G366 N369 L375 L376 E377	G366-K373 VanDerWaalsContact O-CA 3.32Å; G366-K373 WeakPolarHBondContact O-CA 3.24Å; G366-K373 WeakPolarHBondContact O-CB 3.33Å; G366-K373 WeakPolarHBondContact O-CG 3.4Å; N369-K373 PolarHBondContact O-N 2.82Å; K373-L375 VanDerWaalsContact C-N 3.32Å; K373-L375 PolarHBondContact O-N 3.4Å; K373-L376 PolarHBondContact O-N 2.94Å; K373-E377 VanDerWaalsContact O-CB 3.31Å; K373-E377 WeakPolarHBondContact O-CB 3.32Å; K373-E377 PolarHBondContact O-N 3.31Å
374	P	48.8	Very low	42.8	Very low	76 Å²	76	75.8 Å²	75.8	49%	0.494	39%	0.389	S	S	.	.	H	α-helix	trans	-68.7	-31.3	-178.2	26.8	-34.9	0	0	0	112.6	P370 R378	P370-P374 WeakPolarHBondContact O-CD 3.38Å; P374-R378 WeakPolarHBondContact O-CB 3.35Å; P374-R378 PolarHBondContact O-N 2.85Å
375	L	42.4	Very low	42.8	Very low	61 Å²	61	77.6 Å²	77.6	32%	0.319	39%	0.394	S	S	.	.	H	α-helix	trans	-72.4	-38.9	176.9	-87.5	159.9	0	0	0	111.6	L372 K373 R378 M379	L372-L375 CarbonylContact O-C 3.59Å; L372-L375 WeakPolarHBondContact O-CB 3.38Å; L372-L375 PolarHBondContact O-N 3.49Å; K373-L375 VanDerWaalsContact C-N 3.32Å; K373-L375 PolarHBondContact O-N 3.4Å; L375-R378 PolarHBondContact O-N 2.83Å; L375-M379 WeakPolarHBondContact O-CG 3.19Å; L375-M379 PolarHBondContact O-N 3.14Å
376	L	47.3	Very low	42.5	Very low	8 Å²	8	82.5 Å²	82.5	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-77.4	-35.9	178.8	-143.1	79.2	0	0	0	112	I362 I365 L372 K373 R378 M379 N380	I362-L376 HydrophobicContact CG2-CD1 4.07Å; I362-L376 HydrophobicContact CG2-CD2 3.95Å; I362-L376 HydrophobicContact CG2-CG 4.14Å; I362-L376 WeakPolarHBondContact O-CD2 3.41Å; I365-L376 HydrophobicContact CB-CD2 3.69Å; I365-L376 HydrophobicContact CG2-CD2 3.98Å; L372-L376 WeakPolarHBondContact O-CB 3.02Å; L372-L376 PolarHBondContact O-N 3.39Å; K373-L376 PolarHBondContact O-N 2.94Å; L376-R378 VanDerWaalsContact C-N 3.32Å; L376-M379 HydrophobicContact CD1-CE 3.4Å; L376-M379 HydrophobicContact CG-CE 4.36Å; L376-M379 PolarHBondContact O-N 2.9Å; L376-N380 WeakPolarHBondContact O-CB 3.25Å; L376-N380 VanDerWaalsContact O-CG 3.31Å; L376-N380 PolarHBondContact O-N 3.38Å
377	E	50.5	Low	42.1	Very low	105 Å²	105	85.9 Å²	85.9	49%	0.491	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-37.9	167.6	-89.5	171.8	159.1	0	0	111	K373 N380 M381	K373-E377 VanDerWaalsContact O-CB 3.31Å; K373-E377 WeakPolarHBondContact O-CB 3.32Å; K373-E377 PolarHBondContact O-N 3.31Å; E377-N380 CarbonylContact O-C 3.43Å; E377-N380 PolarHBondContact O-N 3.43Å; E377-M381 WeakPolarHBondContact O-CB 3.26Å; E377-M381 WeakPolarHBondContact O-CG 3.48Å; E377-M381 PolarHBondContact O-N 2.93Å
378	R	42.5	Very low	41.7	Very low	159 Å²	159	83.4 Å²	83.4	60%	0.6	43%	0.426	S	S	*	.	H	α-helix	trans	-67.1	-39.9	174.6	-161.4	170.1	-167.8	170.4	2.3	111.7	P374 L375 L376 L382	P374-R378 WeakPolarHBondContact O-CB 3.35Å; P374-R378 PolarHBondContact O-N 2.85Å; L375-R378 PolarHBondContact O-N 2.83Å; L376-R378 VanDerWaalsContact C-N 3.32Å; R378-L382 HydrophobicContact CG-CD1 4.41Å; R378-L382 WeakPolarHBondContact O-CB 3.27Å; R378-L382 WeakPolarHBondContact O-CD1 3.38Å; R378-L382 WeakPolarHBondContact O-CG 3.4Å; R378-L382 PolarHBondContact O-N 3.18Å
379	M	37.4	Very low	41	Very low	73 Å²	73	83.2 Å²	83.2	36%	0.36	43%	0.429	S	S	.	.	H	α-helix	trans	-69.4	-37.8	173.2	-71.5	-169.9	-54.3	0	0	112.5	L375 L376 L382 S383	L375-M379 WeakPolarHBondContact O-CG 3.19Å; L375-M379 PolarHBondContact O-N 3.14Å; L376-M379 HydrophobicContact CD1-CE 3.4Å; L376-M379 HydrophobicContact CG-CE 4.36Å; L376-M379 PolarHBondContact O-N 2.9Å; M379-L382 PolarHBondContact O-N 3.39Å; M379-S383 WeakPolarHBondContact O-CB 3.3Å; M379-S383 PolarHBondContact O-N 2.94Å; M379-S383 PolarHBondContact O-OG 3.39Å
380	N	45.1	Very low	40.5	Very low	35 Å²	35	87.3 Å²	87.3	19%	0.187	46%	0.456	C	S	.	.	H	α-helix	trans	-72.7	-28	175.3	-80.4	-20.5	0	0	0	112.6	L376 E377 S383 K384	L376-N380 WeakPolarHBondContact O-CB 3.25Å; L376-N380 VanDerWaalsContact O-CG 3.31Å; L376-N380 PolarHBondContact O-N 3.38Å; E377-N380 CarbonylContact O-C 3.43Å; E377-N380 PolarHBondContact O-N 3.43Å; N380-S383 WeakPolarHBondContact CA-OG 3.34Å; N380-S383 PolarHBondContact O-OG 2.89Å; N380-K384 WeakPolarHBondContact O-CA 3.34Å; N380-K384 WeakPolarHBondContact O-CB 3.21Å; N380-K384 WeakPolarHBondContact O-CG 3.1Å; N380-K384 PolarHBondContact O-N 3.46Å
381	M	36.8	Very low	39.6	Very low	110 Å²	110	86.8 Å²	86.8	54%	0.542	45%	0.454	S	S	.	.	H	α-helix	trans	-74.1	-38.6	171.3	-75.4	-79.3	-89.5	0	0	110.3	E377 Q385	E377-M381 WeakPolarHBondContact O-CB 3.26Å; E377-M381 WeakPolarHBondContact O-CG 3.48Å; E377-M381 PolarHBondContact O-N 2.93Å; M381-Q385 VanDerWaalsContact O-CB 3.25Å; M381-Q385 WeakPolarHBondContact O-CB 3.11Å; M381-Q385 VanDerWaalsContact O-CG 3.26Å; M381-Q385 WeakPolarHBondContact O-CG 3.16Å; M381-Q385 PolarHBondContact O-N 2.9Å
382	L	34.4	Very low	38.7	Very low	102 Å²	102	85.8 Å²	85.8	53%	0.534	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-36.1	173.2	-70.6	165	0	0	0	112	R378 M379 Q386	R378-L382 HydrophobicContact CG-CD1 4.41Å; R378-L382 WeakPolarHBondContact O-CB 3.27Å; R378-L382 WeakPolarHBondContact O-CD1 3.38Å; R378-L382 WeakPolarHBondContact O-CG 3.4Å; R378-L382 PolarHBondContact O-N 3.18Å; M379-L382 PolarHBondContact O-N 3.39Å; L382-Q386 PolarHBondContact O-N 3.34Å
383	S	37.3	Very low	38	Very low	12 Å²	12	90.6 Å²	90.6	8%	0.084	49%	0.492	C	S	.	.	H	α-helix	trans	-77.9	-37.9	176	79.8	0	0	0	0	112.2	M379 N380 Q386 Q387	M379-S383 WeakPolarHBondContact O-CB 3.3Å; M379-S383 PolarHBondContact O-N 2.94Å; M379-S383 PolarHBondContact O-OG 3.39Å; N380-S383 WeakPolarHBondContact CA-OG 3.34Å; N380-S383 PolarHBondContact O-OG 2.89Å; S383-Q386 CarbonylContact O-C 3.27Å; S383-Q386 WeakPolarHBondContact O-CA 3.37Å; S383-Q386 WeakPolarHBondContact O-CB 3.27Å; S383-Q386 PolarHBondContact O-N 3.45Å; S383-Q387 WeakPolarHBondContact O-CB 3.47Å; S383-Q387 WeakPolarHBondContact O-CG 3.35Å; S383-Q387 PolarHBondContact O-N 2.99Å
384	K	35.2	Very low	37.2	Very low	124 Å²	124	91.9 Å²	91.9	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-68	-35.3	171.7	-76.9	176.4	179.4	178.8	0	111.3	N380 Q386 Q387 T388	N380-K384 WeakPolarHBondContact O-CA 3.34Å; N380-K384 WeakPolarHBondContact O-CB 3.21Å; N380-K384 WeakPolarHBondContact O-CG 3.1Å; N380-K384 PolarHBondContact O-N 3.46Å; K384-Q386 PolarHBondContact O-N 2.97Å; K384-Q387 PolarHBondContact O-N 3.42Å; K384-Q387 VanDerWaalsContact O-N 3.14Å; K384-T388 HydrophobicContact CB-CG2 4.47Å; K384-T388 WeakPolarHBondContact O-CB 3.33Å; K384-T388 PolarHBondContact O-N 3.04Å; K384-T388 PolarHBondContact O-OG1 3.15Å
385	Q	37.5	Very low	36.3	Very low	145 Å²	145	93.5 Å²	93.5	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-23.4	168.5	-79.3	-172.3	-27.8	0	0	112.7	M381	M381-Q385 VanDerWaalsContact O-CB 3.25Å; M381-Q385 WeakPolarHBondContact O-CB 3.11Å; M381-Q385 VanDerWaalsContact O-CG 3.26Å; M381-Q385 WeakPolarHBondContact O-CG 3.16Å; M381-Q385 PolarHBondContact O-N 2.9Å
386	Q	34	Very low	35.8	Very low	123 Å²	123	96.5 Å²	96.5	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-87.9	-21.7	170.2	-82.7	176	-39.6	0	0	114.6	L382 S383 K384 V390 I609	L382-Q386 PolarHBondContact O-N 3.34Å; S383-Q386 CarbonylContact O-C 3.27Å; S383-Q386 WeakPolarHBondContact O-CA 3.37Å; S383-Q386 WeakPolarHBondContact O-CB 3.27Å; S383-Q386 PolarHBondContact O-N 3.45Å; K384-Q386 PolarHBondContact O-N 2.97Å; Q386-V390 WeakPolarHBondContact O-CG2 3.28Å; Q386-I609 HydrophobicContact CB-CD1 4.39Å
387	Q	34.8	Very low	34.7	Very low	77 Å²	77	105.3 Å²	105.3	36%	0.36	59%	0.589	S	S	.	*	H	α-helix	trans	-105.1	-29.6	-175.4	-75.6	174.5	-5.8	0	0	114.3	S383 K384 A389 V390 S391 I609	S383-Q387 WeakPolarHBondContact O-CB 3.47Å; S383-Q387 WeakPolarHBondContact O-CG 3.35Å; S383-Q387 PolarHBondContact O-N 2.99Å; K384-Q387 PolarHBondContact O-N 3.42Å; K384-Q387 VanDerWaalsContact O-N 3.14Å; Q387-A389 PolarHBondContact O-N 2.85Å; Q387-V390 PolarHBondContact O-N 3.09Å; Q387-S391 PolarHBondContact O-N 3.35Å; Q387-S391 PolarHBondContact O-OG 2.8Å; Q387-I609 HydrophobicContact CG-CD1 4.05Å
388	T	33.3	Very low	33.7	Very low	95 Å²	95	105.8 Å²	105.8	58%	0.583	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-12.4	172.2	59.1	0	0	0	0	112.5	K384 V390	K384-T388 HydrophobicContact CB-CG2 4.47Å; K384-T388 WeakPolarHBondContact O-CB 3.33Å; K384-T388 PolarHBondContact O-N 3.04Å; K384-T388 PolarHBondContact O-OG1 3.15Å; T388-V390 PolarHBondContact O-N 2.8Å
389	A	31	Very low	32.8	Very low	81 Å²	81	103.8 Å²	103.8	67%	0.669	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-8	163.9	0	0	0	0	0	113.5	Q387	Q387-A389 PolarHBondContact O-N 2.85Å
390	V	32.3	Very low	32.4	Very low	119 Å²	119	108.2 Å²	108.2	72%	0.721	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.7	-2.2	-169.7	-172.8	0	0	0	0	113.5	Q386 Q387 T388	Q386-V390 WeakPolarHBondContact O-CG2 3.28Å; Q387-V390 PolarHBondContact O-N 3.09Å; T388-V390 PolarHBondContact O-N 2.8Å
391	S	29.3	Very low	31.5	Very low	91 Å²	91	112.5 Å²	112.5	64%	0.636	66%	0.659	S	S	*	*			trans	-136.6	66.7	-175.4	47.8	0	0	0	0	113.6	Q387	Q387-S391 PolarHBondContact O-N 3.35Å; Q387-S391 PolarHBondContact O-OG 2.8Å
392	S	28.9	Very low	31.2	Very low	109 Å²	109	113.5 Å²	113.5	76%	0.762	67%	0.671	S	S	*	*			trans	-146.8	79.2	161	51.9	0	0	0	0	111.5
393	S	29.9	Very low	31	Very low	113 Å²	113	114.5 Å²	114.5	79%	0.79	68%	0.684	S	S	*	*			trans	-164.6	89.6	158.7	58.4	0	0	0	0	111.9
394	S	31.4	Very low	30.7	Very low	111 Å²	111	119.3 Å²	119.3	78%	0.776	71%	0.709	S	S	*	*			trans	155.5	88.2	147.2	47.9	0	0	0	0	108.4
395	S	31.4	Very low	30.4	Very low	110 Å²	110	118.2 Å²	118.2	77%	0.769	71%	0.714	S	S	*	*				82.8	86.8	94.8	68	0	0	0	0	113.9
396	S	31.7	Very low	30.1	Very low	124 Å²	124	117.7 Å²	117.7	87%	0.867	72%	0.715	S	S	*	*				-179.3	124.8	128.9	33.8	0	0	0	0	110.1
397	F	24.8	Very low	30.1	Very low	193 Å²	193	115.1 Å²	115.1	85%	0.846	71%	0.711	S	S	*	*			trans	-59.9	154.6	171.6	-84.6	-90.2	0	0	0	111
398	P	28.6	Very low	30	Very low	116 Å²	116	116 Å²	116	75%	0.753	72%	0.715	S	S	*	*				-142.7	143.2	58.8	31.5	-8.8	0	0	0	118
399	T	24.4	Very low	29.9	Very low	116 Å²	116	116.3 Å²	116.3	71%	0.712	71%	0.713	S	S	*	*			trans	10.1	106.7	141.7	6.8	0	0	0	0	118.1
400	L	27.3	Very low	29.9	Very low	167 Å²	167	116.2 Å²	116.2	87%	0.874	71%	0.707	S	S	*	*			trans	-145.4	118.8	141.6	-142.9	78.9	0	0	0	110.4
401	T	27	Very low	29.8	Very low	124 Å²	124	118.1 Å²	118.1	76%	0.761	70%	0.702	S	S	*	*			trans	-65.3	114.3	179.5	44.4	0	0	0	0	112.2
402	T	30.3	Very low	29.8	Very low	132 Å²	132	120.8 Å²	120.8	81%	0.81	70%	0.699	S	S	*	*			trans	-154.1	148.6	155.5	43.2	0	0	0	0	111.1
403	P	30.9	Very low	30	Very low	123 Å²	123	123 Å²	123	80%	0.799	70%	0.697	S	S	*	*			trans	-83.8	154.8	-151.1	32.4	-34.5	0	0	0	115.3
404	N	30.4	Very low	30.2	Very low	113 Å²	113	122 Å²	122	60%	0.604	69%	0.69	S	S	*	*			trans	-26.6	119.1	178.5	-135.1	-9.1	0	0	0	116.8	L406 S407	N404-L406 VanDerWaalsContact C-N 3.25Å; N404-L406 PolarHBondContact O-N 3.1Å; N404-S407 PolarHBondContact O-OG 3.18Å; N404-S407 VanDerWaalsContact O-OG 3.11Å
405	P	30	Very low	30.3	Very low	101 Å²	101	123.9 Å²	123.9	66%	0.656	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-6.4	-179.9	28	-32.4	0	0	0	114.6	S407 Q408	P405-S407 VanDerWaalsContact C-N 3.32Å; P405-S407 PolarHBondContact O-N 2.83Å; P405-Q408 PolarHBondContact O-N 3.39Å
406	L	30.1	Very low	30.1	Very low	133 Å²	133	128.1 Å²	128.1	70%	0.696	69%	0.686	S	S	*	*	H	α-helix	trans	-75.6	-15.2	177.4	-88	156.2	0	0	0	114.2	N404	N404-L406 VanDerWaalsContact C-N 3.25Å; N404-L406 PolarHBondContact O-N 3.1Å
407	S	35.1	Very low	29.9	Very low	69 Å²	69	127.6 Å²	127.6	48%	0.483	67%	0.673	S	S	.	*	H	α-helix	trans	-87.3	-9.8	174.9	62.4	0	0	0	0	113.8	N404 P405 S410	N404-S407 PolarHBondContact O-OG 3.18Å; N404-S407 VanDerWaalsContact O-OG 3.11Å; P405-S407 VanDerWaalsContact C-N 3.32Å; P405-S407 PolarHBondContact O-N 2.83Å; S407-S410 PolarHBondContact O-OG 3.32Å
408	Q	32.5	Very low	30.4	Very low	97 Å²	97	125.6 Å²	125.6	45%	0.453	67%	0.67	S	S	.	*	H	α-helix	trans	-87.5	-28.2	176.4	-68.5	-88.2	-8.6	0	0	111.5	P405 S410 R411 Y412	P405-Q408 PolarHBondContact O-N 3.39Å; Q408-S410 PolarHBondContact O-N 3.28Å; Q408-R411 WeakPolarHBondContact O-CB 3.22Å; Q408-R411 PolarHBondContact O-N 3.22Å; Q408-R411 VanDerWaalsContact O-N 3.09Å; Q408-Y412 WeakPolarHBondContact O-CD2 3.42Å; Q408-Y412 PolarHBondContact O-N 2.93Å
409	L	29.8	Very low	30.4	Very low	100 Å²	100	129.9 Å²	129.9	52%	0.524	67%	0.672	S	S	.	*	H	α-helix	trans	-68.8	-33.9	-175.2	-141.8	83.4	0	0	0	113.2	R411 Y412 Q413	L409-R411 PolarHBondContact O-N 3.31Å; L409-Y412 PolarHBondContact O-N 3Å; L409-Q413 PolarHBondContact O-N 2.65Å
410	S	33	Very low	30.6	Very low	80 Å²	80	131.1 Å²	131.1	56%	0.559	68%	0.675	S	S	*	*	H	α-helix	trans	-70.2	-20.3	173.7	58.7	0	0	0	0	113	S407 Q408	S407-S410 PolarHBondContact O-OG 3.32Å; Q408-S410 PolarHBondContact O-N 3.28Å
411	R	30.1	Very low	30.9	Very low	159 Å²	159	128.4 Å²	128.4	60%	0.6	67%	0.665	S	S	*	*	H	α-helix	trans	-82.8	-29	178.9	-152.5	179.9	-68.9	-175.6	-1.8	112	Q408 L409 S414	Q408-R411 WeakPolarHBondContact O-CB 3.22Å; Q408-R411 PolarHBondContact O-N 3.22Å; Q408-R411 VanDerWaalsContact O-N 3.09Å; L409-R411 PolarHBondContact O-N 3.31Å; R411-S414 PolarHBondContact O-OG 3.08Å
412	Y	29	Very low	30.9	Very low	147 Å²	147	131.9 Å²	131.9	58%	0.576	67%	0.669	S	S	*	*	H	α-helix	trans	-79.5	-23.1	174.4	-83.2	-76.8	0	0	0	114	Q408 L409 S414	Q408-Y412 WeakPolarHBondContact O-CD2 3.42Å; Q408-Y412 PolarHBondContact O-N 2.93Å; L409-Y412 PolarHBondContact O-N 3Å; Y412-S414 VanDerWaalsContact C-N 3.35Å
413	Q	33.5	Very low	30.8	Very low	156 Å²	156	136.6 Å²	136.6	73%	0.729	67%	0.672	S	S	*	*	S	Bend	trans	-76.5	-19.2	174.8	-87.3	174.7	-50.6	0	0	113.9	L409	L409-Q413 PolarHBondContact O-N 2.65Å
414	S	33.2	Very low	30.6	Very low	92 Å²	92	136.7 Å²	136.7	64%	0.643	67%	0.671	S	S	*	*	S	Bend	trans	-86.7	-16	177.1	49.9	0	0	0	0	114.6	R411 Y412	R411-S414 PolarHBondContact O-OG 3.08Å; Y412-S414 VanDerWaalsContact C-N 3.35Å
415	E	32.5	Very low	30.4	Very low	150 Å²	150	136.2 Å²	136.2	70%	0.701	67%	0.668	S	S	*	*	S	Bend	trans	-89	-13.1	-179.8	-81.9	-177.5	161	0	0	114.1	N417	E415-N417 VanDerWaalsContact C-N 3.26Å; E415-N417 PolarHBondContact O-N 3.25Å
416	W	29.2	Very low	30.3	Very low	198 Å²	198	135.7 Å²	135.7	75%	0.75	67%	0.665	S	S	*	*			trans	-83.6	76.8	171.7	-76.5	88.4	0	0	0	110.3	I418	W416-I418 PolarHBondContact O-N 2.74Å
417	N	26.7	Very low	30.2	Very low	114 Å²	114	137.1 Å²	137.1	61%	0.61	67%	0.668	S	S	*	*			trans	-65.3	101.8	168.5	-140.7	-8.1	0	0	0	108.2	E415 Y419 N420	E415-N417 VanDerWaalsContact C-N 3.26Å; E415-N417 PolarHBondContact O-N 3.25Å; N417-Y419 PolarHBondContact O-N 3.31Å; N417-N420 PolarHBondContact O-N 2.73Å
418	I	34.9	Very low	29.9	Very low	151 Å²	151	143.3 Å²	143.3	77%	0.774	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-0.4	-175.7	-74.1	165.6	0	0	0	113.4	W416	W416-I418 PolarHBondContact O-N 2.74Å
419	Y	28.7	Very low	29.7	Very low	205 Å²	205	148.5 Å²	148.5	80%	0.804	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-13	177.1	-75.9	-84.4	0	0	0	115.4	N417	N417-Y419 PolarHBondContact O-N 3.31Å
420	N	29.4	Very low	29.7	Very low	142 Å²	142	149.7 Å²	149.7	76%	0.759	70%	0.704	S	S	*	*			trans	-102	4.5	-174.4	-79.5	-13.2	0	0	0	116.1	N417 K422	N417-N420 PolarHBondContact O-N 2.73Å; N420-K422 VanDerWaalsContact C-N 3.32Å; N420-K422 PolarHBondContact O-N 3.39Å
421	V	32.2	Very low	29.7	Very low	111 Å²	111	149.3 Å²	149.3	67%	0.673	71%	0.713	S	S	*	*	S	Bend	trans	-74.8	93.3	161.7	-177.1	0	0	0	0	106.7	R423	V421-R423 PolarHBondContact O-N 3.39Å
422	K	28.5	Very low	29.9	Very low	196 Å²	196	148.8 Å²	148.8	85%	0.852	72%	0.722	S	S	*	*			trans	-42	112.7	169.9	-88.6	-179.5	176.7	175.8	0	108	N420 V424	N420-K422 VanDerWaalsContact C-N 3.32Å; N420-K422 PolarHBondContact O-N 3.39Å; K422-V424 PolarHBondContact O-N 3.3Å
423	R	26.6	Very low	29.9	Very low	231 Å²	231	146 Å²	146	87%	0.872	72%	0.717	S	S	*	*			trans	-39.1	115.5	172.5	-89.6	179.1	-97.4	-158.4	-6.2	108.4	V421 N425	V421-R423 PolarHBondContact O-N 3.39Å; R423-N425 PolarHBondContact O-N 2.83Å
424	V	27.9	Very low	29.9	Very low	126 Å²	126	141.1 Å²	141.1	76%	0.764	71%	0.708	S	S	*	*			trans	-51.2	116.2	163.3	175.4	0	0	0	0	105.7	K422 P426	K422-V424 PolarHBondContact O-N 3.3Å; V424-P426 WeakPolarHBondContact O-CD 3.14Å
425	N	25.4	Very low	29.9	Very low	102 Å²	102	141.7 Å²	141.7	55%	0.545	70%	0.703	S	S	.	*			trans	-58.2	123.4	-169.7	-145.2	16.6	0	0	0	108.5	R423 E427 Y428	R423-N425 PolarHBondContact O-N 2.83Å; N425-E427 PolarHBondContact O-N 2.81Å; N425-Y428 PolarHBondContact O-N 3.43Å
426	P	29.1	Very low	30	Very low	91 Å²	91	139.9 Å²	139.9	59%	0.591	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	14	-177.6	27.9	-32.8	0	0	0	114.1	V424 W429	V424-P426 WeakPolarHBondContact O-CD 3.14Å; P426-W429 VanDerWaalsContact CA-CD1 3.4Å
427	E	27.4	Very low	30.4	Very low	162 Å²	162	134.7 Å²	134.7	76%	0.757	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-0.2	171.8	-71.2	179.4	151.8	0	0	113.2	N425 W429	N425-E427 PolarHBondContact O-N 2.81Å; E427-W429 VanDerWaalsContact C-N 3.3Å
428	Y	28.2	Very low	30.7	Very low	200 Å²	200	131.9 Å²	131.9	78%	0.784	67%	0.67	S	S	*	*			trans	-94.8	22.9	171.2	-120.2	-89.6	0	0	0	113.3	N425 D430	N425-Y428 PolarHBondContact O-N 3.43Å; Y428-D430 VanDerWaalsContact C-N 3.29Å; Y428-D430 PolarHBondContact O-N 3.47Å
429	W	29.2	Very low	30.5	Very low	206 Å²	206	127.7 Å²	127.7	78%	0.78	65%	0.653	S	S	*	*			trans	-94.8	52.7	175	-63.3	72.6	0	0	0	109.9	P426 E427 G431	P426-W429 VanDerWaalsContact CA-CD1 3.4Å; E427-W429 VanDerWaalsContact C-N 3.3Å; W429-G431 PolarHBondContact O-N 3.24Å
430	D	28.8	Very low	30.9	Very low	125 Å²	125	125.2 Å²	125.2	67%	0.668	65%	0.646	S	S	*	*			trans	-78.7	120.3	168	-93.3	-25.8	0	0	0	108.5	Y428 D432	Y428-D430 VanDerWaalsContact C-N 3.29Å; Y428-D430 PolarHBondContact O-N 3.47Å; D430-D432 PolarHBondContact O-N 2.81Å
431	G	32.4	Very low	31.2	Very low	72 Å²	72	123.3 Å²	123.3	74%	0.742	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	20.4	-171.2	0	0	0	0	0	116.5	W429	W429-G431 PolarHBondContact O-N 3.24Å
432	D	34.1	Very low	31.3	Very low	148 Å²	148	123 Å²	123	79%	0.791	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-3.2	177.9	-75.7	-17.6	0	0	0	113	D430	D430-D432 PolarHBondContact O-N 2.81Å
433	L	30.3	Very low	31.5	Very low	89 Å²	89	118.9 Å²	118.9	47%	0.466	62%	0.615	S	S	.	*			trans	-109.2	84	-172.1	-75.1	146.5	0	0	0	111.4	L435	L433-L435 HydrophobicContact CD2-CD1 4.5Å; L433-L435 PolarHBondContact O-N 3.49Å
434	G	33.3	Very low	31.7	Very low	52 Å²	52	111.8 Å²	111.8	54%	0.536	60%	0.599	S	S	.	*			trans	-65.2	58.4	177.2	0	0	0	0	0	115.4
435	L	32.2	Very low	32.1	Very low	104 Å²	104	109 Å²	109	55%	0.545	59%	0.585	S	S	.	*			trans	-113.5	93.8	-179.2	-72.2	168.3	0	0	0	110.9	L433 A624	L433-L435 HydrophobicContact CD2-CD1 4.5Å; L433-L435 PolarHBondContact O-N 3.49Å; L435-A624 HydrophobicContact CD1-CB 4.28Å; L435-A624 HydrophobicContact CD2-CB 3.79Å
436	M	35.1	Very low	32.7	Very low	112 Å²	112	110.4 Å²	110.4	55%	0.552	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-85.6	126.2	157	-154.5	168.3	103.3	0	0	107.8	I725	M436-I725 HydrophobicContact CE-CD1 3.64Å; M436-I725 HydrophobicContact CE-CG1 3.86Å
437	I	37.2	Very low	33.1	Very low	90 Å²	90	113.7 Å²	113.7	46%	0.462	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-52.9	133	169.4	-60.8	163.5	0	0	0	107	L441 I442	I437-L441 HydrophobicContact CG2-CB 3.54Å; I437-L441 HydrophobicContact CG2-CG 4.48Å; I437-I442 HydrophobicContact CG2-CG1 4.34Å
438	P	33	Very low	33.4	Very low	55 Å²	55	112.8 Å²	112.8	36%	0.357	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-54.6	140.7	178.5	23.2	-34.5	0	0	0	109.7	K440 L441	P438-K440 PolarHBondContact O-N 3.23Å; P438-L441 HydrophobicContact CG-CD1 3.62Å; P438-L441 PolarHBondContact O-N 2.7Å
439	P	32.2	Very low	33.8	Very low	62 Å²	62	110.8 Å²	110.8	40%	0.403	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-56	-20.1	178.5	19.3	-30.4	0	0	0	112.7	L441 I442 I725	P439-L441 PolarHBondContact O-N 3.09Å; P439-L441 VanDerWaalsContact O-N 3.11Å; P439-I442 PolarHBondContact O-N 2.84Å; P439-I725 HydrophobicContact CG-CG2 4.3Å
440	K	37.1	Very low	33.9	Very low	153 Å²	153	108.2 Å²	108.2	67%	0.665	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-61.7	-11	172.4	-65.9	-177.1	178.3	176.9	0	114.8	P438	P438-K440 PolarHBondContact O-N 3.23Å
441	L	34.9	Very low	34	Very low	102 Å²	102	112.5 Å²	112.5	53%	0.534	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-111.5	-0.5	177.5	-93.4	116.2	0	0	0	114.4	I437 P438 P439	I437-L441 HydrophobicContact CG2-CB 3.54Å; I437-L441 HydrophobicContact CG2-CG 4.48Å; P438-L441 HydrophobicContact CG-CD1 3.62Å; P438-L441 PolarHBondContact O-N 2.7Å; P439-L441 PolarHBondContact O-N 3.09Å; P439-L441 VanDerWaalsContact O-N 3.11Å
442	I	35.1	Very low	33.8	Very low	104 Å²	104	112 Å²	112	53%	0.533	60%	0.596	S	S	.	*			trans	-100.8	0	-172.1	-56.4	175.8	0	0	0	112.6	I437 P439 P444	I437-I442 HydrophobicContact CG2-CG1 4.34Å; P439-I442 PolarHBondContact O-N 2.84Å; I442-P444 WeakPolarHBondContact O-CD 3.27Å
443	I	31.5	Very low	33.9	Very low	111 Å²	111	109.6 Å²	109.6	57%	0.569	59%	0.588	S	S	*	*			trans	-87.7	106	171.8	-52.7	173.6	0	0	0	108.3	S445	I443-S445 PolarHBondContact O-N 3.36Å
444	P	31.2	Very low	34.3	Very low	81 Å²	81	114.5 Å²	114.5	53%	0.526	60%	0.601	S	S	.	*			trans	-65.6	133.9	167.8	29.3	-31	0	0	0	107.8	I442 I446	I442-P444 WeakPolarHBondContact O-CD 3.27Å; P444-I446 PolarHBondContact O-N 2.76Å
445	S	35.5	Very low	34.8	Very low	68 Å²	68	117.9 Å²	117.9	48%	0.476	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.5	6.2	-179.4	43	0	0	0	0	115.6	I443	I443-S445 PolarHBondContact O-N 3.36Å
446	I	38.3	Very low	35	Very low	131 Å²	131	117.2 Å²	117.2	67%	0.672	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-24.2	-176.8	-82.2	168.9	0	0	0	112.9	P444	P444-I446 PolarHBondContact O-N 2.76Å
447	E	37.9	Very low	35	Very low	161 Å²	161	116.3 Å²	116.3	75%	0.752	61%	0.607	S	S	*	*	S	Bend	trans	-91.4	-10.8	177.5	-80.5	-172.6	144.1	0	0	114.5	Q449	E447-Q449 VanDerWaalsContact C-N 3.3Å
448	Q	34.9	Very low	34.9	Very low	143 Å²	143	120.2 Å²	120.2	67%	0.668	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-80.2	-10.8	172.8	-72.6	-176	-23.4	0	0	113.3
449	Q	36	Very low	35.4	Very low	157 Å²	157	126.3 Å²	126.3	73%	0.734	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-82.6	-8	-178.7	-71	-168.1	-39.9	0	0	114.4	E447	E447-Q449 VanDerWaalsContact C-N 3.3Å
450	L	31.4	Very low	35.4	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-89.6	-5.2	-176.1	-131.6	74.5	0	0	0	114.8
451	Y	29.7	Very low	35.2	Very low	216 Å²	216	131.4 Å²	131.4	85%	0.847	66%	0.662	S	S	*	*	S	Bend	trans	-122.9	108	168.5	-82.6	-90	0	0	0	108.7
452	G	28.7	Very low	35.1	Very low	62 Å²	62	129.8 Å²	129.8	64%	0.639	67%	0.67	S	S	*	*			trans	-58.5	147	-156.5	0	0	0	0	0	116.6
453	P	37.4	Very low	35.2	Very low	96 Å²	96	136.7 Å²	136.7	62%	0.623	69%	0.69	S	S	*	*			trans	-67.7	145.2	170.2	-3.1	18.1	0	0	0	110.6	D455	P453-D455 PolarHBondContact O-N 3.27Å
454	R	36.8	Very low	35.7	Very low	193 Å²	193	138.8 Å²	138.8	73%	0.728	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	1.5	-178.9	-99.4	176.5	-172.4	175.5	2.2	117.3
455	D	44.1	Very low	35.9	Very low	122 Å²	122	143.2 Å²	143.2	65%	0.652	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-13.6	-170.8	-61.1	-37.4	0	0	0	113.9	P453	P453-D455 PolarHBondContact O-N 3.27Å
456	T	37	Very low	36.2	Very low	91 Å²	91	144.6 Å²	144.6	56%	0.558	72%	0.717	S	S	*	*	S	Bend	trans	-77.7	-22.2	175.3	47	0	0	0	0	113.7
457	V	34.4	Very low	36.2	Very low	92 Å²	92	143.8 Å²	143.8	56%	0.558	72%	0.718	S	S	*	*	S	Bend	trans	-81.1	-25.1	-178.2	-176	0	0	0	0	112.6	L460	V457-L460 PolarHBondContact O-N 2.7Å
458	K	36.8	Very low	36.4	Very low	173 Å²	173	142.7 Å²	142.7	75%	0.752	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-15.8	176.4	-88.1	-177.8	174.6	-179.8	0	114.5
459	Q	43.1	Very low	36.6	Very low	182 Å²	182	144.4 Å²	144.4	85%	0.85	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-17.9	170.1	-82.6	-178	-9.5	0	0	113
460	L	32.6	Very low	37	Very low	135 Å²	135	144.8 Å²	144.8	71%	0.707	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-22.6	-176.6	-90.2	147.5	0	0	0	114.1	V457	V457-L460 PolarHBondContact O-N 2.7Å
461	Y	32.2	Very low	37.4	Very low	187 Å²	187	142.4 Å²	142.4	73%	0.733	71%	0.708	S	S	*	*	S	Bend	trans	-125.7	111.8	-178.3	-69.9	-85.5	0	0	0	110.2
462	G	32.2	Very low	37.9	Very low	68 Å²	68	138 Å²	138	70%	0.701	70%	0.698	S	S	*	*			trans	-63.2	-179.8	-160.9	0	0	0	0	0	118.6	N464	G462-N464 PolarHBondContact O-N 2.74Å
463	R	37.3	Very low	38.4	Very low	249 Å²	249	142.4 Å²	142.4	94%	0.94	70%	0.699	S	S	*	*	S	Bend	trans	-53.3	2.9	-163.6	-162	176	-89.9	166.5	-8.1	118.8
464	N	43	Very low	38.5	Very low	156 Å²	156	139.1 Å²	139.1	83%	0.834	68%	0.683	S	S	*	*			trans	-116.6	24.6	-169.7	-75.4	-5.7	0	0	0	115.5	G462	G462-N464 PolarHBondContact O-N 2.74Å
465	Y	35.5	Very low	38.7	Very low	174 Å²	174	132.2 Å²	132.2	68%	0.682	66%	0.66	S	S	*	*			trans	-84.8	123.1	175.7	-136.5	-93	0	0	0	110.9	T467 F471	Y465-T467 PolarHBondContact O-N 3.17Å; Y465-F471 HydrophobicContact CE1-CE2 4.35Å; Y465-F471 HydrophobicContact CE1-CZ 4.39Å
466	P	41.4	Very low	38.5	Very low	97 Å²	97	133.2 Å²	133.2	63%	0.63	66%	0.658	S	S	*	*			trans	-65.5	102.2	-176.7	24.9	-31.7	0	0	0	110.7
467	T	38.9	Very low	38.7	Very low	114 Å²	114	135 Å²	135	70%	0.699	66%	0.664	S	S	*	*			trans	-82.3	113.9	161.5	48.8	0	0	0	0	107.4	Y465	Y465-T467 PolarHBondContact O-N 3.17Å
468	D	41.3	Very low	39.1	Very low	137 Å²	137	136.8 Å²	136.8	73%	0.733	67%	0.671	S	S	*	*	S	Bend	trans	166.9	138	146.2	-85.2	-27.7	0	0	0	109.3	E470 F471	D468-E470 PolarHBondContact O-N 2.76Å; D468-F471 PolarHBondContact O-N 3.24Å
469	K	39.7	Very low	39.2	Very low	179 Å²	179	131.8 Å²	131.8	78%	0.778	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	19.6	-35.8	169.4	-70.1	174.8	179.7	170.9	0	121.6	K473	K469-K473 PolarHBondContact O-N 3.48Å
470	E	44.1	Very low	38.7	Very low	166 Å²	166	131.5 Å²	131.5	78%	0.776	65%	0.649	S	S	*	*	H	α-helix	trans	-71.4	-37.1	171.9	-66.4	-169.8	155.3	0	0	112.9	D468 I472 K473 G474	D468-E470 PolarHBondContact O-N 2.76Å; E470-I472 VanDerWaalsContact C-N 3.29Å; E470-I472 PolarHBondContact O-N 2.9Å; E470-K473 CarbonylContact O-C 3.59Å; E470-K473 WeakPolarHBondContact O-CB 3.33Å; E470-K473 PolarHBondContact O-N 2.85Å; E470-K473 VanDerWaalsContact O-N 3.1Å; E470-G474 PolarHBondContact O-N 3.31Å
471	F	38.5	Very low	38.8	Very low	101 Å²	101	134.6 Å²	134.6	44%	0.443	65%	0.651	S	S	.	*	H	α-helix	trans	-65	-34.8	174.6	-173	-114	0	0	0	111.8	Y465 D468 K473 G474 I475	Y465-F471 HydrophobicContact CE1-CE2 4.35Å; Y465-F471 HydrophobicContact CE1-CZ 4.39Å; D468-F471 PolarHBondContact O-N 3.24Å; F471-K473 VanDerWaalsContact C-N 3.34Å; F471-G474 PolarHBondContact O-N 2.95Å; F471-I475 HydrophobicContact CD1-CD1 3.44Å; F471-I475 VanDerWaalsContact CD1-CD1 3.44Å; F471-I475 HydrophobicContact CD1-CG1 4.28Å; F471-I475 HydrophobicContact CE1-CD1 3.18Å; F471-I475 HydrophobicContact CE1-CG1 4.06Å; F471-I475 HydrophobicContact CE2-CD1 4.38Å; F471-I475 HydrophobicContact CE2-CG1 4.42Å; F471-I475 HydrophobicContact CG-CD1 4.16Å; F471-I475 HydrophobicContact CZ-CD1 3.7Å; F471-I475 HydrophobicContact CZ-CG1 4.12Å; F471-I475 WeakPolarHBondContact O-CB 3.43Å; F471-I475 VanDerWaalsContact O-CG1 3.22Å; F471-I475 WeakPolarHBondContact O-CG1 3.4Å; F471-I475 PolarHBondContact O-N 3.5Å
472	I	40.2	Very low	38.6	Very low	124 Å²	124	128 Å²	128	64%	0.636	63%	0.628	S	S	*	*	H	α-helix	trans	-71.4	-31	174.6	-62	179	0	0	0	111.1	E470 K476	E470-I472 VanDerWaalsContact C-N 3.29Å; E470-I472 PolarHBondContact O-N 2.9Å; I472-K476 WeakPolarHBondContact O-CB 3.43Å; I472-K476 PolarHBondContact O-N 3.49Å
