A0A087XQY6_POEFO Loading...

CREB3 regulatory factor

AlphaFold DB , UniProt , Accession A0A087XQY6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 712 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	29.4	Very low	40.4	Very low	239 Å²	239	141.5 Å²	141.5	100%	1.177	83%	0.829	S	S	*	*				0	153.3	0	-90.2	-167.6	71	0	0	108.4
2	P	43	Very low	41.5	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-88.3	168.9	-164.2	35.6	-36.8	0	0	0	114
3	Q	34.6	Very low	41.2	Very low	185 Å²	185	143.8 Å²	143.8	86%	0.864	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-82.5	158.6	166.6	-70.6	174.8	-30.8	0	0	111.1
4	P	51.8	Low	40.6	Very low	123 Å²	123	138.8 Å²	138.8	80%	0.799	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-90.5	146.2	-179.3	35.3	-33.8	0	0	0	113.5
5	S	36.6	Very low	40.6	Very low	120 Å²	120	139.9 Å²	139.9	84%	0.839	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-80.7	158.2	162.9	-45	0	0	0	0	111.1
6	V	46	Very low	40.3	Very low	149 Å²	149	137.3 Å²	137.3	90%	0.903	82%	0.82	S	S	*	*			trans	-116.1	151	165.2	-69.8	0	0	0	0	110.1
7	S	38.4	Very low	40	Very low	122 Å²	122	139.5 Å²	139.5	85%	0.853	82%	0.817	S	S	*	*			trans	-155.2	127.3	-162.8	167.4	0	0	0	0	112.9
8	G	37.4	Very low	39.6	Very low	66 Å²	66	141.5 Å²	141.5	68%	0.68	82%	0.817	S	S	*	*			trans	77.2	139.8	149.4	0	0	0	0	0	118.8
9	M	32.8	Very low	39.3	Very low	181 Å²	181	141.9 Å²	141.9	89%	0.892	82%	0.816	S	S	*	*			trans	-151.9	152.3	145.5	-86.5	-48.4	-48.7	0	0	109.6
10	E	35.1	Very low	38.7	Very low	161 Å²	161	146.3 Å²	146.3	75%	0.752	82%	0.82	S	S	*	*			trans	-155	177.7	-179.7	-153.8	-150.5	124.9	0	0	107.8
11	P	59.2	Low	38.6	Very low	93 Å²	93	144.4 Å²	144.4	60%	0.604	82%	0.817	S	S	*	*				-93.1	-155.3	-102.6	40.1	-24.2	0	0	0	112.9
12	P	54.1	Low	38.5	Very low	102 Å²	102	143 Å²	143	66%	0.662	80%	0.804	S	S	*	*				-153.1	145.8	111.1	37.7	-20.1	0	0	0	118.6
13	F	36.8	Very low	38	Very low	211 Å²	211	140.9 Å²	140.9	93%	0.925	80%	0.797	S	S	*	*			trans	62.3	150.2	159.3	-56.7	-59.9	0	0	0	120.3
14	G	33.1	Very low	38	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	79%	0.793	S	S	*	*			cis	179	160.5	-5.1	0	0	0	0	0	114.3
15	D	41.6	Very low	36.9	Very low	155 Å²	155	142.8 Å²	142.8	83%	0.829	80%	0.8	S	S	*	*			trans	-69.5	154.1	-170.5	-73.7	-62.5	0	0	0	118.1
16	A	35.3	Very low	36.7	Very low	99 Å²	99	141 Å²	141	82%	0.818	79%	0.792	S	S	*	*			trans	-157.6	143.2	137.2	0	0	0	0	0	113.6
17	F	35.6	Very low	36.3	Very low	175 Å²	175	141.6 Å²	141.6	77%	0.768	79%	0.789	S	S	*	*			trans	-84.4	172.3	174.7	-70.8	-106.4	0	0	0	110.3
18	Q	32	Very low	36	Very low	175 Å²	175	141.1 Å²	141.1	82%	0.818	78%	0.782	S	S	*	*			cis	-174.2	160	46.4	-156.4	158.7	97.2	0	0	112.8
19	N	34.4	Very low	35.7	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	78%	0.78	S	S	*	*			trans	-81	149.5	177.9	-81.3	-84.8	0	0	0	113.6
20	Y	27.5	Very low	35.9	Very low	229 Å²	229	140 Å²	140	90%	0.898	78%	0.776	S	S	*	*			trans	-147.8	151.7	149.5	-112.2	-82	0	0	0	111.2
21	S	35.8	Very low	35.8	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	78%	0.777	S	S	*	*			trans	-139.3	135.8	-173.2	169.4	0	0	0	0	110.9
22	F	27.8	Very low	34.7	Very low	210 Å²	210	143.7 Å²	143.7	92%	0.921	79%	0.789	S	S	*	*			trans	-158	171.7	149.8	-138.2	-101.3	0	0	0	111.7
23	A	31.7	Very low	33.9	Very low	72 Å²	72	146.4 Å²	146.4	60%	0.595	80%	0.797	S	S	*	*			trans	-119.8	177.2	-162.7	0	0	0	0	0	115.1
24	D	34.3	Very low	33.7	Very low	148 Å²	148	140.8 Å²	140.8	79%	0.791	79%	0.79	S	S	*	*			trans	57.3	117.1	164.6	-70.7	-17.2	0	0	0	119.7
25	Q	30.1	Very low	33.5	Very low	201 Å²	201	143.5 Å²	143.5	94%	0.939	79%	0.792	S	S	*	*				-159.3	157.1	119.2	-105.9	143.3	112.1	0	0	111.5
26	A	32.6	Very low	32.9	Very low	82 Å²	82	141.7 Å²	141.7	68%	0.678	79%	0.791	S	S	*	*			trans	-123.3	-177.1	178.5	0	0	0	0	0	110.1
27	L	37.1	Very low	32.8	Very low	161 Å²	161	142.8 Å²	142.8	84%	0.843	79%	0.793	S	S	*	*			trans	76.5	149.3	177.3	-45.4	-179.3	0	0	0	113.4
28	T	31.3	Very low	32.5	Very low	113 Å²	113	142.2 Å²	142.2	69%	0.693	80%	0.798	S	S	*	*			cis	-165.1	173.9	-14.5	22.2	0	0	0	0	109.7
29	S	31.3	Very low	33.3	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	79%	0.79	S	S	*	*			trans	63.7	108.1	141.2	56.9	0	0	0	0	120.8
30	T	36.3	Very low	33.2	Very low	131 Å²	131	138.4 Å²	138.4	80%	0.804	79%	0.788	S	S	*	*				30.1	150.7	114	56.6	0	0	0	0	122.2
31	E	33.3	Very low	33.3	Very low	169 Å²	169	137.8 Å²	137.8	79%	0.79	79%	0.791	S	S	*	*			trans	94.6	114.1	150.9	-163.6	177	-176.1	0	0	117.8
32	L	35.9	Very low	33.3	Very low	162 Å²	162	139.8 Å²	139.8	85%	0.848	79%	0.79	S	S	*	*				-169	161.9	112.3	-98	170.2	0	0	0	111.9
33	L	38.2	Very low	33.7	Very low	160 Å²	160	139.8 Å²	139.8	84%	0.838	79%	0.785	S	S	*	*			trans	-127.5	164.8	-170.5	-78.1	170	0	0	0	112.9
34	A	32.2	Very low	34	Very low	92 Å²	92	143.7 Å²	143.7	76%	0.76	79%	0.792	S	S	*	*			trans	73.2	159.6	160.5	0	0	0	0	0	116.4
35	T	30	Very low	33.9	Very low	132 Å²	132	143.3 Å²	143.3	81%	0.81	79%	0.789	S	S	*	*			cis	-142.7	141.4	15.5	53.7	0	0	0	0	113.7
36	S	27.3	Very low	34	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	78%	0.775	S	S	*	*				-163.7	151.4	129.8	60.9	0	0	0	0	109.8
37	S	34.4	Very low	34.3	Very low	122 Å²	122	143 Å²	143	85%	0.853	79%	0.788	S	S	*	*			trans	-159.6	144.6	-176.4	-50.5	0	0	0	0	110.7
38	D	27.9	Very low	33.9	Very low	163 Å²	163	141.6 Å²	141.6	87%	0.872	78%	0.781	S	S	*	*			trans	-155.6	144.2	148.9	-140.8	17.2	0	0	0	109.3
39	P	50.7	Low	34	Very low	99 Å²	99	143.2 Å²	143.2	64%	0.643	78%	0.783	S	S	*	*			trans	-115.2	161.3	-169.7	41.1	-32.3	0	0	0	114.7
40	D	31.2	Very low	33.9	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	79%	0.79	S	S	*	*				174	100.7	121.8	-100.1	-10.3	0	0	0	112.9
41	F	30.7	Very low	33.7	Very low	216 Å²	216	145.8 Å²	145.8	95%	0.947	79%	0.788	S	S	*	*				-156.1	152.3	127.1	-135.9	-101	0	0	0	110.4
42	M	34.7	Very low	33.4	Very low	150 Å²	150	145.7 Å²	145.7	74%	0.739	79%	0.787	S	S	*	*			trans	-104.5	135.5	-155.9	-74.9	-157	-55.6	0	0	117
43	Y	35.5	Very low	33.1	Very low	209 Å²	209	146.4 Å²	146.4	82%	0.82	79%	0.786	S	S	*	*			trans	72.2	142.6	142.9	-93.5	-91	0	0	0	122
44	E	38.7	Very low	32.6	Very low	155 Å²	155	144 Å²	144	72%	0.724	78%	0.783	S	S	*	*			trans	-69.7	152.2	171.9	-51.6	159	120.8	0	0	111.8
45	L	33.1	Very low	32.9	Very low	140 Å²	140	144.8 Å²	144.8	73%	0.733	78%	0.781	S	S	*	*				-171.4	160.7	112.1	-122.4	64.8	0	0	0	112.4