473	K	40.2	Very low	38.4	Very low	154 Å²	154	129.8 Å²	129.8	67%	0.67	62%	0.619	S	S	*	*	H	α-helix	trans	-73.1	-34.8	172.4	-127.6	177.1	-178.3	-177.6	0	112	K469 E470 F471	K469-K473 PolarHBondContact O-N 3.48Å; E470-K473 CarbonylContact O-C 3.59Å; E470-K473 WeakPolarHBondContact O-CB 3.33Å; E470-K473 PolarHBondContact O-N 2.85Å; E470-K473 VanDerWaalsContact O-N 3.1Å; F471-K473 VanDerWaalsContact C-N 3.34Å
474	G	40	Very low	38	Very low	27 Å²	27	125 Å²	125	28%	0.278	61%	0.605	S	S	.	*	H	α-helix	trans	-69.8	-44.9	173.4	0	0	0	0	0	112.8	E470 F471 K476 N477 D478	E470-G474 PolarHBondContact O-N 3.31Å; F471-G474 PolarHBondContact O-N 2.95Å; G474-K476 PolarHBondContact O-N 3.29Å; G474-N477 PolarHBondContact O-N 2.83Å; G474-N477 VanDerWaalsContact O-N 3.08Å; G474-D478 PolarHBondContact O-N 3.02Å
475	I	40.9	Very low	37.4	Very low	48 Å²	48	121.1 Å²	121.1	25%	0.246	59%	0.587	C	S	.	*	H	α-helix	trans	-61.4	-34.2	174.8	-69.2	165.9	0	0	0	111.3	F471 N477 H479 L482	F471-I475 HydrophobicContact CD1-CD1 3.44Å; F471-I475 VanDerWaalsContact CD1-CD1 3.44Å; F471-I475 HydrophobicContact CD1-CG1 4.28Å; F471-I475 HydrophobicContact CE1-CD1 3.18Å; F471-I475 HydrophobicContact CE1-CG1 4.06Å; F471-I475 HydrophobicContact CE2-CD1 4.38Å; F471-I475 HydrophobicContact CE2-CG1 4.42Å; F471-I475 HydrophobicContact CG-CD1 4.16Å; F471-I475 HydrophobicContact CZ-CD1 3.7Å; F471-I475 HydrophobicContact CZ-CG1 4.12Å; F471-I475 WeakPolarHBondContact O-CB 3.43Å; F471-I475 VanDerWaalsContact O-CG1 3.22Å; F471-I475 WeakPolarHBondContact O-CG1 3.4Å; F471-I475 PolarHBondContact O-N 3.5Å; I475-N477 PolarHBondContact O-N 3.33Å; I475-H479 HydrophobicContact CG2-CB 4.34Å; I475-H479 PolarHBondContact O-N 2.93Å; I475-L482 HydrophobicContact CG2-CB 4.35Å
476	K	39.7	Very low	37.3	Very low	143 Å²	143	122.6 Å²	122.6	62%	0.622	60%	0.6	S	S	*	*	H	α-helix	trans	-67.3	-22.1	178.8	-155.2	174.9	-174	-177.8	0	113.2	I472 G474	I472-K476 WeakPolarHBondContact O-CB 3.43Å; I472-K476 PolarHBondContact O-N 3.49Å; G474-K476 PolarHBondContact O-N 3.29Å
477	N	41.6	Very low	37	Very low	128 Å²	128	121.1 Å²	121.1	68%	0.684	59%	0.592	S	S	*	*	H	α-helix	trans	-109.1	-32.1	-176.3	-67.6	-10.3	0	0	0	113.1	G474 I475	G474-N477 PolarHBondContact O-N 2.83Å; G474-N477 VanDerWaalsContact O-N 3.08Å; I475-N477 PolarHBondContact O-N 3.33Å
478	D	42	Very low	36.7	Very low	130 Å²	130	120.9 Å²	120.9	70%	0.695	58%	0.583	S	S	*	*	H	α-helix	trans	-107.2	-5.7	-172.9	-67.6	-30.6	0	0	0	114.2	G474	G474-D478 PolarHBondContact O-N 3.02Å
479	H	39.3	Very low	36.2	Very low	69 Å²	69	120.2 Å²	120.2	32%	0.319	58%	0.579	S	S	.	*			trans	-129	72.5	175	-58.2	-33.7	0	0	0	111.3	I475 W481 L482	I475-H479 HydrophobicContact CG2-CB 4.34Å; I475-H479 PolarHBondContact O-N 2.93Å; H479-W481 AromaticContact CG-NE1 3.77Å; H479-W481 AromaticContact ND1-NE1 3.61Å; H479-W481 PolarHBondContact O-N 3.38Å; H479-L482 HydrophobicContact CB-CB 3.91Å; H479-L482 HydrophobicContact CB-CD1 3.86Å; H479-L482 HydrophobicContact CB-CG 4.41Å; H479-L482 PolarHBondContact O-N 3Å
480	Q	31.9	Very low	36.1	Very low	176 Å²	176	117.1 Å²	117.1	82%	0.822	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	-22.1	169.7	-127.2	175.9	-12.1	0	0	113.2
481	W	33.9	Very low	35.6	Very low	200 Å²	200	115.8 Å²	115.8	76%	0.758	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-11.4	178.1	68.9	-88.4	0	0	0	114.7	H479	H479-W481 AromaticContact CG-NE1 3.77Å; H479-W481 AromaticContact ND1-NE1 3.61Å; H479-W481 PolarHBondContact O-N 3.38Å
482	L	28.1	Very low	35.5	Very low	47 Å²	47	119.4 Å²	119.4	25%	0.246	58%	0.581	C	S	.	*			trans	-105.7	4.4	-178.5	-91.1	156.8	0	0	0	113.9	I475 H479 F484	I475-L482 HydrophobicContact CG2-CB 4.35Å; H479-L482 HydrophobicContact CB-CB 3.91Å; H479-L482 HydrophobicContact CB-CD1 3.86Å; H479-L482 HydrophobicContact CB-CG 4.41Å; H479-L482 PolarHBondContact O-N 3Å; L482-F484 VanDerWaalsContact C-N 3.33Å; L482-F484 PolarHBondContact O-N 2.85Å
483	Q	28.8	Very low	35.8	Very low	107 Å²	107	118.3 Å²	118.3	50%	0.5	57%	0.573	S	S	.	*			trans	-67.7	92.9	165.9	-74.3	-173.7	-13.5	0	0	109	T485	Q483-T485 PolarHBondContact O-N 2.52Å
484	F	29.3	Very low	36.6	Very low	149 Å²	149	116 Å²	116	65%	0.654	56%	0.564	S	S	*	*			trans	-64.9	86.1	157.8	-84.2	-86.2	0	0	0	107.1	L482 Q486 Q488	L482-F484 VanDerWaalsContact C-N 3.33Å; L482-F484 PolarHBondContact O-N 2.85Å; F484-Q486 PolarHBondContact O-N 3.49Å; F484-Q488 VanDerWaalsContact CD1-OE1 3.28Å
485	T	30.3	Very low	37.9	Very low	73 Å²	73	116 Å²	116	45%	0.448	56%	0.557	S	S	.	*			trans	-58.7	136.6	166.7	47	0	0	0	0	107.1	Q483 S487 Q488	Q483-T485 PolarHBondContact O-N 2.52Å; T485-S487 PolarHBondContact O-N 3.22Å; T485-S487 PolarHBondContact OG1-OG 2.78Å; T485-Q488 PolarHBondContact O-N 3.19Å; T485-Q488 VanDerWaalsContact O-N 3.12Å
486	Q	32.4	Very low	39.7	Very low	205 Å²	205	116.9 Å²	116.9	96%	0.958	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	18.1	166.8	-158.8	161.4	-24.2	0	0	112.7	F484	F484-Q486 PolarHBondContact O-N 3.49Å
487	S	35.8	Very low	41.8	Very low	66 Å²	66	111.6 Å²	111.6	46%	0.462	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	0.4	173.9	85.2	0	0	0	0	113.6	T485 N489 D490	T485-S487 PolarHBondContact O-N 3.22Å; T485-S487 PolarHBondContact OG1-OG 2.78Å; S487-N489 VanDerWaalsContact C-N 3.29Å; S487-N489 PolarHBondContact O-N 2.82Å; S487-D490 PolarHBondContact O-N 2.87Å
488	Q	32.2	Very low	43.8	Very low	110 Å²	110	109.6 Å²	109.6	51%	0.514	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-79	-6.7	175.1	-80.6	-152.1	-32.3	0	0	114.5	F484 T485	F484-Q488 VanDerWaalsContact CD1-OE1 3.28Å; T485-Q488 PolarHBondContact O-N 3.19Å; T485-Q488 VanDerWaalsContact O-N 3.12Å
489	N	31.8	Very low	45.9	Very low	123 Å²	123	105.6 Å²	105.6	66%	0.658	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-88.2	-2.1	169.7	-81.3	-21.8	0	0	0	113.8	S487	S487-N489 VanDerWaalsContact C-N 3.29Å; S487-N489 PolarHBondContact O-N 2.82Å
490	D	36.7	Very low	48.2	Very low	114 Å²	114	102.6 Å²	102.6	61%	0.61	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-96.3	18.5	170.5	-71.8	-35.8	0	0	0	112.4	S487 Y492	S487-D490 PolarHBondContact O-N 2.87Å; D490-Y492 CarbonylContact O-C 3.56Å; D490-Y492 PolarHBondContact O-N 3.47Å
491	L	33.9	Very low	51	Low	137 Å²	137	95.6 Å²	95.6	72%	0.717	48%	0.477	S	S	*	.			trans	-67.4	16.8	-178.2	-154.5	74.7	0	0	0	114.4
492	Y	36.9	Very low	53.7	Low	177 Å²	177	89.4 Å²	89.4	69%	0.694	46%	0.461	S	S	*	.	S	Bend	trans	-136.1	105.7	156.8	-71.9	-89.9	0	0	0	108.7	D490 H494 Y726	D490-Y492 CarbonylContact O-C 3.56Å; D490-Y492 PolarHBondContact O-N 3.47Å; Y492-H494 PolarHBondContact O-N 3.46Å; Y492-Y726 WeakPolarHBondContact CB-OH 3.49Å
493	H	45.3	Very low	56.6	Low	102 Å²	102	89 Å²	89	47%	0.472	46%	0.462	S	S	.	.			trans	-59.8	124.9	177.3	-77.5	-70.1	0	0	0	111	F280 I495	F280-H493 HydrophobicContact CD1-CB 4.11Å; F280-H493 HydrophobicContact CE1-CB 4.43Å; F280-H493 PolarHBondContact O-CD2 3.28Å; F280-H493 PolarHBondContact O-NE2 3.48Å; F280-H493 VanDerWaalsContact O-NE2 3.11Å; H493-I495 PolarHBondContact O-N 3.4Å
494	H	57.3	Low	59.5	Low	106 Å²	106	84.3 Å²	84.3	49%	0.491	44%	0.441	S	S	.	.			trans	-58.4	110.4	166.5	-174.9	-83.8	0	0	0	108.3	Y492 T496 N728	Y492-H494 PolarHBondContact O-N 3.46Å; H494-T496 PolarHBondContact O-N 3.24Å; H494-N728 PolarHBondContact NE2-ND2 3.46Å; H494-N728 VanDerWaalsContact NE2-ND2 3.14Å; H494-N728 PolarHBondContact NE2-OD1 2.83Å
495	I	67.7	Low	62.5	Low	25 Å²	25	80.4 Å²	80.4	13%	0.128	43%	0.426	C	S	.	.			trans	-72.2	103.1	177	-56.7	174.3	0	0	0	107.2	F280 H493 S499 I500 L719	F280-I495 HydrophobicContact CE1-CD1 4.19Å; F280-I495 HydrophobicContact CE1-CG1 3.84Å; F280-I495 HydrophobicContact CZ-CD1 3.89Å; F280-I495 HydrophobicContact CZ-CG1 4.02Å; H493-I495 PolarHBondContact O-N 3.4Å; I495-S499 WeakPolarHBondContact CG2-OG 3.18Å; I495-I500 HydrophobicContact CG2-CD1 3.85Å; I495-I500 HydrophobicContact CG2-CG1 3.45Å; I495-I500 VanDerWaalsContact CG2-CG1 3.45Å; I495-L719 HydrophobicContact CD1-CD2 3.93Å
496	T	79	Confident	65.4	Low	67 Å²	67	81.1 Å²	81.1	41%	0.411	43%	0.427	S	S	.	.			trans	-61	152.4	176.1	69.4	0	0	0	0	111	H494 S498 S499 I500	H494-T496 PolarHBondContact O-N 3.24Å; T496-S498 PolarHBondContact O-N 2.92Å; T496-S499 PolarHBondContact N-OG 3.45Å; T496-S499 PolarHBondContact O-N 2.99Å; T496-S499 PolarHBondContact O-OG 3.13Å; T496-S499 PolarHBondContact OG1-N 3.22Å; T496-S499 VanDerWaalsContact OG1-N 3.12Å; T496-S499 PolarHBondContact OG1-OG 3.49Å; T496-I500 PolarHBondContact O-N 2.96Å
497	I	83	Confident	68.1	Low	33 Å²	33	74.3 Å²	74.3	17%	0.169	40%	0.399	C	S	.	.	H	α-helix	trans	-59.1	-40.3	175.2	-50.3	-170.6	0	0	0	110	S499 I500 V501 L674 R723	I497-S499 PolarHBondContact O-N 3.42Å; I497-I500 PolarHBondContact O-N 3.46Å; I497-I500 VanDerWaalsContact O-N 3.16Å; I497-V501 HydrophobicContact CG2-CG2 4.33Å; I497-V501 WeakPolarHBondContact O-CG2 3.38Å; I497-V501 PolarHBondContact O-N 3.19Å; I497-L674 HydrophobicContact CG2-CB 4.46Å; I497-L674 HydrophobicContact CG2-CD2 3.98Å; I497-L674 HydrophobicContact CG2-CG 4.49Å; I497-R723 VanDerWaalsContact CD1-NH2 3.26Å
498	S	85.1	Confident	70.6	Confident	86 Å²	86	71.5 Å²	71.5	60%	0.601	38%	0.379	S	S	*	.	H	α-helix	trans	-57.6	-44.4	177.9	-52.1	0	0	0	0	112.4	T496 I500 V501 T502	T496-S498 PolarHBondContact O-N 2.92Å; S498-I500 VanDerWaalsContact C-N 3.33Å; S498-I500 PolarHBondContact O-N 2.94Å; S498-V501 PolarHBondContact O-N 3.42Å; S498-T502 WeakPolarHBondContact O-CB 3.42Å; S498-T502 PolarHBondContact O-N 3.35Å; S498-T502 PolarHBondContact O-OG1 3.31Å; S498-T502 VanDerWaalsContact O-OG1 3.08Å
499	S	86.2	Confident	73.4	Confident	46 Å²	46	67.7 Å²	67.7	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-38.3	177.1	48.4	0	0	0	0	112.4	I495 T496 I497 T502 C503	I495-S499 WeakPolarHBondContact CG2-OG 3.18Å; T496-S499 PolarHBondContact N-OG 3.45Å; T496-S499 PolarHBondContact O-N 2.99Å; T496-S499 PolarHBondContact O-OG 3.13Å; T496-S499 PolarHBondContact OG1-N 3.22Å; T496-S499 VanDerWaalsContact OG1-N 3.12Å; T496-S499 PolarHBondContact OG1-OG 3.49Å; I497-S499 PolarHBondContact O-N 3.42Å; S499-T502 PolarHBondContact O-N 2.84Å; S499-C503 WeakPolarHBondContact O-CB 3.35Å; S499-C503 PolarHBondContact O-N 3.02Å; S499-C503 PolarHBondContact O-SG 2.81Å
500	I	87	Confident	76.1	Confident	5 Å²	5	66 Å²	66	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-63.9	-48.1	176.2	-60.7	171.9	0	0	0	110.1	I495 T496 I497 S498 T502 C503 S504 V678	I495-I500 HydrophobicContact CG2-CD1 3.85Å; I495-I500 HydrophobicContact CG2-CG1 3.45Å; I495-I500 VanDerWaalsContact CG2-CG1 3.45Å; T496-I500 PolarHBondContact O-N 2.96Å; I497-I500 PolarHBondContact O-N 3.46Å; I497-I500 VanDerWaalsContact O-N 3.16Å; S498-I500 VanDerWaalsContact C-N 3.33Å; S498-I500 PolarHBondContact O-N 2.94Å; I500-T502 VanDerWaalsContact C-N 3.34Å; I500-T502 PolarHBondContact O-N 2.92Å; I500-C503 PolarHBondContact O-N 3.34Å; I500-S504 PolarHBondContact O-N 3.47Å; I500-S504 PolarHBondContact O-OG 2.82Å; I500-V678 HydrophobicContact CG2-CG2 4.11Å
501	V	89.9	Confident	78.5	Confident	30 Å²	30	62 Å²	62	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-46.3	179	171.8	0	0	0	0	110.9	I497 S498 C503 S504 I505 M561 L674	I497-V501 HydrophobicContact CG2-CG2 4.33Å; I497-V501 WeakPolarHBondContact O-CG2 3.38Å; I497-V501 PolarHBondContact O-N 3.19Å; S498-V501 PolarHBondContact O-N 3.42Å; V501-C503 PolarHBondContact O-N 3.1Å; V501-S504 PolarHBondContact O-N 2.6Å; V501-I505 HydrophobicContact CG1-CD1 4.19Å; V501-I505 WeakPolarHBondContact O-CG1 3.42Å; V501-I505 PolarHBondContact O-N 3.47Å; V501-I505 VanDerWaalsContact O-N 3.08Å; V501-M561 HydrophobicContact CB-CE 4.2Å; V501-M561 HydrophobicContact CG1-CE 3.58Å; V501-M561 HydrophobicContact CG1-SD 4.42Å; V501-M561 HydrophobicContact CG2-CE 3.84Å; V501-M561 HydrophobicContact CG2-SD 4.19Å; V501-L674 HydrophobicContact CG2-CD2 4.46Å
502	T	90.8	Very high	81.1	Confident	70 Å²	70	55.4 Å²	55.4	43%	0.429	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-43.2	177.7	-61.6	0	0	0	0	111.8	S498 S499 I500 S504 I505 I506	S498-T502 WeakPolarHBondContact O-CB 3.42Å; S498-T502 PolarHBondContact O-N 3.35Å; S498-T502 PolarHBondContact O-OG1 3.31Å; S498-T502 VanDerWaalsContact O-OG1 3.08Å; S499-T502 PolarHBondContact O-N 2.84Å; I500-T502 VanDerWaalsContact C-N 3.34Å; I500-T502 PolarHBondContact O-N 2.92Å; T502-S504 VanDerWaalsContact C-N 3.35Å; T502-S504 PolarHBondContact O-N 2.92Å; T502-I505 PolarHBondContact O-N 2.06Å; T502-I505 VanDerWaalsContact O-N 3.13Å; T502-I506 HydrophobicContact CG2-CD1 3.58Å; T502-I506 HydrophobicContact CG2-CG1 4.32Å; T502-I506 WeakPolarHBondContact O-CG1 3.37Å; T502-I506 PolarHBondContact O-N 3.4Å
503	C	89	Confident	83.5	Confident	38 Å²	38	48.8 Å²	48.8	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-63.7	-39.9	176.1	-65.9	0	0	0	0	112	M276 S499 I500 V501 I505 I506 V507 P508	M276-C503 HydrophobicContact SD-CB 4.39Å; M276-C503 PolarHBondContact SD-SG 3.02Å; S499-C503 WeakPolarHBondContact O-CB 3.35Å; S499-C503 PolarHBondContact O-N 3.02Å; S499-C503 PolarHBondContact O-SG 2.81Å; I500-C503 PolarHBondContact O-N 3.34Å; V501-C503 PolarHBondContact O-N 3.1Å; C503-I505 PolarHBondContact O-N 3.33Å; C503-I506 PolarHBondContact O-N 2.8Å; C503-V507 WeakPolarHBondContact O-CB 3.4Å; C503-V507 WeakPolarHBondContact O-CG2 2.94Å; C503-V507 PolarHBondContact O-N 2.83Å; C503-P508 WeakPolarHBondContact O-CD 3.44Å
504	S	90.6	Very high	85.4	Confident	9 Å²	9	45.7 Å²	45.7	6%	0.063	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-19.9	174.7	-65.1	0	0	0	0	113.5	I500 V501 T502 P508 Y553	I500-S504 PolarHBondContact O-N 3.47Å; I500-S504 PolarHBondContact O-OG 2.82Å; V501-S504 PolarHBondContact O-N 2.6Å; T502-S504 VanDerWaalsContact C-N 3.35Å; T502-S504 PolarHBondContact O-N 2.92Å; S504-P508 VanDerWaalsContact O-CD 3.27Å; S504-P508 WeakPolarHBondContact O-CD 3.42Å; S504-P508 VanDerWaalsContact O-CG 3.31Å; S504-P508 WeakPolarHBondContact O-CG 3.35Å; S504-Y553 PolarHBondContact O-OH 2.97Å
505	I	92	Very high	86.6	Confident	67 Å²	67	41.3 Å²	41.3	34%	0.344	24%	0.241	S	C	.	.	H	α-helix	trans	-83.6	-53.4	170.9	-65.1	164.7	0	0	0	109.6	V501 T502 C503 L509 L557	V501-I505 HydrophobicContact CG1-CD1 4.19Å; V501-I505 WeakPolarHBondContact O-CG1 3.42Å; V501-I505 PolarHBondContact O-N 3.47Å; V501-I505 VanDerWaalsContact O-N 3.08Å; T502-I505 PolarHBondContact O-N 2.06Å; T502-I505 VanDerWaalsContact O-N 3.13Å; C503-I505 PolarHBondContact O-N 3.33Å; I505-L509 HydrophobicContact CG2-CD1 3.93Å; I505-L509 WeakPolarHBondContact O-CB 3.43Å; I505-L509 VanDerWaalsContact O-CD1 3.31Å; I505-L509 WeakPolarHBondContact O-CD1 3.5Å; I505-L509 WeakPolarHBondContact O-CG 3.38Å; I505-L557 HydrophobicContact CD1-CD2 4.43Å; I505-L557 HydrophobicContact CG1-CD2 3.47Å; I505-L557 VanDerWaalsContact CG1-CD2 3.47Å
506	I	91	Very high	87.4	Confident	88 Å²	88	40.2 Å²	40.2	45%	0.451	24%	0.236	S	C	.	.	H	α-helix	trans	-72.4	-50.9	-168.1	-64.2	174.9	0	0	0	111.9	T502 C503 L509 I510	T502-I506 HydrophobicContact CG2-CD1 3.58Å; T502-I506 HydrophobicContact CG2-CG1 4.32Å; T502-I506 WeakPolarHBondContact O-CG1 3.37Å; T502-I506 PolarHBondContact O-N 3.4Å; C503-I506 PolarHBondContact O-N 2.8Å; I506-L509 PolarHBondContact O-N 2.86Å; I506-I510 HydrophobicContact CG2-CD1 3.54Å; I506-I510 HydrophobicContact CG2-CG1 4.3Å; I506-I510 WeakPolarHBondContact O-CG1 3.36Å; I506-I510 PolarHBondContact O-N 3.47Å
507	V	88.1	Confident	87.5	Confident	62 Å²	62	39.9 Å²	39.9	38%	0.376	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-49.5	-171.7	174.4	0	0	0	0	111.6	C503 L509 I510 L511	C503-V507 WeakPolarHBondContact O-CB 3.4Å; C503-V507 WeakPolarHBondContact O-CG2 2.94Å; C503-V507 PolarHBondContact O-N 2.83Å; V507-L509 PolarHBondContact O-N 3.34Å; V507-I510 PolarHBondContact O-N 3.09Å; V507-L511 HydrophobicContact CG1-CD1 3.97Å; V507-L511 HydrophobicContact CG1-CG 4.39Å; V507-L511 WeakPolarHBondContact O-CG 3.27Å; V507-L511 PolarHBondContact O-N 2.85Å
508	P	89.9	Confident	87.4	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.039	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-38.7	177.7	-31.1	44.2	0	0	0	113.8	C503 S504 L511 I512 Y553 A682 V686	C503-P508 WeakPolarHBondContact O-CD 3.44Å; S504-P508 VanDerWaalsContact O-CD 3.27Å; S504-P508 WeakPolarHBondContact O-CD 3.42Å; S504-P508 VanDerWaalsContact O-CG 3.31Å; S504-P508 WeakPolarHBondContact O-CG 3.35Å; P508-L511 PolarHBondContact O-N 3.46Å; P508-I512 WeakPolarHBondContact O-CB 3.43Å; P508-I512 WeakPolarHBondContact O-CD1 3.37Å; P508-I512 WeakPolarHBondContact O-CG1 3.15Å; P508-I512 PolarHBondContact O-N 3.11Å; P508-Y553 HydrophobicContact CB-CE1 3.78Å; P508-Y553 HydrophobicContact CB-CE2 3.97Å; P508-Y553 VanDerWaalsContact CB-CZ 3.47Å; P508-Y553 HydrophobicContact CG-CE1 4.37Å; P508-Y553 VanDerWaalsContact CG-OH 3.29Å; P508-Y553 WeakPolarHBondContact CG-OH 3.28Å; P508-A682 HydrophobicContact CG-CB 3.72Å; P508-V686 HydrophobicContact CB-CG2 3.54Å; P508-V686 HydrophobicContact CG-CG2 4.14Å
509	L	90.7	Very high	87	Confident	31 Å²	31	36.4 Å²	36.4	16%	0.162	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-39.8	177.8	-70.3	176.4	0	0	0	111.7	I505 I506 V507 C513 F550 Y553	I505-L509 HydrophobicContact CG2-CD1 3.93Å; I505-L509 WeakPolarHBondContact O-CB 3.43Å; I505-L509 VanDerWaalsContact O-CD1 3.31Å; I505-L509 WeakPolarHBondContact O-CD1 3.5Å; I505-L509 WeakPolarHBondContact O-CG 3.38Å; I506-L509 PolarHBondContact O-N 2.86Å; V507-L509 PolarHBondContact O-N 3.34Å; L509-C513 WeakPolarHBondContact O-CB 3.5Å; L509-C513 PolarHBondContact O-N 2.99Å; L509-F550 HydrophobicContact CB-CE1 4.48Å; L509-F550 HydrophobicContact CD2-CB 4.33Å; L509-F550 HydrophobicContact CD2-CD1 3.57Å; L509-F550 HydrophobicContact CD2-CD2 4.31Å; L509-F550 HydrophobicContact CD2-CE1 3.82Å; L509-F550 HydrophobicContact CD2-CG 3.83Å; L509-F550 HydrophobicContact CD2-CZ 4.3Å; L509-Y553 HydrophobicContact CD2-CD1 3.94Å; L509-Y553 HydrophobicContact CG-CD1 4.33Å
510	I	89	Confident	86.4	Confident	87 Å²	87	37.6 Å²	37.6	45%	0.446	20%	0.204	S	C	.	.	H	α-helix	trans	-64.1	-46	173.8	-67.6	172.3	0	0	0	110.4	I506 V507 I512 C513 F514	I506-I510 HydrophobicContact CG2-CD1 3.54Å; I506-I510 HydrophobicContact CG2-CG1 4.3Å; I506-I510 WeakPolarHBondContact O-CG1 3.36Å; I506-I510 PolarHBondContact O-N 3.47Å; V507-I510 PolarHBondContact O-N 3.09Å; I510-I512 PolarHBondContact O-N 3.29Å; I510-C513 PolarHBondContact O-N 2.97Å; I510-F514 WeakPolarHBondContact O-CB 3.49Å; I510-F514 PolarHBondContact O-N 3.49Å
511	L	87.1	Confident	85.9	Confident	29 Å²	29	43.4 Å²	43.4	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-43.4	179.1	-70.8	175.4	0	0	0	112.2	V507 P508 F514 S515 V686	V507-L511 HydrophobicContact CG1-CD1 3.97Å; V507-L511 HydrophobicContact CG1-CG 4.39Å; V507-L511 WeakPolarHBondContact O-CG 3.27Å; V507-L511 PolarHBondContact O-N 2.85Å; P508-L511 PolarHBondContact O-N 3.46Å; L511-F514 PolarHBondContact O-N 2.91Å; L511-S515 VanDerWaalsContact O-CB 3.3Å; L511-S515 WeakPolarHBondContact O-CB 3.19Å; L511-S515 PolarHBondContact O-N 3.47Å; L511-S515 PolarHBondContact O-OG 3.13Å; L511-V686 HydrophobicContact CB-CG1 4.23Å; L511-V686 HydrophobicContact CD1-CG1 3.92Å
512	I	87.5	Confident	84.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-50.5	175.3	-68.5	163.2	0	0	0	109.9	P508 I510 F514 S515 E516 L546 L549 F550 Y553 F685 Y689	P508-I512 WeakPolarHBondContact O-CB 3.43Å; P508-I512 WeakPolarHBondContact O-CD1 3.37Å; P508-I512 WeakPolarHBondContact O-CG1 3.15Å; P508-I512 PolarHBondContact O-N 3.11Å; I510-I512 PolarHBondContact O-N 3.29Å; I512-F514 VanDerWaalsContact C-N 3.33Å; I512-F514 PolarHBondContact O-N 3.3Å; I512-S515 WeakPolarHBondContact CA-OG 3.42Å; I512-S515 PolarHBondContact O-N 2.88Å; I512-S515 PolarHBondContact O-OG 3.43Å; I512-E516 PolarHBondContact O-N 3.2Å; I512-L546 HydrophobicContact CG2-CD1 4.49Å; I512-L549 HydrophobicContact CG2-CB 4.11Å; I512-L549 HydrophobicContact CG2-CD1 4.19Å; I512-F550 HydrophobicContact CB-CE1 4.29Å; I512-F550 HydrophobicContact CG2-CD1 4.24Å; I512-F550 HydrophobicContact CG2-CE1 3.96Å; I512-Y553 HydrophobicContact CD1-CG 4.3Å; I512-F685 HydrophobicContact CD1-CD1 4.32Å; I512-F685 HydrophobicContact CD1-CE1 3.88Å; I512-Y689 HydrophobicContact CB-CE1 4.34Å; I512-Y689 HydrophobicContact CG1-CD1 4.08Å; I512-Y689 HydrophobicContact CG1-CE1 4.08Å; I512-Y689 HydrophobicContact CG2-CE1 4.01Å
513	C	87.9	Confident	83.8	Confident	38 Å²	38	42.2 Å²	42.2	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-56.4	-48.2	178.8	-170.5	0	0	0	0	111.6	L509 I510 S515 E516 I517 L546 F550	L509-C513 WeakPolarHBondContact O-CB 3.5Å; L509-C513 PolarHBondContact O-N 2.99Å; I510-C513 PolarHBondContact O-N 2.97Å; C513-S515 PolarHBondContact O-N 3.34Å; C513-E516 PolarHBondContact O-N 3.41Å; C513-I517 WeakPolarHBondContact O-CB 3.31Å; C513-I517 WeakPolarHBondContact O-CD1 3.41Å; C513-I517 WeakPolarHBondContact O-CG1 3.47Å; C513-I517 PolarHBondContact O-N 2.81Å; C513-L546 HydrophobicContact CB-CD1 4.34Å; C513-F550 HydrophobicContact CB-CZ 4.17Å
514	F	85	Confident	82.7	Confident	36 Å²	36	42.4 Å²	42.4	16%	0.158	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-42.7	179.3	-175.1	-98.4	0	0	0	112.5	L264 L265 L268 I510 L511 I512 E516 I517 A518	L264-F514 HydrophobicContact CB-CE1 4.26Å; L264-F514 HydrophobicContact CB-CE2 4.31Å; L264-F514 HydrophobicContact CB-CZ 3.49Å; L264-F514 VanDerWaalsContact CB-CZ 3.49Å; L264-F514 HydrophobicContact CD1-CZ 4.21Å; L264-F514 HydrophobicContact CG-CZ 4.47Å; L265-F514 HydrophobicContact CD2-CD1 3.5Å; L265-F514 HydrophobicContact CD2-CE1 3.64Å; L265-F514 HydrophobicContact CG-CD1 4.18Å; L265-F514 HydrophobicContact CG-CE1 3.77Å; L268-F514 HydrophobicContact CD1-CB 3.94Å; L268-F514 HydrophobicContact CD1-CD1 3.46Å; L268-F514 VanDerWaalsContact CD1-CD1 3.46Å; L268-F514 HydrophobicContact CD1-CD2 3.05Å; L268-F514 HydrophobicContact CD1-CE1 3.67Å; L268-F514 HydrophobicContact CD1-CE2 3.26Å; L268-F514 HydrophobicContact CD1-CG 3.14Å; L268-F514 HydrophobicContact CD1-CZ 3.58Å; L268-F514 HydrophobicContact CG-CD2 4.48Å; I510-F514 WeakPolarHBondContact O-CB 3.49Å; I510-F514 PolarHBondContact O-N 3.49Å; L511-F514 PolarHBondContact O-N 2.91Å; I512-F514 VanDerWaalsContact C-N 3.33Å; I512-F514 PolarHBondContact O-N 3.3Å; F514-E516 PolarHBondContact O-N 3.47Å; F514-I517 PolarHBondContact O-N 2.88Å; F514-A518 HydrophobicContact CE1-CB 4.35Å; F514-A518 WeakPolarHBondContact O-CB 3.44Å; F514-A518 PolarHBondContact O-N 3.37Å
515	S	82.2	Confident	81.2	Confident	14 Å²	14	45.3 Å²	45.3	10%	0.098	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-39	178.4	68.5	0	0	0	0	112.8	L511 I512 C513 F519 Y689	L511-S515 VanDerWaalsContact O-CB 3.3Å; L511-S515 WeakPolarHBondContact O-CB 3.19Å; L511-S515 PolarHBondContact O-N 3.47Å; L511-S515 PolarHBondContact O-OG 3.13Å; I512-S515 WeakPolarHBondContact CA-OG 3.42Å; I512-S515 PolarHBondContact O-N 2.88Å; I512-S515 PolarHBondContact O-OG 3.43Å; C513-S515 PolarHBondContact O-N 3.34Å; S515-F519 VanDerWaalsContact O-CB 3.31Å; S515-F519 WeakPolarHBondContact O-CB 3.41Å; S515-F519 PolarHBondContact O-N 2.84Å; S515-Y689 WeakPolarHBondContact OG-CE1 3.36Å
516	E	83.7	Confident	79.6	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-69.3	-40.5	174.1	-75.3	-68	177.9	0	0	111.3	I512 C513 F514 F519 Y520 F542 L546 L549 Y689	I512-E516 PolarHBondContact O-N 3.2Å; C513-E516 PolarHBondContact O-N 3.41Å; F514-E516 PolarHBondContact O-N 3.47Å; E516-F519 PolarHBondContact O-N 3.04Å; E516-Y520 VanDerWaalsContact O-CB 3.29Å; E516-Y520 WeakPolarHBondContact O-CB 3.28Å; E516-Y520 PolarHBondContact O-N 2.64Å; E516-F542 HydrophobicContact CB-CD2 4.33Å; E516-F542 HydrophobicContact CB-CE2 3.65Å; E516-F542 HydrophobicContact CB-CZ 4.46Å; E516-L546 HydrophobicContact CB-CD1 4.45Å; E516-L546 HydrophobicContact CG-CD1 4.42Å; E516-L549 HydrophobicContact CG-CD1 4.07Å; E516-L549 WeakPolarHBondContact OE1-CD1 3.41Å; E516-Y689 WeakPolarHBondContact CG-OH 3.34Å; E516-Y689 PolarHBondContact OE1-OH 2.99Å
517	I	82.6	Confident	77.8	Confident	59 Å²	59	47.2 Å²	47.2	30%	0.303	25%	0.246	S	C	.	.	H	α-helix	trans	-61.4	-46.7	175.8	-71.5	167.4	0	0	0	110	C513 F514 F519 Y520 F521 F542	C513-I517 WeakPolarHBondContact O-CB 3.31Å; C513-I517 WeakPolarHBondContact O-CD1 3.41Å; C513-I517 WeakPolarHBondContact O-CG1 3.47Å; C513-I517 PolarHBondContact O-N 2.81Å; F514-I517 PolarHBondContact O-N 2.88Å; I517-F519 VanDerWaalsContact C-N 3.34Å; I517-F519 PolarHBondContact O-N 3.03Å; I517-Y520 WeakPolarHBondContact O-CB 3.14Å; I517-Y520 PolarHBondContact O-N 3.38Å; I517-F521 HydrophobicContact CG2-CD2 3.53Å; I517-F521 HydrophobicContact CG2-CE2 3.45Å; I517-F521 VanDerWaalsContact CG2-CE2 3.45Å; I517-F521 WeakPolarHBondContact O-CD2 3.08Å; I517-F521 PolarHBondContact O-N 3.33Å; I517-F542 HydrophobicContact CG1-CE2 4.28Å; I517-F542 HydrophobicContact CG1-CZ 3.8Å
518	A	79.4	Confident	76.1	Confident	13 Å²	13	49.5 Å²	49.5	11%	0.107	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-44.2	176.3	0	0	0	0	0	111.4	V261 F514 F521 F522	V261-A518 HydrophobicContact CG1-CB 3.83Å; V261-A518 HydrophobicContact CG2-CB 4.36Å; F514-A518 HydrophobicContact CE1-CB 4.35Å; F514-A518 WeakPolarHBondContact O-CB 3.44Å; F514-A518 PolarHBondContact O-N 3.37Å; A518-F521 PolarHBondContact O-N 3.42Å; A518-F522 WeakPolarHBondContact O-CB 3.28Å; A518-F522 PolarHBondContact O-N 3.37Å
519	F	76.9	Confident	74.4	Confident	34 Å²	34	55.8 Å²	55.8	15%	0.149	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-39.2	175.7	-170.4	-107.4	0	0	0	112.3	S515 E516 I517 F522 N523 F697	S515-F519 VanDerWaalsContact O-CB 3.31Å; S515-F519 WeakPolarHBondContact O-CB 3.41Å; S515-F519 PolarHBondContact O-N 2.84Å; E516-F519 PolarHBondContact O-N 3.04Å; I517-F519 VanDerWaalsContact C-N 3.34Å; I517-F519 PolarHBondContact O-N 3.03Å; F519-F522 PolarHBondContact O-N 2.89Å; F519-N523 WeakPolarHBondContact CD1-ND2 3.38Å; F519-N523 WeakPolarHBondContact CE1-ND2 3.18Å; F519-N523 WeakPolarHBondContact CZ-ND2 3.14Å; F519-N523 WeakPolarHBondContact O-CB 3.24Å; F519-N523 PolarHBondContact O-N 3.17Å; F519-N523 PolarHBondContact O-ND2 3.13Å; F519-F697 HydrophobicContact CD2-CE2 4.13Å; F519-F697 HydrophobicContact CD2-CZ 4.21Å; F519-F697 HydrophobicContact CE2-CE2 4.14Å; F519-F697 HydrophobicContact CE2-CZ 4.07Å
520	Y	75.1	Confident	72.4	Confident	70 Å²	70	57.8 Å²	57.8	28%	0.275	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-46.6	175.2	177.5	-95.5	0	0	0	111.6	E516 I517 N523 C524 T539 F542	E516-Y520 VanDerWaalsContact O-CB 3.29Å; E516-Y520 WeakPolarHBondContact O-CB 3.28Å; E516-Y520 PolarHBondContact O-N 2.64Å; I517-Y520 WeakPolarHBondContact O-CB 3.14Å; I517-Y520 PolarHBondContact O-N 3.38Å; Y520-N523 PolarHBondContact O-N 3.34Å; Y520-C524 VanDerWaalsContact O-CB 3.29Å; Y520-C524 WeakPolarHBondContact O-CB 3.31Å; Y520-C524 PolarHBondContact O-N 3.42Å; Y520-T539 PolarHBondContact OH-OG1 2.94Å; Y520-F542 HydrophobicContact CD2-CB 4.05Å; Y520-F542 HydrophobicContact CD2-CD2 4.15Å; Y520-F542 HydrophobicContact CD2-CG 4.2Å; Y520-F542 HydrophobicContact CE2-CB 4.4Å; Y520-F542 HydrophobicContact CG-CD2 4.23Å
521	F	74.9	Confident	70.3	Confident	127 Å²	127	64.3 Å²	64.3	56%	0.557	34%	0.335	S	S	*	.	H	α-helix	trans	-65.4	-38.4	176.1	-81.5	-65.7	0	0	0	112.4	I517 A518 C524 C525	I517-F521 HydrophobicContact CG2-CD2 3.53Å; I517-F521 HydrophobicContact CG2-CE2 3.45Å; I517-F521 VanDerWaalsContact CG2-CE2 3.45Å; I517-F521 WeakPolarHBondContact O-CD2 3.08Å; I517-F521 PolarHBondContact O-N 3.33Å; A518-F521 PolarHBondContact O-N 3.42Å; F521-C524 WeakPolarHBondContact O-CB 3.3Å; F521-C524 PolarHBondContact O-N 2.82Å; F521-C525 PolarHBondContact O-N 3.42Å; F521-C525 PolarHBondContact O-SG 3.5Å
522	F	69.9	Low	68.6	Low	24 Å²	24	67.2 Å²	67.2	11%	0.105	35%	0.354	C	S	.	.	H	α-helix	trans	-61.6	-49.8	175.4	-172	-82.2	0	0	0	111.2	Y254 L258 A518 F519 C524 C525 Q526 F697	Y254-F522 HydrophobicContact CD1-CE2 4.36Å; Y254-F522 AromaticContact CD1-CZ 3.86Å; Y254-F522 HydrophobicContact CD1-CZ 3.86Å; Y254-F522 HydrophobicContact CE1-CZ 4.41Å; L258-F522 HydrophobicContact CD1-CE2 4.39Å; L258-F522 HydrophobicContact CG-CE2 4.32Å; A518-F522 WeakPolarHBondContact O-CB 3.28Å; A518-F522 PolarHBondContact O-N 3.37Å; F519-F522 PolarHBondContact O-N 2.89Å; F522-C524 VanDerWaalsContact C-N 3.27Å; F522-C524 PolarHBondContact O-N 2.89Å; F522-C525 WeakPolarHBondContact O-CB 3.38Å; F522-C525 PolarHBondContact O-N 3.47Å; F522-Q526 PolarHBondContact O-N 2.92Å; F522-Q526 VanDerWaalsContact O-N 3.11Å; F522-F697 AromaticContact CD1-CE1 3.68Å; F522-F697 HydrophobicContact CD1-CE1 3.68Å; F522-F697 AromaticContact CD1-CZ 3.58Å; F522-F697 HydrophobicContact CD1-CZ 3.58Å; F522-F697 HydrophobicContact CD2-CZ 4.48Å; F522-F697 HydrophobicContact CE1-CD1 4.3Å; F522-F697 AromaticContact CE1-CE1 3.21Å; F522-F697 HydrophobicContact CE1-CE1 3.21Å; F522-F697 AromaticContact CE1-CZ 3.65Å; F522-F697 HydrophobicContact CE1-CZ 3.65Å; F522-F697 HydrophobicContact CE2-CE1 4.17Å; F522-F697 HydrophobicContact CE2-CZ 4.49Å; F522-F697 HydrophobicContact CG-CE1 4.37Å; F522-F697 HydrophobicContact CG-CZ 4.04Å; F522-F697 HydrophobicContact CZ-CD1 4.2Å; F522-F697 AromaticContact CZ-CE1 3.46Å; F522-F697 HydrophobicContact CZ-CE1 3.46Å; F522-F697 VanDerWaalsContact CZ-CE1 3.46Å; F522-F697 HydrophobicContact CZ-CZ 4.1Å
523	N	67.5	Low	66.6	Low	51 Å²	51	75.6 Å²	75.6	27%	0.273	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-31.5	174.8	-71.8	-58.8	0	0	0	112	F519 Y520 Q526 M527	F519-N523 WeakPolarHBondContact CD1-ND2 3.38Å; F519-N523 WeakPolarHBondContact CE1-ND2 3.18Å; F519-N523 WeakPolarHBondContact CZ-ND2 3.14Å; F519-N523 WeakPolarHBondContact O-CB 3.24Å; F519-N523 PolarHBondContact O-N 3.17Å; F519-N523 PolarHBondContact O-ND2 3.13Å; Y520-N523 PolarHBondContact O-N 3.34Å; N523-Q526 CarbonylContact O-C 3.59Å; N523-Q526 PolarHBondContact O-N 3.22Å; N523-M527 WeakPolarHBondContact O-CB 3.26Å; N523-M527 PolarHBondContact O-N 2.96Å
524	C	65.1	Low	65	Low	43 Å²	43	76.7 Å²	76.7	29%	0.291	41%	0.407	S	S	.	.	H	α-helix	trans	-66.8	-36.9	174.4	-168.6	0	0	0	0	111.7	Y520 F521 F522 Q526 M527 C528	Y520-C524 VanDerWaalsContact O-CB 3.29Å; Y520-C524 WeakPolarHBondContact O-CB 3.31Å; Y520-C524 PolarHBondContact O-N 3.42Å; F521-C524 WeakPolarHBondContact O-CB 3.3Å; F521-C524 PolarHBondContact O-N 2.82Å; F522-C524 VanDerWaalsContact C-N 3.27Å; F522-C524 PolarHBondContact O-N 2.89Å; C524-Q526 VanDerWaalsContact C-N 3.32Å; C524-M527 PolarHBondContact O-N 3.2Å; C524-C528 PolarHBondContact O-N 2.89Å; C524-C528 PolarHBondContact O-SG 3.05Å; C524-C528 VanDerWaalsContact O-SG 3.35Å
525	C	59.4	Low	63.8	Low	69 Å²	69	83.1 Å²	83.1	47%	0.466	44%	0.435	S	S	.	.	H	α-helix	trans	-63.9	-39	172.6	-68	0	0	0	0	111.3	F521 F522 C528	F521-C525 PolarHBondContact O-N 3.42Å; F521-C525 PolarHBondContact O-SG 3.5Å; F522-C525 WeakPolarHBondContact O-CB 3.38Å; F522-C525 PolarHBondContact O-N 3.47Å; C525-C528 PolarHBondContact O-N 3.41Å
526	Q	59.9	Low	62.9	Low	99 Å²	99	88.9 Å²	88.9	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-67.7	-35.9	172.3	-166.9	174	-4.1	0	0	112.2	F522 N523 C524 C528 L529	F522-Q526 PolarHBondContact O-N 2.92Å; F522-Q526 VanDerWaalsContact O-N 3.11Å; N523-Q526 CarbonylContact O-C 3.59Å; N523-Q526 PolarHBondContact O-N 3.22Å; C524-Q526 VanDerWaalsContact C-N 3.32Å; Q526-C528 VanDerWaalsContact C-N 3.32Å; Q526-C528 PolarHBondContact O-N 3Å; Q526-L529 PolarHBondContact O-N 2.91Å
527	M	52.5	Low	61.6	Low	97 Å²	97	96.5 Å²	96.5	48%	0.478	49%	0.492	S	S	.	.	H	α-helix	trans	-70.5	-25.6	177.7	-154.8	81.9	71.5	0	0	112.4	N523 C524 L529 T530	N523-M527 WeakPolarHBondContact O-CB 3.26Å; N523-M527 PolarHBondContact O-N 2.96Å; C524-M527 PolarHBondContact O-N 3.2Å; M527-L529 PolarHBondContact O-N 3.49Å; M527-L529 VanDerWaalsContact O-N 3.14Å; M527-T530 CarbonylContact O-C 3.43Å; M527-T530 PolarHBondContact O-N 3.39Å; M527-T530 PolarHBondContact O-OG1 3.02Å
528	C	52.8	Low	60.7	Low	110 Å²	110	95.2 Å²	95.2	74%	0.743	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.3	173.5	-74.3	0	0	0	0	113	C524 C525 Q526	C524-C528 PolarHBondContact O-N 2.89Å; C524-C528 PolarHBondContact O-SG 3.05Å; C524-C528 VanDerWaalsContact O-SG 3.35Å; C525-C528 PolarHBondContact O-N 3.41Å; Q526-C528 VanDerWaalsContact C-N 3.32Å; Q526-C528 PolarHBondContact O-N 3Å
529	L	52.5	Low	60.3	Low	137 Å²	137	97 Å²	97	72%	0.717	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-18.8	170.3	-78.3	115.1	0	0	0	113.9	Q526 M527	Q526-L529 PolarHBondContact O-N 2.91Å; M527-L529 PolarHBondContact O-N 3.49Å; M527-L529 VanDerWaalsContact O-N 3.14Å
530	T	50.5	Low	60.1	Low	74 Å²	74	101.1 Å²	101.1	45%	0.454	52%	0.524	S	S	.	.	S	Bend	trans	-114.7	107.1	-177.7	60.6	0	0	0	0	110.2	M527 T532	M527-T530 CarbonylContact O-C 3.43Å; M527-T530 PolarHBondContact O-N 3.39Å; M527-T530 PolarHBondContact O-OG1 3.02Å; T530-T532 PolarHBondContact O-N 3.04Å
531	K	43.7	Very low	59.9	Low	223 Å²	223	102.8 Å²	102.8	97%	0.97	53%	0.533	S	S	*	.			trans	-67.8	70.8	-176.9	-159.7	179.9	-171.7	179.4	0	111.1
532	T	51.9	Low	60	Low	90 Å²	90	98.4 Å²	98.4	55%	0.552	51%	0.514	S	S	*	.			trans	-120.3	129.9	176.7	77.5	0	0	0	0	111.2	T530 S534	T530-T532 PolarHBondContact O-N 3.04Å; T532-S534 PolarHBondContact O-N 2.77Å
533	N	44.9	Very low	60.5	Low	177 Å²	177	101.6 Å²	101.6	95%	0.947	53%	0.531	S	S	*	.			trans	-100.1	49.9	-159.5	-142.8	-9.1	0	0	0	112.5
534	S	54.7	Low	61.1	Low	60 Å²	60	101 Å²	101	42%	0.42	54%	0.537	S	S	.	.			trans	-133.4	54.7	178.5	65	0	0	0	0	113.4	T532 L536 W537 G538	T532-S534 PolarHBondContact O-N 2.77Å; S534-L536 PolarHBondContact O-N 3.48Å; S534-L536 VanDerWaalsContact O-N 3.1Å; S534-W537 PolarHBondContact O-N 2.86Å; S534-G538 PolarHBondContact O-N 2.81Å
535	K	59.1	Low	61.8	Low	172 Å²	172	102.8 Å²	102.8	75%	0.748	54%	0.541	S	S	*	.	H	α-helix	trans	-47.8	-38.6	172.8	-112.1	-178.4	178.6	-179.4	0	113.1	W537 T539	K535-W537 PolarHBondContact O-N 3.47Å; K535-T539 PolarHBondContact O-N 2.85Å; K535-T539 PolarHBondContact O-OG1 2.96Å
536	L	63.3	Low	63	Low	135 Å²	135	100.9 Å²	100.9	71%	0.707	53%	0.526	S	S	*	.	H	α-helix	trans	-66.1	-35.9	-179.1	-170.5	65.5	0	0	0	112.9	S534 T539 M540	S534-L536 PolarHBondContact O-N 3.48Å; S534-L536 VanDerWaalsContact O-N 3.1Å; L536-T539 PolarHBondContact O-N 3.44Å; L536-M540 VanDerWaalsContact O-CG 3.27Å; L536-M540 WeakPolarHBondContact O-CG 3.4Å; L536-M540 PolarHBondContact O-N 3.03Å; L536-M540 VanDerWaalsContact O-N 3.11Å
537	W	57.7	Low	64.3	Low	163 Å²	163	103.8 Å²	103.8	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-74.2	-34.3	-177.3	-164.4	36.6	0	0	0	112.1	S534 K535 K541	S534-W537 PolarHBondContact O-N 2.86Å; K535-W537 PolarHBondContact O-N 3.47Å; W537-K541 WeakPolarHBondContact O-CG 3.33Å; W537-K541 PolarHBondContact O-N 2.87Å
538	G	64	Low	65.9	Low	32 Å²	32	105.6 Å²	105.6	33%	0.33	54%	0.535	S	S	.	.	H	α-helix	trans	-62.4	-45.6	171.9	0	0	0	0	0	112.4	S534 K541 F542	S534-G538 PolarHBondContact O-N 2.81Å; G538-K541 PolarHBondContact O-N 3.4Å; G538-F542 PolarHBondContact O-N 3.46Å; G538-F542 VanDerWaalsContact O-N 3.07Å
539	T	70	Confident	67.5	Low	49 Å²	49	101 Å²	101	30%	0.301	50%	0.503	S	S	.	.	H	α-helix	trans	-66.5	-39.2	179.7	-53.1	0	0	0	0	112.7	Y520 K535 L536 K541 F542 I543	Y520-T539 PolarHBondContact OH-OG1 2.94Å; K535-T539 PolarHBondContact O-N 2.85Å; K535-T539 PolarHBondContact O-OG1 2.96Å; L536-T539 PolarHBondContact O-N 3.44Å; T539-K541 VanDerWaalsContact C-N 3.35Å; T539-K541 PolarHBondContact O-N 3.05Å; T539-F542 WeakPolarHBondContact O-CB 3.44Å; T539-F542 PolarHBondContact O-N 3.39Å; T539-I543 HydrophobicContact CG2-CD1 4Å; T539-I543 WeakPolarHBondContact O-CG1 3.48Å; T539-I543 PolarHBondContact O-N 3.15Å
540	M	72.2	Confident	69.3	Low	121 Å²	121	97.2 Å²	97.2	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-66.5	-36.5	177.2	-66.7	-61.9	-112.5	0	0	112.4	L536 G544	L536-M540 VanDerWaalsContact O-CG 3.27Å; L536-M540 WeakPolarHBondContact O-CG 3.4Å; L536-M540 PolarHBondContact O-N 3.03Å; L536-M540 VanDerWaalsContact O-N 3.11Å; M540-G544 PolarHBondContact O-N 2.78Å
541	K	71.9	Confident	71.2	Confident	105 Å²	105	97.4 Å²	97.4	46%	0.457	48%	0.479	S	S	.	.	H	α-helix	trans	-63.9	-42.8	172.6	-75.5	-178.2	178.9	175.1	0	111.6	W537 G538 T539 G544 Q545	W537-K541 WeakPolarHBondContact O-CG 3.33Å; W537-K541 PolarHBondContact O-N 2.87Å; G538-K541 PolarHBondContact O-N 3.4Å; T539-K541 VanDerWaalsContact C-N 3.35Å; T539-K541 PolarHBondContact O-N 3.05Å; K541-G544 PolarHBondContact O-N 2.69Å; K541-Q545 WeakPolarHBondContact O-CB 3.31Å; K541-Q545 VanDerWaalsContact O-CG 3.29Å; K541-Q545 WeakPolarHBondContact O-CG 3.22Å; K541-Q545 PolarHBondContact O-N 2.69Å
542	F	76.7	Confident	73.4	Confident	36 Å²	36	88.2 Å²	88.2	16%	0.158	44%	0.441	C	S	.	.	H	α-helix	trans	-58.8	-50.7	175.9	168.9	-96.5	0	0	0	112.1	E516 I517 Y520 G538 T539 G544 Q545 L546	E516-F542 HydrophobicContact CB-CD2 4.33Å; E516-F542 HydrophobicContact CB-CE2 3.65Å; E516-F542 HydrophobicContact CB-CZ 4.46Å; I517-F542 HydrophobicContact CG1-CE2 4.28Å; I517-F542 HydrophobicContact CG1-CZ 3.8Å; Y520-F542 HydrophobicContact CD2-CB 4.05Å; Y520-F542 HydrophobicContact CD2-CD2 4.15Å; Y520-F542 HydrophobicContact CD2-CG 4.2Å; Y520-F542 HydrophobicContact CE2-CB 4.4Å; Y520-F542 HydrophobicContact CG-CD2 4.23Å; G538-F542 PolarHBondContact O-N 3.46Å; G538-F542 VanDerWaalsContact O-N 3.07Å; T539-F542 WeakPolarHBondContact O-CB 3.44Å; T539-F542 PolarHBondContact O-N 3.39Å; F542-G544 VanDerWaalsContact C-N 3.33Å; F542-G544 PolarHBondContact O-N 3.43Å; F542-Q545 PolarHBondContact O-N 3.12Å; F542-L546 PolarHBondContact O-N 3.45Å
543	I	81.2	Confident	75.3	Confident	91 Å²	91	83.9 Å²	83.9	47%	0.467	42%	0.415	S	S	.	.	H	α-helix	trans	-61.2	-43.1	179.1	-64.7	161.9	0	0	0	110.8	T539 Q545 L546 Y547	T539-I543 HydrophobicContact CG2-CD1 4Å; T539-I543 WeakPolarHBondContact O-CG1 3.48Å; T539-I543 PolarHBondContact O-N 3.15Å; I543-Q545 VanDerWaalsContact C-N 3.33Å; I543-Q545 PolarHBondContact O-N 2.7Å; I543-L546 PolarHBondContact O-N 3.39Å; I543-Y547 WeakPolarHBondContact O-CB 3.29Å; I543-Y547 PolarHBondContact O-N 3.5Å
544	G	79.5	Confident	77.6	Confident	38 Å²	38	78.8 Å²	78.8	39%	0.392	39%	0.387	S	S	.	.	H	α-helix	trans	-64.6	-34.6	177.4	0	0	0	0	0	113.6	M540 K541 F542 R548	M540-G544 PolarHBondContact O-N 2.78Å; K541-G544 PolarHBondContact O-N 2.69Å; F542-G544 VanDerWaalsContact C-N 3.33Å; F542-G544 PolarHBondContact O-N 3.43Å; G544-R548 WeakPolarHBondContact O-CB 3.29Å; G544-R548 PolarHBondContact O-N 3.49Å
545	Q	79.6	Confident	79.4	Confident	81 Å²	81	82.1 Å²	82.1	38%	0.379	39%	0.394	S	S	.	.	H	α-helix	trans	-70.3	-47	174.7	-75	176.8	10.7	0	0	111.4	K541 F542 I543 Y547 R548 L549	K541-Q545 WeakPolarHBondContact O-CB 3.31Å; K541-Q545 VanDerWaalsContact O-CG 3.29Å; K541-Q545 WeakPolarHBondContact O-CG 3.22Å; K541-Q545 PolarHBondContact O-N 2.69Å; F542-Q545 PolarHBondContact O-N 3.12Å; I543-Q545 VanDerWaalsContact C-N 3.33Å; I543-Q545 PolarHBondContact O-N 2.7Å; Q545-Y547 PolarHBondContact O-N 3.01Å; Q545-R548 PolarHBondContact O-N 3.34Å; Q545-L549 WeakPolarHBondContact O-CG 3.42Å; Q545-L549 PolarHBondContact O-N 3.45Å
546	L	85.4	Confident	81	Confident	29 Å²	29	73.9 Å²	73.9	15%	0.152	36%	0.358	C	S	.	.	H	α-helix	trans	-58.1	-47.3	177.9	-171	72.7	0	0	0	111.6	I512 C513 E516 F542 I543 R548 L549 F550	I512-L546 HydrophobicContact CG2-CD1 4.49Å; C513-L546 HydrophobicContact CB-CD1 4.34Å; E516-L546 HydrophobicContact CB-CD1 4.45Å; E516-L546 HydrophobicContact CG-CD1 4.42Å; F542-L546 PolarHBondContact O-N 3.45Å; I543-L546 PolarHBondContact O-N 3.39Å; L546-R548 PolarHBondContact O-N 3.4Å; L546-L549 PolarHBondContact O-N 2.94Å; L546-F550 HydrophobicContact CD1-CD1 4.25Å; L546-F550 HydrophobicContact CD1-CE1 3.61Å; L546-F550 HydrophobicContact CD1-CZ 3.78Å; L546-F550 HydrophobicContact CD2-CE2 4.37Å; L546-F550 HydrophobicContact CD2-CZ 4.27Å; L546-F550 HydrophobicContact CG-CD1 4.4Å; L546-F550 HydrophobicContact CG-CE1 4.06Å; L546-F550 HydrophobicContact CG-CE2 4.23Å; L546-F550 HydrophobicContact CG-CZ 3.97Å; L546-F550 WeakPolarHBondContact O-CG 3.29Å; L546-F550 PolarHBondContact O-N 2.92Å
547	Y	86.8	Confident	82.5	Confident	159 Å²	159	67.8 Å²	67.8	62%	0.624	33%	0.326	S	S	*	.	H	α-helix	trans	-59.3	-45.7	177	175.8	-102.4	0	0	0	112.4	I543 Q545 L549 F550 I551	I543-Y547 WeakPolarHBondContact O-CB 3.29Å; I543-Y547 PolarHBondContact O-N 3.5Å; Q545-Y547 PolarHBondContact O-N 3.01Å; Y547-L549 VanDerWaalsContact C-N 3.31Å; Y547-L549 PolarHBondContact O-N 2.91Å; Y547-F550 PolarHBondContact O-N 3.18Å; Y547-I551 HydrophobicContact CD1-CD1 4.07Å; Y547-I551 HydrophobicContact CD2-CD1 4.13Å; Y547-I551 HydrophobicContact CE1-CD1 3.41Å; Y547-I551 VanDerWaalsContact CE1-CD1 3.41Å; Y547-I551 HydrophobicContact CE2-CD1 3.48Å; Y547-I551 VanDerWaalsContact CE2-CD1 3.48Å; Y547-I551 HydrophobicContact CE2-CG1 4.25Å; Y547-I551 HydrophobicContact CG-CD1 4.4Å; Y547-I551 PolarHBondContact O-N 3.47Å; Y547-I551 VanDerWaalsContact OH-CD1 3.22Å; Y547-I551 WeakPolarHBondContact OH-CD1 3.47Å
548	R	86.2	Confident	84.2	Confident	136 Å²	136	65.3 Å²	65.3	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-58.8	-44.8	177	-177.2	-176.3	-63.9	-131.2	-1.8	111	G544 Q545 L546 T552	G544-R548 WeakPolarHBondContact O-CB 3.29Å; G544-R548 PolarHBondContact O-N 3.49Å; Q545-R548 PolarHBondContact O-N 3.34Å; L546-R548 PolarHBondContact O-N 3.4Å; R548-T552 WeakPolarHBondContact O-CG2 3.38Å; R548-T552 PolarHBondContact O-N 3.31Å; R548-T552 PolarHBondContact O-OG1 3.09Å; R548-T552 VanDerWaalsContact O-OG1 3.11Å
549	L	86.2	Confident	85.5	Confident	13 Å²	13	65.9 Å²	65.9	7%	0.068	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-46.5	-179.2	-70.7	164.6	0	0	0	112	I512 E516 Q545 L546 Y547 I551 T552 Y553 Y689 V752	I512-L549 HydrophobicContact CG2-CB 4.11Å; I512-L549 HydrophobicContact CG2-CD1 4.19Å; E516-L549 HydrophobicContact CG-CD1 4.07Å; E516-L549 WeakPolarHBondContact OE1-CD1 3.41Å; Q545-L549 WeakPolarHBondContact O-CG 3.42Å; Q545-L549 PolarHBondContact O-N 3.45Å; L546-L549 PolarHBondContact O-N 2.94Å; Y547-L549 VanDerWaalsContact C-N 3.31Å; Y547-L549 PolarHBondContact O-N 2.91Å; L549-I551 PolarHBondContact O-N 3.22Å; L549-T552 WeakPolarHBondContact CA-OG1 3.49Å; L549-T552 PolarHBondContact O-N 2.96Å; L549-T552 PolarHBondContact O-OG1 2.76Å; L549-Y553 WeakPolarHBondContact O-CB 3.45Å; L549-Y553 PolarHBondContact O-N 3.09Å; L549-Y689 HydrophobicContact CD1-CE2 3.53Å; L549-Y689 VanDerWaalsContact CD1-CZ 3.48Å; L549-Y689 WeakPolarHBondContact CD1-OH 3.38Å; L549-Y689 HydrophobicContact CD2-CD2 3.78Å; L549-Y689 HydrophobicContact CD2-CE2 3.36Å; L549-Y689 HydrophobicContact CG-CE2 4.08Å; L549-V752 HydrophobicContact CD2-CG1 4.33Å
550	F	90.6	Very high	86.6	Confident	57 Å²	57	63.6 Å²	63.6	25%	0.25	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-46.6	178.1	-78.6	11.3	0	0	0	111.8	L509 I512 C513 L546 Y547 T552 Y553 I554	L509-F550 HydrophobicContact CB-CE1 4.48Å; L509-F550 HydrophobicContact CD2-CB 4.33Å; L509-F550 HydrophobicContact CD2-CD1 3.57Å; L509-F550 HydrophobicContact CD2-CD2 4.31Å; L509-F550 HydrophobicContact CD2-CE1 3.82Å; L509-F550 HydrophobicContact CD2-CG 3.83Å; L509-F550 HydrophobicContact CD2-CZ 4.3Å; I512-F550 HydrophobicContact CB-CE1 4.29Å; I512-F550 HydrophobicContact CG2-CD1 4.24Å; I512-F550 HydrophobicContact CG2-CE1 3.96Å; C513-F550 HydrophobicContact CB-CZ 4.17Å; L546-F550 HydrophobicContact CD1-CD1 4.25Å; L546-F550 HydrophobicContact CD1-CE1 3.61Å; L546-F550 HydrophobicContact CD1-CZ 3.78Å; L546-F550 HydrophobicContact CD2-CE2 4.37Å; L546-F550 HydrophobicContact CD2-CZ 4.27Å; L546-F550 HydrophobicContact CG-CD1 4.4Å; L546-F550 HydrophobicContact CG-CE1 4.06Å; L546-F550 HydrophobicContact CG-CE2 4.23Å; L546-F550 HydrophobicContact CG-CZ 3.97Å; L546-F550 WeakPolarHBondContact O-CG 3.29Å; L546-F550 PolarHBondContact O-N 2.92Å; Y547-F550 PolarHBondContact O-N 3.18Å; F550-T552 PolarHBondContact O-N 3.25Å; F550-Y553 PolarHBondContact O-N 3.09Å; F550-I554 WeakPolarHBondContact O-CB 3.28Å; F550-I554 VanDerWaalsContact O-CG1 3.24Å; F550-I554 WeakPolarHBondContact O-CG1 3.31Å; F550-I554 PolarHBondContact O-N 2.9Å
551	I	89.9	Confident	87.6	Confident	79 Å²	79	59.5 Å²	59.5	41%	0.405	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-45.2	177.1	-72.7	-177.2	0	0	0	111.3	Y547 L549 Y553 I554 F555	Y547-I551 HydrophobicContact CD1-CD1 4.07Å; Y547-I551 HydrophobicContact CD2-CD1 4.13Å; Y547-I551 HydrophobicContact CE1-CD1 3.41Å; Y547-I551 VanDerWaalsContact CE1-CD1 3.41Å; Y547-I551 HydrophobicContact CE2-CD1 3.48Å; Y547-I551 VanDerWaalsContact CE2-CD1 3.48Å; Y547-I551 HydrophobicContact CE2-CG1 4.25Å; Y547-I551 HydrophobicContact CG-CD1 4.4Å; Y547-I551 PolarHBondContact O-N 3.47Å; Y547-I551 VanDerWaalsContact OH-CD1 3.22Å; Y547-I551 WeakPolarHBondContact OH-CD1 3.47Å; L549-I551 PolarHBondContact O-N 3.22Å; I551-Y553 VanDerWaalsContact C-N 3.33Å; I551-Y553 PolarHBondContact O-N 3.35Å; I551-I554 PolarHBondContact O-N 3.48Å; I551-F555 WeakPolarHBondContact O-CB 3.16Å; I551-F555 PolarHBondContact O-N 3.47Å
552	T	89.3	Confident	88.6	Confident	29 Å²	29	59.6 Å²	59.6	18%	0.178	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-38.2	-178.6	56.4	0	0	0	0	112.5	R548 L549 F550 G556 V752	R548-T552 WeakPolarHBondContact O-CG2 3.38Å; R548-T552 PolarHBondContact O-N 3.31Å; R548-T552 PolarHBondContact O-OG1 3.09Å; R548-T552 VanDerWaalsContact O-OG1 3.11Å; L549-T552 WeakPolarHBondContact CA-OG1 3.49Å; L549-T552 PolarHBondContact O-N 2.96Å; L549-T552 PolarHBondContact O-OG1 2.76Å; F550-T552 PolarHBondContact O-N 3.25Å; T552-G556 PolarHBondContact O-N 3.38Å; T552-G556 VanDerWaalsContact O-N 3.1Å; T552-V752 HydrophobicContact CG2-CG2 3.57Å
553	Y	92.9	Very high	89.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-51.1	175.4	179.2	-105.6	0	0	0	111.8	S504 P508 L509 I512 L549 F550 I551 F555 G556 L557 Y681 A682 F685	S504-Y553 PolarHBondContact O-OH 2.97Å; P508-Y553 HydrophobicContact CB-CE1 3.78Å; P508-Y553 HydrophobicContact CB-CE2 3.97Å; P508-Y553 VanDerWaalsContact CB-CZ 3.47Å; P508-Y553 HydrophobicContact CG-CE1 4.37Å; P508-Y553 VanDerWaalsContact CG-OH 3.29Å; P508-Y553 WeakPolarHBondContact CG-OH 3.28Å; L509-Y553 HydrophobicContact CD2-CD1 3.94Å; L509-Y553 HydrophobicContact CG-CD1 4.33Å; I512-Y553 HydrophobicContact CD1-CG 4.3Å; L549-Y553 WeakPolarHBondContact O-CB 3.45Å; L549-Y553 PolarHBondContact O-N 3.09Å; F550-Y553 PolarHBondContact O-N 3.09Å; I551-Y553 VanDerWaalsContact C-N 3.33Å; I551-Y553 PolarHBondContact O-N 3.35Å; Y553-F555 VanDerWaalsContact C-N 3.28Å; Y553-F555 PolarHBondContact O-N 3.12Å; Y553-G556 PolarHBondContact O-N 3.25Å; Y553-L557 HydrophobicContact CE1-CD2 4.4Å; Y553-L557 WeakPolarHBondContact O-CB 3.33Å; Y553-L557 PolarHBondContact O-N 3.42Å; Y553-Y681 AromaticContact CD2-CE1 3.8Å; Y553-Y681 HydrophobicContact CD2-CE1 3.8Å; Y553-Y681 HydrophobicContact CE2-CD1 4.07Å; Y553-Y681 AromaticContact CE2-CE1 3.41Å; Y553-Y681 HydrophobicContact CE2-CE1 3.41Å; Y553-Y681 VanDerWaalsContact CE2-CE1 3.41Å; Y553-Y681 PolarHBondContact O-OH 2.9Å; Y553-Y681 VanDerWaalsContact O-OH 3.05Å; Y553-A682 WeakPolarHBondContact OH-CB 3.28Å; Y553-F685 HydrophobicContact CD2-CB 4.24Å; Y553-F685 AromaticContact CD2-CD1 3.42Å; Y553-F685 HydrophobicContact CD2-CD1 3.42Å; Y553-F685 VanDerWaalsContact CD2-CD1 3.42Å; Y553-F685 HydrophobicContact CD2-CD2 4.24Å; Y553-F685 AromaticContact CD2-CE1 3.74Å; Y553-F685 HydrophobicContact CD2-CE1 3.74Å; Y553-F685 HydrophobicContact CD2-CE2 4.5Å; Y553-F685 AromaticContact CD2-CG 3.7Å; Y553-F685 HydrophobicContact CD2-CG 3.7Å; Y553-F685 HydrophobicContact CD2-CZ 4.27Å; Y553-F685 HydrophobicContact CE2-CB 4.23Å; Y553-F685 HydrophobicContact CE2-CD1 4.08Å; Y553-F685 HydrophobicContact CE2-CG 4.19Å; Y553-F685 HydrophobicContact CG-CD1 4.35Å; Y553-F685 HydrophobicContact CG-CE1 4.26Å
554	I	93.5	Very high	89.7	Confident	70 Å²	70	57 Å²	57	36%	0.359	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-40.4	179.6	-68.2	168	0	0	0	110.5	F550 I551 L557 L558	F550-I554 WeakPolarHBondContact O-CB 3.28Å; F550-I554 VanDerWaalsContact O-CG1 3.24Å; F550-I554 WeakPolarHBondContact O-CG1 3.31Å; F550-I554 PolarHBondContact O-N 2.9Å; I551-I554 PolarHBondContact O-N 3.48Å; I554-L557 PolarHBondContact O-N 3.24Å; I554-L558 HydrophobicContact CG2-CD1 3.94Å; I554-L558 HydrophobicContact CG2-CG 4.29Å; I554-L558 WeakPolarHBondContact O-CB 3.29Å; I554-L558 VanDerWaalsContact O-CG 3.31Å; I554-L558 WeakPolarHBondContact O-CG 3.31Å; I554-L558 PolarHBondContact O-N 3.08Å
555	F	91	Very high	90.2	Very high	129 Å²	129	62.4 Å²	62.4	57%	0.566	29%	0.289	S	S	*	.	H	α-helix	trans	-58.9	-49.9	175.4	176.8	-100.1	0	0	0	111.6	I551 Y553 L557 L558 T559	I551-F555 WeakPolarHBondContact O-CB 3.16Å; I551-F555 PolarHBondContact O-N 3.47Å; Y553-F555 VanDerWaalsContact C-N 3.28Å; Y553-F555 PolarHBondContact O-N 3.12Å; F555-L557 VanDerWaalsContact C-N 3.32Å; F555-L557 PolarHBondContact O-N 3.43Å; F555-L558 PolarHBondContact O-N 3.3Å; F555-T559 HydrophobicContact CD1-CG2 4.4Å; F555-T559 HydrophobicContact CE1-CG2 4Å; F555-T559 HydrophobicContact CE2-CG2 4.18Å; F555-T559 HydrophobicContact CZ-CG2 3.87Å; F555-T559 WeakPolarHBondContact O-CG2 3.46Å; F555-T559 PolarHBondContact O-N 2.61Å; F555-T559 PolarHBondContact O-OG1 3.05Å
556	G	92.4	Very high	90.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-31.5	178	0	0	0	0	0	113.8	T552 Y553 T559 T560 Y681	T552-G556 PolarHBondContact O-N 3.38Å; T552-G556 VanDerWaalsContact O-N 3.1Å; Y553-G556 PolarHBondContact O-N 3.25Å; G556-T559 WeakPolarHBondContact CA-OG1 3.5Å; G556-T559 PolarHBondContact O-OG1 2.89Å; G556-T560 WeakPolarHBondContact O-CB 3.42Å; G556-T560 PolarHBondContact O-N 2.93Å; G556-T560 VanDerWaalsContact O-N 3.07Å; G556-T560 PolarHBondContact O-OG1 3.36Å; G556-Y681 VanDerWaalsContact CA-OH 3.27Å; G556-Y681 WeakPolarHBondContact CA-OH 3.01Å
557	L	94.7	Very high	90.7	Very high	7 Å²	7	63.3 Å²	63.3	4%	0.037	30%	0.296	C	S	.	.	H	α-helix	trans	-66.9	-46.1	173.4	-173.9	66.5	0	0	0	110.9	I505 Y553 I554 F555 T560 M561 V678 Y681	I505-L557 HydrophobicContact CD1-CD2 4.43Å; I505-L557 HydrophobicContact CG1-CD2 3.47Å; I505-L557 VanDerWaalsContact CG1-CD2 3.47Å; Y553-L557 HydrophobicContact CE1-CD2 4.4Å; Y553-L557 WeakPolarHBondContact O-CB 3.33Å; Y553-L557 PolarHBondContact O-N 3.42Å; I554-L557 PolarHBondContact O-N 3.24Å; F555-L557 VanDerWaalsContact C-N 3.32Å; F555-L557 PolarHBondContact O-N 3.43Å; L557-T560 WeakPolarHBondContact O-CB 3.27Å; L557-T560 PolarHBondContact O-N 3.43Å; L557-M561 HydrophobicContact CD1-CE 3.82Å; L557-M561 HydrophobicContact CG-CE 4.05Å; L557-M561 WeakPolarHBondContact O-CG 3.26Å; L557-M561 PolarHBondContact O-N 3.16Å; L557-V678 HydrophobicContact CD1-CB 4.1Å; L557-V678 HydrophobicContact CD1-CG1 4.4Å; L557-Y681 HydrophobicContact CB-CD1 4.27Å; L557-Y681 HydrophobicContact CB-CE1 3.84Å; L557-Y681 HydrophobicContact CD1-CD1 3.86Å; L557-Y681 HydrophobicContact CD1-CE1 4.27Å
558	L	93.8	Very high	90.6	Very high	110 Å²	110	56.3 Å²	56.3	58%	0.576	27%	0.269	S	S	*	.	H	α-helix	trans	-64.1	-40.1	177.9	-72.5	174.1	0	0	0	112.2	I554 F555 T560 M561 L562	I554-L558 HydrophobicContact CG2-CD1 3.94Å; I554-L558 HydrophobicContact CG2-CG 4.29Å; I554-L558 WeakPolarHBondContact O-CB 3.29Å; I554-L558 VanDerWaalsContact O-CG 3.31Å; I554-L558 WeakPolarHBondContact O-CG 3.31Å; I554-L558 PolarHBondContact O-N 3.08Å; F555-L558 PolarHBondContact O-N 3.3Å; L558-T560 VanDerWaalsContact C-N 3.33Å; L558-M561 PolarHBondContact O-N 3.31Å; L558-L562 WeakPolarHBondContact O-CB 3.27Å; L558-L562 PolarHBondContact O-N 3.08Å
559	T	91.2	Very high	90.3	Very high	45 Å²	45	53.4 Å²	53.4	28%	0.276	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-39.4	175	56.6	0	0	0	0	111.5	F555 G556 L562 L563	F555-T559 HydrophobicContact CD1-CG2 4.4Å; F555-T559 HydrophobicContact CE1-CG2 4Å; F555-T559 HydrophobicContact CE2-CG2 4.18Å; F555-T559 HydrophobicContact CZ-CG2 3.87Å; F555-T559 WeakPolarHBondContact O-CG2 3.46Å; F555-T559 PolarHBondContact O-N 2.61Å; F555-T559 PolarHBondContact O-OG1 3.05Å; G556-T559 WeakPolarHBondContact CA-OG1 3.5Å; G556-T559 PolarHBondContact O-OG1 2.89Å; T559-L562 PolarHBondContact O-N 3.42Å; T559-L563 VanDerWaalsContact O-CB 3.27Å; T559-L563 WeakPolarHBondContact O-CB 3.25Å; T559-L563 PolarHBondContact O-N 2.97Å
560	T	93.3	Very high	89.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-47.3	173.4	-56.3	0	0	0	0	111.4	G556 L557 L558 L563 V564 A677 V678 I744	G556-T560 WeakPolarHBondContact O-CB 3.42Å; G556-T560 PolarHBondContact O-N 2.93Å; G556-T560 VanDerWaalsContact O-N 3.07Å; G556-T560 PolarHBondContact O-OG1 3.36Å; L557-T560 WeakPolarHBondContact O-CB 3.27Å; L557-T560 PolarHBondContact O-N 3.43Å; L558-T560 VanDerWaalsContact C-N 3.33Å; T560-L563 PolarHBondContact O-N 3.38Å; T560-V564 WeakPolarHBondContact O-CB 3.31Å; T560-V564 WeakPolarHBondContact O-CG2 3.48Å; T560-V564 PolarHBondContact O-N 3.22Å; T560-A677 HydrophobicContact CG2-CB 3.92Å; T560-V678 HydrophobicContact CG2-CG1 4.33Å; T560-I744 HydrophobicContact CG2-CD1 4.2Å; T560-I744 WeakPolarHBondContact OG1-CD1 3.3Å; T560-I744 WeakPolarHBondContact OG1-CG2 3.47Å
561	M	93.9	Very high	89.1	Confident	36 Å²	36	54.8 Å²	54.8	18%	0.177	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-47.9	177.7	-64.4	-78.3	176.5	0	0	111.6	V501 L557 L558 W565 L674 V678	V501-M561 HydrophobicContact CB-CE 4.2Å; V501-M561 HydrophobicContact CG1-CE 3.58Å; V501-M561 HydrophobicContact CG1-SD 4.42Å; V501-M561 HydrophobicContact CG2-CE 3.84Å; V501-M561 HydrophobicContact CG2-SD 4.19Å; L557-M561 HydrophobicContact CD1-CE 3.82Å; L557-M561 HydrophobicContact CG-CE 4.05Å; L557-M561 WeakPolarHBondContact O-CG 3.26Å; L557-M561 PolarHBondContact O-N 3.16Å; L558-M561 PolarHBondContact O-N 3.31Å; M561-W565 VanDerWaalsContact O-CB 3.24Å; M561-W565 WeakPolarHBondContact O-CB 3.35Å; M561-W565 PolarHBondContact O-N 3.44Å; M561-L674 HydrophobicContact SD-CD1 3.63Å; M561-L674 HydrophobicContact SD-CD2 4.12Å; M561-L674 HydrophobicContact SD-CG 4.09Å; M561-V678 HydrophobicContact CE-CB 3.71Å; M561-V678 HydrophobicContact CE-CG1 3.13Å; M561-V678 HydrophobicContact CE-CG2 4.23Å; M561-V678 HydrophobicContact CG-CG1 4.32Å; M561-V678 HydrophobicContact SD-CG1 3.48Å; M561-V678 WeakPolarHBondContact SD-CG1 3.46Å
562	L	91.7	Very high	88.1	Confident	106 Å²	106	51 Å²	51	56%	0.555	26%	0.263	S	S	*	.	H	α-helix	trans	-61.3	-48.7	179.9	-175	82.9	0	0	0	111	L558 T559 W565 L566	L558-L562 WeakPolarHBondContact O-CB 3.27Å; L558-L562 PolarHBondContact O-N 3.08Å; T559-L562 PolarHBondContact O-N 3.42Å; L562-W565 PolarHBondContact O-N 2.91Å; L562-L566 HydrophobicContact CG-CD1 4.27Å; L562-L566 WeakPolarHBondContact O-CG 3.15Å; L562-L566 PolarHBondContact O-N 3.11Å
563	L	90.6	Very high	87.1	Confident	73 Å²	73	52.6 Å²	52.6	38%	0.382	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-48.5	-178.4	-174.7	72.3	0	0	0	111.1	T559 T560 W565 L566 I567 I740 I744	T559-L563 VanDerWaalsContact O-CB 3.27Å; T559-L563 WeakPolarHBondContact O-CB 3.25Å; T559-L563 PolarHBondContact O-N 2.97Å; T560-L563 PolarHBondContact O-N 3.38Å; L563-W565 VanDerWaalsContact C-N 3.28Å; L563-W565 PolarHBondContact O-N 3.15Å; L563-L566 PolarHBondContact O-N 3.48Å; L563-I567 HydrophobicContact CG-CD1 4.03Å; L563-I567 VanDerWaalsContact O-CG1 3.29Å; L563-I567 WeakPolarHBondContact O-CG1 3.45Å; L563-I567 PolarHBondContact O-N 3.01Å; L563-I740 HydrophobicContact CD2-CG2 3.83Å; L563-I744 HydrophobicContact CD2-CD1 3.87Å