46	D	31.9	Very low	32.9	Very low	120 Å²	120	145 Å²	145	64%	0.642	79%	0.786	S	S	*	*			trans	57	88.7	151.4	-58.6	-16.9	0	0	0	120.4	D48	D46-D48 HydrophobicContact CB-CB 4.18Å; D46-D48 PolarHBondContact O-N 2.88Å; D46-D48 VanDerWaalsContact O-N 3.09Å
47	T	38.8	Very low	33.1	Very low	157 Å²	157	143.3 Å²	143.3	96%	0.963	79%	0.787	S	S	*	*			trans	-77.1	67.6	148.9	49.4	0	0	0	0	110.6
48	D	28.5	Very low	32.9	Very low	131 Å²	131	145 Å²	145	70%	0.701	79%	0.786	S	S	*	*			trans	-97.4	153.7	-173	-147.9	-2.9	0	0	0	114.4	D46 S50	D46-D48 HydrophobicContact CB-CB 4.18Å; D46-D48 PolarHBondContact O-N 2.88Å; D46-D48 VanDerWaalsContact O-N 3.09Å; D48-S50 PolarHBondContact O-N 3.35Å
49	M	33.7	Very low	33	Very low	147 Å²	147	142.4 Å²	142.4	72%	0.724	78%	0.781	S	S	*	*			trans	-72.9	110.6	-164.6	-78.1	-87.6	-78.9	0	0	114.2	H51	M49-H51 VanDerWaalsContact C-N 3.27Å; M49-H51 PolarHBondContact O-N 3.42Å; M49-H51 VanDerWaalsContact O-N 3.11Å
50	S	28.3	Very low	32.2	Very low	114 Å²	114	145.1 Å²	145.1	80%	0.797	79%	0.788	S	S	*	*			trans	-85.6	41	175.9	54.7	0	0	0	0	115.1	D48 Q52	D48-S50 PolarHBondContact O-N 3.35Å; S50-Q52 PolarHBondContact O-N 3.38Å
51	H	32.1	Very low	32.4	Very low	162 Å²	162	145 Å²	145	75%	0.75	79%	0.792	S	S	*	*			trans	-76	71.9	165.5	-91.6	79.1	0	0	0	111	M49 Q53	M49-H51 VanDerWaalsContact C-N 3.27Å; M49-H51 PolarHBondContact O-N 3.42Å; M49-H51 VanDerWaalsContact O-N 3.11Å; H51-Q53 PolarHBondContact O-N 2.78Å
52	Q	28.1	Very low	32.5	Very low	168 Å²	168	137.7 Å²	137.7	79%	0.785	78%	0.778	S	S	*	*			trans	-71.7	84.3	177.3	-85.8	-90.9	-13.3	0	0	112.2	S50	S50-Q52 PolarHBondContact O-N 3.38Å
53	Q	28.2	Very low	32.5	Very low	176 Å²	176	138.2 Å²	138.2	82%	0.822	79%	0.79	S	S	*	*			trans	-73.5	129.5	153.3	-67.8	-172.9	3.4	0	0	109.2	H51 P55	H51-Q53 PolarHBondContact O-N 2.78Å; Q53-P55 WeakPolarHBondContact O-CD 3.44Å
54	S	27.9	Very low	32.3	Very low	111 Å²	111	131.3 Å²	131.3	78%	0.776	78%	0.782	S	S	*	*			trans	-102	119.3	170	-74.5	0	0	0	0	111.3
55	P	39.9	Very low	32.1	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	79%	0.793	S	S	*	*			trans	-128.9	156.7	159.2	37.4	-25.8	0	0	0	114.7	Q53	Q53-P55 WeakPolarHBondContact O-CD 3.44Å
56	C	29.6	Very low	32	Very low	137 Å²	137	129.2 Å²	129.2	93%	0.926	79%	0.793	S	S	*	*			trans	85.7	113.6	163.6	-62.4	0	0	0	0	119.7
57	G	29.9	Very low	32.1	Very low	81 Å²	81	127 Å²	127	84%	0.835	80%	0.799	S	S	*	*			trans	-164.5	114.6	163.3	0	0	0	0	0	108.2
58	D	31.8	Very low	32	Very low	158 Å²	158	128 Å²	128	85%	0.845	79%	0.789	S	S	*	*			trans	-76.5	138.6	-159.8	-134.1	-36.3	0	0	0	114.9
59	S	29.9	Very low	32.4	Very low	108 Å²	108	129 Å²	129	76%	0.755	79%	0.79	S	S	*	*			trans	179.1	111.8	135.2	-82.6	0	0	0	0	115.9
60	I	34.1	Very low	32.6	Very low	155 Å²	155	129.2 Å²	129.2	80%	0.795	80%	0.799	S	S	*	*			trans	74.6	135.2	132.1	-144.1	169.4	0	0	0	122.8
61	V	35.5	Very low	33.1	Very low	142 Å²	142	133 Å²	133	86%	0.861	80%	0.804	S	S	*	*			trans	69.4	123.2	175.6	-163.9	0	0	0	0	115.6
62	G	32.5	Very low	33.1	Very low	63 Å²	63	128.9 Å²	128.9	65%	0.649	81%	0.806	S	S	*	*			cis	153.8	147	-2.6	0	0	0	0	0	111.7
63	V	33.4	Very low	33.1	Very low	161 Å²	161	124.2 Å²	124.2	98%	0.976	80%	0.803	S	S	*	*			trans	71.9	131.9	-178.8	-169.3	0	0	0	0	114.9
64	G	31.7	Very low	33.4	Very low	64 Å²	64	122.7 Å²	122.7	66%	0.66	81%	0.805	S	S	*	*			cis	162.4	150.6	-9.2	0	0	0	0	0	113.4
65	D	34.9	Very low	33.7	Very low	180 Å²	180	124.2 Å²	124.2	96%	0.963	81%	0.805	S	S	*	*			trans	64.6	147.2	177.2	-132.6	23.4	0	0	0	115.3
66	G	31.7	Very low	33.5	Very low	70 Å²	70	127.9 Å²	127.9	72%	0.722	81%	0.813	S	S	*	*			cis	146.8	133.5	-1.5	0	0	0	0	0	108.8
67	G	32.8	Very low	33.6	Very low	74 Å²	74	130 Å²	130	76%	0.763	81%	0.813	S	S	*	*			cis	177.5	-163.3	-3	0	0	0	0	0	109.7
68	K	38.6	Very low	33.9	Very low	178 Å²	178	135.5 Å²	135.5	77%	0.774	82%	0.82	S	S	*	*			trans	76	92.9	162.4	-59.6	-162	158.5	-82.8	0	121.8
69	E	36.7	Very low	34	Very low	153 Å²	153	131 Å²	131	72%	0.715	81%	0.81	S	S	*	*				25	127	116	75.7	-139.3	148.7	0	0	122.1
70	V	37.2	Very low	34.3	Very low	151 Å²	151	134.7 Å²	134.7	92%	0.915	82%	0.821	S	S	*	*			trans	-160.9	147.5	134	68.2	0	0	0	0	110.4
71	E	39.4	Very low	34.2	Very low	192 Å²	192	130.5 Å²	130.5	90%	0.897	82%	0.816	S	S	*	*			trans	-127.4	147.3	-177.8	-174.4	-167.1	156.5	0	0	111.4
72	G	30.6	Very low	33.9	Very low	77 Å²	77	133.4 Å²	133.4	79%	0.794	82%	0.82	S	S	*	*			trans	115.1	147.6	153	0	0	0	0	0	116.5
73	G	29.7	Very low	33.7	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	83%	0.828	S	S	*	*			trans	153.9	42.3	163.9	0	0	0	0	0	122.2
74	V	32.9	Very low	33.5	Very low	145 Å²	145	136.4 Å²	136.4	88%	0.879	82%	0.818	S	S	*	*			trans	52.9	144.2	152	-62	0	0	0	0	122.5
75	D	34.3	Very low	33.9	Very low	143 Å²	143	138.9 Å²	138.9	77%	0.765	82%	0.821	S	S	*	*			trans	-66.3	138.9	172.5	-49.2	-101.3	0	0	0	114.4
76	Q	35.8	Very low	33.8	Very low	185 Å²	185	135.6 Å²	135.6	86%	0.864	81%	0.807	S	S	*	*				158.5	108	122.3	-85.8	157.2	104.9	0	0	112.4
77	L	32.6	Very low	33.9	Very low	180 Å²	180	139.6 Å²	139.6	94%	0.942	81%	0.807	S	S	*	*				-158.6	127.8	122.5	-139.1	76.8	0	0	0	109.8
78	M	35.9	Very low	34.1	Very low	198 Å²	198	141.8 Å²	141.8	98%	0.975	81%	0.81	S	S	*	*			trans	-100.7	123.4	174.7	-173.1	178	-168.1	0	0	109.4
79	G	33.9	Very low	33.9	Very low	62 Å²	62	136.5 Å²	136.5	64%	0.639	80%	0.796	S	S	*	*			trans	155.9	126.1	168	0	0	0	0	0	115.5
80	L	35.9	Very low	34.3	Very low	187 Å²	187	132.6 Å²	132.6	98%	0.979	79%	0.785	S	S	*	*			trans	69.8	124.8	164.8	-48.5	175.4	0	0	0	116.7
81	G	31.7	Very low	34.4	Very low	67 Å²	67	128.2 Å²	128.2	69%	0.691	77%	0.765	S	S	*	*			trans	136.4	50.6	166.8	0	0	0	0	0	116	C83	G81-C83 PolarHBondContact O-N 2.84Å; G81-C83 VanDerWaalsContact O-N 3.09Å
82	E	29.2	Very low	34.2	Very low	203 Å²	203	125.9 Å²	125.9	95%	0.949	75%	0.752	S	S	*	*			trans	-68.1	102.8	166.1	-70.6	166.6	163	0	0	108.9
83	C	28.2	Very low	34.8	Very low	121 Å²	121	127.5 Å²	127.5	82%	0.818	74%	0.739	S	S	*	*			trans	-112.2	76.4	173.5	-74.9	0	0	0	0	108.8	G81 T85	G81-C83 PolarHBondContact O-N 2.84Å; G81-C83 VanDerWaalsContact O-N 3.09Å; C83-T85 PolarHBondContact O-N 3.36Å
84	E	29.8	Very low	35.6	Very low	165 Å²	165	130.7 Å²	130.7	77%	0.771	74%	0.735	S	S	*	*			trans	-67.5	127.5	179.3	-168.3	179.6	149.8	0	0	111	V86	E84-V86 HydrophobicContact CB-CG2 4.13Å; E84-V86 HydrophobicContact CG-CG2 3.89Å; E84-V86 PolarHBondContact O-N 3.01Å