564	V	91.3	Very high	86	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-39.1	177	169.8	0	0	0	0	111.1	T560 I567 K568 P672 L674 A677 I740	T560-V564 WeakPolarHBondContact O-CB 3.31Å; T560-V564 WeakPolarHBondContact O-CG2 3.48Å; T560-V564 PolarHBondContact O-N 3.22Å; V564-I567 PolarHBondContact O-N 2.94Å; V564-K568 HydrophobicContact CG1-CD 4.16Å; V564-K568 HydrophobicContact CG1-CG 4.29Å; V564-K568 WeakPolarHBondContact O-CB 3.05Å; V564-K568 WeakPolarHBondContact O-CG 3.31Å; V564-K568 PolarHBondContact O-N 3.1Å; V564-P672 HydrophobicContact CB-CG 4.49Å; V564-P672 HydrophobicContact CG1-CG 4.01Å; V564-P672 HydrophobicContact CG2-CG 4.29Å; V564-L674 HydrophobicContact CB-CD1 3.85Å; V564-L674 HydrophobicContact CG1-CB 3.99Å; V564-L674 HydrophobicContact CG1-CD1 3.65Å; V564-L674 HydrophobicContact CG1-CG 4.47Å; V564-L674 HydrophobicContact CG2-CD1 4.48Å; V564-A677 HydrophobicContact CG2-CB 3.69Å; V564-I740 HydrophobicContact CG2-CD1 4.5Å; V564-I740 HydrophobicContact CG2-CG2 4.11Å
565	W	89.7	Confident	85.1	Confident	151 Å²	151	50.9 Å²	50.9	57%	0.572	26%	0.257	S	S	*	.	H	α-helix	trans	-64.4	-42.8	177.4	-170.5	79.8	0	0	0	112.1	M561 L562 L563 I567 K568 V569	M561-W565 VanDerWaalsContact O-CB 3.24Å; M561-W565 WeakPolarHBondContact O-CB 3.35Å; M561-W565 PolarHBondContact O-N 3.44Å; L562-W565 PolarHBondContact O-N 2.91Å; L563-W565 VanDerWaalsContact C-N 3.28Å; L563-W565 PolarHBondContact O-N 3.15Å; W565-I567 PolarHBondContact O-N 2.85Å; W565-K568 PolarHBondContact O-N 2.87Å; W565-V569 HydrophobicContact CD2-CG2 4.28Å; W565-V569 HydrophobicContact CZ2-CG2 4.27Å; W565-V569 WeakPolarHBondContact O-CG2 3.49Å; W565-V569 PolarHBondContact O-N 3.33Å
566	L	87.9	Confident	84	Confident	91 Å²	91	45.4 Å²	45.4	48%	0.476	23%	0.234	S	C	.	.	H	α-helix	trans	-59.8	-45.4	174.3	-71.1	172.8	0	0	0	111.5	L562 L563 V569 S570	L562-L566 HydrophobicContact CG-CD1 4.27Å; L562-L566 WeakPolarHBondContact O-CG 3.15Å; L562-L566 PolarHBondContact O-N 3.11Å; L563-L566 PolarHBondContact O-N 3.48Å; L566-V569 PolarHBondContact O-N 3.31Å; L566-S570 WeakPolarHBondContact O-CB 2.9Å; L566-S570 PolarHBondContact O-N 3.47Å; L566-S570 PolarHBondContact O-OG 3.34Å
567	I	87.6	Confident	82.8	Confident	39 Å²	39	46.3 Å²	46.3	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-40.4	178.9	-59.2	164.5	0	0	0	111	L563 V564 W565 V569 S570 V571 F671 P672 I740	L563-I567 HydrophobicContact CG-CD1 4.03Å; L563-I567 VanDerWaalsContact O-CG1 3.29Å; L563-I567 WeakPolarHBondContact O-CG1 3.45Å; L563-I567 PolarHBondContact O-N 3.01Å; V564-I567 PolarHBondContact O-N 2.94Å; W565-I567 PolarHBondContact O-N 2.85Å; I567-V569 VanDerWaalsContact C-N 3.3Å; I567-V569 PolarHBondContact O-N 3.31Å; I567-S570 WeakPolarHBondContact CA-OG 3.25Å; I567-S570 PolarHBondContact O-N 2.9Å; I567-S570 PolarHBondContact O-OG 3.45Å; I567-V571 HydrophobicContact CG2-CG2 3.83Å; I567-V571 WeakPolarHBondContact O-CB 3.05Å; I567-V571 WeakPolarHBondContact O-CG2 3.3Å; I567-V571 PolarHBondContact O-N 3.27Å; I567-F671 HydrophobicContact CG2-CD1 4.02Å; I567-F671 HydrophobicContact CG2-CE1 3.92Å; I567-P672 HydrophobicContact CB-CG 4.25Å; I567-P672 HydrophobicContact CD1-CG 4.42Å; I567-P672 VanDerWaalsContact CG2-CD 3.45Å; I567-P672 HydrophobicContact CG2-CG 4.11Å; I567-I740 HydrophobicContact CD1-CD1 3.8Å
568	K	85	Confident	81.7	Confident	12 Å²	12	46 Å²	46	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-58.8	-42.9	175.8	-83	-176.9	170.6	-153.8	0	112.4	V564 W565 G572 F671 P672	V564-K568 HydrophobicContact CG1-CD 4.16Å; V564-K568 HydrophobicContact CG1-CG 4.29Å; V564-K568 WeakPolarHBondContact O-CB 3.05Å; V564-K568 WeakPolarHBondContact O-CG 3.31Å; V564-K568 PolarHBondContact O-N 3.1Å; W565-K568 PolarHBondContact O-N 2.87Å; K568-G572 PolarHBondContact O-N 2.79Å; K568-F671 VanDerWaalsContact CA-O 3.31Å; K568-F671 WeakPolarHBondContact CA-O 3.45Å; K568-F671 VanDerWaalsContact CG-O 3.24Å; K568-F671 WeakPolarHBondContact CG-O 3.46Å; K568-P672 WeakPolarHBondContact CE-O 3.33Å
569	V	80.1	Confident	80.3	Confident	75 Å²	75	41.2 Å²	41.2	46%	0.455	21%	0.212	S	C	.	.	H	α-helix	trans	-71.6	-35.4	178.9	174.2	0	0	0	0	111.2	W565 L566 I567	W565-V569 HydrophobicContact CD2-CG2 4.28Å; W565-V569 HydrophobicContact CZ2-CG2 4.27Å; W565-V569 WeakPolarHBondContact O-CG2 3.49Å; W565-V569 PolarHBondContact O-N 3.33Å; L566-V569 PolarHBondContact O-N 3.31Å; I567-V569 VanDerWaalsContact C-N 3.3Å; I567-V569 PolarHBondContact O-N 3.31Å
570	S	77.2	Confident	78.9	Confident	73 Å²	73	42 Å²	42	51%	0.51	21%	0.213	S	C	.	.	H	α-helix	trans	-75.8	-37.8	179.3	67.8	0	0	0	0	113.5	L566 I567	L566-S570 WeakPolarHBondContact O-CB 2.9Å; L566-S570 PolarHBondContact O-N 3.47Å; L566-S570 PolarHBondContact O-OG 3.34Å; I567-S570 WeakPolarHBondContact CA-OG 3.25Å; I567-S570 PolarHBondContact O-N 2.9Å; I567-S570 PolarHBondContact O-OG 3.45Å
571	V	75.1	Confident	77.6	Confident	25 Å²	25	43.1 Å²	43.1	15%	0.152	22%	0.218	C	C	.	.	H	α-helix	trans	-87.9	-45.8	-175.6	178.5	0	0	0	0	112.4	R338 I567 R573 F671	R338-V571 PolarHBondContact NH1-O 2.86Å; I567-V571 HydrophobicContact CG2-CG2 3.83Å; I567-V571 WeakPolarHBondContact O-CB 3.05Å; I567-V571 WeakPolarHBondContact O-CG2 3.3Å; I567-V571 PolarHBondContact O-N 3.27Å; V571-R573 VanDerWaalsContact C-N 3.33Å; V571-R573 HydrophobicContact CG1-CB 4.16Å; V571-R573 PolarHBondContact O-N 3.06Å; V571-F671 HydrophobicContact CB-CD1 4.23Å; V571-F671 HydrophobicContact CG1-CB 4.3Å; V571-F671 HydrophobicContact CG1-CD1 4.02Å; V571-F671 HydrophobicContact CG1-CG 4.46Å; V571-F671 HydrophobicContact CG2-CD1 3.98Å; V571-F671 HydrophobicContact CG2-CE1 4.36Å
572	G	67.7	Low	76.4	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.01	21%	0.21	C	C	.	.			trans	54.9	40.1	177.3	0	0	0	0	0	115.8	L335 K568 R668	L335-G572 WeakPolarHBondContact CD2-O 3.36Å; K568-G572 PolarHBondContact O-N 2.79Å; G572-R668 CarbonylContact C-O 3.34Å; G572-R668 VanDerWaalsContact C-O 3.27Å
573	R	67.6	Low	75.3	Confident	62 Å²	62	40.6 Å²	40.6	23%	0.234	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-70.2	136.3	175	-176.8	-175.8	178.2	135.7	-5.7	110.4	V571 R668 S670 F671	V571-R573 VanDerWaalsContact C-N 3.33Å; V571-R573 HydrophobicContact CG1-CB 4.16Å; V571-R573 PolarHBondContact O-N 3.06Å; R573-R668 CarbonylContact C-O 3.56Å; R573-R668 CarbonylContact O-C 3.45Å; R573-R668 VanDerWaalsContact O-O 3.09Å; R573-S670 VanDerWaalsContact CB-OG 3.24Å; R573-S670 WeakPolarHBondContact CB-OG 3.37Å; R573-S670 VanDerWaalsContact CG-OG 3.27Å; R573-S670 WeakPolarHBondContact CG-OG 3.5Å; R573-S670 WeakPolarHBondContact O-CB 3.41Å; R573-S670 PolarHBondContact O-N 3.33Å; R573-S670 PolarHBondContact O-OG 3.12Å; R573-F671 HydrophobicContact CB-CB 4.02Å
574	L	70.2	Confident	74.1	Confident	25 Å²	25	37.1 Å²	37.1	13%	0.131	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-70.8	145.7	178	-63.6	101	0	0	0	112.4	F340 F578 T632 S670 W730	F340-L574 HydrophobicContact CD2-CD2 4.16Å; F340-L574 HydrophobicContact CE2-CD2 4.39Å; L574-F578 HydrophobicContact CB-CB 4.4Å; L574-F578 HydrophobicContact CB-CG 4.46Å; L574-F578 HydrophobicContact CD2-CB 4.31Å; L574-F578 HydrophobicContact CD2-CD1 3.41Å; L574-F578 VanDerWaalsContact CD2-CD1 3.41Å; L574-F578 HydrophobicContact CD2-CD2 3.72Å; L574-F578 HydrophobicContact CD2-CE1 3.51Å; L574-F578 HydrophobicContact CD2-CE2 3.82Å; L574-F578 HydrophobicContact CD2-CG 3.53Å; L574-F578 HydrophobicContact CD2-CZ 3.71Å; L574-T632 HydrophobicContact CD1-CG2 3.6Å; L574-S670 PolarHBondContact O-OG 3Å; L574-W730 PolarHBondContact O-NE1 3.24Å
575	R	76.1	Confident	73.1	Confident	9 Å²	9	38.5 Å²	38.5	3%	0.034	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-77.8	155.8	175.2	-69.9	-176.4	-176	175.4	11.3	112.6	D577 F578 D666 A667 T669 N728	R575-D577 WeakPolarHBondContact CB-OD1 3.33Å; R575-D577 PolarHBondContact O-N 2.98Å; R575-F578 VanDerWaalsContact O-CB 3.24Å; R575-F578 WeakPolarHBondContact O-CB 3.28Å; R575-F578 PolarHBondContact O-N 3.01Å; R575-F578 VanDerWaalsContact O-N 3.11Å; R575-D666 IonicContact CZ-OD1 3.28Å; R575-D666 IonicContact CZ-OD2 2.86Å; R575-D666 VanDerWaalsContact CZ-OD2 3.28Å; R575-D666 PolarHBondContact NE-O 3.28Å; R575-D666 IonicContact NH1-OD1 2.7Å; R575-D666 IonicContact NH1-OD2 2.66Å; R575-D666 PolarHBondContact NH1-OD2 3.5Å; R575-D666 PolarHBondContact NH2-O 2.93Å; R575-D666 VanDerWaalsContact NH2-O 3.17Å; R575-D666 IonicContact NH2-OD1 3.23Å; R575-D666 PolarHBondContact NH2-OD1 3.43Å; R575-D666 IonicContact NH2-OD2 3.49Å; R575-D666 PolarHBondContact NH2-OD2 3.15Å; R575-A667 PolarHBondContact N-O 3.01Å; R575-T669 PolarHBondContact NE-O 3.4Å; R575-T669 PolarHBondContact NH2-O 3.49Å; R575-N728 VanDerWaalsContact CD-O 3.28Å; R575-N728 WeakPolarHBondContact CD-O 3.38Å
576	P	67.6	Low	72.1	Confident	14 Å²	14	35.9 Å²	35.9	9%	0.091	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.5	176.7	-19.7	29.3	0	0	0	114.4	R727 W730	P576-R727 HydrophobicContact CB-CB 4.11Å; P576-R727 WeakPolarHBondContact CB-O 2.9Å; P576-R727 WeakPolarHBondContact CD-O 3.38Å; P576-R727 PolarHBondContact O-NH2 3.19Å; P576-W730 HydrophobicContact CB-CZ2 4.39Å; P576-W730 HydrophobicContact CG-CD2 3.86Å; P576-W730 HydrophobicContact CG-CE3 4.31Å; P576-W730 HydrophobicContact CG-CG 4.2Å; P576-W730 HydrophobicContact CG-CZ2 4.1Å
577	D	67.1	Low	71.1	Confident	19 Å²	19	37.4 Å²	37.4	10%	0.102	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	3.5	178.4	66.5	-18	0	0	0	114.1	R575 I579 Q580 I581 R727	R575-D577 WeakPolarHBondContact CB-OD1 3.33Å; R575-D577 PolarHBondContact O-N 2.98Å; D577-I579 VanDerWaalsContact C-N 3.31Å; D577-I579 PolarHBondContact O-N 2.69Å; D577-Q580 WeakPolarHBondContact O-CB 3.27Å; D577-Q580 PolarHBondContact O-N 3.31Å; D577-I581 PolarHBondContact O-N 3.46Å; D577-I581 WeakPolarHBondContact OD2-CD1 3.3Å; D577-R727 PolarHBondContact N-O 2.99Å
578	F	71.5	Confident	69.9	Low	1 Å²	1	35.9 Å²	35.9	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-52.5	-44	-174.4	174.2	-100.4	0	0	0	113.8	F340 L574 R575 Q580 I581 C582 F651 L664 A667 R668	F340-F578 HydrophobicContact CE2-CD1 4.33Å; F340-F578 HydrophobicContact CZ-CD1 4.3Å; F340-F578 HydrophobicContact CZ-CE1 4.47Å; L574-F578 HydrophobicContact CB-CB 4.4Å; L574-F578 HydrophobicContact CB-CG 4.46Å; L574-F578 HydrophobicContact CD2-CB 4.31Å; L574-F578 HydrophobicContact CD2-CD1 3.41Å; L574-F578 VanDerWaalsContact CD2-CD1 3.41Å; L574-F578 HydrophobicContact CD2-CD2 3.72Å; L574-F578 HydrophobicContact CD2-CE1 3.51Å; L574-F578 HydrophobicContact CD2-CE2 3.82Å; L574-F578 HydrophobicContact CD2-CG 3.53Å; L574-F578 HydrophobicContact CD2-CZ 3.71Å; R575-F578 VanDerWaalsContact O-CB 3.24Å; R575-F578 WeakPolarHBondContact O-CB 3.28Å; R575-F578 PolarHBondContact O-N 3.01Å; R575-F578 VanDerWaalsContact O-N 3.11Å; F578-Q580 VanDerWaalsContact C-N 3.3Å; F578-Q580 PolarHBondContact O-N 2.96Å; F578-I581 PolarHBondContact O-N 3.45Å; F578-C582 HydrophobicContact CE1-CB 4.11Å; F578-C582 HydrophobicContact CE2-CB 4.21Å; F578-C582 HydrophobicContact CZ-CB 3.92Å; F578-C582 WeakPolarHBondContact O-CB 3.31Å; F578-C582 PolarHBondContact O-N 3.05Å; F578-F651 HydrophobicContact CE1-CD1 4.17Å; F578-F651 AromaticContact CE1-CE1 3.88Å; F578-F651 HydrophobicContact CE1-CE1 3.88Å; F578-F651 HydrophobicContact CZ-CD1 4.03Å; F578-F651 AromaticContact CZ-CE1 3.85Å; F578-F651 HydrophobicContact CZ-CE1 3.85Å; F578-L664 HydrophobicContact CE2-CD1 3.98Å; F578-A667 HydrophobicContact CD2-CB 3.79Å; F578-R668 HydrophobicContact CD2-CG 4.2Å; F578-R668 HydrophobicContact CE2-CG 3.65Å
579	I	63	Low	68.9	Low	8 Å²	8	35.5 Å²	35.5	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-36.2	-178.8	-164.1	79.1	0	0	0	112	F340 D577 R583 P584 W592	F340-I579 HydrophobicContact CE1-CD1 4.47Å; F340-I579 HydrophobicContact CZ-CD1 4.43Å; D577-I579 VanDerWaalsContact C-N 3.31Å; D577-I579 PolarHBondContact O-N 2.69Å; I579-R583 PolarHBondContact O-N 3.22Å; I579-P584 HydrophobicContact CD1-CG 4.21Å; I579-W592 HydrophobicContact CG1-CE3 4.4Å
580	Q	62.7	Low	68.3	Low	63 Å²	63	35 Å²	35	29%	0.294	18%	0.183	S	C	.	.	H	α-helix	trans	-71.6	-34.6	179	-66	-178	-14.4	0	0	111	D577 F578 D617	D577-Q580 WeakPolarHBondContact O-CB 3.27Å; D577-Q580 PolarHBondContact O-N 3.31Å; F578-Q580 VanDerWaalsContact C-N 3.3Å; F578-Q580 PolarHBondContact O-N 2.96Å; Q580-D617 PolarHBondContact NE2-OD1 3.48Å; Q580-D617 VanDerWaalsContact NE2-OD1 3.12Å
581	I	66.9	Low	67.8	Low	22 Å²	22	35.3 Å²	35.3	11%	0.113	18%	0.176	C	C	.	.	H	α-helix	trans	-76	-54.7	177.1	-65	173.8	0	0	0	111.1	D577 F578 R583 E658 K663 A667	D577-I581 PolarHBondContact O-N 3.46Å; D577-I581 WeakPolarHBondContact OD2-CD1 3.3Å; F578-I581 PolarHBondContact O-N 3.45Å; I581-R583 VanDerWaalsContact C-N 3.33Å; I581-R583 PolarHBondContact O-N 3.47Å; I581-E658 HydrophobicContact CG2-CG 4.33Å; I581-E658 VanDerWaalsContact O-CB 3.31Å; I581-E658 WeakPolarHBondContact O-CB 3.23Å; I581-K663 HydrophobicContact CG2-CD 4.2Å; I581-K663 HydrophobicContact CG2-CG 3.88Å; I581-A667 HydrophobicContact CB-CB 4.15Å; I581-A667 HydrophobicContact CD1-CB 3.74Å; I581-A667 HydrophobicContact CG2-CB 3.97Å
582	C	68.1	Low	67.2	Low	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.4	-41.7	-174.1	162.8	0	0	0	0	112.5	F578 F651 C656 M657 E658 L664	F578-C582 HydrophobicContact CE1-CB 4.11Å; F578-C582 HydrophobicContact CE2-CB 4.21Å; F578-C582 HydrophobicContact CZ-CB 3.92Å; F578-C582 WeakPolarHBondContact O-CB 3.31Å; F578-C582 PolarHBondContact O-N 3.05Å; C582-F651 WeakPolarHBondContact SG-CE1 3.48Å; C582-F651 WeakPolarHBondContact SG-CZ 3.32Å; C582-C656 HydrophobicContact CB-CB 4.09Å; C582-C656 WeakPolarHBondContact CB-SG 3.36Å; C582-C656 WeakPolarHBondContact O-CA 3.28Å; C582-C656 VanDerWaalsContact O-CB 3.27Å; C582-C656 WeakPolarHBondContact O-CB 3.24Å; C582-C656 WeakPolarHBondContact SG-CA 3Å; C582-C656 WeakPolarHBondContact SG-CB 3.47Å; C582-C656 CovalentContact SG-SG 2.04Å; C582-C656 PolarHBondContact SG-SG 3.06Å; C582-M657 PolarHBondContact O-N 3.03Å; C582-E658 PolarHBondContact O-N 2.92Å; C582-L664 HydrophobicContact CB-CD1 3.99Å
583	R	67.4	Low	67	Low	89 Å²	89	37 Å²	37	34%	0.336	18%	0.18	S	C	.	.			trans	53.8	84.2	-173.2	-59	162.4	174.5	-164.9	-4.2	110.4	I579 I581 M657	I579-R583 PolarHBondContact O-N 3.22Å; I581-R583 VanDerWaalsContact C-N 3.33Å; I581-R583 PolarHBondContact O-N 3.47Å; R583-M657 HydrophobicContact CB-CB 4.04Å; R583-M657 HydrophobicContact CB-CE 3.78Å; R583-M657 WeakPolarHBondContact O-CB 3.21Å; R583-M657 WeakPolarHBondContact O-CG 3.34Å; R583-M657 PolarHBondContact O-N 2.97Å
584	P	67	Low	66.8	Low	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-58.9	146.8	-171.3	25.3	-35	0	0	0	111.9	I579 C589 W592 Y593 I596 F651 D655	I579-P584 HydrophobicContact CD1-CG 4.21Å; P584-C589 HydrophobicContact CB-CB 3.87Å; P584-C589 HydrophobicContact CG-CB 3.98Å; P584-W592 HydrophobicContact CG-CB 4.24Å; P584-Y593 WeakPolarHBondContact O-CD2 3.48Å; P584-I596 HydrophobicContact CG-CD1 4.26Å; P584-F651 HydrophobicContact CB-CE2 4.45Å; P584-F651 HydrophobicContact CB-CZ 4.15Å; P584-D655 CarbonylContact C-O 3.47Å; P584-D655 VanDerWaalsContact CA-O 3.25Å; P584-D655 WeakPolarHBondContact CA-O 3.36Å
585	T	69.1	Low	66.3	Low	30 Å²	30	38.7 Å²	38.7	18%	0.184	19%	0.185	C	C	.	.			trans	-72.1	160.7	169	59	0	0	0	0	110.6	N587 A588 C589 D655 M657	T585-N587 PolarHBondContact O-N 3.47Å; T585-A588 PolarHBondContact O-N 2.85Å; T585-A588 VanDerWaalsContact O-N 3.13Å; T585-C589 PolarHBondContact O-N 3.43Å; T585-D655 PolarHBondContact N-O 3.23Å; T585-D655 PolarHBondContact OG1-O 2.83Å; T585-M657 HydrophobicContact CG2-CG 4.07Å
586	E	70	Confident	65.6	Low	96 Å²	96	38.8 Å²	38.8	45%	0.449	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.8	-179	-172.2	170.2	-168.8	0	0	112.7	A588 P590 Y593	E586-A588 VanDerWaalsContact C-N 3.35Å; E586-A588 PolarHBondContact O-N 3.37Å; E586-P590 VanDerWaalsContact O-CA 3.29Å; E586-P590 WeakPolarHBondContact O-CA 3.25Å; E586-P590 WeakPolarHBondContact O-CB 3.33Å; E586-Y593 HydrophobicContact CB-CD1 3.63Å; E586-Y593 HydrophobicContact CB-CD2 4.3Å; E586-Y593 HydrophobicContact CB-CE1 3.78Å; E586-Y593 HydrophobicContact CB-CE2 4.4Å; E586-Y593 HydrophobicContact CB-CG 3.91Å; E586-Y593 HydrophobicContact CG-CD1 3.8Å; E586-Y593 HydrophobicContact CG-CE1 4.08Å; E586-Y593 HydrophobicContact CG-CG 4.43Å
587	N	65.2	Low	65.4	Low	123 Å²	123	40.7 Å²	40.7	66%	0.658	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-30.1	-178.1	-60.9	-15.7	0	0	0	112.7	T585 L646	T585-N587 PolarHBondContact O-N 3.47Å; N587-L646 WeakPolarHBondContact O-CD1 3.37Å; N587-L646 WeakPolarHBondContact O-CD2 3.06Å
588	A	64.1	Low	64.8	Low	7 Å²	7	43.3 Å²	43.3	6%	0.058	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-44.7	-172.5	0	0	0	0	0	113	C342 T585 E586 L646 F651 D655	C342-A588 PolarHBondContact SG-O 3.47Å; T585-A588 PolarHBondContact O-N 2.85Å; T585-A588 VanDerWaalsContact O-N 3.13Å; E586-A588 VanDerWaalsContact C-N 3.35Å; E586-A588 PolarHBondContact O-N 3.37Å; A588-L646 WeakPolarHBondContact O-CD2 3.43Å; A588-F651 HydrophobicContact CB-CD2 4.39Å; A588-F651 HydrophobicContact CB-CE2 3.8Å; A588-D655 HydrophobicContact CB-CB 3.6Å
589	C	64.2	Low	63.7	Low	3 Å²	3	45 Å²	45	2%	0.02	21%	0.214	C	C	.	.			trans	-139	82.4	176.3	-59.3	0	0	0	0	110.2	C342 P584 T585 Q591 W592 Y593	C342-C589 HydrophobicContact CB-CB 3.88Å; C342-C589 WeakPolarHBondContact CB-SG 3.44Å; C342-C589 VanDerWaalsContact SG-CA 3.56Å; C342-C589 WeakPolarHBondContact SG-CB 3.26Å; C342-C589 CovalentContact SG-SG 2.03Å; C342-C589 PolarHBondContact SG-SG 3.42Å; P584-C589 HydrophobicContact CB-CB 3.87Å; P584-C589 HydrophobicContact CG-CB 3.98Å; T585-C589 PolarHBondContact O-N 3.43Å; C589-Q591 PolarHBondContact O-N 3.42Å; C589-W592 HydrophobicContact CB-CB 3.85Å; C589-W592 HydrophobicContact CB-CG 4.47Å; C589-W592 PolarHBondContact O-N 2.8Å; C589-Y593 WeakPolarHBondContact O-CB 3.4Å; C589-Y593 PolarHBondContact O-N 3.32Å
590	P	67.4	Low	62.9	Low	64 Å²	64	48.3 Å²	48.3	42%	0.416	23%	0.226	S	C	.	.	H	α-helix	trans	-61.7	-41.3	-169.7	20.8	-32.4	0	0	0	113.2	E586 R594	E586-P590 VanDerWaalsContact O-CA 3.29Å; E586-P590 WeakPolarHBondContact O-CA 3.25Å; E586-P590 WeakPolarHBondContact O-CB 3.33Å; P590-R594 WeakPolarHBondContact O-CG 3.33Å; P590-R594 PolarHBondContact O-N 2.99Å
591	Q	65	Low	62	Low	80 Å²	80	53 Å²	53	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-67.3	-40	179.1	-62.5	-176.9	-22.2	0	0	112.2	I345 V350 C589 I595	I345-Q591 HydrophobicContact CD1-CB 3.39Å; I345-Q591 HydrophobicContact CD1-CG 4.48Å; V350-Q591 HydrophobicContact CG1-CG 4.23Å; C589-Q591 PolarHBondContact O-N 3.42Å; Q591-I595 WeakPolarHBondContact O-CG1 3.47Å; Q591-I595 PolarHBondContact O-N 2.92Å
592	W	63	Low	60.6	Low	6 Å²	6	54 Å²	54	2%	0.023	26%	0.257	C	S	.	.	H	α-helix	trans	-72.1	-40.3	178.7	-83.5	94.1	0	0	0	112.9	P343 I345 I579 P584 C589 R594 I595 I596 L616 V620 L623	P343-W592 HydrophobicContact CG-CZ2 3.67Å; P343-W592 PolarHBondContact O-NE1 3.27Å; I345-W592 HydrophobicContact CD1-CD2 4.38Å; I345-W592 HydrophobicContact CD1-CG 4.2Å; I345-W592 HydrophobicContact CG1-CZ2 4.35Å; I579-W592 HydrophobicContact CG1-CE3 4.4Å; P584-W592 HydrophobicContact CG-CB 4.24Å; C589-W592 HydrophobicContact CB-CB 3.85Å; C589-W592 HydrophobicContact CB-CG 4.47Å; C589-W592 PolarHBondContact O-N 2.8Å; W592-R594 VanDerWaalsContact C-N 3.28Å; W592-R594 PolarHBondContact O-N 3.22Å; W592-I595 PolarHBondContact O-N 3.29Å; W592-I596 VanDerWaalsContact O-CG1 3.31Å; W592-I596 WeakPolarHBondContact O-CG1 3.39Å; W592-I596 PolarHBondContact O-N 3.32Å; W592-L616 HydrophobicContact CZ3-CD1 4.29Å; W592-V620 HydrophobicContact CH2-CG2 3.99Å; W592-V620 HydrophobicContact CZ3-CG2 4.18Å; W592-L623 HydrophobicContact CH2-CD1 3.37Å; W592-L623 HydrophobicContact CZ2-CD1 3.34Å
593	Y	63.9	Low	59.2	Low	56 Å²	56	58.3 Å²	58.3	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-54.9	-46.5	174	176.3	-98.6	0	0	0	110.8	P584 E586 C589 I595 I596 Q597 M657	P584-Y593 WeakPolarHBondContact O-CD2 3.48Å; E586-Y593 HydrophobicContact CB-CD1 3.63Å; E586-Y593 HydrophobicContact CB-CD2 4.3Å; E586-Y593 HydrophobicContact CB-CE1 3.78Å; E586-Y593 HydrophobicContact CB-CE2 4.4Å; E586-Y593 HydrophobicContact CB-CG 3.91Å; E586-Y593 HydrophobicContact CG-CD1 3.8Å; E586-Y593 HydrophobicContact CG-CE1 4.08Å; E586-Y593 HydrophobicContact CG-CG 4.43Å; C589-Y593 WeakPolarHBondContact O-CB 3.4Å; C589-Y593 PolarHBondContact O-N 3.32Å; Y593-I595 PolarHBondContact O-N 3.14Å; Y593-I596 PolarHBondContact O-N 3.31Å; Y593-Q597 HydrophobicContact CD1-CG 4.07Å; Y593-Q597 HydrophobicContact CD2-CG 4.16Å; Y593-Q597 HydrophobicContact CE1-CG 3.69Å; Y593-Q597 HydrophobicContact CE2-CG 3.84Å; Y593-Q597 VanDerWaalsContact CE2-NE2 3.26Å; Y593-Q597 HydrophobicContact CG-CG 4.29Å; Y593-Q597 WeakPolarHBondContact O-CB 3.02Å; Y593-Q597 VanDerWaalsContact O-CG 3.31Å; Y593-Q597 WeakPolarHBondContact O-CG 3.05Å; Y593-Q597 PolarHBondContact O-N 2.93Å; Y593-Q597 PolarHBondContact OH-NE2 3.27Å; Y593-M657 HydrophobicContact CD2-CE 4.12Å; Y593-M657 HydrophobicContact CE2-CE 4.01Å; Y593-M657 HydrophobicContact CE2-SD 3.92Å
594	R	63.9	Low	57.6	Low	121 Å²	121	60.6 Å²	60.6	46%	0.457	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-43.7	178.2	-71.6	178	-173.3	175.6	3.1	113	I354 P590 W592 K598	I354-R594 HydrophobicContact CD1-CB 4.12Å; I354-R594 HydrophobicContact CD1-CG 4.49Å; I354-R594 HydrophobicContact CG1-CB 4.21Å; P590-R594 WeakPolarHBondContact O-CG 3.33Å; P590-R594 PolarHBondContact O-N 2.99Å; W592-R594 VanDerWaalsContact C-N 3.28Å; W592-R594 PolarHBondContact O-N 3.22Å; R594-K598 WeakPolarHBondContact O-CB 3.32Å; R594-K598 PolarHBondContact O-N 2.89Å
595	I	59.8	Low	56.2	Low	2 Å²	2	69.6 Å²	69.6	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-48.1	176.6	-66.3	172.1	0	0	0	110.3	I345 I353 Q591 W592 Y593 K598 T599 L616 I619	I345-I595 HydrophobicContact CD1-CD1 3.56Å; I345-I595 HydrophobicContact CG1-CD1 4.24Å; I345-I595 HydrophobicContact CG2-CD1 4.5Å; I353-I595 HydrophobicContact CG2-CG1 4.32Å; Q591-I595 WeakPolarHBondContact O-CG1 3.47Å; Q591-I595 PolarHBondContact O-N 2.92Å; W592-I595 PolarHBondContact O-N 3.29Å; Y593-I595 PolarHBondContact O-N 3.14Å; I595-K598 PolarHBondContact O-N 2.88Å; I595-T599 WeakPolarHBondContact O-CG2 3.22Å; I595-T599 PolarHBondContact O-N 3.07Å; I595-T599 PolarHBondContact O-OG1 3.48Å; I595-L616 HydrophobicContact CG2-CD1 4.26Å; I595-I619 HydrophobicContact CG2-CD1 3.85Å
596	I	60.5	Low	54.3	Low	10 Å²	10	80 Å²	80	5%	0.051	38%	0.381	C	S	.	.	H	α-helix	trans	-65.5	-43	-177.5	-66.4	166.6	0	0	0	111.2	P584 W592 Y593 T599 R600 L616	P584-I596 HydrophobicContact CG-CD1 4.26Å; W592-I596 VanDerWaalsContact O-CG1 3.31Å; W592-I596 WeakPolarHBondContact O-CG1 3.39Å; W592-I596 PolarHBondContact O-N 3.32Å; Y593-I596 PolarHBondContact O-N 3.31Å; I596-T599 WeakPolarHBondContact CA-OG1 3.4Å; I596-T599 PolarHBondContact O-N 2.78Å; I596-T599 PolarHBondContact O-OG1 2.77Å; I596-R600 PolarHBondContact O-N 2.76Å; I596-R600 VanDerWaalsContact O-N 3.14Å; I596-L616 HydrophobicContact CG1-CD1 4.34Å
597	Q	63.4	Low	52.6	Low	55 Å²	55	80.8 Å²	80.8	26%	0.257	40%	0.397	S	S	.	.	H	α-helix	trans	-64	-42.3	177.6	-72.3	-63.9	-4.1	0	0	111.6	Y593 T599 R600 Q601	Y593-Q597 HydrophobicContact CD1-CG 4.07Å; Y593-Q597 HydrophobicContact CD2-CG 4.16Å; Y593-Q597 HydrophobicContact CE1-CG 3.69Å; Y593-Q597 HydrophobicContact CE2-CG 3.84Å; Y593-Q597 VanDerWaalsContact CE2-NE2 3.26Å; Y593-Q597 HydrophobicContact CG-CG 4.29Å; Y593-Q597 WeakPolarHBondContact O-CB 3.02Å; Y593-Q597 VanDerWaalsContact O-CG 3.31Å; Y593-Q597 WeakPolarHBondContact O-CG 3.05Å; Y593-Q597 PolarHBondContact O-N 2.93Å; Y593-Q597 PolarHBondContact OH-NE2 3.27Å; Q597-T599 VanDerWaalsContact C-N 3.3Å; Q597-T599 PolarHBondContact O-N 3.43Å; Q597-R600 WeakPolarHBondContact O-CA 3.43Å; Q597-R600 WeakPolarHBondContact O-CB 3.22Å; Q597-R600 PolarHBondContact O-N 2.87Å; Q597-Q601 PolarHBondContact O-N 3.34Å
598	K	55.7	Low	50.8	Low	73 Å²	73	79.3 Å²	79.3	32%	0.317	40%	0.401	S	S	.	.	H	α-helix	trans	-64.2	-35.8	178.1	-164.4	164	-174.8	168.3	0	112.7	I353 S356 R594 I595 R600	I353-K598 HydrophobicContact CG2-CD 3.92Å; I353-K598 WeakPolarHBondContact O-CD 3.37Å; I353-K598 WeakPolarHBondContact O-CE 3.49Å; I353-K598 PolarHBondContact O-NZ 2.96Å; S356-K598 PolarHBondContact O-NZ 3.43Å; S356-K598 PolarHBondContact OG-NZ 3.22Å; R594-K598 WeakPolarHBondContact O-CB 3.32Å; R594-K598 PolarHBondContact O-N 2.89Å; I595-K598 PolarHBondContact O-N 2.88Å; K598-R600 VanDerWaalsContact C-N 3.25Å; K598-R600 PolarHBondContact O-N 3.33Å
599	T	46.4	Very low	49.1	Very low	36 Å²	36	82.6 Å²	82.6	22%	0.221	42%	0.417	C	S	.	.	H	α-helix	trans	-70.2	-19.2	171.9	57.8	0	0	0	0	113.9	I595 I596 Q597 S602 L615	I595-T599 WeakPolarHBondContact O-CG2 3.22Å; I595-T599 PolarHBondContact O-N 3.07Å; I595-T599 PolarHBondContact O-OG1 3.48Å; I596-T599 WeakPolarHBondContact CA-OG1 3.4Å; I596-T599 PolarHBondContact O-N 2.78Å; I596-T599 PolarHBondContact O-OG1 2.77Å; Q597-T599 VanDerWaalsContact C-N 3.3Å; Q597-T599 PolarHBondContact O-N 3.43Å; T599-S602 PolarHBondContact O-OG 2.76Å; T599-S602 VanDerWaalsContact O-OG 3.08Å; T599-L615 HydrophobicContact CG2-CD2 4.32Å
600	R	46.8	Very low	47.5	Very low	79 Å²	79	86.2 Å²	86.2	30%	0.298	43%	0.433	S	S	.	.	H	α-helix	trans	-89.4	-35.8	176.4	-96.4	-165.9	-172.6	123.6	29.3	113.6	I596 Q597 K598 S602 T603	I596-R600 PolarHBondContact O-N 2.76Å; I596-R600 VanDerWaalsContact O-N 3.14Å; Q597-R600 WeakPolarHBondContact O-CA 3.43Å; Q597-R600 WeakPolarHBondContact O-CB 3.22Å; Q597-R600 PolarHBondContact O-N 2.87Å; K598-R600 VanDerWaalsContact C-N 3.25Å; K598-R600 PolarHBondContact O-N 3.33Å; R600-S602 PolarHBondContact O-N 3.04Å; R600-S602 VanDerWaalsContact O-N 3.09Å; R600-T603 WeakPolarHBondContact CA-OG1 3.44Å; R600-T603 VanDerWaalsContact O-CB 3.3Å; R600-T603 WeakPolarHBondContact O-CB 3.33Å; R600-T603 PolarHBondContact O-N 3Å; R600-T603 PolarHBondContact O-OG1 3.24Å
601	Q	43.7	Very low	45.9	Very low	162 Å²	162	85.5 Å²	85.5	76%	0.757	43%	0.43	S	S	*	.	H	α-helix	trans	-64.7	-15.6	-177.2	-132.8	168	7.1	0	0	112.8	Q597 T603	Q597-Q601 PolarHBondContact O-N 3.34Å; Q601-T603 VanDerWaalsContact C-N 3.3Å
602	S	38.6	Very low	44.9	Very low	43 Å²	43	85.3 Å²	85.3	30%	0.301	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	2.1	170.8	59.8	0	0	0	0	114.2	T599 R600 S611	T599-S602 PolarHBondContact O-OG 2.76Å; T599-S602 VanDerWaalsContact O-OG 3.08Å; R600-S602 PolarHBondContact O-N 3.04Å; R600-S602 VanDerWaalsContact O-N 3.09Å; S602-S611 WeakPolarHBondContact O-CB 3.3Å; S602-S611 PolarHBondContact O-OG 2.91Å; S602-S611 WeakPolarHBondContact OG-CA 3.46Å; S602-S611 WeakPolarHBondContact OG-CB 3.13Å
603	T	38.2	Very low	44.2	Very low	90 Å²	90	89.6 Å²	89.6	55%	0.552	46%	0.46	S	S	*	.	S	Bend	trans	-105.3	-16	-176.5	-16.2	0	0	0	0	113.5	R600 Q601	R600-T603 WeakPolarHBondContact CA-OG1 3.44Å; R600-T603 VanDerWaalsContact O-CB 3.3Å; R600-T603 WeakPolarHBondContact O-CB 3.33Å; R600-T603 PolarHBondContact O-N 3Å; R600-T603 PolarHBondContact O-OG1 3.24Å; Q601-T603 VanDerWaalsContact C-N 3.3Å
604	D	34.5	Very low	43.4	Very low	137 Å²	137	93.1 Å²	93.1	73%	0.733	47%	0.473	S	S	*	.	S	Bend	trans	-103	113.8	176.7	-71.5	-33.2	0	0	0	109.4
605	E	36	Very low	42.7	Very low	189 Å²	189	90.9 Å²	90.9	88%	0.883	47%	0.47	S	S	*	.	S	Bend	trans	75.8	96.7	168.1	-58.9	-171.2	137.9	0	0	119.3
606	R	29.9	Very low	42.3	Very low	249 Å²	249	92.2 Å²	92.2	94%	0.94	48%	0.477	S	S	*	.	S	Bend	trans	71.7	56	134	-151	173.8	-166.1	160.6	2.1	119.1
607	S	34.5	Very low	41.9	Very low	112 Å²	112	95.3 Å²	95.3	78%	0.783	49%	0.493	S	S	*	.			trans	-164.9	126.7	140.1	46.1	0	0	0	0	110.5
608	A	26.4	Very low	41.3	Very low	91 Å²	91	94.5 Å²	94.5	75%	0.752	49%	0.491	S	S	*	.			trans	-64.6	148.4	177.8	0	0	0	0	0	111.6
609	I	28.5	Very low	41.1	Very low	76 Å²	76	91.1 Å²	91.1	39%	0.39	48%	0.476	S	S	.	.	S	Bend	trans	82	120.2	177.5	-45.8	161.9	0	0	0	110.6	Q386 Q387	Q386-I609 HydrophobicContact CB-CD1 4.39Å; Q387-I609 HydrophobicContact CG-CD1 4.05Å
610	E	31.8	Very low	41.4	Very low	79 Å²	79	90.2 Å²	90.2	37%	0.369	47%	0.471	S	S	.	.			trans	100.4	47.2	168.8	-145.2	148.7	-152.3	0	0	118.5	V359 I362	V359-E610 HydrophobicContact CG1-CG 4.36Å; I362-E610 HydrophobicContact CD1-CG 4.3Å
611	S	34.3	Very low	41.6	Very low	49 Å²	49	88.1 Å²	88.1	34%	0.343	47%	0.47	S	S	.	.			trans	-139.7	46.8	159.5	57.8	0	0	0	0	111.8	S602 P613	S602-S611 WeakPolarHBondContact O-CB 3.3Å; S602-S611 PolarHBondContact O-OG 2.91Å; S602-S611 WeakPolarHBondContact OG-CA 3.46Å; S602-S611 WeakPolarHBondContact OG-CB 3.13Å; S611-P613 WeakPolarHBondContact O-CD 3.34Å
612	D	43.6	Very low	41.9	Very low	76 Å²	76	82.3 Å²	82.3	41%	0.406	44%	0.443	S	S	.	.			trans	-78.3	122.5	-170.4	-151.3	-16.6	0	0	0	110.2	R614 L615	D612-R614 HydrophobicContact CB-CB 4.01Å; D612-R614 HydrophobicContact CB-CG 4.35Å; D612-R614 VanDerWaalsContact CG-CG 3.46Å; D612-R614 PolarHBondContact O-N 3.22Å; D612-R614 WeakPolarHBondContact OD1-CG 3.38Å; D612-R614 IonicContact OD1-NE 3.19Å; D612-R614 WeakPolarHBondContact OD2-CD 3.3Å; D612-R614 WeakPolarHBondContact OD2-CG 3.33Å; D612-R614 IonicContact OD2-NE 3.71Å; D612-R614 PolarHBondContact OD2-NE 3.19Å; D612-L615 PolarHBondContact O-N 3.11Å
613	P	47.3	Very low	42.4	Very low	96 Å²	96	80.7 Å²	80.7	62%	0.623	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-15.4	169.3	18.5	-32.8	0	0	0	113.4	S611 L615 L616 D617	S611-P613 WeakPolarHBondContact O-CD 3.34Å; P613-L615 VanDerWaalsContact C-N 3.27Å; P613-L615 PolarHBondContact O-N 2.8Å; P613-L616 PolarHBondContact O-N 3.09Å; P613-D617 PolarHBondContact O-N 3.42Å
614	R	47.8	Very low	42.8	Very low	131 Å²	131	77.7 Å²	77.7	49%	0.494	42%	0.415	S	S	.	.	H	α-helix	trans	-53.6	-33.2	167.3	-67.4	-172.1	-163.9	-153.5	-6.1	114.8	D612 D617 L618	D612-R614 HydrophobicContact CB-CB 4.01Å; D612-R614 HydrophobicContact CB-CG 4.35Å; D612-R614 VanDerWaalsContact CG-CG 3.46Å; D612-R614 PolarHBondContact O-N 3.22Å; D612-R614 WeakPolarHBondContact OD1-CG 3.38Å; D612-R614 IonicContact OD1-NE 3.19Å; D612-R614 WeakPolarHBondContact OD2-CD 3.3Å; D612-R614 WeakPolarHBondContact OD2-CG 3.33Å; D612-R614 IonicContact OD2-NE 3.71Å; D612-R614 PolarHBondContact OD2-NE 3.19Å; R614-D617 PolarHBondContact O-N 2.95Å; R614-L618 WeakPolarHBondContact O-CB 3.39Å; R614-L618 PolarHBondContact O-N 2.95Å
615	L	48.1	Very low	43.2	Very low	73 Å²	73	77.5 Å²	77.5	38%	0.382	41%	0.408	S	S	.	.	H	α-helix	trans	-67.7	-42.5	-178.9	-176.9	63.7	0	0	0	111.4	T599 D612 P613 L618 I619	T599-L615 HydrophobicContact CG2-CD2 4.32Å; D612-L615 PolarHBondContact O-N 3.11Å; P613-L615 VanDerWaalsContact C-N 3.27Å; P613-L615 PolarHBondContact O-N 2.8Å; L615-L618 PolarHBondContact O-N 3Å; L615-I619 HydrophobicContact CD1-CD1 4.43Å; L615-I619 HydrophobicContact CG-CD1 4.1Å; L615-I619 VanDerWaalsContact O-CG1 3.25Å; L615-I619 WeakPolarHBondContact O-CG1 3.46Å; L615-I619 PolarHBondContact O-N 3.19Å
616	L	51.9	Low	43.6	Very low	31 Å²	31	73.4 Å²	73.4	16%	0.162	39%	0.389	C	S	.	.	H	α-helix	trans	-66.6	-41.9	176.1	-172.9	65.7	0	0	0	110.9	W592 I595 I596 P613 L618 I619 V620	W592-L616 HydrophobicContact CZ3-CD1 4.29Å; I595-L616 HydrophobicContact CG2-CD1 4.26Å; I596-L616 HydrophobicContact CG1-CD1 4.34Å; P613-L616 PolarHBondContact O-N 3.09Å; L616-L618 VanDerWaalsContact C-N 3.31Å; L616-L618 PolarHBondContact O-N 3.36Å; L616-I619 PolarHBondContact O-N 2.98Å; L616-V620 WeakPolarHBondContact O-CB 3.44Å; L616-V620 WeakPolarHBondContact O-CG2 3.46Å; L616-V620 PolarHBondContact O-N 3.49Å
617	D	51.7	Low	43.7	Very low	74 Å²	74	63.4 Å²	63.4	40%	0.396	36%	0.363	S	S	.	.	H	α-helix	trans	-63.3	-37.1	174.1	-78.3	-18.2	0	0	0	112.1	Q580 P613 R614 A621	Q580-D617 PolarHBondContact NE2-OD1 3.48Å; Q580-D617 VanDerWaalsContact NE2-OD1 3.12Å; P613-D617 PolarHBondContact O-N 3.42Å; R614-D617 PolarHBondContact O-N 2.95Å; D617-A621 WeakPolarHBondContact O-CB 3.27Å; D617-A621 PolarHBondContact O-N 3.32Å
618	L	51.3	Low	43.6	Very low	38 Å²	38	61.9 Å²	61.9	20%	0.199	34%	0.342	C	S	.	.	H	α-helix	trans	-68.1	-46.1	176.9	-158.3	100.5	0	0	0	110.8	R614 L615 L616 V620 A621 Q622	R614-L618 WeakPolarHBondContact O-CB 3.39Å; R614-L618 PolarHBondContact O-N 2.95Å; L615-L618 PolarHBondContact O-N 3Å; L616-L618 VanDerWaalsContact C-N 3.31Å; L616-L618 PolarHBondContact O-N 3.36Å; L618-V620 VanDerWaalsContact C-N 3.33Å; L618-V620 PolarHBondContact O-N 2.85Å; L618-A621 PolarHBondContact O-N 3.37Å; L618-Q622 WeakPolarHBondContact O-CB 3.42Å; L618-Q622 WeakPolarHBondContact O-CG 3.41Å; L618-Q622 PolarHBondContact O-N 3.35Å
619	I	52.1	Low	44.2	Very low	3 Å²	3	64.4 Å²	64.4	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-58.8	-47.7	176.4	-69.8	165	0	0	0	109.7	Y349 I353 I595 L615 L616 A621 Q622 L623	Y349-I619 HydrophobicContact CD1-CG1 4.24Å; Y349-I619 HydrophobicContact CE1-CG1 3.86Å; I353-I619 HydrophobicContact CD1-CD1 3.81Å; I595-I619 HydrophobicContact CG2-CD1 3.85Å; L615-I619 HydrophobicContact CD1-CD1 4.43Å; L615-I619 HydrophobicContact CG-CD1 4.1Å; L615-I619 VanDerWaalsContact O-CG1 3.25Å; L615-I619 WeakPolarHBondContact O-CG1 3.46Å; L615-I619 PolarHBondContact O-N 3.19Å; L616-I619 PolarHBondContact O-N 2.98Å; I619-A621 VanDerWaalsContact C-N 3.34Å; I619-A621 PolarHBondContact O-N 2.96Å; I619-Q622 PolarHBondContact O-N 3.14Å; I619-L623 HydrophobicContact CG2-CD1 3.93Å; I619-L623 HydrophobicContact CG2-CG 4.46Å; I619-L623 WeakPolarHBondContact O-CB 3.32Å; I619-L623 WeakPolarHBondContact O-CG 3.47Å; I619-L623 PolarHBondContact O-N 3.31Å
620	V	52.1	Low	44.6	Very low	17 Å²	17	62.6 Å²	62.6	10%	0.103	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-37.1	178.6	179.2	0	0	0	0	111.8	W592 L616 L618 A624 R727	W592-V620 HydrophobicContact CH2-CG2 3.99Å; W592-V620 HydrophobicContact CZ3-CG2 4.18Å; L616-V620 WeakPolarHBondContact O-CB 3.44Å; L616-V620 WeakPolarHBondContact O-CG2 3.46Å; L616-V620 PolarHBondContact O-N 3.49Å; L618-V620 VanDerWaalsContact C-N 3.33Å; L618-V620 PolarHBondContact O-N 2.85Å; V620-A624 WeakPolarHBondContact O-CB 3.24Å; V620-A624 PolarHBondContact O-N 3.41Å; V620-R727 VanDerWaalsContact CG1-CZ 3.48Å; V620-R727 VanDerWaalsContact CG1-NH2 3.3Å
621	A	51.4	Low	44.7	Very low	34 Å²	34	62 Å²	62	28%	0.281	33%	0.326	S	S	.	.	H	α-helix	trans	-67.1	-36.2	174	0	0	0	0	0	112.7	D617 L618 I619 A624 K625	D617-A621 WeakPolarHBondContact O-CB 3.27Å; D617-A621 PolarHBondContact O-N 3.32Å; L618-A621 PolarHBondContact O-N 3.37Å; I619-A621 VanDerWaalsContact C-N 3.34Å; I619-A621 PolarHBondContact O-N 2.96Å; A621-A624 PolarHBondContact O-N 3.03Å; A621-K625 WeakPolarHBondContact O-CG 3.31Å; A621-K625 PolarHBondContact O-N 2.92Å
622	Q	49.5	Very low	44.7	Very low	40 Å²	40	61.6 Å²	61.6	19%	0.187	32%	0.321	C	S	.	.	H	α-helix	trans	-71.5	-39.5	176.4	-68.5	-63.8	-10.7	0	0	111.6	L618 I619 A624 K625 Q626	L618-Q622 WeakPolarHBondContact O-CB 3.42Å; L618-Q622 WeakPolarHBondContact O-CG 3.41Å; L618-Q622 PolarHBondContact O-N 3.35Å; I619-Q622 PolarHBondContact O-N 3.14Å; Q622-A624 VanDerWaalsContact C-N 3.3Å; Q622-A624 PolarHBondContact O-N 2.81Å; Q622-K625 WeakPolarHBondContact O-CB 3.06Å; Q622-K625 PolarHBondContact O-N 3.38Å; Q622-Q626 WeakPolarHBondContact O-CG 3.14Å; Q622-Q626 PolarHBondContact O-N 3.37Å
623	L	49.6	Very low	44.2	Very low	10 Å²	10	60.3 Å²	60.3	5%	0.052	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-42.5	171.7	-70.9	167.6	0	0	0	111.7	P346 W592 I619 Q626 K628	P346-L623 HydrophobicContact CG-CD2 3.75Å; W592-L623 HydrophobicContact CH2-CD1 3.37Å; W592-L623 HydrophobicContact CZ2-CD1 3.34Å; I619-L623 HydrophobicContact CG2-CD1 3.93Å; I619-L623 HydrophobicContact CG2-CG 4.46Å; I619-L623 WeakPolarHBondContact O-CB 3.32Å; I619-L623 WeakPolarHBondContact O-CG 3.47Å; I619-L623 PolarHBondContact O-N 3.31Å; L623-Q626 PolarHBondContact O-N 3.29Å; L623-K628 PolarHBondContact O-N 3.47Å; L623-K628 VanDerWaalsContact O-N 3.17Å
624	A	46.9	Very low	43.6	Very low	27 Å²	27	57.8 Å²	57.8	22%	0.223	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-41.4	174.4	0	0	0	0	0	112.1	L435 V620 A621 Q622 Q626 G627	L435-A624 HydrophobicContact CD1-CB 4.28Å; L435-A624 HydrophobicContact CD2-CB 3.79Å; V620-A624 WeakPolarHBondContact O-CB 3.24Å; V620-A624 PolarHBondContact O-N 3.41Å; A621-A624 PolarHBondContact O-N 3.03Å; Q622-A624 VanDerWaalsContact C-N 3.3Å; Q622-A624 PolarHBondContact O-N 2.81Å; A624-Q626 PolarHBondContact O-N 3.04Å; A624-G627 PolarHBondContact O-N 3.42Å; A624-G627 VanDerWaalsContact O-N 3.08Å
625	K	43.4	Very low	42.8	Very low	133 Å²	133	54.2 Å²	54.2	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-61.6	-30.4	173.8	-82.1	-177.2	175.3	-174.7	0	113.3	A621 Q622 G627	A621-K625 WeakPolarHBondContact O-CG 3.31Å; A621-K625 PolarHBondContact O-N 2.92Å; Q622-K625 WeakPolarHBondContact O-CB 3.06Å; Q622-K625 PolarHBondContact O-N 3.38Å; K625-G627 PolarHBondContact O-N 2.97Å
626	Q	42.7	Very low	41.9	Very low	103 Å²	103	56.4 Å²	56.4	48%	0.481	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	7.1	176.3	-69.8	-172	-5.5	0	0	113.7	Q622 L623 A624 K628	Q622-Q626 WeakPolarHBondContact O-CG 3.14Å; Q622-Q626 PolarHBondContact O-N 3.37Å; L623-Q626 PolarHBondContact O-N 3.29Å; A624-Q626 PolarHBondContact O-N 3.04Å; Q626-K628 PolarHBondContact O-N 3.21Å
627	G	32	Very low	41	Very low	39 Å²	39	60.5 Å²	60.5	40%	0.402	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	15	179.5	0	0	0	0	0	113.9	A624 K625 Y629	A624-G627 PolarHBondContact O-N 3.42Å; A624-G627 VanDerWaalsContact O-N 3.08Å; K625-G627 PolarHBondContact O-N 2.97Å; G627-Y629 WeakPolarHBondContact O-CD1 3.43Å; G627-Y629 WeakPolarHBondContact O-CE1 3.37Å; G627-Y629 PolarHBondContact O-N 3.41Å
628	K	33	Very low	40	Very low	79 Å²	79	62.2 Å²	62.2	34%	0.343	36%	0.359	S	S	.	.			trans	-94.5	91.5	175.7	-66	-171.2	-179.5	-172	0	109.3	L623 Q626	L623-K628 PolarHBondContact O-N 3.47Å; L623-K628 VanDerWaalsContact O-N 3.17Å; Q626-K628 PolarHBondContact O-N 3.21Å
629	Y	40	Very low	39.1	Very low	145 Å²	145	65.6 Å²	65.6	57%	0.569	38%	0.383	S	S	*	.			trans	-94.3	158.9	176.7	47.2	-79	0	0	0	111.2	G627 V631	G627-Y629 WeakPolarHBondContact O-CD1 3.43Å; G627-Y629 WeakPolarHBondContact O-CE1 3.37Å; G627-Y629 PolarHBondContact O-N 3.41Å; Y629-V631 VanDerWaalsContact C-N 3.29Å; Y629-V631 HydrophobicContact CD2-CB 4.31Å; Y629-V631 HydrophobicContact CD2-CG2 3.35Å; Y629-V631 HydrophobicContact CE2-CB 4.21Å; Y629-V631 HydrophobicContact CE2-CG1 4.43Å; Y629-V631 HydrophobicContact CE2-CG2 3.15Å; Y629-V631 HydrophobicContact CG-CG2 4.19Å; Y629-V631 PolarHBondContact O-N 2.86Å
630	L	35.5	Very low	38.1	Very low	38 Å²	38	74.4 Å²	74.4	20%	0.199	42%	0.424	C	S	.	.			trans	-66.3	90.7	166.9	-67.4	176.1	0	0	0	108.4	F340 P343	F340-L630 HydrophobicContact CE1-CD2 4.49Å; F340-L630 HydrophobicContact CE2-CB 4.23Å; F340-L630 HydrophobicContact CE2-CD1 4.11Å; F340-L630 HydrophobicContact CE2-CD2 3.62Å; F340-L630 HydrophobicContact CE2-CG 4.2Å; F340-L630 HydrophobicContact CZ-CD1 4.19Å; F340-L630 HydrophobicContact CZ-CD2 3.41Å; F340-L630 VanDerWaalsContact CZ-CD2 3.41Å; F340-L630 HydrophobicContact CZ-CG 4.33Å; P343-L630 HydrophobicContact CB-CD2 4.15Å; P343-L630 VanDerWaalsContact CD-CD2 3.45Å; P343-L630 HydrophobicContact CG-CD2 3.54Å
631	V	34.3	Very low	37	Very low	67 Å²	67	78.6 Å²	78.6	41%	0.406	45%	0.454	S	S	.	.			trans	-81.9	126.1	172.1	-169.2	0	0	0	0	107.3	Y629 V633	Y629-V631 VanDerWaalsContact C-N 3.29Å; Y629-V631 HydrophobicContact CD2-CB 4.31Å; Y629-V631 HydrophobicContact CD2-CG2 3.35Å; Y629-V631 HydrophobicContact CE2-CB 4.21Å; Y629-V631 HydrophobicContact CE2-CG1 4.43Å; Y629-V631 HydrophobicContact CE2-CG2 3.15Å; Y629-V631 HydrophobicContact CG-CG2 4.19Å; Y629-V631 PolarHBondContact O-N 2.86Å; V631-V633 HydrophobicContact CB-CG2 4.35Å; V631-V633 HydrophobicContact CG1-CG2 4.37Å; V631-V633 PolarHBondContact O-N 3.25Å; V631-V633 VanDerWaalsContact O-N 3.11Å
632	T	34.7	Very low	36	Very low	40 Å²	40	82.6 Å²	82.6	25%	0.245	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	103.8	160.4	52.4	0	0	0	0	107.3	L574 A634	L574-T632 HydrophobicContact CD1-CG2 3.6Å; T632-A634 PolarHBondContact O-N 2.97Å
633	V	33.7	Very low	35.1	Very low	49 Å²	49	86 Å²	86	30%	0.297	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	113.7	178.8	-173.7	0	0	0	0	107.9	K339 V631 T635	K339-V633 PolarHBondContact N-O 3.02Å; K339-V633 PolarHBondContact O-N 3.41Å; V631-V633 HydrophobicContact CB-CG2 4.35Å; V631-V633 HydrophobicContact CG1-CG2 4.37Å; V631-V633 PolarHBondContact O-N 3.25Å; V631-V633 VanDerWaalsContact O-N 3.11Å; V633-T635 HydrophobicContact CB-CG2 4.29Å; V633-T635 HydrophobicContact CG1-CG2 3.64Å; V633-T635 PolarHBondContact O-N 2.9Å; V633-T635 VanDerWaalsContact O-N 3.17Å
634	A	33.2	Very low	34.1	Very low	43 Å²	43	90.3 Å²	90.3	36%	0.355	54%	0.535	S	S	.	.			trans	-74.8	93.6	160.6	0	0	0	0	0	106.9	A330 I333 T632 T636	A330-A634 HydrophobicContact CB-CB 4.26Å; I333-A634 HydrophobicContact CD1-CB 4.1Å; T632-A634 PolarHBondContact O-N 2.97Å; A634-T636 PolarHBondContact O-N 3.39Å
635	T	32.3	Very low	33.3	Very low	55 Å²	55	97.7 Å²	97.7	34%	0.337	56%	0.564	S	S	.	*			trans	-75.5	114	-178.5	58.4	0	0	0	0	110.4	K339 V633	K339-T635 HydrophobicContact CB-CG2 4.27Å; K339-T635 HydrophobicContact CD-CG2 3.74Å; K339-T635 VanDerWaalsContact CD-OG1 3.23Å; K339-T635 WeakPolarHBondContact CD-OG1 3.16Å; K339-T635 WeakPolarHBondContact CE-OG1 3.46Å; K339-T635 HydrophobicContact CG-CG2 4.29Å; K339-T635 PolarHBondContact NZ-OG1 3.36Å; V633-T635 HydrophobicContact CB-CG2 4.29Å; V633-T635 HydrophobicContact CG1-CG2 3.64Å; V633-T635 PolarHBondContact O-N 2.9Å; V633-T635 VanDerWaalsContact O-N 3.17Å
636	T	28.8	Very low	32.9	Very low	120 Å²	120	96.6 Å²	96.6	74%	0.736	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.9	130.6	138.6	48.3	0	0	0	0	107.6	A634 S638	A634-T636 PolarHBondContact O-N 3.39Å; T636-S638 PolarHBondContact O-N 3.47Å
637	P	33.3	Very low	32.3	Very low	116 Å²	116	96.6 Å²	96.6	75%	0.753	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-73	119.4	-177.6	29.4	-30.6	0	0	0	109.6
638	S	31.3	Very low	32.4	Very low	111 Å²	111	102 Å²	102	78%	0.776	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-93	128.5	157	51.8	0	0	0	0	108.1	T636	T636-S638 PolarHBondContact O-N 3.47Å
639	P	31.6	Very low	32.8	Very low	109 Å²	109	99.8 Å²	99.8	71%	0.708	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-80.6	162.3	177.7	36.6	-33.5	0	0	0	110.2
640	E	30	Very low	32.9	Very low	187 Å²	187	97.5 Å²	97.5	87%	0.874	59%	0.592	S	S	*	*			trans	88.8	88.1	162.4	-59.4	173.7	-173.5	0	0	118.2
641	S	30.6	Very low	33.8	Very low	105 Å²	105	97.1 Å²	97.1	73%	0.734	59%	0.589	S	S	*	*			trans	-167.1	88.9	137.7	157.5	0	0	0	0	108.7	T643	S641-T643 PolarHBondContact O-N 2.97Å
642	S	28.7	Very low	34.9	Very low	119 Å²	119	96.6 Å²	96.6	83%	0.832	59%	0.586	S	S	*	*			trans	-75.9	94.2	172.1	51.6	0	0	0	0	110.5
643	T	31.7	Very low	36.1	Very low	112 Å²	112	99.2 Å²	99.2	69%	0.687	60%	0.599	S	S	*	*			trans	-146.4	109.1	151.8	43.3	0	0	0	0	109	S641	S641-T643 PolarHBondContact O-N 2.97Å
644	S	27.4	Very low	37.2	Very low	100 Å²	100	100.7 Å²	100.7	70%	0.699	62%	0.616	S	S	*	*	S	Bend	trans	28.7	117	156.5	58.7	0	0	0	0	119.6
645	H	31	Very low	38.7	Very low	181 Å²	181	100 Å²	100	84%	0.838	61%	0.606	S	S	*	*	S	Bend	trans	94.6	112.7	165.6	-59.5	-83.9	0	0	0	117.8
646	L	34.2	Very low	40.6	Very low	110 Å²	110	98 Å²	98	58%	0.576	59%	0.594	S	S	*	*			trans	70.7	65.2	165.2	-145.3	82.1	0	0	0	117.7	N587 A588	N587-L646 WeakPolarHBondContact O-CD1 3.37Å; N587-L646 WeakPolarHBondContact O-CD2 3.06Å; A588-L646 WeakPolarHBondContact O-CD2 3.43Å
647	S	30.3	Very low	42.6	Very low	104 Å²	104	94.9 Å²	94.9	73%	0.727	57%	0.572	S	S	*	*			trans	-104.5	14.4	-176.9	-44.5	0	0	0	0	116.2
648	D	34.8	Very low	44.6	Very low	153 Å²	153	91 Å²	91	82%	0.818	54%	0.544	S	S	*	.	S	Bend	trans	-120.9	88.7	167.6	-76.2	-32	0	0	0	109	L650	D648-L650 PolarHBondContact O-N 3.5Å
649	G	42.3	Very low	46.6	Very low	32 Å²	32	92.8 Å²	92.8	33%	0.33	55%	0.545	S	S	.	.			trans	-66.8	49.1	-173.4	0	0	0	0	0	116.1	K339	K339-G649 VanDerWaalsContact CA-O 3.25Å; K339-G649 WeakPolarHBondContact CA-O 3.29Å; K339-G649 WeakPolarHBondContact CB-O 3.2Å; K339-G649 VanDerWaalsContact CG-O 3.25Å; K339-G649 WeakPolarHBondContact CG-O 3.37Å
650	L	40.4	Very low	48.7	Very low	96 Å²	96	91.3 Å²	91.3	50%	0.503	53%	0.531	S	S	.	.			trans	-106.7	108	170.7	-174.2	71.7	0	0	0	108.6	D648 T652	D648-L650 PolarHBondContact O-N 3.5Å; L650-T652 HydrophobicContact CD2-CG2 4.31Å; L650-T652 HydrophobicContact CG-CG2 4.35Å; L650-T652 PolarHBondContact O-N 3.09Å; L650-T652 VanDerWaalsContact O-N 3.13Å
651	F	54.8	Low	51	Low	30 Å²	30	88.5 Å²	88.5	13%	0.132	52%	0.521	C	S	.	.			trans	-77.7	100.9	179.7	-159.3	-92.7	0	0	0	110	F340 F578 C582 P584 A588 D655 C656	F340-F651 HydrophobicContact CB-CB 4.05Å; F340-F651 HydrophobicContact CD1-CD2 4.03Å; F340-F651 HydrophobicContact CD1-CE2 4.42Å; F340-F651 HydrophobicContact CD1-CG 4.28Å; F578-F651 HydrophobicContact CE1-CD1 4.17Å; F578-F651 AromaticContact CE1-CE1 3.88Å; F578-F651 HydrophobicContact CE1-CE1 3.88Å; F578-F651 HydrophobicContact CZ-CD1 4.03Å; F578-F651 AromaticContact CZ-CE1 3.85Å; F578-F651 HydrophobicContact CZ-CE1 3.85Å; C582-F651 WeakPolarHBondContact SG-CE1 3.48Å; C582-F651 WeakPolarHBondContact SG-CZ 3.32Å; P584-F651 HydrophobicContact CB-CE2 4.45Å; P584-F651 HydrophobicContact CB-CZ 4.15Å; A588-F651 HydrophobicContact CB-CD2 4.39Å; A588-F651 HydrophobicContact CB-CE2 3.8Å; F651-D655 HydrophobicContact CD1-CB 4.36Å; F651-D655 HydrophobicContact CD2-CB 4.15Å; F651-D655 HydrophobicContact CE1-CB 4.21Å; F651-D655 HydrophobicContact CE2-CB 3.98Å; F651-D655 HydrophobicContact CG-CB 4.33Å; F651-D655 HydrophobicContact CZ-CB 4Å; F651-C656 WeakPolarHBondContact CE1-SG 3.32Å
652	T	58.4	Low	53.2	Low	56 Å²	56	90.1 Å²	90.1	34%	0.344	52%	0.52	S	S	.	.			trans	-86.7	170.8	-175.3	68.4	0	0	0	0	111.9	L650 A654 D655	L650-T652 HydrophobicContact CD2-CG2 4.31Å; L650-T652 HydrophobicContact CG-CG2 4.35Å; L650-T652 PolarHBondContact O-N 3.09Å; L650-T652 VanDerWaalsContact O-N 3.13Å; T652-A654 PolarHBondContact O-N 3.17Å; T652-A654 PolarHBondContact OG1-N 2.78Å; T652-D655 PolarHBondContact N-OD2 3.46Å; T652-D655 WeakPolarHBondContact O-CB 3.32Å; T652-D655 PolarHBondContact O-N 3.12Å; T652-D655 PolarHBondContact OG1-OD2 2.86Å
653	N	58.9	Low	55.3	Low	96 Å²	96	88.6 Å²	88.6	51%	0.513	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-62.6	-23.9	171.4	-71.3	-24.7	0	0	0	112.7	D655 C656 L664 R668	N653-D655 PolarHBondContact O-N 3.07Å; N653-C656 PolarHBondContact O-N 2.92Å; N653-L664 HydrophobicContact CB-CD2 4.49Å; N653-L664 WeakPolarHBondContact OD1-CD2 2.9Å; N653-R668 VanDerWaalsContact OD1-CZ 3.26Å; N653-R668 PolarHBondContact OD1-NH1 2.91Å; N653-R668 PolarHBondContact OD1-NH2 2.84Å
654	A	56.7	Low	57.2	Low	79 Å²	79	83.5 Å²	83.5	65%	0.653	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-71.9	-17.6	178.2	0	0	0	0	0	112.5	T652 C656	T652-A654 PolarHBondContact O-N 3.17Å; T652-A654 PolarHBondContact OG1-N 2.78Å; A654-C656 VanDerWaalsContact C-N 3.3Å
655	D	66	Low	59.5	Low	29 Å²	29	84.6 Å²	84.6	16%	0.155	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-85.1	-2.1	179	-60.7	-45.8	0	0	0	113	P584 T585 A588 F651 T652 N653	P584-D655 CarbonylContact C-O 3.47Å; P584-D655 VanDerWaalsContact CA-O 3.25Å; P584-D655 WeakPolarHBondContact CA-O 3.36Å; T585-D655 PolarHBondContact N-O 3.23Å; T585-D655 PolarHBondContact OG1-O 2.83Å; A588-D655 HydrophobicContact CB-CB 3.6Å; F651-D655 HydrophobicContact CD1-CB 4.36Å; F651-D655 HydrophobicContact CD2-CB 4.15Å; F651-D655 HydrophobicContact CE1-CB 4.21Å; F651-D655 HydrophobicContact CE2-CB 3.98Å; F651-D655 HydrophobicContact CG-CB 4.33Å; F651-D655 HydrophobicContact CZ-CB 4Å; T652-D655 PolarHBondContact N-OD2 3.46Å; T652-D655 WeakPolarHBondContact O-CB 3.32Å; T652-D655 PolarHBondContact O-N 3.12Å; T652-D655 PolarHBondContact OG1-OD2 2.86Å; N653-D655 PolarHBondContact O-N 3.07Å
656	C	70.5	Confident	61.7	Low	14 Å²	14	79 Å²	79	10%	0.095	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-111.6	140.9	178.8	-66.8	0	0	0	0	111.9	C582 F651 N653 A654 L664	C582-C656 HydrophobicContact CB-CB 4.09Å; C582-C656 WeakPolarHBondContact CB-SG 3.36Å; C582-C656 WeakPolarHBondContact O-CA 3.28Å; C582-C656 VanDerWaalsContact O-CB 3.27Å; C582-C656 WeakPolarHBondContact O-CB 3.24Å; C582-C656 WeakPolarHBondContact SG-CA 3Å; C582-C656 WeakPolarHBondContact SG-CB 3.47Å; C582-C656 CovalentContact SG-SG 2.04Å; C582-C656 PolarHBondContact SG-SG 3.06Å; F651-C656 WeakPolarHBondContact CE1-SG 3.32Å; N653-C656 PolarHBondContact O-N 2.92Å; A654-C656 VanDerWaalsContact C-N 3.3Å; C656-L664 HydrophobicContact CB-CD1 4.34Å; C656-L664 HydrophobicContact CB-CD2 4.22Å
657	M	72.1	Confident	63.5	Low	54 Å²	54	73.7 Å²	73.7	27%	0.266	41%	0.408	S	S	.	.			trans	-84.8	-6.4	171.7	-62.5	-170.8	-74.5	0	0	113.5	C582 R583 T585 Y593 N659	C582-M657 PolarHBondContact O-N 3.03Å; R583-M657 HydrophobicContact CB-CB 4.04Å; R583-M657 HydrophobicContact CB-CE 3.78Å; R583-M657 WeakPolarHBondContact O-CB 3.21Å; R583-M657 WeakPolarHBondContact O-CG 3.34Å; R583-M657 PolarHBondContact O-N 2.97Å; T585-M657 HydrophobicContact CG2-CG 4.07Å; Y593-M657 HydrophobicContact CD2-CE 4.12Å; Y593-M657 HydrophobicContact CE2-CE 4.01Å; Y593-M657 HydrophobicContact CE2-SD 3.92Å; M657-N659 PolarHBondContact O-N 3.49Å
658	E	74.1	Confident	65.5	Low	33 Å²	33	70.9 Å²	70.9	15%	0.154	38%	0.381	C	S	.	.			trans	-78.3	112.5	178	179.5	66.4	-112.4	0	0	111.5	I581 C582 N660 K663	I581-E658 HydrophobicContact CG2-CG 4.33Å; I581-E658 VanDerWaalsContact O-CB 3.31Å; I581-E658 WeakPolarHBondContact O-CB 3.23Å; C582-E658 PolarHBondContact O-N 2.92Å; E658-N660 VanDerWaalsContact C-N 3.31Å; E658-N660 HydrophobicContact CG-CB 4.48Å; E658-N660 PolarHBondContact O-N 3.46Å; E658-N660 VanDerWaalsContact OE1-CB 3.31Å; E658-N660 WeakPolarHBondContact OE1-CB 3.39Å; E658-N660 PolarHBondContact OE1-N 2.91Å; E658-K663 HydrophobicContact CG-CD 4.45Å; E658-K663 IonicContact OE2-NZ 3.78Å; E658-K663 PolarHBondContact OE2-NZ 3.43Å
659	N	73.2	Confident	67.4	Low	150 Å²	150	64.7 Å²	64.7	80%	0.802	35%	0.349	S	S	*	.			trans	-75.2	-18.9	-178.4	-62.6	-19.3	0	0	0	113	M657 I661	M657-N659 PolarHBondContact O-N 3.49Å; N659-I661 PolarHBondContact O-N 3.03Å; N659-I661 VanDerWaalsContact O-N 3.16Å
660	N	77.3	Confident	69.1	Low	77 Å²	77	63.1 Å²	63.1	41%	0.412	33%	0.333	S	S	.	.			trans	-82	97.1	-178.2	-167.6	-26.9	0	0	0	111.7	E658 L662 K663 L664	E658-N660 VanDerWaalsContact C-N 3.31Å; E658-N660 HydrophobicContact CG-CB 4.48Å; E658-N660 PolarHBondContact O-N 3.46Å; E658-N660 VanDerWaalsContact OE1-CB 3.31Å; E658-N660 WeakPolarHBondContact OE1-CB 3.39Å; E658-N660 PolarHBondContact OE1-N 2.91Å; N660-L662 PolarHBondContact O-N 3.34Å; N660-L662 WeakPolarHBondContact OD1-CB 3.42Å; N660-L662 PolarHBondContact OD1-N 3.33Å; N660-L662 VanDerWaalsContact OD1-N 3.11Å; N660-K663 HydrophobicContact CB-CB 3.96Å; N660-K663 PolarHBondContact O-N 3.39Å; N660-K663 VanDerWaalsContact O-N 3.11Å; N660-K663 PolarHBondContact OD1-N 3.11Å; N660-L664 PolarHBondContact O-N 2.86Å
661	I	78	Confident	71.2	Confident	129 Å²	129	61.1 Å²	61.1	66%	0.662	32%	0.32	S	S	*	.	H	α-helix	trans	-55.5	-36.8	179.7	-55.3	174.2	0	0	0	112	N659 L664 K665	N659-I661 PolarHBondContact O-N 3.03Å; N659-I661 VanDerWaalsContact O-N 3.16Å; I661-L664 PolarHBondContact O-N 3.14Å; I661-K665 VanDerWaalsContact O-CB 3.24Å; I661-K665 WeakPolarHBondContact O-CB 3.49Å; I661-K665 PolarHBondContact O-N 3.28Å
662	L	77.3	Confident	72.7	Confident	138 Å²	138	59.7 Å²	59.7	72%	0.723	31%	0.314	S	S	*	.	H	α-helix	trans	-66.3	-43.7	179.8	-71.2	163.4	0	0	0	111.3	N660 K665 D666	N660-L662 PolarHBondContact O-N 3.34Å; N660-L662 WeakPolarHBondContact OD1-CB 3.42Å; N660-L662 PolarHBondContact OD1-N 3.33Å; N660-L662 VanDerWaalsContact OD1-N 3.11Å; L662-K665 PolarHBondContact O-N 3.11Å; L662-D666 WeakPolarHBondContact O-CB 3.1Å; L662-D666 PolarHBondContact O-N 3.35Å
663	K	72.2	Confident	74.2	Confident	88 Å²	88	57 Å²	57	38%	0.383	30%	0.298	S	S	.	.	H	α-helix	trans	-66.9	-39.7	178.5	-165.2	-177.9	172.2	-162	0	111.3	I581 E658 N660 D666 A667	I581-K663 HydrophobicContact CG2-CD 4.2Å; I581-K663 HydrophobicContact CG2-CG 3.88Å; E658-K663 HydrophobicContact CG-CD 4.45Å; E658-K663 IonicContact OE2-NZ 3.78Å; E658-K663 PolarHBondContact OE2-NZ 3.43Å; N660-K663 HydrophobicContact CB-CB 3.96Å; N660-K663 PolarHBondContact O-N 3.39Å; N660-K663 VanDerWaalsContact O-N 3.11Å; N660-K663 PolarHBondContact OD1-N 3.11Å; K663-D666 PolarHBondContact O-N 3.2Å; K663-A667 WeakPolarHBondContact O-CB 3.49Å; K663-A667 PolarHBondContact O-N 2.89Å
664	L	72.5	Confident	75.8	Confident	5 Å²	5	54 Å²	54	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-68.6	-38.8	176	-170.8	64.5	0	0	0	112.2	F578 C582 N653 C656 N660 I661 A667 R668	F578-L664 HydrophobicContact CE2-CD1 3.98Å; C582-L664 HydrophobicContact CB-CD1 3.99Å; N653-L664 HydrophobicContact CB-CD2 4.49Å; N653-L664 WeakPolarHBondContact OD1-CD2 2.9Å; C656-L664 HydrophobicContact CB-CD1 4.34Å; C656-L664 HydrophobicContact CB-CD2 4.22Å; N660-L664 PolarHBondContact O-N 2.86Å; I661-L664 PolarHBondContact O-N 3.14Å; L664-A667 PolarHBondContact O-N 3.42Å; L664-R668 WeakPolarHBondContact O-CG 3.38Å; L664-R668 PolarHBondContact O-N 2.76Å
665	K	75.3	Confident	77.4	Confident	122 Å²	122	50.2 Å²	50.2	53%	0.53	25%	0.25	S	S	.	.	H	α-helix	trans	-63.8	-41.7	172.8	-177.5	176.1	-179.6	176.8	0	111.7	I661 L662 R668 T669	I661-K665 VanDerWaalsContact O-CB 3.24Å; I661-K665 WeakPolarHBondContact O-CB 3.49Å; I661-K665 PolarHBondContact O-N 3.28Å; L662-K665 PolarHBondContact O-N 3.11Å; K665-R668 PolarHBondContact O-N 2.9Å; K665-T669 PolarHBondContact O-N 3.2Å; K665-T669 PolarHBondContact O-OG1 3.38Å
666	D	75.8	Confident	78.6	Confident	63 Å²	63	48.9 Å²	48.9	34%	0.337	24%	0.243	S	C	.	.	H	α-helix	trans	-64.6	-41	176.8	-163.3	47.1	0	0	0	111.2	R575 L662 K663 R668 T669	R575-D666 IonicContact CZ-OD1 3.28Å; R575-D666 IonicContact CZ-OD2 2.86Å; R575-D666 VanDerWaalsContact CZ-OD2 3.28Å; R575-D666 PolarHBondContact NE-O 3.28Å; R575-D666 IonicContact NH1-OD1 2.7Å; R575-D666 IonicContact NH1-OD2 2.66Å; R575-D666 PolarHBondContact NH1-OD2 3.5Å; R575-D666 PolarHBondContact NH2-O 2.93Å; R575-D666 VanDerWaalsContact NH2-O 3.17Å; R575-D666 IonicContact NH2-OD1 3.23Å; R575-D666 PolarHBondContact NH2-OD1 3.43Å; R575-D666 IonicContact NH2-OD2 3.49Å; R575-D666 PolarHBondContact NH2-OD2 3.15Å; L662-D666 WeakPolarHBondContact O-CB 3.1Å; L662-D666 PolarHBondContact O-N 3.35Å; K663-D666 PolarHBondContact O-N 3.2Å; D666-R668 PolarHBondContact O-N 2.98Å; D666-T669 PolarHBondContact O-N 2.78Å; D666-T669 PolarHBondContact O-OG1 3.28Å
667	A	72.8	Confident	79.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.9	-27	175.4	0	0	0	0	0	113.7	R575 F578 I581 K663 L664 T669	R575-A667 PolarHBondContact N-O 3.01Å; F578-A667 HydrophobicContact CD2-CB 3.79Å; I581-A667 HydrophobicContact CB-CB 4.15Å; I581-A667 HydrophobicContact CD1-CB 3.74Å; I581-A667 HydrophobicContact CG2-CB 3.97Å; K663-A667 WeakPolarHBondContact O-CB 3.49Å; K663-A667 PolarHBondContact O-N 2.89Å; L664-A667 PolarHBondContact O-N 3.42Å; A667-T669 VanDerWaalsContact C-N 3.34Å
668	R	72.1	Confident	80.7	Confident	45 Å²	45	45.7 Å²	45.7	17%	0.17	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	0.5	174.4	-68.7	-167.6	-179.4	112.1	-10.3	114.4	G572 R573 F578 N653 L664 K665 D666	G572-R668 CarbonylContact C-O 3.34Å; G572-R668 VanDerWaalsContact C-O 3.27Å; R573-R668 CarbonylContact C-O 3.56Å; R573-R668 CarbonylContact O-C 3.45Å; R573-R668 VanDerWaalsContact O-O 3.09Å; F578-R668 HydrophobicContact CD2-CG 4.2Å; F578-R668 HydrophobicContact CE2-CG 3.65Å; N653-R668 VanDerWaalsContact OD1-CZ 3.26Å; N653-R668 PolarHBondContact OD1-NH1 2.91Å; N653-R668 PolarHBondContact OD1-NH2 2.84Å; L664-R668 WeakPolarHBondContact O-CG 3.38Å; L664-R668 PolarHBondContact O-N 2.76Å; K665-R668 PolarHBondContact O-N 2.9Å; D666-R668 PolarHBondContact O-N 2.98Å