85	T	39.3	Very low	36.1	Very low	116 Å²	116	132.4 Å²	132.4	71%	0.712	73%	0.726	S	S	*	*			trans	-77.4	65.9	174.2	49.5	0	0	0	0	110.7	C83 H87	C83-T85 PolarHBondContact O-N 3.36Å; T85-H87 PolarHBondContact O-N 2.69Å; T85-H87 VanDerWaalsContact O-N 3.13Å; T85-H87 PolarHBondContact O-ND1 2.75Å
86	V	34.1	Very low	36.5	Very low	111 Å²	111	129.4 Å²	129.4	67%	0.673	71%	0.71	S	S	*	*			trans	-62.8	114	176.8	-178.3	0	0	0	0	109.1	E84	E84-V86 HydrophobicContact CB-CG2 4.13Å; E84-V86 HydrophobicContact CG-CG2 3.89Å; E84-V86 PolarHBondContact O-N 3.01Å
87	H	33	Very low	36.8	Very low	154 Å²	154	123.7 Å²	123.7	71%	0.713	69%	0.691	S	S	*	*			trans	-76.4	155.1	-179.6	-75.5	47.4	0	0	0	111.3	T85 S89	T85-H87 PolarHBondContact O-N 2.69Å; T85-H87 VanDerWaalsContact O-N 3.13Å; T85-H87 PolarHBondContact O-ND1 2.75Å; H87-S89 PolarHBondContact O-N 2.93Å
88	S	37	Very low	37.2	Very low	120 Å²	120	123.6 Å²	123.6	84%	0.839	68%	0.679	S	S	*	*	S	Bend	trans	-75.8	59	178.6	-53.2	0	0	0	0	113.5
89	S	33.9	Very low	37.5	Very low	67 Å²	67	121.8 Å²	121.8	47%	0.469	66%	0.661	S	S	.	*			trans	-77.6	-43.7	174.2	64	0	0	0	0	112.7	H87 A91 F92	H87-S89 PolarHBondContact O-N 2.93Å; S89-A91 PolarHBondContact O-N 3.48Å; S89-F92 WeakPolarHBondContact O-CB 3.3Å; S89-F92 PolarHBondContact O-N 3.16Å
90	S	45.9	Very low	38	Very low	71 Å²	71	124.8 Å²	124.8	50%	0.497	66%	0.659	S	S	.	*	H	α-helix	trans	-56.1	-22.9	-170.2	170.6	0	0	0	0	115.4	E93 Q94	S90-E93 WeakPolarHBondContact CA-OE2 3.48Å; S90-Q94 WeakPolarHBondContact O-CG 3.07Å
91	A	38.7	Very low	38.4	Very low	59 Å²	59	119 Å²	119	49%	0.488	63%	0.629	S	S	.	*	H	α-helix	trans	-75.5	-30.4	176.2	0	0	0	0	0	112.7	S89 W95	S89-A91 PolarHBondContact O-N 3.48Å; A91-W95 VanDerWaalsContact O-CD1 3.22Å
92	F	35.6	Very low	38.9	Very low	143 Å²	143	120.1 Å²	120.1	63%	0.627	62%	0.618	S	S	*	*	H	α-helix	trans	-77.7	-45.5	-178	-169.8	-90	0	0	0	111.2	S89 Q94 W95 D96	S89-F92 WeakPolarHBondContact O-CB 3.3Å; S89-F92 PolarHBondContact O-N 3.16Å; F92-Q94 PolarHBondContact O-N 3.02Å; F92-Q94 VanDerWaalsContact O-N 3.12Å; F92-W95 WeakPolarHBondContact O-CB 3.08Å; F92-W95 PolarHBondContact O-N 3.02Å; F92-D96 VanDerWaalsContact CE1-OD2 3.31Å; F92-D96 WeakPolarHBondContact CE1-OD2 3.38Å; F92-D96 PolarHBondContact O-N 3.31Å
93	E	43.2	Very low	39.7	Very low	112 Å²	112	113.2 Å²	113.2	52%	0.523	59%	0.591	S	S	.	*	H	α-helix	trans	-58.8	-26.9	178	-62.1	163.5	153	0	0	112.7	S90 S97	S90-E93 WeakPolarHBondContact CA-OE2 3.48Å; E93-S97 PolarHBondContact O-N 3.32Å; E93-S97 PolarHBondContact O-OG 2.96Å
94	Q	47.2	Very low	40.4	Very low	135 Å²	135	112.7 Å²	112.7	63%	0.631	57%	0.571	S	S	*	*	H	α-helix	trans	-71.5	-31.4	172.7	-76.4	-179.1	-11.8	0	0	113.6	S90 F92 Y98	S90-Q94 WeakPolarHBondContact O-CG 3.07Å; F92-Q94 PolarHBondContact O-N 3.02Å; F92-Q94 VanDerWaalsContact O-N 3.12Å; Q94-Y98 PolarHBondContact O-N 3.11Å
95	W	42.5	Very low	40.8	Very low	182 Å²	182	113.2 Å²	113.2	69%	0.689	57%	0.568	S	S	*	*	H	α-helix	trans	-72.7	-40.7	174.8	-77.6	95.7	0	0	0	111.7	A91 F92 Y98 W99	A91-W95 VanDerWaalsContact O-CD1 3.22Å; F92-W95 WeakPolarHBondContact O-CB 3.08Å; F92-W95 PolarHBondContact O-N 3.02Å; W95-Y98 PolarHBondContact O-N 3.45Å; W95-W99 PolarHBondContact O-N 2.87Å
96	D	43	Very low	41	Very low	80 Å²	80	111.2 Å²	111.2	43%	0.428	56%	0.555	S	S	.	*	H	α-helix	trans	-63.4	-45.6	177.3	-70.1	-25	0	0	0	111.1	F92 Y98 W99 E100	F92-D96 VanDerWaalsContact CE1-OD2 3.31Å; F92-D96 WeakPolarHBondContact CE1-OD2 3.38Å; F92-D96 PolarHBondContact O-N 3.31Å; D96-Y98 VanDerWaalsContact C-N 3.27Å; D96-Y98 PolarHBondContact O-N 3.45Å; D96-W99 WeakPolarHBondContact O-CB 3.32Å; D96-W99 PolarHBondContact O-N 3.08Å; D96-W99 VanDerWaalsContact O-N 3.08Å; D96-E100 PolarHBondContact O-N 3.14Å
97	S	41.7	Very low	41.2	Very low	65 Å²	65	113.3 Å²	113.3	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-56.2	-40.6	174.5	-58.9	0	0	0	0	112.6	E93 E100 D101	E93-S97 PolarHBondContact O-N 3.32Å; E93-S97 PolarHBondContact O-OG 2.96Å; S97-E100 PolarHBondContact O-N 3.46Å; S97-D101 PolarHBondContact O-N 2.73Å
98	Y	41.3	Very low	41.5	Very low	178 Å²	178	110.8 Å²	110.8	70%	0.698	54%	0.542	S	S	*	.	H	α-helix	trans	-71.7	-32.1	178.9	-146.4	-98.2	0	0	0	112.3	Q94 W95 D96 L102	Q94-Y98 PolarHBondContact O-N 3.11Å; W95-Y98 PolarHBondContact O-N 3.45Å; D96-Y98 VanDerWaalsContact C-N 3.27Å; D96-Y98 PolarHBondContact O-N 3.45Å; Y98-L102 WeakPolarHBondContact O-CB 3.24Å; Y98-L102 PolarHBondContact O-N 2.87Å
99	W	43.1	Very low	41.8	Very low	159 Å²	159	108.4 Å²	108.4	60%	0.602	53%	0.53	S	S	*	.	H	α-helix	trans	-68.2	-38.3	170.7	-104.3	112.5	0	0	0	112.5	W95 D96 L102 T103	W95-W99 PolarHBondContact O-N 2.87Å; D96-W99 WeakPolarHBondContact O-CB 3.32Å; D96-W99 PolarHBondContact O-N 3.08Å; D96-W99 VanDerWaalsContact O-N 3.08Å; W99-L102 HydrophobicContact CE3-CD2 4.2Å; W99-L102 HydrophobicContact CH2-CD2 4.46Å; W99-L102 HydrophobicContact CZ3-CD2 4.1Å; W99-L102 PolarHBondContact O-N 3.3Å; W99-T103 VanDerWaalsContact O-CB 3.31Å; W99-T103 WeakPolarHBondContact O-CB 3.37Å; W99-T103 PolarHBondContact O-N 3.34Å; W99-T103 PolarHBondContact O-OG1 2.93Å
100	E	44.3	Very low	42.1	Very low	126 Å²	126	109.9 Å²	109.9	59%	0.589	54%	0.54	S	S	*	.	H	α-helix	trans	-65.3	-40.8	174.1	-71.3	-171.7	169	0	0	112.4	D96 S97 T103 R104	D96-E100 PolarHBondContact O-N 3.14Å; S97-E100 PolarHBondContact O-N 3.46Å; E100-T103 PolarHBondContact O-N 2.82Å; E100-R104 WeakPolarHBondContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CG 3.44Å; E100-R104 PolarHBondContact O-N 3.41Å; E100-R104 PolarHBondContact O-NE 3.12Å
101	D	43.9	Very low	42	Very low	66 Å²	66	109.4 Å²	109.4	35%	0.353	54%	0.536	S	S	.	.	H	α-helix	trans	-60.5	-48.6	171.5	-93.5	-42.2	0	0	0	111.4	S97 T103 R104 Y105	S97-D101 PolarHBondContact O-N 2.73Å; D101-T103 VanDerWaalsContact C-N 3.27Å; D101-T103 PolarHBondContact O-N 3.17Å; D101-R104 VanDerWaalsContact CG-NH2 3.29Å; D101-R104 PolarHBondContact O-N 2.95Å; D101-R104 VanDerWaalsContact O-N 3.13Å; D101-R104 IonicContact OD1-CZ 3.15Å; D101-R104 IonicContact OD1-NH1 2.78Å; D101-R104 PolarHBondContact OD1-NH1 2.76Å; D101-R104 IonicContact OD1-NH2 3.89Å; D101-R104 PolarHBondContact OD1-NH2 3.5Å; D101-R104 IonicContact OD2-NH2 3.55Å; D101-Y105 WeakPolarHBondContact O-CD2 3.42Å; D101-Y105 PolarHBondContact O-N 3.43Å