669	T	75.6	Confident	81.6	Confident	22 Å²	22	44.4 Å²	44.4	14%	0.135	22%	0.221	C	C	.	.			trans	-127	94.1	-179.8	56.2	0	0	0	0	111.6	R575 K665 D666 A667	R575-T669 PolarHBondContact NE-O 3.4Å; R575-T669 PolarHBondContact NH2-O 3.49Å; K665-T669 PolarHBondContact O-N 3.2Å; K665-T669 PolarHBondContact O-OG1 3.38Å; D666-T669 PolarHBondContact O-N 2.78Å; D666-T669 PolarHBondContact O-OG1 3.28Å; A667-T669 VanDerWaalsContact C-N 3.34Å
670	S	77.4	Confident	82.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.			trans	-98	-53.5	178.3	61.6	0	0	0	0	112.6	R573 L574 P672 N729 D733	R573-S670 VanDerWaalsContact CB-OG 3.24Å; R573-S670 WeakPolarHBondContact CB-OG 3.37Å; R573-S670 VanDerWaalsContact CG-OG 3.27Å; R573-S670 WeakPolarHBondContact CG-OG 3.5Å; R573-S670 WeakPolarHBondContact O-CB 3.41Å; R573-S670 PolarHBondContact O-N 3.33Å; R573-S670 PolarHBondContact O-OG 3.12Å; L574-S670 PolarHBondContact O-OG 3Å; S670-P672 CarbonylContact O-C 3.58Å; S670-N729 PolarHBondContact O-ND2 2.86Å; S670-D733 VanDerWaalsContact CB-OD2 3.28Å; S670-D733 WeakPolarHBondContact CB-OD2 3.5Å
671	F	83.4	Confident	83.3	Confident	54 Å²	54	34 Å²	34	24%	0.237	17%	0.165	C	C	.	.	S	Bend	trans	-88.7	136.6	-172.2	-176	-90.1	0	0	0	113.8	I567 K568 V571 R573 D733 A736	I567-F671 HydrophobicContact CG2-CD1 4.02Å; I567-F671 HydrophobicContact CG2-CE1 3.92Å; K568-F671 VanDerWaalsContact CA-O 3.31Å; K568-F671 WeakPolarHBondContact CA-O 3.45Å; K568-F671 VanDerWaalsContact CG-O 3.24Å; K568-F671 WeakPolarHBondContact CG-O 3.46Å; V571-F671 HydrophobicContact CB-CD1 4.23Å; V571-F671 HydrophobicContact CG1-CB 4.3Å; V571-F671 HydrophobicContact CG1-CD1 4.02Å; V571-F671 HydrophobicContact CG1-CG 4.46Å; V571-F671 HydrophobicContact CG2-CD1 3.98Å; V571-F671 HydrophobicContact CG2-CE1 4.36Å; R573-F671 HydrophobicContact CB-CB 4.02Å; F671-D733 WeakPolarHBondContact CB-OD1 3.46Å; F671-D733 WeakPolarHBondContact CD2-OD1 3.42Å; F671-A736 HydrophobicContact CD2-CB 4.29Å; F671-A736 HydrophobicContact CE2-CB 3.37Å; F671-A736 HydrophobicContact CZ-CB 3.64Å
672	P	87.9	Confident	84	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	S	Bend	cis	-81.9	164.8	-19.1	31.1	-31.2	0	0	0	110.6	V564 I567 K568 S670 L674 A736 I740	V564-P672 HydrophobicContact CB-CG 4.49Å; V564-P672 HydrophobicContact CG1-CG 4.01Å; V564-P672 HydrophobicContact CG2-CG 4.29Å; I567-P672 HydrophobicContact CB-CG 4.25Å; I567-P672 HydrophobicContact CD1-CG 4.42Å; I567-P672 VanDerWaalsContact CG2-CD 3.45Å; I567-P672 HydrophobicContact CG2-CG 4.11Å; K568-P672 WeakPolarHBondContact CE-O 3.33Å; S670-P672 CarbonylContact O-C 3.58Å; P672-L674 PolarHBondContact O-N 3.45Å; P672-A736 HydrophobicContact CB-CB 4.01Å; P672-I740 HydrophobicContact CB-CD1 3.99Å; P672-I740 HydrophobicContact CG-CD1 3.59Å
673	S	90.3	Very high	84.6	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.103	C	C	.	.			trans	-70.4	113.3	-178.3	176.8	0	0	0	0	111.6	G675 A676 A677 D733	S673-G675 PolarHBondContact O-N 2.95Å; S673-A676 PolarHBondContact O-N 3.31Å; S673-A676 PolarHBondContact OG-N 3.35Å; S673-A677 PolarHBondContact O-N 2.68Å; S673-D733 WeakPolarHBondContact CB-O 3.3Å; S673-D733 PolarHBondContact N-O 3.06Å
674	L	91.1	Very high	85.5	Confident	31 Å²	31	18.7 Å²	18.7	16%	0.162	9%	0.091	C	C	.	.	H	α-helix	trans	-59.9	-45	176.8	-175.1	65.4	0	0	0	112	I497 V501 M561 V564 P672 A676 A677 V678	I497-L674 HydrophobicContact CG2-CB 4.46Å; I497-L674 HydrophobicContact CG2-CD2 3.98Å; I497-L674 HydrophobicContact CG2-CG 4.49Å; V501-L674 HydrophobicContact CG2-CD2 4.46Å; M561-L674 HydrophobicContact SD-CD1 3.63Å; M561-L674 HydrophobicContact SD-CD2 4.12Å; M561-L674 HydrophobicContact SD-CG 4.09Å; V564-L674 HydrophobicContact CB-CD1 3.85Å; V564-L674 HydrophobicContact CG1-CB 3.99Å; V564-L674 HydrophobicContact CG1-CD1 3.65Å; V564-L674 HydrophobicContact CG1-CG 4.47Å; V564-L674 HydrophobicContact CG2-CD1 4.48Å; P672-L674 PolarHBondContact O-N 3.45Å; L674-A676 VanDerWaalsContact C-N 3.29Å; L674-A676 PolarHBondContact O-N 3.02Å; L674-A677 PolarHBondContact O-N 2.85Å; L674-V678 HydrophobicContact CD1-CG1 3.95Å; L674-V678 HydrophobicContact CG-CG1 4.29Å; L674-V678 VanDerWaalsContact O-CG1 3.24Å; L674-V678 WeakPolarHBondContact O-CG1 3.43Å; L674-V678 VanDerWaalsContact O-CG2 3.28Å; L674-V678 WeakPolarHBondContact O-CG2 3.47Å; L674-V678 PolarHBondContact O-N 3.08Å; L674-V678 VanDerWaalsContact O-N 3.09Å
675	G	90.2	Very high	86.3	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-62.5	-36.7	179.4	0	0	0	0	0	112.8	S673 S679	S673-G675 PolarHBondContact O-N 2.95Å; G675-S679 VanDerWaalsContact O-CB 3.31Å; G675-S679 WeakPolarHBondContact O-CB 3.37Å; G675-S679 PolarHBondContact O-N 3.09Å; G675-S679 PolarHBondContact O-OG 2.99Å
676	A	91.1	Very high	87	Confident	1 Å²	1	12.9 Å²	12.9	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-68.2	-46.6	176	0	0	0	0	0	111.5	S673 L674 V678 S679 M680 I734	S673-A676 PolarHBondContact O-N 3.31Å; S673-A676 PolarHBondContact OG-N 3.35Å; L674-A676 VanDerWaalsContact C-N 3.29Å; L674-A676 PolarHBondContact O-N 3.02Å; A676-V678 PolarHBondContact O-N 3.43Å; A676-S679 PolarHBondContact O-OG 3.39Å; A676-S679 VanDerWaalsContact O-OG 3.05Å; A676-M680 WeakPolarHBondContact O-CB 3.47Å; A676-M680 PolarHBondContact O-N 3Å; A676-I734 HydrophobicContact CB-CB 4.3Å; A676-I734 HydrophobicContact CB-CG1 4.38Å; A676-I734 HydrophobicContact CB-CG2 3.93Å
677	A	93.6	Very high	87.4	Confident	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-60.9	-44.2	-179.3	0	0	0	0	0	113.1	T560 V564 S673 L674 Y681 G737 G741	T560-A677 HydrophobicContact CG2-CB 3.92Å; V564-A677 HydrophobicContact CG2-CB 3.69Å; S673-A677 PolarHBondContact O-N 2.68Å; L674-A677 PolarHBondContact O-N 2.85Å; A677-Y681 VanDerWaalsContact O-CB 3.3Å; A677-Y681 WeakPolarHBondContact O-CB 3.44Å; A677-Y681 PolarHBondContact O-N 3.41Å; A677-G737 WeakPolarHBondContact CA-O 3.27Å; A677-G737 VanDerWaalsContact CB-O 3.3Å; A677-G737 WeakPolarHBondContact CB-O 3.35Å; A677-G741 WeakPolarHBondContact O-CA 3.33Å
678	V	94	Very high	87.9	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-77.7	-35.3	-173.4	-55.3	0	0	0	0	112	I500 L557 T560 M561 L674 A676 A682	I500-V678 HydrophobicContact CG2-CG2 4.11Å; L557-V678 HydrophobicContact CD1-CB 4.1Å; L557-V678 HydrophobicContact CD1-CG1 4.4Å; T560-V678 HydrophobicContact CG2-CG1 4.33Å; M561-V678 HydrophobicContact CE-CB 3.71Å; M561-V678 HydrophobicContact CE-CG1 3.13Å; M561-V678 HydrophobicContact CE-CG2 4.23Å; M561-V678 HydrophobicContact CG-CG1 4.32Å; M561-V678 HydrophobicContact SD-CG1 3.48Å; M561-V678 WeakPolarHBondContact SD-CG1 3.46Å; L674-V678 HydrophobicContact CD1-CG1 3.95Å; L674-V678 HydrophobicContact CG-CG1 4.29Å; L674-V678 VanDerWaalsContact O-CG1 3.24Å; L674-V678 WeakPolarHBondContact O-CG1 3.43Å; L674-V678 VanDerWaalsContact O-CG2 3.28Å; L674-V678 WeakPolarHBondContact O-CG2 3.47Å; L674-V678 PolarHBondContact O-N 3.08Å; L674-V678 VanDerWaalsContact O-N 3.09Å; A676-V678 PolarHBondContact O-N 3.43Å; V678-A682 VanDerWaalsContact O-CB 3.29Å; V678-A682 WeakPolarHBondContact O-CB 2.87Å; V678-A682 PolarHBondContact O-N 3.18Å
679	S	92.4	Very high	88.5	Confident	7 Å²	7	10.6 Å²	10.6	5%	0.049	6%	0.058	C	C	.	.	H	α-helix	trans	-67.7	-41.3	174.3	55.4	0	0	0	0	111.5	G675 A676 A682 A683	G675-S679 VanDerWaalsContact O-CB 3.31Å; G675-S679 WeakPolarHBondContact O-CB 3.37Å; G675-S679 PolarHBondContact O-N 3.09Å; G675-S679 PolarHBondContact O-OG 2.99Å; A676-S679 PolarHBondContact O-OG 3.39Å; A676-S679 VanDerWaalsContact O-OG 3.05Å; S679-A682 PolarHBondContact O-N 3.02Å; S679-A683 WeakPolarHBondContact O-CB 3.4Å; S679-A683 PolarHBondContact O-N 3.33Å
680	M	91.8	Very high	88.8	Confident	8 Å²	8	10.8 Å²	10.8	4%	0.039	6%	0.058	C	C	.	.	H	α-helix	trans	-71.2	-40.4	177.6	-168.7	59.5	70.2	0	0	112.3	A676 A682 A683 I684 A716 W738 I742	A676-M680 WeakPolarHBondContact O-CB 3.47Å; A676-M680 PolarHBondContact O-N 3Å; M680-A682 VanDerWaalsContact C-N 3.34Å; M680-A682 PolarHBondContact O-N 3.38Å; M680-A683 PolarHBondContact O-N 3.36Å; M680-I684 HydrophobicContact CG-CG1 4.31Å; M680-I684 WeakPolarHBondContact O-CG1 3.33Å; M680-I684 PolarHBondContact O-N 3.31Å; M680-I684 HydrophobicContact SD-CD1 4.33Å; M680-I684 HydrophobicContact SD-CG1 4.08Å; M680-A716 HydrophobicContact CE-CB 4.29Å; M680-W738 HydrophobicContact CB-CB 4.41Å; M680-W738 HydrophobicContact CB-CG 4.29Å; M680-W738 HydrophobicContact CE-CB 4.18Å; M680-W738 HydrophobicContact CE-CD2 3.79Å; M680-W738 HydrophobicContact CE-CE3 4.47Å; M680-W738 HydrophobicContact CE-CG 3.62Å; M680-W738 HydrophobicContact CG-CB 4.16Å; M680-W738 HydrophobicContact CG-CG 4.33Å; M680-I742 HydrophobicContact CG-CD1 4.03Å; M680-I742 HydrophobicContact CG-CG1 3.5Å; M680-I742 HydrophobicContact SD-CD1 4.4Å; M680-I742 HydrophobicContact SD-CG1 4.2Å
681	Y	93.8	Very high	88.9	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-55.4	-50.5	171.7	169.5	-95.7	0	0	0	111.3	Y553 G556 L557 A677 A683 F685 I744 A745	Y553-Y681 AromaticContact CD2-CE1 3.8Å; Y553-Y681 HydrophobicContact CD2-CE1 3.8Å; Y553-Y681 HydrophobicContact CE2-CD1 4.07Å; Y553-Y681 AromaticContact CE2-CE1 3.41Å; Y553-Y681 HydrophobicContact CE2-CE1 3.41Å; Y553-Y681 VanDerWaalsContact CE2-CE1 3.41Å; Y553-Y681 PolarHBondContact O-OH 2.9Å; Y553-Y681 VanDerWaalsContact O-OH 3.05Å; G556-Y681 VanDerWaalsContact CA-OH 3.27Å; G556-Y681 WeakPolarHBondContact CA-OH 3.01Å; L557-Y681 HydrophobicContact CB-CD1 4.27Å; L557-Y681 HydrophobicContact CB-CE1 3.84Å; L557-Y681 HydrophobicContact CD1-CD1 3.86Å; L557-Y681 HydrophobicContact CD1-CE1 4.27Å; A677-Y681 VanDerWaalsContact O-CB 3.3Å; A677-Y681 WeakPolarHBondContact O-CB 3.44Å; A677-Y681 PolarHBondContact O-N 3.41Å; Y681-A683 PolarHBondContact O-N 2.84Å; Y681-F685 VanDerWaalsContact O-CB 3.31Å; Y681-F685 WeakPolarHBondContact O-CB 3.24Å; Y681-F685 PolarHBondContact O-N 3.47Å; Y681-I744 HydrophobicContact CD2-CB 4.36Å; Y681-I744 HydrophobicContact CD2-CG2 4.07Å; Y681-I744 HydrophobicContact CE2-CG2 4.02Å; Y681-A745 HydrophobicContact CD2-CB 3.74Å; Y681-A745 HydrophobicContact CE2-CB 4.15Å
682	A	93.1	Very high	88.6	Confident	7 Å²	7	11.7 Å²	11.7	6%	0.058	7%	0.069	C	C	.	.	H	α-helix	trans	-57.5	-47.4	177.6	0	0	0	0	0	112.1	P508 Y553 V678 S679 M680 V686	P508-A682 HydrophobicContact CG-CB 3.72Å; Y553-A682 WeakPolarHBondContact OH-CB 3.28Å; V678-A682 VanDerWaalsContact O-CB 3.29Å; V678-A682 WeakPolarHBondContact O-CB 2.87Å; V678-A682 PolarHBondContact O-N 3.18Å; S679-A682 PolarHBondContact O-N 3.02Å; M680-A682 VanDerWaalsContact C-N 3.34Å; M680-A682 PolarHBondContact O-N 3.38Å; A682-V686 WeakPolarHBondContact O-CB 3.38Å; A682-V686 VanDerWaalsContact O-CG2 3.28Å; A682-V686 WeakPolarHBondContact O-CG2 3.31Å; A682-V686 PolarHBondContact O-N 2.86Å; A682-V686 VanDerWaalsContact O-N 3.09Å
683	A	90.3	Very high	88.2	Confident	1 Å²	1	12 Å²	12	1%	0.008	7%	0.071	C	C	.	.	H	α-helix	trans	-61.4	-50.6	-178.8	0	0	0	0	0	112.4	S679 M680 Y681 T687 V712 A716	S679-A683 WeakPolarHBondContact O-CB 3.4Å; S679-A683 PolarHBondContact O-N 3.33Å; M680-A683 PolarHBondContact O-N 3.36Å; Y681-A683 PolarHBondContact O-N 2.84Å; A683-T687 VanDerWaalsContact O-CB 3.29Å; A683-T687 WeakPolarHBondContact O-CB 3.31Å; A683-T687 PolarHBondContact O-N 2.96Å; A683-T687 PolarHBondContact O-OG1 2.9Å; A683-V712 HydrophobicContact CB-CB 4.28Å; A683-V712 HydrophobicContact CB-CG1 3.61Å; A683-A716 HydrophobicContact CB-CB 4.37Å
684	I	90	Very high	87.3	Confident	26 Å²	26	13.8 Å²	13.8	13%	0.133	8%	0.08	C	C	.	.	H	α-helix	trans	-66.8	-44.8	-178.5	-63	-61.9	0	0	0	110.8	M680 V686 T687 V688 L709 I742 A745	M680-I684 HydrophobicContact CG-CG1 4.31Å; M680-I684 WeakPolarHBondContact O-CG1 3.33Å; M680-I684 PolarHBondContact O-N 3.31Å; M680-I684 HydrophobicContact SD-CD1 4.33Å; M680-I684 HydrophobicContact SD-CG1 4.08Å; I684-V686 PolarHBondContact O-N 3.04Å; I684-T687 PolarHBondContact O-N 3.21Å; I684-V688 HydrophobicContact CG2-CG2 4.12Å; I684-V688 WeakPolarHBondContact O-CB 3.29Å; I684-V688 VanDerWaalsContact O-CG2 3.28Å; I684-V688 WeakPolarHBondContact O-CG2 3.39Å; I684-V688 PolarHBondContact O-N 3.21Å; I684-L709 HydrophobicContact CD1-CD1 4.46Å; I684-I742 HydrophobicContact CG1-CG1 4.1Å; I684-A745 HydrophobicContact CB-CB 3.73Å; I684-A745 HydrophobicContact CG2-CB 3.6Å
685	F	90.9	Very high	86.3	Confident	2 Å²	2	17 Å²	17	1%	0.009	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-51.2	-179.5	-175.6	-81.5	0	0	0	111.6	I512 Y553 Y681 T687 V688 Y689 V748 C749	I512-F685 HydrophobicContact CD1-CD1 4.32Å; I512-F685 HydrophobicContact CD1-CE1 3.88Å; Y553-F685 HydrophobicContact CD2-CB 4.24Å; Y553-F685 AromaticContact CD2-CD1 3.42Å; Y553-F685 HydrophobicContact CD2-CD1 3.42Å; Y553-F685 VanDerWaalsContact CD2-CD1 3.42Å; Y553-F685 HydrophobicContact CD2-CD2 4.24Å; Y553-F685 AromaticContact CD2-CE1 3.74Å; Y553-F685 HydrophobicContact CD2-CE1 3.74Å; Y553-F685 HydrophobicContact CD2-CE2 4.5Å; Y553-F685 AromaticContact CD2-CG 3.7Å; Y553-F685 HydrophobicContact CD2-CG 3.7Å; Y553-F685 HydrophobicContact CD2-CZ 4.27Å; Y553-F685 HydrophobicContact CE2-CB 4.23Å; Y553-F685 HydrophobicContact CE2-CD1 4.08Å; Y553-F685 HydrophobicContact CE2-CG 4.19Å; Y553-F685 HydrophobicContact CG-CD1 4.35Å; Y553-F685 HydrophobicContact CG-CE1 4.26Å; Y681-F685 VanDerWaalsContact O-CB 3.31Å; Y681-F685 WeakPolarHBondContact O-CB 3.24Å; Y681-F685 PolarHBondContact O-N 3.47Å; F685-T687 VanDerWaalsContact C-N 3.33Å; F685-T687 PolarHBondContact O-N 3.27Å; F685-V688 PolarHBondContact O-N 3.17Å; F685-Y689 WeakPolarHBondContact O-CB 3.33Å; F685-Y689 PolarHBondContact O-N 3.23Å; F685-V748 HydrophobicContact CD2-CG1 4.33Å; F685-V748 HydrophobicContact CE2-CG1 3.86Å; F685-C749 VanDerWaalsContact CD2-SG 3.52Å
686	V	88.5	Confident	85	Confident	3 Å²	3	22.4 Å²	22.4	2%	0.018	12%	0.121	C	C	.	.	H	α-helix	trans	-61.4	-43.9	179.7	171.5	0	0	0	0	110.6	P508 L511 A682 I684 Y689 I690	P508-V686 HydrophobicContact CB-CG2 3.54Å; P508-V686 HydrophobicContact CG-CG2 4.14Å; L511-V686 HydrophobicContact CB-CG1 4.23Å; L511-V686 HydrophobicContact CD1-CG1 3.92Å; A682-V686 WeakPolarHBondContact O-CB 3.38Å; A682-V686 VanDerWaalsContact O-CG2 3.28Å; A682-V686 WeakPolarHBondContact O-CG2 3.31Å; A682-V686 PolarHBondContact O-N 2.86Å; A682-V686 VanDerWaalsContact O-N 3.09Å; I684-V686 PolarHBondContact O-N 3.04Å; V686-Y689 PolarHBondContact O-N 3.43Å; V686-I690 HydrophobicContact CG1-CD1 3.53Å; V686-I690 HydrophobicContact CG1-CG1 4.19Å; V686-I690 WeakPolarHBondContact O-CB 3.21Å; V686-I690 VanDerWaalsContact O-CG1 3.28Å; V686-I690 WeakPolarHBondContact O-CG1 3.19Å; V686-I690 PolarHBondContact O-N 3.03Å
687	T	84.8	Confident	83.7	Confident	6 Å²	6	24.5 Å²	24.5	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-63.3	-50.3	-179.2	-58	0	0	0	0	111.9	A683 I684 F685 Y689 I690 T691 L709	A683-T687 VanDerWaalsContact O-CB 3.29Å; A683-T687 WeakPolarHBondContact O-CB 3.31Å; A683-T687 PolarHBondContact O-N 2.96Å; A683-T687 PolarHBondContact O-OG1 2.9Å; I684-T687 PolarHBondContact O-N 3.21Å; F685-T687 VanDerWaalsContact C-N 3.33Å; F685-T687 PolarHBondContact O-N 3.27Å; T687-Y689 VanDerWaalsContact C-N 3.27Å; T687-Y689 PolarHBondContact O-N 2.66Å; T687-I690 PolarHBondContact O-N 3.37Å; T687-T691 VanDerWaalsContact O-CB 3.29Å; T687-T691 WeakPolarHBondContact O-CB 3.36Å; T687-T691 PolarHBondContact O-N 3.41Å; T687-T691 PolarHBondContact O-OG1 2.91Å; T687-L709 HydrophobicContact CG2-CB 3.62Å; T687-L709 HydrophobicContact CG2-CD1 3.56Å; T687-L709 HydrophobicContact CG2-CG 4.19Å
688	V	84.7	Confident	81.9	Confident	48 Å²	48	33.8 Å²	33.8	29%	0.291	17%	0.165	S	C	.	.	H	α-helix	trans	-61.8	-40.8	179.6	169.8	0	0	0	0	110.4	I684 F685 T691 S692 C749 L753	I684-V688 HydrophobicContact CG2-CG2 4.12Å; I684-V688 WeakPolarHBondContact O-CB 3.29Å; I684-V688 VanDerWaalsContact O-CG2 3.28Å; I684-V688 WeakPolarHBondContact O-CG2 3.39Å; I684-V688 PolarHBondContact O-N 3.21Å; F685-V688 PolarHBondContact O-N 3.17Å; V688-T691 PolarHBondContact O-N 3.03Å; V688-S692 WeakPolarHBondContact O-CB 3.24Å; V688-S692 PolarHBondContact O-N 3.17Å; V688-C749 HydrophobicContact CB-CB 4.47Å; V688-C749 HydrophobicContact CG1-CB 3.79Å; V688-L753 HydrophobicContact CG1-CD1 3.62Å
689	Y	84.6	Confident	80.3	Confident	5 Å²	5	41.9 Å²	41.9	2%	0.02	21%	0.209	C	C	.	.	H	α-helix	trans	-66.1	-49.8	177.9	172.4	-103.7	0	0	0	112.6	I512 S515 E516 L549 F685 V686 T687 T691 S692 L693	I512-Y689 HydrophobicContact CB-CE1 4.34Å; I512-Y689 HydrophobicContact CG1-CD1 4.08Å; I512-Y689 HydrophobicContact CG1-CE1 4.08Å; I512-Y689 HydrophobicContact CG2-CE1 4.01Å; S515-Y689 WeakPolarHBondContact OG-CE1 3.36Å; E516-Y689 WeakPolarHBondContact CG-OH 3.34Å; E516-Y689 PolarHBondContact OE1-OH 2.99Å; L549-Y689 HydrophobicContact CD1-CE2 3.53Å; L549-Y689 VanDerWaalsContact CD1-CZ 3.48Å; L549-Y689 WeakPolarHBondContact CD1-OH 3.38Å; L549-Y689 HydrophobicContact CD2-CD2 3.78Å; L549-Y689 HydrophobicContact CD2-CE2 3.36Å; L549-Y689 HydrophobicContact CG-CE2 4.08Å; F685-Y689 WeakPolarHBondContact O-CB 3.33Å; F685-Y689 PolarHBondContact O-N 3.23Å; V686-Y689 PolarHBondContact O-N 3.43Å; T687-Y689 VanDerWaalsContact C-N 3.27Å; T687-Y689 PolarHBondContact O-N 2.66Å; Y689-T691 VanDerWaalsContact C-N 3.28Å; Y689-T691 PolarHBondContact O-N 3.28Å; Y689-S692 WeakPolarHBondContact O-CA 3.06Å; Y689-S692 WeakPolarHBondContact O-CB 3.17Å; Y689-S692 PolarHBondContact O-N 2.99Å; Y689-S692 PolarHBondContact O-OG 2.7Å; Y689-L693 HydrophobicContact CD1-CD1 4.26Å; Y689-L693 HydrophobicContact CE1-CD1 3.57Å; Y689-L693 HydrophobicContact CE1-CG 4.26Å; Y689-L693 HydrophobicContact CE2-CD1 4.4Å; Y689-L693 HydrophobicContact CE2-CD2 4.34Å; Y689-L693 HydrophobicContact CE2-CG 4.27Å; Y689-L693 PolarHBondContact O-N 3.05Å
690	I	81.1	Confident	78.5	Confident	26 Å²	26	43.5 Å²	43.5	13%	0.133	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-42.7	175.4	-69	173.4	0	0	0	110.2	V686 T687 S692 L693 L694	V686-I690 HydrophobicContact CG1-CD1 3.53Å; V686-I690 HydrophobicContact CG1-CG1 4.19Å; V686-I690 WeakPolarHBondContact O-CB 3.21Å; V686-I690 VanDerWaalsContact O-CG1 3.28Å; V686-I690 WeakPolarHBondContact O-CG1 3.19Å; V686-I690 PolarHBondContact O-N 3.03Å; T687-I690 PolarHBondContact O-N 3.37Å; I690-S692 VanDerWaalsContact C-N 3.27Å; I690-S692 PolarHBondContact O-N 2.95Å; I690-L693 WeakPolarHBondContact O-CB 3.17Å; I690-L693 PolarHBondContact O-N 3.4Å; I690-L693 VanDerWaalsContact O-N 3.13Å; I690-L694 HydrophobicContact CG2-CD1 3.9Å; I690-L694 HydrophobicContact CG2-CG 4.31Å; I690-L694 WeakPolarHBondContact O-CG 3.45Å; I690-L694 PolarHBondContact O-N 3.27Å
691	T	79.8	Confident	76.9	Confident	53 Å²	53	46.8 Å²	46.8	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-40.5	175.5	-56.1	0	0	0	0	111.5	T687 V688 Y689 L693 L694 K695 P705	T687-T691 VanDerWaalsContact O-CB 3.29Å; T687-T691 WeakPolarHBondContact O-CB 3.36Å; T687-T691 PolarHBondContact O-N 3.41Å; T687-T691 PolarHBondContact O-OG1 2.91Å; V688-T691 PolarHBondContact O-N 3.03Å; Y689-T691 VanDerWaalsContact C-N 3.28Å; Y689-T691 PolarHBondContact O-N 3.28Å; T691-L693 VanDerWaalsContact C-N 3.34Å; T691-L693 PolarHBondContact O-N 3.19Å; T691-L694 PolarHBondContact O-N 2.86Å; T691-K695 PolarHBondContact O-N 3.37Å; T691-P705 HydrophobicContact CG2-CB 3.8Å; T691-P705 HydrophobicContact CG2-CG 4.39Å; T691-P705 VanDerWaalsContact OG1-CB 3.22Å; T691-P705 WeakPolarHBondContact OG1-CB 3.42Å
692	S	77.7	Confident	75.4	Confident	20 Å²	20	54.1 Å²	54.1	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-67	-33.2	177.2	80.7	0	0	0	0	113.3	V688 Y689 I690 L753	V688-S692 WeakPolarHBondContact O-CB 3.24Å; V688-S692 PolarHBondContact O-N 3.17Å; Y689-S692 WeakPolarHBondContact O-CA 3.06Å; Y689-S692 WeakPolarHBondContact O-CB 3.17Å; Y689-S692 PolarHBondContact O-N 2.99Å; Y689-S692 PolarHBondContact O-OG 2.7Å; I690-S692 VanDerWaalsContact C-N 3.27Å; I690-S692 PolarHBondContact O-N 2.95Å; S692-L753 WeakPolarHBondContact OG-CD2 3.18Å
693	L	77.8	Confident	74	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-41.4	173.3	-68.1	174.9	0	0	0	111	Y689 I690 T691 K695	Y689-L693 HydrophobicContact CD1-CD1 4.26Å; Y689-L693 HydrophobicContact CE1-CD1 3.57Å; Y689-L693 HydrophobicContact CE1-CG 4.26Å; Y689-L693 HydrophobicContact CE2-CD1 4.4Å; Y689-L693 HydrophobicContact CE2-CD2 4.34Å; Y689-L693 HydrophobicContact CE2-CG 4.27Å; Y689-L693 PolarHBondContact O-N 3.05Å; I690-L693 WeakPolarHBondContact O-CB 3.17Å; I690-L693 PolarHBondContact O-N 3.4Å; I690-L693 VanDerWaalsContact O-N 3.13Å; T691-L693 VanDerWaalsContact C-N 3.34Å; T691-L693 PolarHBondContact O-N 3.19Å; L693-K695 VanDerWaalsContact C-N 3.31Å; L693-K695 PolarHBondContact O-N 3.49Å
694	L	72.1	Confident	72.9	Confident	37 Å²	37	58.3 Å²	58.3	19%	0.194	31%	0.308	C	S	.	.	H	α-helix	trans	-76.2	-16.2	-178.3	-64.4	176.9	0	0	0	113.8	I690 T691 N696 F697 I704	I690-L694 HydrophobicContact CG2-CD1 3.9Å; I690-L694 HydrophobicContact CG2-CG 4.31Å; I690-L694 WeakPolarHBondContact O-CG 3.45Å; I690-L694 PolarHBondContact O-N 3.27Å; T691-L694 PolarHBondContact O-N 2.86Å; L694-N696 PolarHBondContact O-N 3.33Å; L694-N696 VanDerWaalsContact O-N 3.09Å; L694-F697 HydrophobicContact CD2-CD2 4.01Å; L694-F697 CarbonylContact O-C 3.39Å; L694-F697 WeakPolarHBondContact O-CA 3.21Å; L694-F697 WeakPolarHBondContact O-CB 3.47Å; L694-F697 PolarHBondContact O-N 3Å; L694-I704 HydrophobicContact CD1-CB 4.21Å; L694-I704 HydrophobicContact CD1-CG2 3.42Å; L694-I704 VanDerWaalsContact CD1-CG2 3.42Å
695	K	69.8	Low	71.6	Confident	99 Å²	99	58.2 Å²	58.2	43%	0.43	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-54.8	-29.3	175.7	-173.9	-179.5	174.6	-171.7	0	112.7	T691 L693 F697 R698	T691-K695 PolarHBondContact O-N 3.37Å; L693-K695 VanDerWaalsContact C-N 3.31Å; L693-K695 PolarHBondContact O-N 3.49Å; K695-F697 VanDerWaalsContact C-N 3.25Å; K695-F697 PolarHBondContact O-N 3.23Å; K695-R698 WeakPolarHBondContact O-CB 3.25Å; K695-R698 WeakPolarHBondContact O-CG 3.45Å; K695-R698 PolarHBondContact O-N 3.27Å
696	N	63.6	Low	70.4	Confident	114 Å²	114	63.9 Å²	63.9	61%	0.61	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-71.2	-21.5	175.5	-76.4	41.2	0	0	0	112.9	L694 R698	L694-N696 PolarHBondContact O-N 3.33Å; L694-N696 VanDerWaalsContact O-N 3.09Å; N696-R698 VanDerWaalsContact C-N 3.34Å
697	F	64.2	Low	69.3	Low	45 Å²	45	69.2 Å²	69.2	20%	0.197	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-101.1	38.1	176.2	-54.6	-61.4	0	0	0	111.1	F519 F522 L694 K695 D699 A700	F519-F697 HydrophobicContact CD2-CE2 4.13Å; F519-F697 HydrophobicContact CD2-CZ 4.21Å; F519-F697 HydrophobicContact CE2-CE2 4.14Å; F519-F697 HydrophobicContact CE2-CZ 4.07Å; F522-F697 AromaticContact CD1-CE1 3.68Å; F522-F697 HydrophobicContact CD1-CE1 3.68Å; F522-F697 AromaticContact CD1-CZ 3.58Å; F522-F697 HydrophobicContact CD1-CZ 3.58Å; F522-F697 HydrophobicContact CD2-CZ 4.48Å; F522-F697 HydrophobicContact CE1-CD1 4.3Å; F522-F697 AromaticContact CE1-CE1 3.21Å; F522-F697 HydrophobicContact CE1-CE1 3.21Å; F522-F697 AromaticContact CE1-CZ 3.65Å; F522-F697 HydrophobicContact CE1-CZ 3.65Å; F522-F697 HydrophobicContact CE2-CE1 4.17Å; F522-F697 HydrophobicContact CE2-CZ 4.49Å; F522-F697 HydrophobicContact CG-CE1 4.37Å; F522-F697 HydrophobicContact CG-CZ 4.04Å; F522-F697 HydrophobicContact CZ-CD1 4.2Å; F522-F697 AromaticContact CZ-CE1 3.46Å; F522-F697 HydrophobicContact CZ-CE1 3.46Å; F522-F697 VanDerWaalsContact CZ-CE1 3.46Å; F522-F697 HydrophobicContact CZ-CZ 4.1Å; L694-F697 HydrophobicContact CD2-CD2 4.01Å; L694-F697 CarbonylContact O-C 3.39Å; L694-F697 WeakPolarHBondContact O-CA 3.21Å; L694-F697 WeakPolarHBondContact O-CB 3.47Å; L694-F697 PolarHBondContact O-N 3Å; K695-F697 VanDerWaalsContact C-N 3.25Å; K695-F697 PolarHBondContact O-N 3.23Å; F697-D699 PolarHBondContact O-N 3.39Å; F697-A700 WeakPolarHBondContact O-CB 3.42Å; F697-A700 PolarHBondContact O-N 3.39Å
698	R	55.7	Low	68.6	Low	194 Å²	194	70.2 Å²	70.2	73%	0.732	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-13	-171.3	-120.4	167.9	173.3	169.6	-7.1	115.4	K695 N696	K695-R698 WeakPolarHBondContact O-CB 3.25Å; K695-R698 WeakPolarHBondContact O-CG 3.45Å; K695-R698 PolarHBondContact O-N 3.27Å; N696-R698 VanDerWaalsContact C-N 3.34Å
699	D	59	Low	67.8	Low	171 Å²	171	71.1 Å²	71.1	91%	0.914	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.8	175.2	-55.3	-29.5	0	0	0	113.6	F697	F697-D699 PolarHBondContact O-N 3.39Å
700	A	55.2	Low	67.2	Low	40 Å²	40	75.1 Å²	75.1	33%	0.331	39%	0.393	S	S	.	.	S	Bend	trans	-95.9	118.4	175.3	0	0	0	0	0	111	F697 L702 I704	F697-A700 WeakPolarHBondContact O-CB 3.42Å; F697-A700 PolarHBondContact O-N 3.39Å; A700-L702 PolarHBondContact O-N 2.84Å; A700-I704 HydrophobicContact CB-CD1 4.36Å
701	C	58.6	Low	66.8	Low	77 Å²	77	75.4 Å²	75.4	52%	0.52	40%	0.403	S	S	.	.			trans	-2.2	112.9	169.9	-142.3	0	0	0	0	115.3	C703 I704	C701-C703 HydrophobicContact CB-CB 3.75Å; C701-C703 WeakPolarHBondContact CB-SG 3.28Å; C701-C703 PolarHBondContact O-N 3.47Å; C701-C703 WeakPolarHBondContact SG-CB 3.41Å; C701-C703 CovalentContact SG-SG 2.06Å; C701-C703 PolarHBondContact SG-SG 3.45Å; C701-I704 PolarHBondContact O-N 3.16Å; C701-I704 VanDerWaalsContact O-N 3.1Å
702	L	61.4	Low	66.5	Low	155 Å²	155	74.6 Å²	74.6	81%	0.812	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-14.1	165.2	-79	159.7	0	0	0	114.2	A700 I704 P705 F706	A700-L702 PolarHBondContact O-N 2.84Å; L702-I704 PolarHBondContact O-N 3.02Å; L702-P705 VanDerWaalsContact O-CD 3.26Å; L702-P705 WeakPolarHBondContact O-CD 3.43Å; L702-P705 WeakPolarHBondContact O-CG 3.31Å; L702-F706 PolarHBondContact O-N 3.47Å
703	C	65.2	Low	66.3	Low	57 Å²	57	75 Å²	75	39%	0.385	40%	0.401	S	S	.	.	H	α-helix	trans	-53.2	-37.3	173.7	-39.8	0	0	0	0	112.3	C701 F706 L707	C701-C703 HydrophobicContact CB-CB 3.75Å; C701-C703 WeakPolarHBondContact CB-SG 3.28Å; C701-C703 PolarHBondContact O-N 3.47Å; C701-C703 WeakPolarHBondContact SG-CB 3.41Å; C701-C703 CovalentContact SG-SG 2.06Å; C701-C703 PolarHBondContact SG-SG 3.45Å; C703-F706 PolarHBondContact O-N 3Å; C703-L707 VanDerWaalsContact O-CB 3.31Å; C703-L707 WeakPolarHBondContact O-CB 3.24Å; C703-L707 WeakPolarHBondContact O-CG 3.27Å; C703-L707 PolarHBondContact O-N 2.73Å
704	I	65.5	Low	66.4	Low	39 Å²	39	79.4 Å²	79.4	20%	0.2	42%	0.423	C	S	.	.	H	α-helix	trans	-69.3	-54	-173.7	-61.8	151	0	0	0	113.1	F262 L694 A700 C701 L702 F706 L707 S708	F262-I704 HydrophobicContact CD1-CG2 4.47Å; F262-I704 HydrophobicContact CE1-CB 4.49Å; F262-I704 HydrophobicContact CE1-CD1 3.86Å; F262-I704 HydrophobicContact CE1-CG1 4.06Å; F262-I704 HydrophobicContact CE1-CG2 3.61Å; F262-I704 HydrophobicContact CE2-CD1 3.87Å; F262-I704 HydrophobicContact CZ-CD1 3.29Å; F262-I704 HydrophobicContact CZ-CG1 3.99Å; F262-I704 HydrophobicContact CZ-CG2 4.18Å; L694-I704 HydrophobicContact CD1-CB 4.21Å; L694-I704 HydrophobicContact CD1-CG2 3.42Å; L694-I704 VanDerWaalsContact CD1-CG2 3.42Å; A700-I704 HydrophobicContact CB-CD1 4.36Å; C701-I704 PolarHBondContact O-N 3.16Å; C701-I704 VanDerWaalsContact O-N 3.1Å; L702-I704 PolarHBondContact O-N 3.02Å; I704-F706 PolarHBondContact O-N 3.27Å; I704-L707 PolarHBondContact O-N 3.11Å; I704-S708 PolarHBondContact O-N 3.47Å