102	L	41.7	Very low	42.1	Very low	89 Å²	89	112.1 Å²	112.1	47%	0.466	54%	0.542	S	S	.	.	H	α-helix	trans	-60.7	-36.7	177.9	-175.7	62.3	0	0	0	112.3	Y98 W99 T106	Y98-L102 WeakPolarHBondContact O-CB 3.24Å; Y98-L102 PolarHBondContact O-N 2.87Å; W99-L102 HydrophobicContact CE3-CD2 4.2Å; W99-L102 HydrophobicContact CH2-CD2 4.46Å; W99-L102 HydrophobicContact CZ3-CD2 4.1Å; W99-L102 PolarHBondContact O-N 3.3Å; L102-T106 WeakPolarHBondContact O-CB 3.39Å; L102-T106 PolarHBondContact O-N 2.9Å; L102-T106 PolarHBondContact O-OG1 3.04Å
103	T	46.2	Very low	42.6	Very low	59 Å²	59	110.2 Å²	110.2	36%	0.362	54%	0.538	S	S	.	.	H	α-helix	trans	-77	-26.6	177.7	-52.4	0	0	0	0	112.1	W99 E100 D101 R107	W99-T103 VanDerWaalsContact O-CB 3.31Å; W99-T103 WeakPolarHBondContact O-CB 3.37Å; W99-T103 PolarHBondContact O-N 3.34Å; W99-T103 PolarHBondContact O-OG1 2.93Å; E100-T103 PolarHBondContact O-N 2.82Å; D101-T103 VanDerWaalsContact C-N 3.27Å; D101-T103 PolarHBondContact O-N 3.17Å; T103-R107 WeakPolarHBondContact O-CG 3.47Å; T103-R107 PolarHBondContact O-N 3.17Å; T103-R107 PolarHBondContact O-NE 2.87Å
104	R	43.6	Very low	42.8	Very low	110 Å²	110	113.7 Å²	113.7	42%	0.415	55%	0.546	S	S	.	.	H	α-helix	trans	-68.8	-48.9	168	-79.6	-177.8	-85.7	115.6	0.4	110.8	E100 D101 T106 R107 L108	E100-R104 WeakPolarHBondContact O-CB 3.29Å; E100-R104 WeakPolarHBondContact O-CG 3.44Å; E100-R104 PolarHBondContact O-N 3.41Å; E100-R104 PolarHBondContact O-NE 3.12Å; D101-R104 VanDerWaalsContact CG-NH2 3.29Å; D101-R104 PolarHBondContact O-N 2.95Å; D101-R104 VanDerWaalsContact O-N 3.13Å; D101-R104 IonicContact OD1-CZ 3.15Å; D101-R104 IonicContact OD1-NH1 2.78Å; D101-R104 PolarHBondContact OD1-NH1 2.76Å; D101-R104 IonicContact OD1-NH2 3.89Å; D101-R104 PolarHBondContact OD1-NH2 3.5Å; D101-R104 IonicContact OD2-NH2 3.55Å; R104-T106 VanDerWaalsContact C-N 3.34Å; R104-T106 PolarHBondContact O-N 2.81Å; R104-R107 PolarHBondContact O-N 3.23Å; R104-L108 WeakPolarHBondContact O-CD1 3.45Å; R104-L108 PolarHBondContact O-N 2.92Å
105	Y	38.5	Very low	42.5	Very low	176 Å²	176	108.6 Å²	108.6	69%	0.69	53%	0.529	S	S	*	.	H	α-helix	trans	-59.4	-40.9	174.1	-90.2	-81	0	0	0	113.2	D101 R107 L108 A109	D101-Y105 WeakPolarHBondContact O-CD2 3.42Å; D101-Y105 PolarHBondContact O-N 3.43Å; Y105-R107 VanDerWaalsContact C-N 3.33Å; Y105-R107 PolarHBondContact O-N 2.75Å; Y105-L108 PolarHBondContact O-N 2.89Å; Y105-A109 PolarHBondContact O-N 2.8Å
106	T	43.7	Very low	42.5	Very low	73 Å²	73	106 Å²	106	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-63	-37.7	178.1	-58.5	0	0	0	0	112.2	L102 R104 L108 A109	L102-T106 WeakPolarHBondContact O-CB 3.39Å; L102-T106 PolarHBondContact O-N 2.9Å; L102-T106 PolarHBondContact O-OG1 3.04Å; R104-T106 VanDerWaalsContact C-N 3.34Å; R104-T106 PolarHBondContact O-N 2.81Å; T106-L108 PolarHBondContact O-N 3.45Å; T106-A109 WeakPolarHBondContact O-CB 3.24Å; T106-A109 PolarHBondContact O-N 3.32Å
107	R	38.3	Very low	42.4	Very low	156 Å²	156	111.1 Å²	111.1	59%	0.589	55%	0.552	S	S	*	*	H	α-helix	trans	-67.2	-34	177.1	-79.1	-178.3	-74.2	173.9	-5.1	113.3	T103 R104 Y105 A109 S110	T103-R107 WeakPolarHBondContact O-CG 3.47Å; T103-R107 PolarHBondContact O-N 3.17Å; T103-R107 PolarHBondContact O-NE 2.87Å; R104-R107 PolarHBondContact O-N 3.23Å; Y105-R107 VanDerWaalsContact C-N 3.33Å; Y105-R107 PolarHBondContact O-N 2.75Å; R107-A109 VanDerWaalsContact C-N 3.26Å; R107-A109 PolarHBondContact O-N 3.4Å; R107-S110 WeakPolarHBondContact O-CB 3.42Å; R107-S110 PolarHBondContact O-N 2.89Å; R107-S110 VanDerWaalsContact O-N 3.16Å; R107-S110 PolarHBondContact O-OG 3.39Å
108	L	38.5	Very low	42.7	Very low	100 Å²	100	113.8 Å²	113.8	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-65.3	-26.7	174.9	-92.9	69.5	0	0	0	113	R104 Y105 T106 S110 C111	R104-L108 WeakPolarHBondContact O-CD1 3.45Å; R104-L108 PolarHBondContact O-N 2.92Å; Y105-L108 PolarHBondContact O-N 2.89Å; T106-L108 PolarHBondContact O-N 3.45Å; L108-S110 PolarHBondContact O-N 3.24Å; L108-C111 PolarHBondContact O-N 2.73Å; L108-C111 VanDerWaalsContact O-N 3.15Å
109	A	44	Very low	43.2	Very low	71 Å²	71	106.8 Å²	106.8	59%	0.587	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-7.3	175.4	0	0	0	0	0	113.9	Y105 T106 R107	Y105-A109 PolarHBondContact O-N 2.8Å; T106-A109 WeakPolarHBondContact O-CB 3.24Å; T106-A109 PolarHBondContact O-N 3.32Å; R107-A109 VanDerWaalsContact C-N 3.26Å; R107-A109 PolarHBondContact O-N 3.4Å
110	S	39.4	Very low	43.5	Very low	98 Å²	98	105.8 Å²	105.8	69%	0.685	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-15.3	173.1	-8.3	0	0	0	0	113.4	R107 L108	R107-S110 WeakPolarHBondContact O-CB 3.42Å; R107-S110 PolarHBondContact O-N 2.89Å; R107-S110 VanDerWaalsContact O-N 3.16Å; R107-S110 PolarHBondContact O-OG 3.39Å; L108-S110 PolarHBondContact O-N 3.24Å
111	C	43.3	Very low	43.3	Very low	61 Å²	61	108.9 Å²	108.9	41%	0.412	55%	0.552	S	S	.	*	S	Bend	trans	-72.3	148.9	169.7	-64.6	0	0	0	0	109.5	L108 I113	L108-C111 PolarHBondContact O-N 2.73Å; L108-C111 VanDerWaalsContact O-N 3.15Å; C111-I113 VanDerWaalsContact O-CG1 3.3Å; C111-I113 WeakPolarHBondContact O-CG1 3.44Å; C111-I113 PolarHBondContact O-N 3.18Å
112	D	41.4	Very low	43.6	Very low	115 Å²	115	111.1 Å²	111.1	62%	0.615	56%	0.563	S	S	*	*			trans	-72	95.1	177.4	-170.2	2.2	0	0	0	109.9	W114 G115	D112-W114 PolarHBondContact O-N 3.1Å; D112-W114 VanDerWaalsContact OD1-CD1 3.26Å; D112-W114 PolarHBondContact OD1-N 3.38Å; D112-G115 PolarHBondContact O-N 3.01Å
113	I	46.6	Very low	43.8	Very low	103 Å²	103	110.1 Å²	110.1	53%	0.528	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-5.4	-173.3	-35.3	-178.4	0	0	0	112.6	C111	C111-I113 VanDerWaalsContact O-CG1 3.3Å; C111-I113 WeakPolarHBondContact O-CG1 3.44Å; C111-I113 PolarHBondContact O-N 3.18Å
114	W	46.4	Very low	43.9	Very low	186 Å²	186	112.1 Å²	112.1	71%	0.705	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-1.8	171.5	-52.9	98.1	0	0	0	113.4	D112 T116	D112-W114 PolarHBondContact O-N 3.1Å; D112-W114 VanDerWaalsContact OD1-CD1 3.26Å; D112-W114 PolarHBondContact OD1-N 3.38Å; W114-T116 PolarHBondContact O-N 2.81Å
115	G	40.5	Very low	43.9	Very low	27 Å²	27	112.7 Å²	112.7	28%	0.278	59%	0.593	S	S	.	*			trans	-73.3	111.8	177.2	0	0	0	0	0	113.5	D112 K117	D112-G115 PolarHBondContact O-N 3.01Å; G115-K117 PolarHBondContact O-N 3.04Å
116	T	42.5	Very low	44.4	Very low	128 Å²	128	106.5 Å²	106.5	79%	0.785	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	25.7	-170.4	68.6	0	0	0	0	115.5	W114	W114-T116 PolarHBondContact O-N 2.81Å
117	K	41.8	Very low	44.6	Very low	187 Å²	187	107.3 Å²	107.3	81%	0.813	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-17.2	-176.7	-160.4	-176.1	176.3	-168	0	113.6	G115	G115-K117 PolarHBondContact O-N 3.04Å
118	E	46.9	Very low	45.1	Very low	121 Å²	121	101.6 Å²	101.6	57%	0.565	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-25.1	-170.9	-59.7	177.5	-117.5	0	0	111.9	F121	E118-F121 PolarHBondContact O-N 2.98Å
119	V	52	Low	45.7	Very low	31 Å²	31	97.1 Å²	97.1	19%	0.188	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-65.9	-38.2	-179.6	-175.1	0	0	0	0	112.2	F121 L122 L124 F127	V119-F121 PolarHBondContact O-N 2.99Å; V119-F121 VanDerWaalsContact O-N 3.15Å; V119-L122 PolarHBondContact O-N 3.49Å; V119-L122 VanDerWaalsContact O-N 3.15Å; V119-L124 HydrophobicContact CG1-CB 4.04Å; V119-F127 HydrophobicContact CG1-CD2 4.26Å; V119-F127 HydrophobicContact CG1-CE2 3.96Å
120	D	49.1	Very low	46	Very low	138 Å²	138	95.4 Å²	95.4	74%	0.738	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-56.9	-30.8	-178.3	-64.9	1.2	0	0	0	112.9	L122	D120-L122 VanDerWaalsContact C-N 3.32Å; D120-L122 PolarHBondContact O-N 2.89Å
121	F	41.4	Very low	46.4	Very low	192 Å²	192	93.5 Å²	93.5	84%	0.842	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-80.2	-11.7	-175.1	-143.8	-91.7	0	0	0	113.7	E118 V119	E118-F121 PolarHBondContact O-N 2.98Å; V119-F121 PolarHBondContact O-N 2.99Å; V119-F121 VanDerWaalsContact O-N 3.15Å
122	L	49.2	Very low	47.3	Very low	113 Å²	113	93.5 Å²	93.5	59%	0.592	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-111.1	-0.6	-176.6	-64.1	178.5	0	0	0	113.8	V119 D120 L124	V119-L122 PolarHBondContact O-N 3.49Å; V119-L122 VanDerWaalsContact O-N 3.15Å; D120-L122 VanDerWaalsContact C-N 3.32Å; D120-L122 PolarHBondContact O-N 2.89Å; L122-L124 HydrophobicContact CB-CD1 3.93Å; L122-L124 HydrophobicContact CB-CG 4.03Å; L122-L124 HydrophobicContact CD1-CD1 4.16Å; L122-L124 PolarHBondContact O-N 2.89Å
123	G	47.4	Very low	48	Very low	67 Å²	67	92.1 Å²	92.1	69%	0.691	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	20.3	179.3	0	0	0	0	0	114.6	D125	G123-D125 PolarHBondContact O-N 3.36Å
124	L	47.8	Very low	48.7	Very low	102 Å²	102	92.3 Å²	92.3	53%	0.534	48%	0.477	S	S	.	.			trans	-79.7	40.9	-176.4	-70.2	170.5	0	0	0	113.3	V119 L122 D126 F127	V119-L124 HydrophobicContact CG1-CB 4.04Å; L122-L124 HydrophobicContact CB-CD1 3.93Å; L122-L124 HydrophobicContact CB-CG 4.03Å; L122-L124 HydrophobicContact CD1-CD1 4.16Å; L122-L124 PolarHBondContact O-N 2.89Å; L124-D126 PolarHBondContact O-N 3.45Å; L124-F127 WeakPolarHBondContact O-CD2 3.46Å
125	D	43.2	Very low	49.3	Very low	121 Å²	121	89.3 Å²	89.3	65%	0.647	47%	0.471	S	S	*	.			trans	-76.5	27.2	-174.8	-162.8	23.9	0	0	0	114.5	G123 F127 S128	G123-D125 PolarHBondContact O-N 3.36Å; D125-F127 PolarHBondContact O-N 2.93Å; D125-S128 PolarHBondContact O-OG 3.02Å; D125-S128 VanDerWaalsContact O-OG 3.12Å
126	D	48.7	Very low	50.2	Low	46 Å²	46	91.1 Å²	91.1	25%	0.246	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	11.7	174.1	-153.8	46.8	0	0	0	112.1	L124 K625 T682 S683	L124-D126 PolarHBondContact O-N 3.45Å; D126-K625 PolarHBondContact O-NZ 3.24Å; D126-K625 IonicContact OD2-NZ 3.31Å; D126-K625 PolarHBondContact OD2-NZ 3.13Å; D126-T682 WeakPolarHBondContact OD2-CB 3.35Å; D126-T682 PolarHBondContact OD2-N 3.35Å; D126-T682 PolarHBondContact OD2-OG1 3.46Å; D126-S683 WeakPolarHBondContact OD1-CB 3.47Å; D126-S683 PolarHBondContact OD1-OG 3.46Å; D126-S683 PolarHBondContact OD2-N 3.16Å
127	F	47.6	Very low	51.1	Low	90 Å²	90	88.3 Å²	88.3	40%	0.395	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.9	165.6	-70.8	-78.8	0	0	0	112.7	V119 L124 D125 S129 Q132	V119-F127 HydrophobicContact CG1-CD2 4.26Å; V119-F127 HydrophobicContact CG1-CE2 3.96Å; L124-F127 WeakPolarHBondContact O-CD2 3.46Å; D125-F127 PolarHBondContact O-N 2.93Å; F127-S129 PolarHBondContact O-N 3.4Å; F127-S129 VanDerWaalsContact O-N 3.13Å; F127-Q132 PolarHBondContact O-NE2 2.82Å
128	S	50	Low	51.7	Low	36 Å²	36	84 Å²	84	25%	0.252	45%	0.449	S	S	.	.			trans	-48.7	115.4	162	48.8	0	0	0	0	111	D125	D125-S128 PolarHBondContact O-OG 3.02Å; D125-S128 VanDerWaalsContact O-OG 3.12Å
129	S	51.5	Low	52.2	Low	7 Å²	7	87.1 Å²	87.1	5%	0.049	46%	0.456	C	S	.	.			trans	-67.8	149.4	161	-177.6	0	0	0	0	108	F127 Y131 Q132	F127-S129 PolarHBondContact O-N 3.4Å; F127-S129 VanDerWaalsContact O-N 3.13Å; S129-Y131 PolarHBondContact O-N 3.12Å; S129-Q132 PolarHBondContact O-N 2.98Å
130	P	48.4	Very low	52.9	Low	35 Å²	35	89.4 Å²	89.4	23%	0.227	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	4.3	173.8	-30.2	37.1	0	0	0	117.4	V686 N687 L690	P130-V686 HydrophobicContact CG-CB 4.45Å; P130-V686 HydrophobicContact CG-CG1 3.72Å; P130-N687 WeakPolarHBondContact CB-OD1 3.33Å; P130-L690 HydrophobicContact CB-CD1 4.18Å; P130-L690 HydrophobicContact CG-CD1 4.19Å
131	Y	48.9	Very low	53.7	Low	57 Å²	57	86.5 Å²	86.5	22%	0.224	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	17.3	176.6	-48.8	-62.2	0	0	0	112.1	S129 L575 A617	S129-Y131 PolarHBondContact O-N 3.12Å; Y131-L575 HydrophobicContact CD2-CD1 3.96Å; Y131-L575 HydrophobicContact CG-CD1 4.37Å; Y131-A617 HydrophobicContact CD2-CB 4.49Å
132	Q	61.3	Low	55.3	Low	61 Å²	61	80.8 Å²	80.8	29%	0.285	44%	0.44	S	S	.	.			trans	-86.4	129.2	160.9	-56.5	-146.1	84.3	0	0	107.9	F127 S129 I137	F127-Q132 PolarHBondContact O-NE2 2.82Å; S129-Q132 PolarHBondContact O-N 2.98Å; Q132-I137 HydrophobicContact CB-CD1 4.33Å
133	D	56.1	Low	55.8	Low	87 Å²	87	81 Å²	81	47%	0.465	44%	0.44	S	S	.	.			trans	-137.9	108.3	177.2	176.5	-17.1	0	0	0	104.4	E135 V136 I137	D133-E135 PolarHBondContact O-N 3.2Å; D133-E135 WeakPolarHBondContact OD1-CB 3.38Å; D133-E135 PolarHBondContact OD1-N 3.23Å; D133-E135 VanDerWaalsContact OD1-N 3.16Å; D133-V136 HydrophobicContact CB-CB 4.19Å; D133-V136 HydrophobicContact CB-CG2 3.97Å; D133-V136 WeakPolarHBondContact O-CA 3.31Å; D133-V136 WeakPolarHBondContact O-CB 3.21Å; D133-V136 PolarHBondContact O-N 2.97Å; D133-I137 PolarHBondContact O-N 2.99Å
134	E	62.2	Low	56.8	Low	107 Å²	107	81.1 Å²	81.1	50%	0.5	44%	0.435	S	S	.	.	H	α-helix	trans	-66.8	-24.3	-171	-59.9	-48	125	0	0	112.1	V136 I137 S138	E134-V136 VanDerWaalsContact C-N 3.27Å; E134-V136 PolarHBondContact O-N 2.79Å; E134-I137 PolarHBondContact O-N 2.92Å; E134-I137 WeakPolarHBondContact OE1-CD1 3.3Å; E134-S138 WeakPolarHBondContact O-CB 3.3Å; E134-S138 PolarHBondContact O-N 3.48Å; E134-S138 PolarHBondContact O-OG 3.29Å