705	P	63.2	Low	66.9	Low	23 Å²	23	81 Å²	81	15%	0.149	44%	0.435	C	S	.	.	H	α-helix	trans	-65.6	-27.3	176	26	-35.6	0	0	0	112.5	T691 L702 S708 L709	T691-P705 HydrophobicContact CG2-CB 3.8Å; T691-P705 HydrophobicContact CG2-CG 4.39Å; T691-P705 VanDerWaalsContact OG1-CB 3.22Å; T691-P705 WeakPolarHBondContact OG1-CB 3.42Å; L702-P705 VanDerWaalsContact O-CD 3.26Å; L702-P705 WeakPolarHBondContact O-CD 3.43Å; L702-P705 WeakPolarHBondContact O-CG 3.31Å; P705-S708 WeakPolarHBondContact CA-OG 3.33Å; P705-S708 PolarHBondContact O-OG 3.44Å; P705-L709 VanDerWaalsContact O-CB 3.31Å; P705-L709 WeakPolarHBondContact O-CB 3.37Å; P705-L709 PolarHBondContact O-N 2.74Å
706	F	65.4	Low	67.3	Low	122 Å²	122	76.4 Å²	76.4	54%	0.535	42%	0.415	S	S	.	.	H	α-helix	trans	-71.5	-41.3	175.8	-168.3	-106.6	0	0	0	111.9	L702 C703 I704 L709 L710	L702-F706 PolarHBondContact O-N 3.47Å; C703-F706 PolarHBondContact O-N 3Å; I704-F706 PolarHBondContact O-N 3.27Å; F706-L709 PolarHBondContact O-N 3.48Å; F706-L710 HydrophobicContact CD1-CD1 3.64Å; F706-L710 HydrophobicContact CD1-CG 4.24Å; F706-L710 HydrophobicContact CE1-CD1 3.32Å; F706-L710 HydrophobicContact CE1-CG 4.03Å; F706-L710 HydrophobicContact CZ-CD1 3.98Å; F706-L710 HydrophobicContact CZ-CD2 4.46Å; F706-L710 HydrophobicContact CZ-CG 4.29Å; F706-L710 WeakPolarHBondContact O-CB 3.31Å; F706-L710 VanDerWaalsContact O-CG 3.3Å; F706-L710 WeakPolarHBondContact O-CG 3.37Å; F706-L710 PolarHBondContact O-N 3.44Å
707	L	67	Low	68.1	Low	115 Å²	115	73.9 Å²	73.9	60%	0.602	40%	0.401	S	S	*	.	H	α-helix	trans	-67	-36.6	174.7	-73	170.2	0	0	0	111.9	C703 I704 L710 G711	C703-L707 VanDerWaalsContact O-CB 3.31Å; C703-L707 WeakPolarHBondContact O-CB 3.24Å; C703-L707 WeakPolarHBondContact O-CG 3.27Å; C703-L707 PolarHBondContact O-N 2.73Å; I704-L707 PolarHBondContact O-N 3.11Å; L707-L710 PolarHBondContact O-N 3.4Å; L707-G711 PolarHBondContact O-N 2.98Å
708	S	69	Low	69	Low	26 Å²	26	75.8 Å²	75.8	18%	0.182	41%	0.413	C	S	.	.	H	α-helix	trans	-69.3	-40.1	174.3	71.8	0	0	0	0	112.2	I704 P705 V712	I704-S708 PolarHBondContact O-N 3.47Å; P705-S708 WeakPolarHBondContact CA-OG 3.33Å; P705-S708 PolarHBondContact O-OG 3.44Å; S708-V712 WeakPolarHBondContact O-CG2 3.24Å; S708-V712 PolarHBondContact O-N 2.74Å
709	L	67.7	Low	70.2	Confident	68 Å²	68	67.7 Å²	67.7	36%	0.356	38%	0.384	S	S	.	.	H	α-helix	trans	-58.1	-50.4	171.7	-173.7	76.8	0	0	0	110.7	I684 T687 P705 F706 S713	I684-L709 HydrophobicContact CD1-CD1 4.46Å; T687-L709 HydrophobicContact CG2-CB 3.62Å; T687-L709 HydrophobicContact CG2-CD1 3.56Å; T687-L709 HydrophobicContact CG2-CG 4.19Å; P705-L709 VanDerWaalsContact O-CB 3.31Å; P705-L709 WeakPolarHBondContact O-CB 3.37Å; P705-L709 PolarHBondContact O-N 2.74Å; F706-L709 PolarHBondContact O-N 3.48Å; L709-S713 WeakPolarHBondContact O-CB 3.36Å; L709-S713 PolarHBondContact O-N 3.13Å
710	L	71.3	Confident	71	Confident	88 Å²	88	59.5 Å²	59.5	46%	0.461	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-45.6	-178.9	-75	178.3	0	0	0	111.6	F706 L707 L714	F706-L710 HydrophobicContact CD1-CD1 3.64Å; F706-L710 HydrophobicContact CD1-CG 4.24Å; F706-L710 HydrophobicContact CE1-CD1 3.32Å; F706-L710 HydrophobicContact CE1-CG 4.03Å; F706-L710 HydrophobicContact CZ-CD1 3.98Å; F706-L710 HydrophobicContact CZ-CD2 4.46Å; F706-L710 HydrophobicContact CZ-CG 4.29Å; F706-L710 WeakPolarHBondContact O-CB 3.31Å; F706-L710 VanDerWaalsContact O-CG 3.3Å; F706-L710 WeakPolarHBondContact O-CG 3.37Å; F706-L710 PolarHBondContact O-N 3.44Å; L707-L710 PolarHBondContact O-N 3.4Å; L710-L714 WeakPolarHBondContact O-CB 3.06Å; L710-L714 PolarHBondContact O-N 3.3Å
711	G	72.9	Confident	72	Confident	33 Å²	33	60.7 Å²	60.7	34%	0.34	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-52.2	-177.4	0	0	0	0	0	112.7	L707 L714 V715	L707-G711 PolarHBondContact O-N 2.98Å; G711-L714 PolarHBondContact O-N 3.37Å; G711-V715 WeakPolarHBondContact O-CG2 3.27Å; G711-V715 PolarHBondContact O-N 2.95Å; G711-V715 VanDerWaalsContact O-N 3.15Å
712	V	74.4	Confident	72.9	Confident	36 Å²	36	59 Å²	59	22%	0.218	33%	0.329	C	S	.	.	H	α-helix	trans	-74.6	-34.1	-176.2	-168.5	0	0	0	0	111.3	A683 S708 V715 A716	A683-V712 HydrophobicContact CB-CB 4.28Å; A683-V712 HydrophobicContact CB-CG1 3.61Å; S708-V712 WeakPolarHBondContact O-CG2 3.24Å; S708-V712 PolarHBondContact O-N 2.74Å; V712-V715 PolarHBondContact O-N 3.44Å; V712-A716 PolarHBondContact O-N 2.98Å; V712-A716 VanDerWaalsContact O-N 3.15Å
713	S	73.4	Confident	73.6	Confident	29 Å²	29	52 Å²	52	20%	0.203	29%	0.292	C	S	.	.	H	α-helix	trans	-65	-43.2	171.7	-172.7	0	0	0	0	111.3	L709 V715 A716 L717	L709-S713 WeakPolarHBondContact O-CB 3.36Å; L709-S713 PolarHBondContact O-N 3.13Å; S713-V715 VanDerWaalsContact C-N 3.31Å; S713-V715 PolarHBondContact O-N 3.42Å; S713-A716 CarbonylContact O-C 3.5Å; S713-A716 WeakPolarHBondContact O-CA 3.39Å; S713-A716 WeakPolarHBondContact O-CB 3.5Å; S713-A716 PolarHBondContact O-N 3.23Å; S713-L717 VanDerWaalsContact O-CG 3.31Å; S713-L717 WeakPolarHBondContact O-CG 3.28Å; S713-L717 PolarHBondContact O-N 3.47Å
714	L	80.9	Confident	73.8	Confident	99 Å²	99	50.7 Å²	50.7	52%	0.518	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-39.8	177.9	-174.4	67.9	0	0	0	112	L710 G711 L717 I718	L710-L714 WeakPolarHBondContact O-CB 3.06Å; L710-L714 PolarHBondContact O-N 3.3Å; G711-L714 PolarHBondContact O-N 3.37Å; L714-L717 WeakPolarHBondContact O-CB 3.48Å; L714-L717 PolarHBondContact O-N 2.77Å; L714-I718 HydrophobicContact CG-CD1 4.06Å; L714-I718 VanDerWaalsContact O-CG1 3.25Å; L714-I718 WeakPolarHBondContact O-CG1 3.12Å; L714-I718 PolarHBondContact O-N 2.99Å
715	V	81.2	Confident	73.7	Confident	71 Å²	71	51 Å²	51	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-45.1	173.5	175	0	0	0	0	111	G711 V712 S713 L717 I718 L719	G711-V715 WeakPolarHBondContact O-CG2 3.27Å; G711-V715 PolarHBondContact O-N 2.95Å; G711-V715 VanDerWaalsContact O-N 3.15Å; V712-V715 PolarHBondContact O-N 3.44Å; S713-V715 VanDerWaalsContact C-N 3.31Å; S713-V715 PolarHBondContact O-N 3.42Å; V715-L717 VanDerWaalsContact C-N 3.31Å; V715-L717 PolarHBondContact O-N 2.89Å; V715-I718 PolarHBondContact O-N 3.38Å; V715-L719 HydrophobicContact CG1-CD1 4.21Å; V715-L719 HydrophobicContact CG1-CG 4.47Å; V715-L719 VanDerWaalsContact O-CG 3.3Å; V715-L719 WeakPolarHBondContact O-CG 3.36Å; V715-L719 PolarHBondContact O-N 3.35Å
716	A	79.3	Confident	73.8	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-36.8	175.8	0	0	0	0	0	112.4	M680 A683 V712 S713 L719 G720	M680-A716 HydrophobicContact CE-CB 4.29Å; A683-A716 HydrophobicContact CB-CB 4.37Å; V712-A716 PolarHBondContact O-N 2.98Å; V712-A716 VanDerWaalsContact O-N 3.15Å; S713-A716 CarbonylContact O-C 3.5Å; S713-A716 WeakPolarHBondContact O-CA 3.39Å; S713-A716 WeakPolarHBondContact O-CB 3.5Å; S713-A716 PolarHBondContact O-N 3.23Å; A716-L719 PolarHBondContact O-N 3.06Å; A716-G720 PolarHBondContact O-N 3.41Å
717	L	79.8	Confident	73.7	Confident	60 Å²	60	51.1 Å²	51.1	31%	0.314	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-49.8	173.5	-68.7	178.1	0	0	0	110.8	S713 L714 V715 L719 G720 V721 W738	S713-L717 VanDerWaalsContact O-CG 3.31Å; S713-L717 WeakPolarHBondContact O-CG 3.28Å; S713-L717 PolarHBondContact O-N 3.47Å; L714-L717 WeakPolarHBondContact O-CB 3.48Å; L714-L717 PolarHBondContact O-N 2.77Å; V715-L717 VanDerWaalsContact C-N 3.31Å; V715-L717 PolarHBondContact O-N 2.89Å; L717-L719 VanDerWaalsContact C-N 3.33Å; L717-L719 PolarHBondContact O-N 2.84Å; L717-G720 CarbonylContact O-C 3.51Å; L717-G720 WeakPolarHBondContact O-CA 3.45Å; L717-G720 PolarHBondContact O-N 3.43Å; L717-G720 VanDerWaalsContact O-N 3.09Å; L717-V721 WeakPolarHBondContact O-CG2 3.39Å; L717-V721 PolarHBondContact O-N 3.29Å; L717-W738 HydrophobicContact CD2-CE3 4.16Å; L717-W738 HydrophobicContact CD2-CH2 3.12Å; L717-W738 HydrophobicContact CD2-CZ2 3.52Å; L717-W738 HydrophobicContact CD2-CZ3 3.46Å; L717-W738 VanDerWaalsContact CD2-CZ3 3.46Å; L717-W738 HydrophobicContact CG-CH2 4.39Å
718	I	82.5	Confident	73.8	Confident	85 Å²	85	46.1 Å²	46.1	44%	0.436	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-44.3	178.3	-68.4	163.7	0	0	0	110.6	L714 V715 G720 V721 N722	L714-I718 HydrophobicContact CG-CD1 4.06Å; L714-I718 VanDerWaalsContact O-CG1 3.25Å; L714-I718 WeakPolarHBondContact O-CG1 3.12Å; L714-I718 PolarHBondContact O-N 2.99Å; V715-I718 PolarHBondContact O-N 3.38Å; I718-G720 VanDerWaalsContact C-N 3.3Å; I718-G720 PolarHBondContact O-N 3.34Å; I718-V721 PolarHBondContact O-N 3.37Å; I718-N722 VanDerWaalsContact O-CB 3.32Å; I718-N722 WeakPolarHBondContact O-CB 3.43Å; I718-N722 PolarHBondContact O-N 2.93Å; I718-N722 PolarHBondContact O-ND2 2.96Å
719	L	81.8	Confident	74.2	Confident	24 Å²	24	45 Å²	45	13%	0.126	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-38.6	175.6	-70.2	175.3	0	0	0	111.9	I495 V715 A716 L717 R723	I495-L719 HydrophobicContact CD1-CD2 3.93Å; V715-L719 HydrophobicContact CG1-CD1 4.21Å; V715-L719 HydrophobicContact CG1-CG 4.47Å; V715-L719 VanDerWaalsContact O-CG 3.3Å; V715-L719 WeakPolarHBondContact O-CG 3.36Å; V715-L719 PolarHBondContact O-N 3.35Å; A716-L719 PolarHBondContact O-N 3.06Å; L717-L719 VanDerWaalsContact C-N 3.33Å; L717-L719 PolarHBondContact O-N 2.84Å; L719-R723 WeakPolarHBondContact O-CG 3.46Å; L719-R723 PolarHBondContact O-N 3.14Å
720	G	76.1	Confident	74.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-52.3	173.6	0	0	0	0	0	112.3	A716 L717 I718 N722 R723 V724 I734	A716-G720 PolarHBondContact O-N 3.41Å; L717-G720 CarbonylContact O-C 3.51Å; L717-G720 WeakPolarHBondContact O-CA 3.45Å; L717-G720 PolarHBondContact O-N 3.43Å; L717-G720 VanDerWaalsContact O-N 3.09Å; I718-G720 VanDerWaalsContact C-N 3.3Å; I718-G720 PolarHBondContact O-N 3.34Å; G720-N722 VanDerWaalsContact C-N 3.31Å; G720-N722 PolarHBondContact O-N 2.91Å; G720-R723 WeakPolarHBondContact O-CB 3.41Å; G720-R723 PolarHBondContact O-N 3.02Å; G720-V724 PolarHBondContact O-N 2.72Å; G720-I734 VanDerWaalsContact O-CD1 3.22Å; G720-I734 WeakPolarHBondContact O-CD1 3.39Å
721	V	74.8	Confident	74.9	Confident	64 Å²	64	45.1 Å²	45.1	39%	0.388	24%	0.236	S	C	.	.	H	α-helix	trans	-59.1	-41.8	179.8	171.5	0	0	0	0	111.2	L717 I718 R723 V724 I725	L717-V721 WeakPolarHBondContact O-CG2 3.39Å; L717-V721 PolarHBondContact O-N 3.29Å; I718-V721 PolarHBondContact O-N 3.37Å; V721-R723 PolarHBondContact O-N 2.87Å; V721-V724 WeakPolarHBondContact O-CA 3.33Å; V721-V724 WeakPolarHBondContact O-CB 3.49Å; V721-V724 PolarHBondContact O-N 2.74Å; V721-I725 HydrophobicContact CG1-CD1 3.73Å; V721-I725 HydrophobicContact CG1-CG1 4.2Å; V721-I725 WeakPolarHBondContact O-CG1 3.31Å; V721-I725 PolarHBondContact O-N 3.21Å
722	N	77.7	Confident	75.3	Confident	42 Å²	42	47.4 Å²	47.4	23%	0.225	24%	0.238	C	C	.	.	H	α-helix	trans	-55.4	-37.4	174.7	-77.3	-16.9	0	0	0	111.7	I718 G720 V724 I725 Y726	I718-N722 VanDerWaalsContact O-CB 3.32Å; I718-N722 WeakPolarHBondContact O-CB 3.43Å; I718-N722 PolarHBondContact O-N 2.93Å; I718-N722 PolarHBondContact O-ND2 2.96Å; G720-N722 VanDerWaalsContact C-N 3.31Å; G720-N722 PolarHBondContact O-N 2.91Å; N722-V724 VanDerWaalsContact C-N 3.35Å; N722-V724 PolarHBondContact O-N 3.41Å; N722-I725 PolarHBondContact O-N 3.13Å; N722-Y726 HydrophobicContact CB-CD2 4.42Å; N722-Y726 HydrophobicContact CB-CE2 4.4Å; N722-Y726 WeakPolarHBondContact O-CD2 3.36Å; N722-Y726 PolarHBondContact O-N 2.92Å
723	R	76.9	Confident	75.8	Confident	8 Å²	8	45.7 Å²	45.7	3%	0.03	23%	0.227	C	C	.	.	H	α-helix	trans	-71.1	-28.9	178.1	-64.6	-179.5	74.9	119.3	9.1	113.3	I497 L719 G720 V721 R727 N728 N729 I734	I497-R723 VanDerWaalsContact CD1-NH2 3.26Å; L719-R723 WeakPolarHBondContact O-CG 3.46Å; L719-R723 PolarHBondContact O-N 3.14Å; G720-R723 WeakPolarHBondContact O-CB 3.41Å; G720-R723 PolarHBondContact O-N 3.02Å; V721-R723 PolarHBondContact O-N 2.87Å; R723-R727 PolarHBondContact O-N 3.18Å; R723-N728 HydrophobicContact CB-CB 4.36Å; R723-N728 PolarHBondContact O-N 2.69Å; R723-N729 HydrophobicContact CB-CB 4.44Å; R723-N729 VanDerWaalsContact CZ-OD1 3.26Å; R723-N729 PolarHBondContact NE-OD1 3.38Å; R723-N729 PolarHBondContact NH2-OD1 2.04Å; R723-N729 PolarHBondContact O-N 3.27Å; R723-I734 HydrophobicContact CB-CD1 4.26Å
724	V	68.2	Low	76.5	Confident	30 Å²	30	44.4 Å²	44.4	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-67.3	-50.6	169.2	-172.7	0	0	0	0	109.7	G720 V721 N722 Y726 R727 F731 I734	G720-V724 PolarHBondContact O-N 2.72Å; V721-V724 WeakPolarHBondContact O-CA 3.33Å; V721-V724 WeakPolarHBondContact O-CB 3.49Å; V721-V724 PolarHBondContact O-N 2.74Å; N722-V724 VanDerWaalsContact C-N 3.35Å; N722-V724 PolarHBondContact O-N 3.41Å; V724-Y726 VanDerWaalsContact C-N 3.29Å; V724-Y726 PolarHBondContact O-N 3.02Å; V724-R727 PolarHBondContact O-N 2.82Å; V724-F731 HydrophobicContact CG2-CD2 4.36Å; V724-I734 HydrophobicContact CB-CD1 4.37Å; V724-I734 HydrophobicContact CG2-CD1 3.15Å
725	I	64.9	Low	76.8	Confident	46 Å²	46	42.3 Å²	42.3	24%	0.236	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-42.5	-176.9	-66	171.4	0	0	0	111	M436 P439 V721 N722 R727	M436-I725 HydrophobicContact CE-CD1 3.64Å; M436-I725 HydrophobicContact CE-CG1 3.86Å; P439-I725 HydrophobicContact CG-CG2 4.3Å; V721-I725 HydrophobicContact CG1-CD1 3.73Å; V721-I725 HydrophobicContact CG1-CG1 4.2Å; V721-I725 WeakPolarHBondContact O-CG1 3.31Å; V721-I725 PolarHBondContact O-N 3.21Å; N722-I725 PolarHBondContact O-N 3.13Å; I725-R727 PolarHBondContact O-N 3.11Å
726	Y	64.5	Low	77.1	Confident	74 Å²	74	39.8 Å²	39.8	29%	0.29	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	12.4	177.7	-67	-64.3	0	0	0	114.2	Y492 N722 V724 N728	Y492-Y726 WeakPolarHBondContact CB-OH 3.49Å; N722-Y726 HydrophobicContact CB-CD2 4.42Å; N722-Y726 HydrophobicContact CB-CE2 4.4Å; N722-Y726 WeakPolarHBondContact O-CD2 3.36Å; N722-Y726 PolarHBondContact O-N 2.92Å; V724-Y726 VanDerWaalsContact C-N 3.29Å; V724-Y726 PolarHBondContact O-N 3.02Å; Y726-N728 PolarHBondContact O-N 3.24Å
727	R	63.2	Low	77.7	Confident	73 Å²	73	39.7 Å²	39.7	28%	0.275	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	23.3	176.8	-67	-179.3	62.2	-156.1	-3.7	114.4	P576 D577 V620 R723 V724 I725	P576-R727 HydrophobicContact CB-CB 4.11Å; P576-R727 WeakPolarHBondContact CB-O 2.9Å; P576-R727 WeakPolarHBondContact CD-O 3.38Å; P576-R727 PolarHBondContact O-NH2 3.19Å; D577-R727 PolarHBondContact N-O 2.99Å; V620-R727 VanDerWaalsContact CG1-CZ 3.48Å; V620-R727 VanDerWaalsContact CG1-NH2 3.3Å; R723-R727 PolarHBondContact O-N 3.18Å; V724-R727 PolarHBondContact O-N 2.82Å; I725-R727 PolarHBondContact O-N 3.11Å
728	N	69.9	Low	78.3	Confident	9 Å²	9	38.5 Å²	38.5	5%	0.048	18%	0.184	C	C	.	.	S	Bend	trans	-77.3	-27.2	178.7	-71.3	-34.5	0	0	0	111.7	H494 R575 R723 Y726	H494-N728 PolarHBondContact NE2-ND2 3.46Å; H494-N728 VanDerWaalsContact NE2-ND2 3.14Å; H494-N728 PolarHBondContact NE2-OD1 2.83Å; R575-N728 VanDerWaalsContact CD-O 3.28Å; R575-N728 WeakPolarHBondContact CD-O 3.38Å; R723-N728 HydrophobicContact CB-CB 4.36Å; R723-N728 PolarHBondContact O-N 2.69Å; Y726-N728 PolarHBondContact O-N 3.24Å
729	N	77	Confident	78.7	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.189	C	C	.	.	S	Bend	trans	-148.7	152.3	-174.8	-76.9	105.5	0	0	0	111	S670 R723 D733 I734	S670-N729 PolarHBondContact O-ND2 2.86Å; R723-N729 HydrophobicContact CB-CB 4.44Å; R723-N729 VanDerWaalsContact CZ-OD1 3.26Å; R723-N729 PolarHBondContact NE-OD1 3.38Å; R723-N729 PolarHBondContact NH2-OD1 2.04Å; R723-N729 PolarHBondContact O-N 3.27Å; N729-D733 HydrophobicContact CB-CB 4.25Å; N729-D733 PolarHBondContact ND2-OD2 2.88Å; N729-I734 HydrophobicContact CB-CD1 4.2Å; N729-I734 HydrophobicContact CB-CG1 4.21Å
730	W	76.3	Confident	79.3	Confident	70 Å²	70	39.6 Å²	39.6	27%	0.265	19%	0.19	S	C	.	.			trans	-72.2	155.4	167	-57.1	95.4	0	0	0	110	L574 P576 E732 D733 I734	L574-W730 PolarHBondContact O-NE1 3.24Å; P576-W730 HydrophobicContact CB-CZ2 4.39Å; P576-W730 HydrophobicContact CG-CD2 3.86Å; P576-W730 HydrophobicContact CG-CE3 4.31Å; P576-W730 HydrophobicContact CG-CG 4.2Å; P576-W730 HydrophobicContact CG-CZ2 4.1Å; W730-E732 VanDerWaalsContact C-N 3.29Å; W730-E732 PolarHBondContact O-N 3.18Å; W730-D733 HydrophobicContact CB-CB 4.49Å; W730-D733 VanDerWaalsContact CD1-OD2 3.3Å; W730-D733 PolarHBondContact N-OD2 3.03Å; W730-D733 WeakPolarHBondContact O-CB 3.46Å; W730-D733 PolarHBondContact O-N 3.05Å; W730-D733 VanDerWaalsContact O-N 3.13Å; W730-I734 PolarHBondContact O-N 3.24Å
731	F	77.8	Confident	80.1	Confident	88 Å²	88	39.6 Å²	39.6	39%	0.386	19%	0.19	S	C	.	.	H	α-helix	trans	-58.4	-43.4	174.9	-179.5	-108.9	0	0	0	111.5	V724 D733 I734 L735	V724-F731 HydrophobicContact CG2-CD2 4.36Å; F731-D733 VanDerWaalsContact C-N 3.28Å; F731-D733 PolarHBondContact O-N 3.45Å; F731-I734 WeakPolarHBondContact O-CB 3.4Å; F731-I734 PolarHBondContact O-N 3.26Å; F731-L735 HydrophobicContact CD1-CD1 3.85Å; F731-L735 HydrophobicContact CD1-CG 4.23Å; F731-L735 HydrophobicContact CE1-CD1 3.37Å; F731-L735 HydrophobicContact CE1-CD2 4.29Å; F731-L735 HydrophobicContact CE1-CG 3.84Å; F731-L735 HydrophobicContact CZ-CD1 3.95Å; F731-L735 HydrophobicContact CZ-CD2 4Å; F731-L735 HydrophobicContact CZ-CG 3.98Å; F731-L735 PolarHBondContact O-N 2.65Å
732	E	80.1	Confident	80.8	Confident	82 Å²	82	39.3 Å²	39.3	38%	0.383	19%	0.185	S	C	.	.	H	α-helix	trans	-57.7	-36.8	174.3	-59.1	-46.6	126.3	0	0	113.4	W730 I734 L735 A736	W730-E732 VanDerWaalsContact C-N 3.29Å; W730-E732 PolarHBondContact O-N 3.18Å; E732-I734 PolarHBondContact O-N 3.39Å; E732-L735 PolarHBondContact O-N 3.31Å; E732-A736 VanDerWaalsContact O-CB 3.31Å; E732-A736 WeakPolarHBondContact O-CB 3.22Å; E732-A736 PolarHBondContact O-N 3.26Å
733	D	86	Confident	81.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-34	176.8	-56.2	-22.7	0	0	0	111.4	S670 F671 S673 N729 W730 F731 G737	S670-D733 VanDerWaalsContact CB-OD2 3.28Å; S670-D733 WeakPolarHBondContact CB-OD2 3.5Å; F671-D733 WeakPolarHBondContact CB-OD1 3.46Å; F671-D733 WeakPolarHBondContact CD2-OD1 3.42Å; S673-D733 WeakPolarHBondContact CB-O 3.3Å; S673-D733 PolarHBondContact N-O 3.06Å; N729-D733 HydrophobicContact CB-CB 4.25Å; N729-D733 PolarHBondContact ND2-OD2 2.88Å; W730-D733 HydrophobicContact CB-CB 4.49Å; W730-D733 VanDerWaalsContact CD1-OD2 3.3Å; W730-D733 PolarHBondContact N-OD2 3.03Å; W730-D733 WeakPolarHBondContact O-CB 3.46Å; W730-D733 PolarHBondContact O-N 3.05Å; W730-D733 VanDerWaalsContact O-N 3.13Å; F731-D733 VanDerWaalsContact C-N 3.28Å; F731-D733 PolarHBondContact O-N 3.45Å; D733-G737 PolarHBondContact O-N 2.95Å
734	I	87.1	Confident	82.2	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-76.9	-44.3	-179.1	-69.3	154.7	0	0	0	110.3	A676 G720 R723 V724 N729 W730 F731 E732 G737 W738	A676-I734 HydrophobicContact CB-CB 4.3Å; A676-I734 HydrophobicContact CB-CG1 4.38Å; A676-I734 HydrophobicContact CB-CG2 3.93Å; G720-I734 VanDerWaalsContact O-CD1 3.22Å; G720-I734 WeakPolarHBondContact O-CD1 3.39Å; R723-I734 HydrophobicContact CB-CD1 4.26Å; V724-I734 HydrophobicContact CB-CD1 4.37Å; V724-I734 HydrophobicContact CG2-CD1 3.15Å; N729-I734 HydrophobicContact CB-CD1 4.2Å; N729-I734 HydrophobicContact CB-CG1 4.21Å; W730-I734 PolarHBondContact O-N 3.24Å; F731-I734 WeakPolarHBondContact O-CB 3.4Å; F731-I734 PolarHBondContact O-N 3.26Å; E732-I734 PolarHBondContact O-N 3.39Å; I734-G737 WeakPolarHBondContact O-CA 3.49Å; I734-G737 PolarHBondContact O-N 3.35Å; I734-W738 HydrophobicContact CG2-CD2 4.09Å; I734-W738 HydrophobicContact CG2-CH2 4.02Å; I734-W738 HydrophobicContact CG2-CZ2 3.57Å; I734-W738 HydrophobicContact CG2-CZ3 4.49Å; I734-W738 PolarHBondContact O-N 3.03Å
735	L	87.1	Confident	83.4	Confident	55 Å²	55	40.1 Å²	40.1	29%	0.288	19%	0.194	S	C	.	.	H	α-helix	trans	-57.5	-49.6	173.4	-72.1	-177.7	0	0	0	111.3	F731 E732 G737 W738 I739	F731-L735 HydrophobicContact CD1-CD1 3.85Å; F731-L735 HydrophobicContact CD1-CG 4.23Å; F731-L735 HydrophobicContact CE1-CD1 3.37Å; F731-L735 HydrophobicContact CE1-CD2 4.29Å; F731-L735 HydrophobicContact CE1-CG 3.84Å; F731-L735 HydrophobicContact CZ-CD1 3.95Å; F731-L735 HydrophobicContact CZ-CD2 4Å; F731-L735 HydrophobicContact CZ-CG 3.98Å; F731-L735 PolarHBondContact O-N 2.65Å; E732-L735 PolarHBondContact O-N 3.31Å; L735-G737 VanDerWaalsContact C-N 3.29Å; L735-G737 PolarHBondContact O-N 3.34Å; L735-W738 HydrophobicContact CD2-CE3 4.09Å; L735-W738 HydrophobicContact CD2-CZ3 4.16Å; L735-W738 PolarHBondContact O-N 3.46Å; L735-I739 WeakPolarHBondContact O-CG1 3.1Å; L735-I739 PolarHBondContact O-N 3.39Å
736	A	89.1	Confident	84.5	Confident	19 Å²	19	42.6 Å²	42.6	16%	0.157	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-41.2	176	0	0	0	0	0	111.8	F671 P672 E732 I739 I740	F671-A736 HydrophobicContact CD2-CB 4.29Å; F671-A736 HydrophobicContact CE2-CB 3.37Å; F671-A736 HydrophobicContact CZ-CB 3.64Å; P672-A736 HydrophobicContact CB-CB 4.01Å; E732-A736 VanDerWaalsContact O-CB 3.31Å; E732-A736 WeakPolarHBondContact O-CB 3.22Å; E732-A736 PolarHBondContact O-N 3.26Å; A736-I739 PolarHBondContact O-N 3.43Å; A736-I740 WeakPolarHBondContact O-CD1 3.27Å; A736-I740 VanDerWaalsContact O-CG1 3.27Å; A736-I740 WeakPolarHBondContact O-CG1 3.35Å; A736-I740 PolarHBondContact O-N 2.78Å
737	G	91.6	Very high	85.6	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-50.8	173.6	0	0	0	0	0	112.4	A677 D733 I734 L735 I739 I740 G741	A677-G737 WeakPolarHBondContact CA-O 3.27Å; A677-G737 VanDerWaalsContact CB-O 3.3Å; A677-G737 WeakPolarHBondContact CB-O 3.35Å; D733-G737 PolarHBondContact O-N 2.95Å; I734-G737 WeakPolarHBondContact O-CA 3.49Å; I734-G737 PolarHBondContact O-N 3.35Å; L735-G737 VanDerWaalsContact C-N 3.29Å; L735-G737 PolarHBondContact O-N 3.34Å; G737-I739 PolarHBondContact O-N 3Å; G737-I740 PolarHBondContact O-N 3.33Å; G737-G741 PolarHBondContact O-N 3.39Å
738	W	91.6	Very high	86.9	Confident	35 Å²	35	43 Å²	43	13%	0.133	21%	0.21	C	C	.	.	H	α-helix	trans	-59.8	-45.3	177.7	-70.5	-16.1	0	0	0	112.6	M680 L717 I734 L735 I740 G741 I742	M680-W738 HydrophobicContact CB-CB 4.41Å; M680-W738 HydrophobicContact CB-CG 4.29Å; M680-W738 HydrophobicContact CE-CB 4.18Å; M680-W738 HydrophobicContact CE-CD2 3.79Å; M680-W738 HydrophobicContact CE-CE3 4.47Å; M680-W738 HydrophobicContact CE-CG 3.62Å; M680-W738 HydrophobicContact CG-CB 4.16Å; M680-W738 HydrophobicContact CG-CG 4.33Å; L717-W738 HydrophobicContact CD2-CE3 4.16Å; L717-W738 HydrophobicContact CD2-CH2 3.12Å; L717-W738 HydrophobicContact CD2-CZ2 3.52Å; L717-W738 HydrophobicContact CD2-CZ3 3.46Å; L717-W738 VanDerWaalsContact CD2-CZ3 3.46Å; L717-W738 HydrophobicContact CG-CH2 4.39Å; I734-W738 HydrophobicContact CG2-CD2 4.09Å; I734-W738 HydrophobicContact CG2-CH2 4.02Å; I734-W738 HydrophobicContact CG2-CZ2 3.57Å; I734-W738 HydrophobicContact CG2-CZ3 4.49Å; I734-W738 PolarHBondContact O-N 3.03Å; L735-W738 HydrophobicContact CD2-CE3 4.09Å; L735-W738 HydrophobicContact CD2-CZ3 4.16Å; L735-W738 PolarHBondContact O-N 3.46Å; W738-I740 VanDerWaalsContact C-N 3.33Å; W738-I740 PolarHBondContact O-N 2.94Å; W738-G741 PolarHBondContact O-N 2.79Å; W738-I742 WeakPolarHBondContact O-CB 3.21Å; W738-I742 WeakPolarHBondContact O-CG1 3.31Å; W738-I742 PolarHBondContact O-N 3.09Å
739	I	91.5	Very high	87.7	Confident	105 Å²	105	42.9 Å²	42.9	54%	0.538	21%	0.21	S	C	.	.	H	α-helix	trans	-57.6	-47.6	177.9	-68.2	166	0	0	0	110.4	L735 A736 G737 G741 I742 C743	L735-I739 WeakPolarHBondContact O-CG1 3.1Å; L735-I739 PolarHBondContact O-N 3.39Å; A736-I739 PolarHBondContact O-N 3.43Å; G737-I739 PolarHBondContact O-N 3Å; I739-G741 PolarHBondContact O-N 3.03Å; I739-I742 PolarHBondContact O-N 3.15Å; I739-C743 WeakPolarHBondContact O-CB 3.34Å; I739-C743 PolarHBondContact O-N 3.22Å; I739-C743 PolarHBondContact O-SG 2.81Å
740	I	93.2	Very high	88	Confident	27 Å²	27	49.1 Å²	49.1	14%	0.138	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-47.5	177.7	-69	164.8	0	0	0	110.9	L563 V564 I567 P672 A736 G737 W738 I742 C743 I744	L563-I740 HydrophobicContact CD2-CG2 3.83Å; V564-I740 HydrophobicContact CG2-CD1 4.5Å; V564-I740 HydrophobicContact CG2-CG2 4.11Å; I567-I740 HydrophobicContact CD1-CD1 3.8Å; P672-I740 HydrophobicContact CB-CD1 3.99Å; P672-I740 HydrophobicContact CG-CD1 3.59Å; A736-I740 WeakPolarHBondContact O-CD1 3.27Å; A736-I740 VanDerWaalsContact O-CG1 3.27Å; A736-I740 WeakPolarHBondContact O-CG1 3.35Å; A736-I740 PolarHBondContact O-N 2.78Å; G737-I740 PolarHBondContact O-N 3.33Å; W738-I740 VanDerWaalsContact C-N 3.33Å; W738-I740 PolarHBondContact O-N 2.94Å; I740-I742 PolarHBondContact O-N 3.29Å; I740-C743 PolarHBondContact O-N 3.45Å; I740-I744 HydrophobicContact CG2-CD1 3.88Å; I740-I744 WeakPolarHBondContact O-CG1 3.32Å; I740-I744 PolarHBondContact O-N 3.23Å; I740-I744 VanDerWaalsContact O-N 3.12Å
741	G	93	Very high	88.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-43.3	178.8	0	0	0	0	0	113	A677 G737 W738 I739 A745	A677-G741 WeakPolarHBondContact O-CA 3.33Å; G737-G741 PolarHBondContact O-N 3.39Å; W738-G741 PolarHBondContact O-N 2.79Å; I739-G741 PolarHBondContact O-N 3.03Å; G741-A745 VanDerWaalsContact O-CB 3.27Å; G741-A745 WeakPolarHBondContact O-CB 3.43Å; G741-A745 PolarHBondContact O-N 2.99Å
742	I	90.8	Very high	88.4	Confident	58 Å²	58	47.7 Å²	47.7	30%	0.297	23%	0.234	S	C	.	.	H	α-helix	trans	-62.9	-50.2	177.3	-68.8	164.4	0	0	0	110.5	M680 I684 W738 I739 I740 I744 A745 I746	M680-I742 HydrophobicContact CG-CD1 4.03Å; M680-I742 HydrophobicContact CG-CG1 3.5Å; M680-I742 HydrophobicContact SD-CD1 4.4Å; M680-I742 HydrophobicContact SD-CG1 4.2Å; I684-I742 HydrophobicContact CG1-CG1 4.1Å; W738-I742 WeakPolarHBondContact O-CB 3.21Å; W738-I742 WeakPolarHBondContact O-CG1 3.31Å; W738-I742 PolarHBondContact O-N 3.09Å; I739-I742 PolarHBondContact O-N 3.15Å; I740-I742 PolarHBondContact O-N 3.29Å; I742-I744 VanDerWaalsContact C-N 3.34Å; I742-I744 PolarHBondContact O-N 3.42Å; I742-A745 PolarHBondContact O-N 3.48Å; I742-I746 HydrophobicContact CG2-CD1 3.58Å; I742-I746 HydrophobicContact CG2-CG1 4.28Å; I742-I746 WeakPolarHBondContact O-CG1 3.45Å; I742-I746 PolarHBondContact O-N 3.06Å
743	C	91.6	Very high	88.3	Confident	76 Å²	76	45.5 Å²	45.5	51%	0.514	23%	0.225	S	C	.	.	H	α-helix	trans	-58.1	-45.7	-178.5	-73.6	0	0	0	0	111.9	I739 I740 Y747	I739-C743 WeakPolarHBondContact O-CB 3.34Å; I739-C743 PolarHBondContact O-N 3.22Å; I739-C743 PolarHBondContact O-SG 2.81Å; I740-C743 PolarHBondContact O-N 3.45Å; C743-Y747 WeakPolarHBondContact O-CB 3.49Å; C743-Y747 PolarHBondContact O-N 3.01Å; C743-Y747 VanDerWaalsContact O-N 3.07Å
744	I	92.9	Very high	87.8	Confident	22 Å²	22	51.7 Å²	51.7	11%	0.113	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-42.7	178.7	-62.4	171	0	0	0	110.8	T560 L563 Y681 I740 I742 I746 Y747 V748	T560-I744 HydrophobicContact CG2-CD1 4.2Å; T560-I744 WeakPolarHBondContact OG1-CD1 3.3Å; T560-I744 WeakPolarHBondContact OG1-CG2 3.47Å; L563-I744 HydrophobicContact CD2-CD1 3.87Å; Y681-I744 HydrophobicContact CD2-CB 4.36Å; Y681-I744 HydrophobicContact CD2-CG2 4.07Å; Y681-I744 HydrophobicContact CE2-CG2 4.02Å; I740-I744 HydrophobicContact CG2-CD1 3.88Å; I740-I744 WeakPolarHBondContact O-CG1 3.32Å; I740-I744 PolarHBondContact O-N 3.23Å; I740-I744 VanDerWaalsContact O-N 3.12Å; I742-I744 VanDerWaalsContact C-N 3.34Å; I742-I744 PolarHBondContact O-N 3.42Å; I744-I746 PolarHBondContact O-N 3.34Å; I744-Y747 PolarHBondContact O-N 3.47Å; I744-V748 HydrophobicContact CG2-CG2 4.14Å; I744-V748 VanDerWaalsContact O-CG2 3.32Å; I744-V748 WeakPolarHBondContact O-CG2 3.48Å; I744-V748 PolarHBondContact O-N 2.82Å
745	A	91.8	Very high	87.3	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.3	-47.8	178.4	0	0	0	0	0	111.6	Y681 I684 G741 I742 Y747 V748 C749	Y681-A745 HydrophobicContact CD2-CB 3.74Å; Y681-A745 HydrophobicContact CE2-CB 4.15Å; I684-A745 HydrophobicContact CB-CB 3.73Å; I684-A745 HydrophobicContact CG2-CB 3.6Å; G741-A745 VanDerWaalsContact O-CB 3.27Å; G741-A745 WeakPolarHBondContact O-CB 3.43Å; G741-A745 PolarHBondContact O-N 2.99Å; I742-A745 PolarHBondContact O-N 3.48Å; A745-Y747 VanDerWaalsContact C-N 3.34Å; A745-Y747 PolarHBondContact O-N 2.91Å; A745-V748 PolarHBondContact O-N 3.21Å; A745-C749 VanDerWaalsContact O-CB 3.23Å; A745-C749 WeakPolarHBondContact O-CB 3.47Å; A745-C749 PolarHBondContact O-N 3.08Å; A745-C749 PolarHBondContact O-SG 2.98Å