135	E	59.8	Low	58	Low	123 Å²	123	81.4 Å²	81.4	58%	0.575	43%	0.434	S	S	*	.	H	α-helix	trans	-70	-24.3	171	-67.2	-158.8	-148.5	0	0	112.9	D133 S138 R139	D133-E135 PolarHBondContact O-N 3.2Å; D133-E135 WeakPolarHBondContact OD1-CB 3.38Å; D133-E135 PolarHBondContact OD1-N 3.23Å; D133-E135 VanDerWaalsContact OD1-N 3.16Å; E135-S138 PolarHBondContact O-OG 3.45Å; E135-R139 WeakPolarHBondContact O-CD 3.46Å; E135-R139 WeakPolarHBondContact O-CG 3.18Å; E135-R139 PolarHBondContact O-NE 3.2Å; E135-R139 IonicContact OE2-NH2 2.69Å; E135-R139 PolarHBondContact OE2-NH2 3.44Å
136	V	59.1	Low	59.3	Low	64 Å²	64	77.2 Å²	77.2	39%	0.388	41%	0.411	S	S	.	.	H	α-helix	trans	-86.7	-36.6	175	179	0	0	0	0	110.7	D133 E134 R139 T140	D133-V136 HydrophobicContact CB-CB 4.19Å; D133-V136 HydrophobicContact CB-CG2 3.97Å; D133-V136 WeakPolarHBondContact O-CA 3.31Å; D133-V136 WeakPolarHBondContact O-CB 3.21Å; D133-V136 PolarHBondContact O-N 2.97Å; E134-V136 VanDerWaalsContact C-N 3.27Å; E134-V136 PolarHBondContact O-N 2.79Å; V136-R139 PolarHBondContact O-N 3.03Å; V136-T140 WeakPolarHBondContact O-CB 3.44Å; V136-T140 PolarHBondContact O-N 3.14Å; V136-T140 VanDerWaalsContact O-N 3.13Å; V136-T140 PolarHBondContact O-OG1 3.14Å
137	I	59.8	Low	60.3	Low	69 Å²	69	79.2 Å²	79.2	35%	0.354	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-49.9	178.1	-68.1	168.8	0	0	0	110.4	Q132 D133 E134 R139 T140	Q132-I137 HydrophobicContact CB-CD1 4.33Å; D133-I137 PolarHBondContact O-N 2.99Å; E134-I137 PolarHBondContact O-N 2.92Å; E134-I137 WeakPolarHBondContact OE1-CD1 3.3Å; I137-R139 PolarHBondContact O-N 2.92Å; I137-R139 VanDerWaalsContact O-N 3.13Å; I137-T140 PolarHBondContact O-N 3.07Å
138	S	55.8	Low	61.1	Low	97 Å²	97	78.3 Å²	78.3	68%	0.678	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-21.6	177.1	54	0	0	0	0	114.7	E134 E135	E134-S138 WeakPolarHBondContact O-CB 3.3Å; E134-S138 PolarHBondContact O-N 3.48Å; E134-S138 PolarHBondContact O-OG 3.29Å; E135-S138 PolarHBondContact O-OG 3.45Å
139	R	57.7	Low	61.4	Low	187 Å²	187	81.7 Å²	81.7	71%	0.706	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-6.3	176.5	-62.1	177.1	-154.4	-138	10.7	114	E135 V136 I137	E135-R139 WeakPolarHBondContact O-CD 3.46Å; E135-R139 WeakPolarHBondContact O-CG 3.18Å; E135-R139 PolarHBondContact O-NE 3.2Å; E135-R139 IonicContact OE2-NH2 2.69Å; E135-R139 PolarHBondContact OE2-NH2 3.44Å; V136-R139 PolarHBondContact O-N 3.03Å; I137-R139 PolarHBondContact O-N 2.92Å; I137-R139 VanDerWaalsContact O-N 3.13Å
140	T	65.7	Low	61.6	Low	79 Å²	79	86.5 Å²	86.5	49%	0.485	46%	0.464	S	S	.	.	S	Bend	trans	-90.9	117.5	-179.1	-62.8	0	0	0	0	109.9	V136 I137 T142	V136-T140 WeakPolarHBondContact O-CB 3.44Å; V136-T140 PolarHBondContact O-N 3.14Å; V136-T140 VanDerWaalsContact O-N 3.13Å; V136-T140 PolarHBondContact O-OG1 3.14Å; I137-T140 PolarHBondContact O-N 3.07Å; T140-T142 PolarHBondContact O-N 3.37Å
141	P	65.9	Low	61.8	Low	77 Å²	77	89.6 Å²	89.6	50%	0.5	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-63.2	130.7	-178.6	25.7	-33.9	0	0	0	111	L146	P141-L146 HydrophobicContact CB-CD2 4.31Å; P141-L146 HydrophobicContact CB-CG 4.38Å; P141-L146 HydrophobicContact CG-CD2 4.32Å
142	T	74.5	Confident	62	Low	72 Å²	72	93.3 Å²	93.3	44%	0.442	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-68.8	157.4	-177.8	62.7	0	0	0	0	112	T140 A144 Q145 L146	T140-T142 PolarHBondContact O-N 3.37Å; T142-A144 PolarHBondContact O-N 3.49Å; T142-Q145 PolarHBondContact O-N 3.33Å; T142-Q145 VanDerWaalsContact O-N 3.15Å; T142-Q145 WeakPolarHBondContact OG1-CG 3.48Å; T142-Q145 PolarHBondContact OG1-N 2.86Å; T142-Q145 PolarHBondContact OG1-OE1 2.98Å; T142-L146 WeakPolarHBondContact O-CG 3.29Å; T142-L146 PolarHBondContact O-N 2.9Å
143	L	60.4	Low	61.2	Low	116 Å²	116	95.2 Å²	95.2	61%	0.607	53%	0.527	S	S	*	.	H	α-helix	trans	-58.5	-30.8	174.5	-171.5	66.4	0	0	0	112.1	N147	L143-N147 WeakPolarHBondContact O-CB 3.34Å; L143-N147 PolarHBondContact O-N 3.46Å; L143-N147 PolarHBondContact O-ND2 2.89Å
144	A	69.2	Low	60.9	Low	71 Å²	71	98 Å²	98	59%	0.587	55%	0.547	S	S	*	.	H	α-helix	trans	-66.6	-49.7	174.4	0	0	0	0	0	111.8	T142 L146 N147 S148	T142-A144 PolarHBondContact O-N 3.49Å; A144-L146 VanDerWaalsContact C-N 3.33Å; A144-L146 PolarHBondContact O-N 3.08Å; A144-N147 PolarHBondContact O-N 3.35Å; A144-N147 VanDerWaalsContact O-N 3.09Å; A144-S148 PolarHBondContact O-N 3.21Å; A144-S148 PolarHBondContact O-OG 3.2Å
145	Q	72.3	Confident	59.9	Low	107 Å²	107	97.9 Å²	97.9	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-58.2	-44.2	176.8	-74.6	161	-50.3	0	0	111.8	T142 N147 S148	T142-Q145 PolarHBondContact O-N 3.33Å; T142-Q145 VanDerWaalsContact O-N 3.15Å; T142-Q145 WeakPolarHBondContact OG1-CG 3.48Å; T142-Q145 PolarHBondContact OG1-N 2.86Å; T142-Q145 PolarHBondContact OG1-OE1 2.98Å; Q145-N147 PolarHBondContact O-N 2.93Å; Q145-S148 WeakPolarHBondContact CA-OG 3.47Å; Q145-S148 PolarHBondContact O-N 2.95Å; Q145-S148 PolarHBondContact O-OG 3.32Å
146	L	71.4	Confident	59.2	Low	34 Å²	34	100.9 Å²	100.9	18%	0.178	57%	0.571	C	S	.	*	H	α-helix	trans	-65.3	-22	177.9	-67.4	174.7	0	0	0	114.1	P141 T142 A144	P141-L146 HydrophobicContact CB-CD2 4.31Å; P141-L146 HydrophobicContact CB-CG 4.38Å; P141-L146 HydrophobicContact CG-CD2 4.32Å; T142-L146 WeakPolarHBondContact O-CG 3.29Å; T142-L146 PolarHBondContact O-N 2.9Å; A144-L146 VanDerWaalsContact C-N 3.33Å; A144-L146 PolarHBondContact O-N 3.08Å
147	N	67.8	Low	58.7	Low	88 Å²	88	102.3 Å²	102.3	47%	0.471	59%	0.589	S	S	.	*	H	α-helix	trans	-91.7	-33.1	176.1	-71	-15.4	0	0	0	112.2	L143 A144 Q145 E149 D150	L143-N147 WeakPolarHBondContact O-CB 3.34Å; L143-N147 PolarHBondContact O-N 3.46Å; L143-N147 PolarHBondContact O-ND2 2.89Å; A144-N147 PolarHBondContact O-N 3.35Å; A144-N147 VanDerWaalsContact O-N 3.09Å; Q145-N147 PolarHBondContact O-N 2.93Å; N147-E149 VanDerWaalsContact C-N 3.25Å; N147-E149 PolarHBondContact O-N 2.81Å; N147-D150 PolarHBondContact O-N 3.06Å
148	S	65.5	Low	57.9	Low	70 Å²	70	106.4 Å²	106.4	49%	0.49	61%	0.611	S	S	.	*	H	α-helix	trans	-64	-27.7	179.5	47.8	0	0	0	0	113.8	A144 Q145 D150 S151	A144-S148 PolarHBondContact O-N 3.21Å; A144-S148 PolarHBondContact O-OG 3.2Å; Q145-S148 WeakPolarHBondContact CA-OG 3.47Å; Q145-S148 PolarHBondContact O-N 2.95Å; Q145-S148 PolarHBondContact O-OG 3.32Å; S148-D150 VanDerWaalsContact C-N 3.27Å; S148-D150 PolarHBondContact O-N 3.24Å; S148-S151 PolarHBondContact O-N 3.09Å
149	E	56.7	Low	56.9	Low	108 Å²	108	112.2 Å²	112.2	51%	0.505	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-67	-22.1	176.7	-67.4	-177.8	160.6	0	0	113.9	N147	N147-E149 VanDerWaalsContact C-N 3.25Å; N147-E149 PolarHBondContact O-N 2.81Å
150	D	54.3	Low	55.9	Low	107 Å²	107	108.2 Å²	108.2	57%	0.572	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-84.3	-9.8	178.2	-87.5	-2.3	0	0	0	113.5	N147 S148 L152 R600	N147-D150 PolarHBondContact O-N 3.06Å; S148-D150 VanDerWaalsContact C-N 3.27Å; S148-D150 PolarHBondContact O-N 3.24Å; D150-L152 VanDerWaalsContact C-N 3.35Å; D150-R600 IonicContact OD1-CZ 2.66Å; D150-R600 IonicContact OD1-NH1 3.74Å; D150-R600 PolarHBondContact OD1-NH1 3.07Å; D150-R600 IonicContact OD1-NH2 2.87Å; D150-R600 PolarHBondContact OD1-NH2 3.28Å; D150-R600 IonicContact OD2-CZ 2.7Å; D150-R600 IonicContact OD2-NH1 3.27Å; D150-R600 PolarHBondContact OD2-NH1 3.27Å; D150-R600 IonicContact OD2-NH2 3.16Å
151	S	53.3	Low	54.6	Low	100 Å²	100	110.6 Å²	110.6	70%	0.699	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-86.2	-2.6	-178.8	-60.4	0	0	0	0	114	S148	S148-S151 PolarHBondContact O-N 3.09Å
152	L	52.5	Low	53.2	Low	135 Å²	135	112.7 Å²	112.7	71%	0.707	65%	0.646	S	S	*	*	S	Bend	trans	-83.4	123	179.6	-65.9	176.3	0	0	0	111	D150	D150-L152 VanDerWaalsContact C-N 3.35Å
153	P	45.7	Very low	51.4	Low	102 Å²	102	117 Å²	117	66%	0.662	67%	0.666	S	S	*	*			trans	-68.3	141.4	-179.1	27.7	-34.2	0	0	0	111.9	C155	P153-C155 PolarHBondContact O-N 2.93Å
154	V	50.1	Low	50.2	Low	145 Å²	145	119 Å²	119	88%	0.879	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	44.6	-170.7	-161.5	0	0	0	0	112.8
155	C	40.8	Very low	48.4	Very low	105 Å²	105	121.6 Å²	121.6	71%	0.709	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-19.7	-172.1	-64.6	0	0	0	0	114.3	P153 A157	P153-C155 PolarHBondContact O-N 2.93Å; C155-A157 PolarHBondContact O-N 3.13Å
156	E	44.2	Very low	46.4	Very low	186 Å²	186	124.3 Å²	124.3	87%	0.869	70%	0.702	S	S	*	*	S	Bend	trans	-84	-9.1	-168.5	-160.3	158.3	-153.8	0	0	114.2	L158	E156-L158 PolarHBondContact O-N 2.88Å; E156-L158 VanDerWaalsContact O-N 3.12Å
157	A	48.6	Very low	44.6	Very low	93 Å²	93	128.4 Å²	128.4	77%	0.769	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	16.8	-175.6	0	0	0	0	0	115.6	C155	C155-A157 PolarHBondContact O-N 3.13Å
158	L	42.8	Very low	42.6	Very low	156 Å²	156	130.3 Å²	130.3	82%	0.817	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	19.8	-171.4	-75.5	177.9	0	0	0	115.9	E156	E156-L158 PolarHBondContact O-N 2.88Å; E156-L158 VanDerWaalsContact O-N 3.12Å
159	Y	34.5	Very low	40.9	Very low	218 Å²	218	132.2 Å²	132.2	86%	0.855	76%	0.763	S	S	*	*			trans	-126.2	120.7	163.3	-89	-87.4	0	0	0	111.4
160	P	38.2	Very low	39.6	Very low	104 Å²	104	136 Å²	136	68%	0.675	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.1	135.4	170.1	31.2	-32.1	0	0	0	109.8	V162	P160-V162 PolarHBondContact O-N 2.73Å
161	P	38.8	Very low	38.6	Very low	129 Å²	129	136.5 Å²	136.5	84%	0.838	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.1	129.9	171.5	28.3	-33	0	0	0	109.7
162	V	35.3	Very low	37.7	Very low	121 Å²	121	137.1 Å²	137.1	73%	0.733	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-94.9	116	171.5	175.9	0	0	0	0	107.9	P160 L164	P160-V162 PolarHBondContact O-N 2.73Å; V162-L164 HydrophobicContact CG1-CD1 4.48Å; V162-L164 PolarHBondContact O-N 2.99Å
163	D	37.3	Very low	36.6	Very low	163 Å²	163	136.1 Å²	136.1	87%	0.872	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-58.8	122.7	171.3	-81.4	-49.2	0	0	0	110.9
164	L	34.3	Very low	35.9	Very low	157 Å²	157	140 Å²	140	82%	0.822	81%	0.805	S	S	*	*			trans	-153.1	117.8	163	-110.2	149.6	0	0	0	110.5	V162	V162-L164 HydrophobicContact CG1-CD1 4.48Å; V162-L164 PolarHBondContact O-N 2.99Å
165	T	32	Very low	35.2	Very low	126 Å²	126	138.4 Å²	138.4	77%	0.773	80%	0.798	S	S	*	*			trans	-73.9	134.6	-177.7	50.5	0	0	0	0	112.4
166	L	30.8	Very low	34.5	Very low	163 Å²	163	140.5 Å²	140.5	85%	0.853	80%	0.801	S	S	*	*			trans	30.4	150.7	142.9	-65	171	0	0	0	121.3
167	P	33.6	Very low	34.2	Very low	120 Å²	120	137 Å²	137	78%	0.779	80%	0.795	S	S	*	*			cis	-127.7	179.5	-23.7	39.6	-24.7	0	0	0	112
168	C	24.2	Very low	33.1	Very low	129 Å²	129	137.2 Å²	137.2	87%	0.872	79%	0.79	S	S	*	*			trans	-139.8	119.4	167.3	-164.9	0	0	0	0	111.4
169	S	29.8	Very low	32.5	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-85.7	163	171.9	53.4	0	0	0	0	111.6
170	Q	31	Very low	32.2	Very low	186 Å²	186	132.1 Å²	132.1	87%	0.869	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.7	156.7	-177.6	-83.1	-168.4	-5.5	0	0	114.7
171	P	33.3	Very low	32	Very low	118 Å²	118	135.1 Å²	135.1	77%	0.766	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-82.7	172.4	-167.1	35.4	-38.8	0	0	0	113.6
172	P	33.8	Very low	31.7	Very low	113 Å²	113	139.1 Å²	139.1	73%	0.734	78%	0.775	S	S	*	*				-138.7	164.5	123.2	38.7	-29.4	0	0	0	115.6
173	S	29.1	Very low	31.6	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	77%	0.767	S	S	*	*			trans	68.2	123.1	154.3	51.5	0	0	0	0	121.1
174	Q	30.9	Very low	31.4	Very low	183 Å²	183	139.5 Å²	139.5	86%	0.855	77%	0.766	S	S	*	*			trans	-62.5	171.9	153.4	-65.1	-177.5	-0.2	0	0	111.2
175	P	36.2	Very low	31	Very low	113 Å²	113	135.1 Å²	135.1	73%	0.734	76%	0.758	S	S	*	*			cis	-140.5	173.9	18.2	42	-22.7	0	0	0	119
176	L	26.1	Very low	31.1	Very low	149 Å²	149	138 Å²	138	78%	0.78	77%	0.768	S	S	*	*			trans	-41	150.3	153	-87.7	162.8	0	0	0	113.2
177	P	36.6	Very low	31	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	76%	0.762	S	S	*	*				-146.5	150.1	68.7	38.9	-20.4	0	0	0	119
178	S	25.6	Very low	31	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	76%	0.764	S	S	*	*			trans	32	134.9	131.2	-50.3	0	0	0	0	121.1
179	Q	30.8	Very low	31.3	Very low	163 Å²	163	133.4 Å²	133.4	76%	0.762	76%	0.759	S	S	*	*				-176.5	120.3	106.7	-85.5	-106.5	-2.1	0	0	114
180	N	27.8	Very low	31.4	Very low	105 Å²	105	134.2 Å²	134.2	56%	0.561	76%	0.764	S	S	*	*			trans	58.9	126.5	133.3	-88.1	-35.9	0	0	0	124.4
181	K	35.1	Very low	31.6	Very low	166 Å²	166	130.7 Å²	130.7	72%	0.722	76%	0.755	S	S	*	*				87	101.9	124.3	-74.6	166.6	-172.5	153.8	0	122.8
182	R	32.8	Very low	31.6	Very low	214 Å²	214	136 Å²	136	81%	0.808	76%	0.76	S	S	*	*				79.3	141.4	106.3	-114.5	-168.4	172.3	-149.7	-1.9	121.9
183	L	32.8	Very low	32.3	Very low	109 Å²	109	136 Å²	136	57%	0.571	76%	0.761	S	S	*	*			trans	73.1	125.5	155	-60	173.4	0	0	0	116.1
184	Q	32.3	Very low	32.7	Very low	183 Å²	183	135.6 Å²	135.6	86%	0.855	76%	0.757	S	S	*	*				60.2	130.4	71.9	-63	178.9	7.1	0	0	113
185	G	27.3	Very low	33.7	Very low	64 Å²	64	133 Å²	133	66%	0.66	76%	0.757	S	S	*	*			cis	147.9	148.1	-4.3	0	0	0	0	0	112.6