746	I	88.1	Confident	86.7	Confident	98 Å²	98	55.6 Å²	55.6	50%	0.503	27%	0.267	S	S	.	.	H	α-helix	trans	-59	-46	176.6	-68.2	171.9	0	0	0	110.6	I742 I744 C749 F750	I742-I746 HydrophobicContact CG2-CD1 3.58Å; I742-I746 HydrophobicContact CG2-CG1 4.28Å; I742-I746 WeakPolarHBondContact O-CG1 3.45Å; I742-I746 PolarHBondContact O-N 3.06Å; I744-I746 PolarHBondContact O-N 3.34Å; I746-C749 PolarHBondContact O-N 2.81Å; I746-F750 VanDerWaalsContact O-CB 3.3Å; I746-F750 WeakPolarHBondContact O-CB 3.25Å; I746-F750 PolarHBondContact O-N 2.89Å
747	Y	88.6	Confident	85.9	Confident	145 Å²	145	58.2 Å²	58.2	57%	0.569	28%	0.278	S	S	*	.	H	α-helix	trans	-59.8	-49.4	179	176	-94.5	0	0	0	112.4	C743 I744 A745 F750 K751	C743-Y747 WeakPolarHBondContact O-CB 3.49Å; C743-Y747 PolarHBondContact O-N 3.01Å; C743-Y747 VanDerWaalsContact O-N 3.07Å; I744-Y747 PolarHBondContact O-N 3.47Å; A745-Y747 VanDerWaalsContact C-N 3.34Å; A745-Y747 PolarHBondContact O-N 2.91Å; Y747-F750 PolarHBondContact O-N 2.96Å; Y747-K751 HydrophobicContact CE1-CG 4.37Å; Y747-K751 WeakPolarHBondContact O-CG 3.16Å; Y747-K751 PolarHBondContact O-N 2.6Å; Y747-K751 VanDerWaalsContact O-N 3.14Å
748	V	90.3	Very high	85.2	Confident	9 Å²	9	63.4 Å²	63.4	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-47	179.8	177.6	0	0	0	0	110.2	F685 I744 A745 F750 K751 V752	F685-V748 HydrophobicContact CD2-CG1 4.33Å; F685-V748 HydrophobicContact CE2-CG1 3.86Å; I744-V748 HydrophobicContact CG2-CG2 4.14Å; I744-V748 VanDerWaalsContact O-CG2 3.32Å; I744-V748 WeakPolarHBondContact O-CG2 3.48Å; I744-V748 PolarHBondContact O-N 2.82Å; A745-V748 PolarHBondContact O-N 3.21Å; V748-F750 PolarHBondContact O-N 2.63Å; V748-K751 PolarHBondContact O-N 2.91Å; V748-V752 HydrophobicContact CG1-CG2 4.2Å; V748-V752 VanDerWaalsContact O-CG2 3.3Å; V748-V752 WeakPolarHBondContact O-CG2 3.22Å; V748-V752 PolarHBondContact O-N 2.98Å
749	C	86.7	Confident	84.3	Confident	7 Å²	7	65.7 Å²	65.7	5%	0.047	32%	0.315	C	S	.	.	H	α-helix	trans	-59.3	-44.2	177.7	-72.9	0	0	0	0	111.9	F685 V688 A745 I746 K751 V752 L753	F685-C749 VanDerWaalsContact CD2-SG 3.52Å; V688-C749 HydrophobicContact CB-CB 4.47Å; V688-C749 HydrophobicContact CG1-CB 3.79Å; A745-C749 VanDerWaalsContact O-CB 3.23Å; A745-C749 WeakPolarHBondContact O-CB 3.47Å; A745-C749 PolarHBondContact O-N 3.08Å; A745-C749 PolarHBondContact O-SG 2.98Å; I746-C749 PolarHBondContact O-N 2.81Å; C749-K751 VanDerWaalsContact C-N 3.34Å; C749-K751 PolarHBondContact O-N 3.47Å; C749-V752 PolarHBondContact O-N 2.9Å; C749-L753 VanDerWaalsContact O-CB 3.25Å; C749-L753 WeakPolarHBondContact O-CB 3.32Å; C749-L753 VanDerWaalsContact O-CG 3.27Å; C749-L753 WeakPolarHBondContact O-CG 3.42Å; C749-L753 PolarHBondContact O-N 3.45Å
750	F	83.8	Confident	83.4	Confident	134 Å²	134	63.5 Å²	63.5	59%	0.588	30%	0.304	S	S	*	.	H	α-helix	trans	-58.4	-46.7	176.7	-178.5	-96.7	0	0	0	111.1	I746 Y747 V748 V752 Y754	I746-F750 VanDerWaalsContact O-CB 3.3Å; I746-F750 WeakPolarHBondContact O-CB 3.25Å; I746-F750 PolarHBondContact O-N 2.89Å; Y747-F750 PolarHBondContact O-N 2.96Å; V748-F750 PolarHBondContact O-N 2.63Å; F750-V752 PolarHBondContact O-N 3.46Å; F750-Y754 WeakPolarHBondContact O-CB 3.11Å; F750-Y754 PolarHBondContact O-N 2.88Å
751	K	81.1	Confident	82.6	Confident	105 Å²	105	67.4 Å²	67.4	46%	0.457	33%	0.325	S	S	.	.	H	α-helix	trans	-63.8	-40.6	177.8	-72	-68.7	-174.7	-179.2	0	112.8	Y747 V748 C749 N755	Y747-K751 HydrophobicContact CE1-CG 4.37Å; Y747-K751 WeakPolarHBondContact O-CG 3.16Å; Y747-K751 PolarHBondContact O-N 2.6Å; Y747-K751 VanDerWaalsContact O-N 3.14Å; V748-K751 PolarHBondContact O-N 2.91Å; C749-K751 VanDerWaalsContact C-N 3.34Å; C749-K751 PolarHBondContact O-N 3.47Å; K751-N755 WeakPolarHBondContact O-CB 2.97Å; K751-N755 PolarHBondContact O-N 3.08Å; K751-N755 PolarHBondContact O-ND2 3.29Å; K751-N755 VanDerWaalsContact O-ND2 3.15Å
752	V	81.6	Confident	81.9	Confident	23 Å²	23	72.4 Å²	72.4	14%	0.139	35%	0.352	C	S	.	.	H	α-helix	trans	-72.1	-49.4	-179.2	173.9	0	0	0	0	111.6	L549 T552 V748 C749 F750 N755 R756	L549-V752 HydrophobicContact CD2-CG1 4.33Å; T552-V752 HydrophobicContact CG2-CG2 3.57Å; V748-V752 HydrophobicContact CG1-CG2 4.2Å; V748-V752 VanDerWaalsContact O-CG2 3.3Å; V748-V752 WeakPolarHBondContact O-CG2 3.22Å; V748-V752 PolarHBondContact O-N 2.98Å; C749-V752 PolarHBondContact O-N 2.9Å; F750-V752 PolarHBondContact O-N 3.46Å; V752-N755 PolarHBondContact O-N 3.3Å; V752-R756 PolarHBondContact O-N 3.26Å
753	L	77.2	Confident	81.3	Confident	36 Å²	36	73 Å²	73	19%	0.188	36%	0.358	C	S	.	.	H	α-helix	trans	-68.5	-42.6	-177.9	-66.5	-178.8	0	0	0	111.9	V688 S692 C749 N755 R756 D757	V688-L753 HydrophobicContact CG1-CD1 3.62Å; S692-L753 WeakPolarHBondContact OG-CD2 3.18Å; C749-L753 VanDerWaalsContact O-CB 3.25Å; C749-L753 WeakPolarHBondContact O-CB 3.32Å; C749-L753 VanDerWaalsContact O-CG 3.27Å; C749-L753 WeakPolarHBondContact O-CG 3.42Å; C749-L753 PolarHBondContact O-N 3.45Å; L753-N755 VanDerWaalsContact C-N 3.28Å; L753-N755 PolarHBondContact O-N 3.23Å; L753-R756 WeakPolarHBondContact O-CB 3.44Å; L753-R756 PolarHBondContact O-N 3.4Å; L753-R756 VanDerWaalsContact O-N 3.09Å; L753-D757 PolarHBondContact O-N 2.84Å
754	Y	75.5	Confident	80.7	Confident	131 Å²	131	73.4 Å²	73.4	51%	0.514	36%	0.355	S	S	.	.	H	α-helix	trans	-58	-43.1	174.8	179.9	-97.2	0	0	0	111.6	F750 K758	F750-Y754 WeakPolarHBondContact O-CB 3.11Å; F750-Y754 PolarHBondContact O-N 2.88Å; Y754-K758 HydrophobicContact CE1-CD 4.32Å; Y754-K758 VanDerWaalsContact O-CB 3.26Å; Y754-K758 WeakPolarHBondContact O-CB 3.17Å; Y754-K758 PolarHBondContact O-N 3.32Å
755	N	76.3	Confident	80	Confident	84 Å²	84	80 Å²	80	45%	0.449	38%	0.38	S	S	.	.	H	α-helix	trans	-68.4	-34	176.9	-76.6	-18.2	0	0	0	112.6	K751 V752 L753 L759	K751-N755 WeakPolarHBondContact O-CB 2.97Å; K751-N755 PolarHBondContact O-N 3.08Å; K751-N755 PolarHBondContact O-ND2 3.29Å; K751-N755 VanDerWaalsContact O-ND2 3.15Å; V752-N755 PolarHBondContact O-N 3.3Å; L753-N755 VanDerWaalsContact C-N 3.28Å; L753-N755 PolarHBondContact O-N 3.23Å; N755-L759 VanDerWaalsContact O-CB 3.28Å; N755-L759 WeakPolarHBondContact O-CB 3.13Å; N755-L759 PolarHBondContact O-N 3.13Å
756	R	73.9	Confident	79.5	Confident	54 Å²	54	82.9 Å²	82.9	20%	0.204	40%	0.395	C	S	.	.	H	α-helix	trans	-66.1	-50.5	175.7	175.9	-178	165	148.4	1.4	111	V752 L753 K758 L759 N760	V752-R756 PolarHBondContact O-N 3.26Å; L753-R756 WeakPolarHBondContact O-CB 3.44Å; L753-R756 PolarHBondContact O-N 3.4Å; L753-R756 VanDerWaalsContact O-N 3.09Å; R756-K758 PolarHBondContact O-N 3.19Å; R756-L759 PolarHBondContact O-N 2.84Å; R756-N760 VanDerWaalsContact O-CG 3.26Å; R756-N760 PolarHBondContact O-N 3.37Å; R756-N760 PolarHBondContact O-ND2 3.35Å
757	D	73.4	Confident	79.1	Confident	73 Å²	73	83.4 Å²	83.4	39%	0.39	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-45.9	-179.9	-72	-14.3	0	0	0	110.4	L753 L759 N760 D761	L753-D757 PolarHBondContact O-N 2.84Å; D757-L759 VanDerWaalsContact C-N 3.34Å; D757-L759 PolarHBondContact O-N 3.44Å; D757-N760 PolarHBondContact O-N 3.4Å; D757-D761 PolarHBondContact O-N 2.99Å
758	K	75.6	Confident	78.9	Confident	110 Å²	110	80.7 Å²	80.7	48%	0.478	39%	0.394	S	S	.	.	H	α-helix	trans	-58.3	-42.7	174.6	-175.2	173.6	-177.4	176.1	0	112.8	Y754 R756 D761 L762	Y754-K758 HydrophobicContact CE1-CD 4.32Å; Y754-K758 VanDerWaalsContact O-CB 3.26Å; Y754-K758 WeakPolarHBondContact O-CB 3.17Å; Y754-K758 PolarHBondContact O-N 3.32Å; R756-K758 PolarHBondContact O-N 3.19Å; K758-D761 PolarHBondContact O-N 3.23Å; K758-L762 HydrophobicContact CG-CD1 3.83Å; K758-L762 WeakPolarHBondContact O-CD1 3.34Å; K758-L762 PolarHBondContact O-N 3.2Å
759	L	72.9	Confident	78.7	Confident	83 Å²	83	86.9 Å²	86.9	44%	0.435	42%	0.416	S	S	.	.	H	α-helix	trans	-66.5	-41.3	178.3	-174.4	64.2	0	0	0	111.2	N755 R756 D757 L762 T763	N755-L759 VanDerWaalsContact O-CB 3.28Å; N755-L759 WeakPolarHBondContact O-CB 3.13Å; N755-L759 PolarHBondContact O-N 3.13Å; R756-L759 PolarHBondContact O-N 2.84Å; D757-L759 VanDerWaalsContact C-N 3.34Å; D757-L759 PolarHBondContact O-N 3.44Å; L759-L762 PolarHBondContact O-N 3.4Å; L759-T763 WeakPolarHBondContact O-CG2 3.35Å; L759-T763 PolarHBondContact O-N 2.84Å; L759-T763 PolarHBondContact O-OG1 2.91Å; L759-T763 VanDerWaalsContact O-OG1 3.13Å
760	N	72.5	Confident	78.8	Confident	59 Å²	59	93.1 Å²	93.1	32%	0.316	44%	0.439	S	S	.	.	H	α-helix	trans	-61.8	-45	176.4	-70.5	-22.3	0	0	0	111	R756 D757 L762 T763 N764	R756-N760 VanDerWaalsContact O-CG 3.26Å; R756-N760 PolarHBondContact O-N 3.37Å; R756-N760 PolarHBondContact O-ND2 3.35Å; D757-N760 PolarHBondContact O-N 3.4Å; N760-L762 PolarHBondContact O-N 3.29Å; N760-T763 WeakPolarHBondContact CA-OG1 3.37Å; N760-T763 PolarHBondContact O-N 3.13Å; N760-T763 PolarHBondContact O-OG1 2.75Å; N760-N764 WeakPolarHBondContact O-CB 3.17Å; N760-N764 VanDerWaalsContact O-CG 3.29Å; N760-N764 PolarHBondContact O-N 3.24Å; N760-N764 PolarHBondContact O-ND2 3.43Å
761	D	77	Confident	78.9	Confident	108 Å²	108	90.8 Å²	90.8	58%	0.578	43%	0.432	S	S	*	.	H	α-helix	trans	-62.1	-44	177.2	-69.5	-20	0	0	0	112.1	D757 K758 T763 N764 Y765	D757-D761 PolarHBondContact O-N 2.99Å; K758-D761 PolarHBondContact O-N 3.23Å; D761-T763 VanDerWaalsContact C-N 3.34Å; D761-T763 PolarHBondContact O-N 3.04Å; D761-N764 PolarHBondContact O-N 2.9Å; D761-Y765 VanDerWaalsContact O-CB 3.28Å; D761-Y765 WeakPolarHBondContact O-CB 3.18Å; D761-Y765 PolarHBondContact O-N 2.87Å
762	L	77.7	Confident	79.2	Confident	105 Å²	105	91.3 Å²	91.3	55%	0.55	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-41.9	174.6	-94.5	88.5	0	0	0	111.9	K758 L759 N760 D766	K758-L762 HydrophobicContact CG-CD1 3.83Å; K758-L762 WeakPolarHBondContact O-CD1 3.34Å; K758-L762 PolarHBondContact O-N 3.2Å; L759-L762 PolarHBondContact O-N 3.4Å; N760-L762 PolarHBondContact O-N 3.29Å; L762-D766 PolarHBondContact O-N 2.94Å
763	T	78.8	Confident	79.6	Confident	71 Å²	71	96.4 Å²	96.4	44%	0.436	45%	0.453	S	S	.	.	H	α-helix	trans	-69	-39.2	178.8	55.2	0	0	0	0	112.5	L759 N760 D761 D766 L767	L759-T763 WeakPolarHBondContact O-CG2 3.35Å; L759-T763 PolarHBondContact O-N 2.84Å; L759-T763 PolarHBondContact O-OG1 2.91Å; L759-T763 VanDerWaalsContact O-OG1 3.13Å; N760-T763 WeakPolarHBondContact CA-OG1 3.37Å; N760-T763 PolarHBondContact O-N 3.13Å; N760-T763 PolarHBondContact O-OG1 2.75Å; D761-T763 VanDerWaalsContact C-N 3.34Å; D761-T763 PolarHBondContact O-N 3.04Å; T763-D766 PolarHBondContact O-N 3.41Å; T763-L767 WeakPolarHBondContact O-CB 3.48Å; T763-L767 PolarHBondContact O-N 3.16Å
764	N	79.1	Confident	80.2	Confident	85 Å²	85	99 Å²	99	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-40.3	176.1	-75.2	-33.2	0	0	0	110.9	N760 D761 L767 N768	N760-N764 WeakPolarHBondContact O-CB 3.17Å; N760-N764 VanDerWaalsContact O-CG 3.29Å; N760-N764 PolarHBondContact O-N 3.24Å; N760-N764 PolarHBondContact O-ND2 3.43Å; D761-N764 PolarHBondContact O-N 2.9Å; N764-L767 PolarHBondContact O-N 3.23Å; N764-N768 VanDerWaalsContact O-CB 3.27Å; N764-N768 WeakPolarHBondContact O-CB 3.13Å; N764-N768 VanDerWaalsContact O-CG 3.27Å; N764-N768 PolarHBondContact O-N 3.4Å; N764-N768 PolarHBondContact O-ND2 3.31Å
765	Y	78.1	Confident	80.9	Confident	161 Å²	161	97.3 Å²	97.3	63%	0.631	46%	0.462	S	S	*	.	H	α-helix	trans	-63.4	-48.4	174.5	-179.7	-98.6	0	0	0	112.2	D761 L767 N768 R769	D761-Y765 VanDerWaalsContact O-CB 3.28Å; D761-Y765 WeakPolarHBondContact O-CB 3.18Å; D761-Y765 PolarHBondContact O-N 2.87Å; Y765-L767 VanDerWaalsContact C-N 3.33Å; Y765-L767 PolarHBondContact O-N 3.39Å; Y765-N768 PolarHBondContact O-N 3.23Å; Y765-R769 VanDerWaalsContact O-CB 3.28Å; Y765-R769 WeakPolarHBondContact O-CB 3.29Å; Y765-R769 PolarHBondContact O-N 3.03Å
766	D	81.9	Confident	81.6	Confident	60 Å²	60	98.5 Å²	98.5	32%	0.321	47%	0.469	S	S	.	.	H	α-helix	trans	-65.2	-37.8	177.9	-168.8	35.4	0	0	0	111.6	L762 T763 R769 R770	L762-D766 PolarHBondContact O-N 2.94Å; T763-D766 PolarHBondContact O-N 3.41Å; D766-R769 PolarHBondContact O-N 3.21Å; D766-R770 VanDerWaalsContact O-CG 3.3Å; D766-R770 WeakPolarHBondContact O-CG 3.06Å; D766-R770 PolarHBondContact O-N 3.17Å; D766-R770 IonicContact OD1-NE 3.6Å; D766-R770 IonicContact OD2-CZ 3.35Å; D766-R770 IonicContact OD2-NE 3.15Å; D766-R770 PolarHBondContact OD2-NE 3.19Å; D766-R770 VanDerWaalsContact OD2-NE 3.15Å; D766-R770 IonicContact OD2-NH2 2.8Å; D766-R770 PolarHBondContact OD2-NH2 2.89Å
767	L	79.9	Confident	82.3	Confident	109 Å²	109	101.5 Å²	101.5	57%	0.571	49%	0.488	S	S	*	.	H	α-helix	trans	-64.8	-48.9	175.6	-172.2	68.7	0	0	0	111.7	T763 N764 Y765 R769 R770 L771	T763-L767 WeakPolarHBondContact O-CB 3.48Å; T763-L767 PolarHBondContact O-N 3.16Å; N764-L767 PolarHBondContact O-N 3.23Å; Y765-L767 VanDerWaalsContact C-N 3.33Å; Y765-L767 PolarHBondContact O-N 3.39Å; L767-R769 VanDerWaalsContact C-N 3.28Å; L767-R769 PolarHBondContact O-N 3.46Å; L767-R770 PolarHBondContact O-N 3.46Å; L767-R770 VanDerWaalsContact O-N 3.14Å; L767-L771 WeakPolarHBondContact O-CB 3.46Å; L767-L771 PolarHBondContact O-N 3Å
768	N	83.4	Confident	83.2	Confident	88 Å²	88	103.3 Å²	103.3	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-38.2	176.6	-77.5	-16.5	0	0	0	111.5	N764 Y765 R770 L771 H772	N764-N768 VanDerWaalsContact O-CB 3.27Å; N764-N768 WeakPolarHBondContact O-CB 3.13Å; N764-N768 VanDerWaalsContact O-CG 3.27Å; N764-N768 PolarHBondContact O-N 3.4Å; N764-N768 PolarHBondContact O-ND2 3.31Å; Y765-N768 PolarHBondContact O-N 3.23Å; N768-R770 PolarHBondContact O-N 2.56Å; N768-L771 PolarHBondContact O-N 3.25Å; N768-H772 PolarHBondContact O-CD2 2.7Å; N768-H772 PolarHBondContact O-N 3.28Å
769	R	86.6	Confident	83.9	Confident	139 Å²	139	103 Å²	103	53%	0.525	50%	0.497	S	S	.	.	H	α-helix	trans	-65.4	-37.1	175.3	-170.5	179.5	-175.9	-163.9	3.2	112.6	Y765 D766 L767 R773	Y765-R769 VanDerWaalsContact O-CB 3.28Å; Y765-R769 WeakPolarHBondContact O-CB 3.29Å; Y765-R769 PolarHBondContact O-N 3.03Å; D766-R769 PolarHBondContact O-N 3.21Å; L767-R769 VanDerWaalsContact C-N 3.28Å; L767-R769 PolarHBondContact O-N 3.46Å; R769-R773 PolarHBondContact O-N 3.23Å; R769-R773 PolarHBondContact O-NE 3.43Å
770	R	88.5	Confident	84.7	Confident	137 Å²	137	103 Å²	103	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-70.7	-40.8	173.3	-70.1	174.1	-166.7	-148.8	6.5	111.3	D766 L767 N768 R773 I774	D766-R770 VanDerWaalsContact O-CG 3.3Å; D766-R770 WeakPolarHBondContact O-CG 3.06Å; D766-R770 PolarHBondContact O-N 3.17Å; D766-R770 IonicContact OD1-NE 3.6Å; D766-R770 IonicContact OD2-CZ 3.35Å; D766-R770 IonicContact OD2-NE 3.15Å; D766-R770 PolarHBondContact OD2-NE 3.19Å; D766-R770 VanDerWaalsContact OD2-NE 3.15Å; D766-R770 IonicContact OD2-NH2 2.8Å; D766-R770 PolarHBondContact OD2-NH2 2.89Å; L767-R770 PolarHBondContact O-N 3.46Å; L767-R770 VanDerWaalsContact O-N 3.14Å; N768-R770 PolarHBondContact O-N 2.56Å; R770-R773 PolarHBondContact O-N 3Å; R770-I774 WeakPolarHBondContact O-CG1 3.43Å; R770-I774 PolarHBondContact O-N 2.99Å
771	L	86.8	Confident	85.5	Confident	85 Å²	85	105.3 Å²	105.3	45%	0.445	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-46.7	178.1	-171.6	65.8	0	0	0	111.4	L767 N768 R773 I774 Q775	L767-L771 WeakPolarHBondContact O-CB 3.46Å; L767-L771 PolarHBondContact O-N 3Å; N768-L771 PolarHBondContact O-N 3.25Å; L771-R773 VanDerWaalsContact C-N 3.32Å; L771-R773 PolarHBondContact O-N 3.32Å; L771-I774 PolarHBondContact O-N 3.19Å; L771-I774 VanDerWaalsContact O-N 3.17Å; L771-Q775 WeakPolarHBondContact O-CB 3.32Å; L771-Q775 WeakPolarHBondContact O-CG 3.39Å; L771-Q775 PolarHBondContact O-N 3.48Å
772	H	85.6	Confident	86.1	Confident	116 Å²	116	105.5 Å²	105.5	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-39.4	174.9	-85.3	-55	0	0	0	113	N768 Q775 N776	N768-H772 PolarHBondContact O-CD2 2.7Å; N768-H772 PolarHBondContact O-N 3.28Å; H772-Q775 PolarHBondContact O-N 3.25Å; H772-N776 WeakPolarHBondContact O-CB 3.25Å; H772-N776 VanDerWaalsContact O-CG 3.3Å; H772-N776 PolarHBondContact O-N 3.11Å
773	R	90.6	Very high	86.6	Confident	131 Å²	131	104.2 Å²	104.2	49%	0.494	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-41.7	175.1	-79.3	-173.8	-77.6	-169.7	-1.1	112.2	R769 R770 L771 L777	R769-R773 PolarHBondContact O-N 3.23Å; R769-R773 PolarHBondContact O-NE 3.43Å; R770-R773 PolarHBondContact O-N 3Å; L771-R773 VanDerWaalsContact C-N 3.32Å; L771-R773 PolarHBondContact O-N 3.32Å; R773-L777 WeakPolarHBondContact O-CG 3.36Å; R773-L777 PolarHBondContact O-N 3.29Å; R773-L777 VanDerWaalsContact O-N 3.07Å
774	I	89.2	Confident	87.1	Confident	90 Å²	90	107 Å²	107	46%	0.462	50%	0.504	S	S	.	.	H	α-helix	trans	-68.4	-42.8	177.7	-66.2	167.4	0	0	0	110.7	R770 L771 N776 L777 I778	R770-I774 WeakPolarHBondContact O-CG1 3.43Å; R770-I774 PolarHBondContact O-N 2.99Å; L771-I774 PolarHBondContact O-N 3.19Å; L771-I774 VanDerWaalsContact O-N 3.17Å; I774-N776 VanDerWaalsContact C-N 3.34Å; I774-N776 PolarHBondContact O-N 3.24Å; I774-L777 PolarHBondContact O-N 3.45Å; I774-I778 HydrophobicContact CG2-CD1 3.82Å; I774-I778 HydrophobicContact CG2-CG1 4.38Å; I774-I778 WeakPolarHBondContact O-CG1 3.38Å; I774-I778 PolarHBondContact O-N 2.76Å
775	Q	90.7	Very high	87.6	Confident	96 Å²	96	109.1 Å²	109.1	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-44	176.1	-76.1	175.5	-34.2	0	0	111.6	L771 H772 L777 I778 Q779	L771-Q775 WeakPolarHBondContact O-CB 3.32Å; L771-Q775 WeakPolarHBondContact O-CG 3.39Å; L771-Q775 PolarHBondContact O-N 3.48Å; H772-Q775 PolarHBondContact O-N 3.25Å; Q775-L777 PolarHBondContact O-N 2.03Å; Q775-I778 PolarHBondContact O-N 3.45Å; Q775-Q779 WeakPolarHBondContact O-CB 3.24Å; Q775-Q779 PolarHBondContact O-N 3.18Å
776	N	90.4	Very high	88.1	Confident	108 Å²	108	106 Å²	106	58%	0.578	50%	0.5	S	S	*	.	H	α-helix	trans	-61.9	-42.3	175	-73.5	-2	0	0	0	111.9	H772 I774 Q779 T780	H772-N776 WeakPolarHBondContact O-CB 3.25Å; H772-N776 VanDerWaalsContact O-CG 3.3Å; H772-N776 PolarHBondContact O-N 3.11Å; I774-N776 VanDerWaalsContact C-N 3.34Å; I774-N776 PolarHBondContact O-N 3.24Å; N776-Q779 PolarHBondContact O-N 2.84Å; N776-T780 WeakPolarHBondContact O-CG2 3.42Å; N776-T780 PolarHBondContact O-N 2.73Å; N776-T780 PolarHBondContact O-OG1 3.31Å
777	L	90.4	Very high	88.3	Confident	118 Å²	118	105.8 Å²	105.8	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-62.6	-43.6	176.2	-75.6	165.5	0	0	0	112.1	R773 I774 Q775 T780 H781	R773-L777 WeakPolarHBondContact O-CG 3.36Å; R773-L777 PolarHBondContact O-N 3.29Å; R773-L777 VanDerWaalsContact O-N 3.07Å; I774-L777 PolarHBondContact O-N 3.45Å; Q775-L777 PolarHBondContact O-N 2.03Å; L777-T780 WeakPolarHBondContact CA-OG1 3.22Å; L777-T780 PolarHBondContact O-N 3.16Å; L777-T780 PolarHBondContact O-OG1 2.79Å; L777-H781 WeakPolarHBondContact O-CB 2.94Å; L777-H781 PolarHBondContact O-N 2.99Å
778	I	90.5	Very high	88.7	Confident	111 Å²	111	104.6 Å²	104.6	57%	0.569	50%	0.495	S	S	*	.	H	α-helix	trans	-62.6	-44.8	176.8	-67.6	167.6	0	0	0	110.6	I774 Q775 H781 H782	I774-I778 HydrophobicContact CG2-CD1 3.82Å; I774-I778 HydrophobicContact CG2-CG1 4.38Å; I774-I778 WeakPolarHBondContact O-CG1 3.38Å; I774-I778 PolarHBondContact O-N 2.76Å; Q775-I778 PolarHBondContact O-N 3.45Å; I778-H781 PolarHBondContact O-N 3.02Å; I778-H782 WeakPolarHBondContact O-CB 3.45Å; I778-H782 PolarHBondContact O-N 3.36Å
779	Q	91.4	Very high	88.8	Confident	103 Å²	103	105.4 Å²	105.4	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-60.2	-48.5	177.6	-170.7	62.7	36.1	0	0	110.9	Q775 N776 H781 H782 D783	Q775-Q779 WeakPolarHBondContact O-CB 3.24Å; Q775-Q779 PolarHBondContact O-N 3.18Å; N776-Q779 PolarHBondContact O-N 2.84Å; Q779-H781 VanDerWaalsContact C-N 3.28Å; Q779-H781 PolarHBondContact O-N 3.26Å; Q779-H782 WeakPolarHBondContact O-CB 3.17Å; Q779-H782 PolarHBondContact O-N 3.34Å; Q779-H782 VanDerWaalsContact O-N 3.1Å; Q779-D783 PolarHBondContact NE2-OD1 2.82Å; Q779-D783 VanDerWaalsContact NE2-OD1 3.09Å; Q779-D783 PolarHBondContact O-N 2.85Å
780	T	89.9	Confident	88.8	Confident	84 Å²	84	104.6 Å²	104.6	52%	0.515	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-34.6	178.3	56.6	0	0	0	0	113.2	N776 L777 Y784	N776-T780 WeakPolarHBondContact O-CG2 3.42Å; N776-T780 PolarHBondContact O-N 2.73Å; N776-T780 PolarHBondContact O-OG1 3.31Å; L777-T780 WeakPolarHBondContact CA-OG1 3.22Å; L777-T780 PolarHBondContact O-N 3.16Å; L777-T780 PolarHBondContact O-OG1 2.79Å; T780-Y784 WeakPolarHBondContact O-CB 3.29Å; T780-Y784 PolarHBondContact O-N 2.87Å
781	H	88.9	Confident	88.6	Confident	107 Å²	107	103.5 Å²	103.5	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-74.5	-33.7	176.4	-173.2	-78.5	0	0	0	112.1	L777 I778 Q779 K785	L777-H781 WeakPolarHBondContact O-CB 2.94Å; L777-H781 PolarHBondContact O-N 2.99Å; I778-H781 PolarHBondContact O-N 3.02Å; Q779-H781 VanDerWaalsContact C-N 3.28Å; Q779-H781 PolarHBondContact O-N 3.26Å; H781-K785 PolarHBondContact O-N 3.42Å
782	H	89.2	Confident	88.4	Confident	112 Å²	112	105.5 Å²	105.5	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-44.7	172.6	-164.2	67.1	0	0	0	110.9	I778 Q779 Y784 K785 Q786	I778-H782 WeakPolarHBondContact O-CB 3.45Å; I778-H782 PolarHBondContact O-N 3.36Å; Q779-H782 WeakPolarHBondContact O-CB 3.17Å; Q779-H782 PolarHBondContact O-N 3.34Å; Q779-H782 VanDerWaalsContact O-N 3.1Å; H782-Y784 PolarHBondContact O-N 2.58Å; H782-K785 PolarHBondContact O-N 3.1Å; H782-Q786 WeakPolarHBondContact O-CB 3.22Å; H782-Q786 PolarHBondContact O-N 2.84Å
783	D	89.4	Confident	88.4	Confident	77 Å²	77	108 Å²	108	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-42.3	176.1	-61.9	-20.1	0	0	0	111.4	Q779 Q786 S787	Q779-D783 PolarHBondContact NE2-OD1 2.82Å; Q779-D783 VanDerWaalsContact NE2-OD1 3.09Å; Q779-D783 PolarHBondContact O-N 2.85Å; D783-Q786 PolarHBondContact O-N 3.17Å; D783-S787 WeakPolarHBondContact O-CB 3.46Å; D783-S787 PolarHBondContact O-N 3.36Å
784	Y	88.9	Confident	88	Confident	131 Å²	131	111.5 Å²	111.5	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-59.2	-50.8	174.1	-177.8	-89.4	0	0	0	111.3	T780 H782 Q786 S787 E788	T780-Y784 WeakPolarHBondContact O-CB 3.29Å; T780-Y784 PolarHBondContact O-N 2.87Å; H782-Y784 PolarHBondContact O-N 2.58Å; Y784-Q786 VanDerWaalsContact C-N 3.33Å; Y784-Q786 PolarHBondContact O-N 3.23Å; Y784-S787 PolarHBondContact O-N 3.42Å; Y784-S787 VanDerWaalsContact O-N 3.13Å; Y784-S787 PolarHBondContact O-OG 3.23Å; Y784-E788 HydrophobicContact CD1-CG 4.27Å; Y784-E788 VanDerWaalsContact CE1-CD 3.49Å; Y784-E788 HydrophobicContact CE1-CG 3.72Å; Y784-E788 PolarHBondContact O-N 3.06Å; Y784-E788 PolarHBondContact OH-OE1 3.03Å
785	K	89	Confident	87.5	Confident	129 Å²	129	116 Å²	116	56%	0.561	56%	0.558	S	S	*	*	H	α-helix	trans	-60.9	-39.7	177.8	-84.9	-169.9	162.6	-176.5	0	112.8	H781 H782 S787 E788 L789	H781-K785 PolarHBondContact O-N 3.42Å; H782-K785 PolarHBondContact O-N 3.1Å; K785-S787 VanDerWaalsContact C-N 3.31Å; K785-E788 PolarHBondContact O-N 3.07Å; K785-L789 PolarHBondContact O-N 2.82Å
786	Q	88.4	Confident	87.3	Confident	95 Å²	95	117.1 Å²	117.1	44%	0.444	56%	0.563	S	S	.	*	H	α-helix	trans	-68.9	-32.1	177.7	-167.1	168.5	1.8	0	0	111.8	H782 D783 Y784 K790	H782-Q786 WeakPolarHBondContact O-CB 3.22Å; H782-Q786 PolarHBondContact O-N 2.84Å; D783-Q786 PolarHBondContact O-N 3.17Å; Y784-Q786 VanDerWaalsContact C-N 3.33Å; Y784-Q786 PolarHBondContact O-N 3.23Å; Q786-K790 WeakPolarHBondContact O-CG 3.25Å; Q786-K790 PolarHBondContact O-N 3.37Å
787	S	87.2	Confident	87.1	Confident	56 Å²	56	117.5 Å²	117.5	39%	0.392	56%	0.562	S	S	.	*	H	α-helix	trans	-68.5	-41.4	172.7	76.8	0	0	0	0	112.4	D783 Y784 K785 K790 M791	D783-S787 WeakPolarHBondContact O-CB 3.46Å; D783-S787 PolarHBondContact O-N 3.36Å; Y784-S787 PolarHBondContact O-N 3.42Å; Y784-S787 VanDerWaalsContact O-N 3.13Å; Y784-S787 PolarHBondContact O-OG 3.23Å; K785-S787 VanDerWaalsContact C-N 3.31Å; S787-K790 PolarHBondContact O-N 2.89Å; S787-M791 WeakPolarHBondContact O-CG 3.11Å; S787-M791 PolarHBondContact O-N 3.47Å
788	E	88.4	Confident	87	Confident	84 Å²	84	117.5 Å²	117.5	39%	0.393	56%	0.559	S	S	.	*	H	α-helix	trans	-64.1	-41	173.9	-69.9	-147	148.6	0	0	111.7	Y784 K785 K790 M791 M792	Y784-E788 HydrophobicContact CD1-CG 4.27Å; Y784-E788 VanDerWaalsContact CE1-CD 3.49Å; Y784-E788 HydrophobicContact CE1-CG 3.72Å; Y784-E788 PolarHBondContact O-N 3.06Å; Y784-E788 PolarHBondContact OH-OE1 3.03Å; K785-E788 PolarHBondContact O-N 3.07Å; E788-K790 VanDerWaalsContact C-N 3.32Å; E788-K790 PolarHBondContact O-N 2.98Å; E788-M791 PolarHBondContact O-N 3.12Å; E788-M792 WeakPolarHBondContact O-CB 3.07Å; E788-M792 WeakPolarHBondContact O-CG 3.23Å; E788-M792 PolarHBondContact O-N 3.3Å
789	L	85.5	Confident	86.8	Confident	104 Å²	104	117.9 Å²	117.9	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-64.7	-36	176.5	-150.6	87.4	0	0	0	112.2	K785 K793	K785-L789 PolarHBondContact O-N 2.82Å; L789-K793 WeakPolarHBondContact O-CG 3.46Å; L789-K793 PolarHBondContact O-N 3.02Å
790	K	86.7	Confident	86.5	Confident	122 Å²	122	118.8 Å²	118.8	53%	0.53	56%	0.563	S	S	.	*	H	α-helix	trans	-67.1	-45.2	173	-76.9	176.4	-178.5	179.6	0	111.1	Q786 S787 E788 M792 K793 Y794	Q786-K790 WeakPolarHBondContact O-CG 3.25Å; Q786-K790 PolarHBondContact O-N 3.37Å; S787-K790 PolarHBondContact O-N 2.89Å; E788-K790 VanDerWaalsContact C-N 3.32Å; E788-K790 PolarHBondContact O-N 2.98Å; K790-M792 VanDerWaalsContact C-N 3.35Å; K790-M792 PolarHBondContact O-N 3.17Å; K790-K793 PolarHBondContact O-N 3.47Å; K790-K793 VanDerWaalsContact O-N 3.09Å; K790-Y794 WeakPolarHBondContact O-CD2 3.19Å; K790-Y794 PolarHBondContact O-N 3Å; K790-Y794 VanDerWaalsContact O-N 3.1Å
791	M	83.9	Confident	86.2	Confident	114 Å²	114	121.1 Å²	121.1	56%	0.562	57%	0.567	S	S	*	*	H	α-helix	trans	-61.3	-41.9	176.8	-72.7	-64.3	-63.6	0	0	111.9	S787 E788 K793 Y794 L795	S787-M791 WeakPolarHBondContact O-CG 3.11Å; S787-M791 PolarHBondContact O-N 3.47Å; E788-M791 PolarHBondContact O-N 3.12Å; M791-K793 PolarHBondContact O-N 3.25Å; M791-Y794 PolarHBondContact O-N 2.76Å; M791-Y794 VanDerWaalsContact O-N 3.11Å; M791-L795 WeakPolarHBondContact O-CG 3.32Å; M791-L795 PolarHBondContact O-N 3.46Å
792	M	83.2	Confident	86.1	Confident	127 Å²	127	122.1 Å²	122.1	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-67.4	-18.4	174.2	-72.9	-154.6	-126.2	0	0	114.3	E788 K790 L795	E788-M792 WeakPolarHBondContact O-CB 3.07Å; E788-M792 WeakPolarHBondContact O-CG 3.23Å; E788-M792 PolarHBondContact O-N 3.3Å; K790-M792 VanDerWaalsContact C-N 3.35Å; K790-M792 PolarHBondContact O-N 3.17Å; M792-L795 VanDerWaalsContact O-OXT 3.07Å
793	K	84.4	Confident	85.8	Confident	169 Å²	169	122.9 Å²	122.9	74%	0.735	58%	0.576	S	S	*	*	H	α-helix	trans	-85.7	-22.6	170.5	-76.3	-178	179.1	-171	0	113	L789 K790 M791	L789-K793 WeakPolarHBondContact O-CG 3.46Å; L789-K793 PolarHBondContact O-N 3.02Å; K790-K793 PolarHBondContact O-N 3.47Å; K790-K793 VanDerWaalsContact O-N 3.09Å; M791-K793 PolarHBondContact O-N 3.25Å
794	Y	82.1	Confident	85.5	Confident	205 Å²	205	126.8 Å²	126.8	80%	0.804	59%	0.589	S	S	*	*	H	α-helix	trans	-84.9	-36.1	176.6	-86.1	-70.3	0	0	0	112.3	K790 M791	K790-Y794 WeakPolarHBondContact O-CD2 3.19Å; K790-Y794 PolarHBondContact O-N 3Å; K790-Y794 VanDerWaalsContact O-N 3.1Å; M791-Y794 PolarHBondContact O-N 2.76Å; M791-Y794 VanDerWaalsContact O-N 3.11Å
795	L	78.5	Confident	85.2	Confident	185 Å²	185	126.4 Å²	126.4	97%	0.969	60%	0.596	S	S	*	*			trans	-70.4	0	165	-67.8	170.3	0	0	0	109.6	M791 M792	M791-L795 WeakPolarHBondContact O-CG 3.32Å; M791-L795 PolarHBondContact O-N 3.46Å; M792-L795 VanDerWaalsContact O-OXT 3.07Å

Retrieved 795 of 795 residues in 1251.1 ms (Link to these results)

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