186	L	32.9	Very low	33.3	Very low	188 Å²	188	133 Å²	133	98%	0.984	76%	0.757	S	S	*	*			trans	68	140.5	179.6	-47.6	169.6	0	0	0	114.6
187	G	29.3	Very low	33.6	Very low	70 Å²	70	131.7 Å²	131.7	72%	0.722	76%	0.761	S	S	*	*			cis	-155.5	-133.2	-6.9	0	0	0	0	0	108.7
188	V	33.8	Very low	33.3	Very low	134 Å²	134	131.3 Å²	131.3	81%	0.812	77%	0.768	S	S	*	*			cis	-159.6	148.4	-5	-161.1	0	0	0	0	108.4
189	S	31.3	Very low	33.5	Very low	110 Å²	110	132.7 Å²	132.7	77%	0.769	78%	0.777	S	S	*	*			trans	51.5	123.4	158.6	-71	0	0	0	0	123.4
190	S	31.3	Very low	33.5	Very low	127 Å²	127	131.1 Å²	131.1	89%	0.888	78%	0.784	S	S	*	*				-162.2	169.4	104.2	-159.9	0	0	0	0	111.4
191	V	33.8	Very low	33.6	Very low	112 Å²	112	130.9 Å²	130.9	68%	0.679	79%	0.791	S	S	*	*			trans	-142.2	129	-149.4	170.6	0	0	0	0	116.4
192	R	35	Very low	33.5	Very low	230 Å²	230	132 Å²	132	87%	0.868	80%	0.799	S	S	*	*			trans	65.8	172.8	156.1	-87.1	-176.9	171.1	-128.3	-2.2	119.2
193	P	48.4	Very low	33.3	Very low	114 Å²	114	127.2 Å²	127.2	74%	0.74	80%	0.798	S	S	*	*			cis	-127.7	170.3	-1.6	23.5	0.2	0	0	0	117.4
194	S	37.6	Very low	33.4	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	81%	0.813	S	S	*	*			trans	-88.6	172.5	161.8	-39.7	0	0	0	0	111.3
195	P	50.9	Low	33.9	Very low	130 Å²	130	129.9 Å²	129.9	84%	0.844	81%	0.807	S	S	*	*				-148.5	-155.5	81.7	40.9	-20.7	0	0	0	114.4
196	C	28.5	Very low	34.2	Very low	111 Å²	111	132.3 Å²	132.3	75%	0.75	81%	0.813	S	S	*	*			trans	-117.8	167.6	-152.7	-44.5	0	0	0	0	116.4
197	S	31.7	Very low	34.2	Very low	122 Å²	122	134 Å²	134	85%	0.853	81%	0.807	S	S	*	*			trans	65.6	122.1	143.9	-56.3	0	0	0	0	122
198	A	30	Very low	34.3	Very low	106 Å²	106	134.6 Å²	134.6	88%	0.876	80%	0.8	S	S	*	*			trans	-154.9	148.6	141.8	0	0	0	0	0	110.4
199	S	31.3	Very low	34.2	Very low	125 Å²	125	136.5 Å²	136.5	87%	0.874	80%	0.804	S	S	*	*			trans	-114.7	148.8	-177.5	-47.6	0	0	0	0	111.8
200	S	29.1	Very low	34.2	Very low	129 Å²	129	139.5 Å²	139.5	90%	0.902	80%	0.804	S	S	*	*			trans	-159.4	161.3	158.1	52.6	0	0	0	0	112
201	S	31.6	Very low	34.2	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	80%	0.797	S	S	*	*			trans	-131.1	-176.3	-171	60.9	0	0	0	0	111.7
202	Q	31.3	Very low	34.1	Very low	190 Å²	190	137.7 Å²	137.7	89%	0.888	79%	0.793	S	S	*	*			trans	77.7	150.3	-176.7	-42.2	175.1	27.1	0	0	113.1
203	S	29.2	Very low	34.1	Very low	113 Å²	113	135.5 Å²	135.5	79%	0.79	79%	0.79	S	S	*	*			cis	-149.3	168.9	8.5	56.3	0	0	0	0	113
204	R	34.3	Very low	34	Very low	239 Å²	239	135.6 Å²	135.6	90%	0.902	79%	0.791	S	S	*	*			trans	-100.2	153.6	162.7	-93	-174.7	172.9	-158.9	-1	108.2
205	P	43.7	Very low	33.7	Very low	110 Å²	110	139 Å²	139	71%	0.714	80%	0.795	S	S	*	*				-161.3	164.3	77.8	41.5	-20.4	0	0	0	120.4
206	S	33	Very low	32.6	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	80%	0.796	S	S	*	*			trans	69.3	157.5	150.3	72.1	0	0	0	0	119.2
207	R	32.5	Very low	33.2	Very low	224 Å²	224	137.9 Å²	137.9	85%	0.845	79%	0.792	S	S	*	*			cis	-154.9	139	11.2	-152.8	-167.1	-175.3	-162.6	0.9	114
208	S	31.6	Very low	33.4	Very low	83 Å²	83	141.3 Å²	141.3	58%	0.58	80%	0.795	S	S	*	*			trans	43.1	131.8	147.2	63.1	0	0	0	0	124.3
209	L	32.2	Very low	33.6	Very low	173 Å²	173	145.8 Å²	145.8	91%	0.906	79%	0.794	S	S	*	*				-158.2	170.7	109	-100.6	170.6	0	0	0	110.4
210	F	31.6	Very low	33.7	Very low	173 Å²	173	144.2 Å²	144.2	76%	0.759	79%	0.789	S	S	*	*			trans	-133	145	-155.7	-104.3	-91.9	0	0	0	116.2
211	A	30.6	Very low	33.9	Very low	91 Å²	91	144.4 Å²	144.4	75%	0.752	79%	0.785	S	S	*	*			trans	179.6	122.7	138.8	0	0	0	0	0	107.8
212	D	31.7	Very low	34.3	Very low	110 Å²	110	151 Å²	151	59%	0.588	79%	0.794	S	S	*	*			cis	73.9	126.1	41.7	-63.9	-14.4	0	0	0	112.9
213	F	35.7	Very low	34.8	Very low	185 Å²	185	147.8 Å²	147.8	81%	0.811	79%	0.79	S	S	*	*			cis	-164.7	-179.8	-7.1	-112.7	-78.4	0	0	0	105.3
214	P	47	Very low	34.9	Very low	116 Å²	116	149.3 Å²	149.3	75%	0.753	79%	0.794	S	S	*	*			cis	-129.6	168.2	-15.2	40.3	-24.6	0	0	0	115.8
215	E	30.9	Very low	35.1	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	79%	0.789	S	S	*	*			trans	-117.8	140	162.1	-174	-177.7	156	0	0	110.1
216	S	28.3	Very low	34.4	Very low	122 Å²	122	142.6 Å²	142.6	85%	0.853	79%	0.793	S	S	*	*			trans	-118.8	75.2	-179.7	63.5	0	0	0	0	112.2
217	S	39	Very low	34.4	Very low	96 Å²	96	141.6 Å²	141.6	67%	0.671	79%	0.786	S	S	*	*			trans	-101.2	107.1	174.9	-166.6	0	0	0	0	110.7
218	Q	37.8	Very low	34.6	Very low	195 Å²	195	137.4 Å²	137.4	91%	0.911	79%	0.785	S	S	*	*			trans	-118.3	157.7	176	-78.9	-161.6	-6.9	0	0	112.2
219	K	34.1	Very low	34.7	Very low	199 Å²	199	142.3 Å²	142.3	87%	0.865	80%	0.799	S	S	*	*			trans	-136.2	119.1	-159.3	16.1	-179.8	169.8	-174.9	0	109.5
220	A	31.7	Very low	35.1	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	79%	0.793	S	S	*	*			trans	-144.8	116.6	173.2	0	0	0	0	0	107.4
221	T	34.9	Very low	35	Very low	133 Å²	133	140.7 Å²	140.7	82%	0.816	80%	0.8	S	S	*	*				75.4	97.7	78.9	-56.8	0	0	0	0	112.1
222	R	38.4	Very low	35.1	Very low	237 Å²	237	140.2 Å²	140.2	89%	0.894	80%	0.796	S	S	*	*			trans	-72.1	136.6	162.6	-65.2	-178.6	177.7	-172.3	-1.1	109.4
223	P	41.8	Very low	35.5	Very low	124 Å²	124	144.7 Å²	144.7	81%	0.805	81%	0.81	S	S	*	*			trans	-78.3	149.3	159.7	32.7	-31.9	0	0	0	110.7
224	V	32.3	Very low	35.3	Very low	144 Å²	144	141.8 Å²	141.8	87%	0.873	81%	0.808	S	S	*	*			trans	-109.5	153	173.1	169.8	0	0	0	0	109.3
225	A	39.2	Very low	34.5	Very low	96 Å²	96	143.7 Å²	143.7	79%	0.793	81%	0.807	S	S	*	*			trans	-80.2	155	-167.9	0	0	0	0	0	115.5
226	S	28.2	Very low	34.4	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	81%	0.809	S	S	*	*			trans	-179.6	144.6	159.7	-178	0	0	0	0	108.7
227	S	33.3	Very low	34.5	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	80%	0.803	S	S	*	*			cis	-161.6	160.1	-22.9	-77.5	0	0	0	0	108.2
228	T	36.4	Very low	34.1	Very low	136 Å²	136	148.7 Å²	148.7	83%	0.834	82%	0.816	S	S	*	*			trans	38.3	124	152.3	55	0	0	0	0	121.4
229	E	33.8	Very low	33.7	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	81%	0.807	S	S	*	*				-162.3	157.4	110.3	-166.8	154.6	105.9	0	0	110.6
230	T	41.5	Very low	33.6	Very low	129 Å²	129	141.7 Å²	141.7	79%	0.791	81%	0.81	S	S	*	*			trans	-117.1	138.2	175.2	54.3	0	0	0	0	110.8
231	M	29.5	Very low	33.6	Very low	184 Å²	184	141.5 Å²	141.5	91%	0.906	81%	0.808	S	S	*	*			trans	-159.1	164.9	167.5	-102	-67.4	173.9	0	0	112.4
232	A	32.8	Very low	33.5	Very low	80 Å²	80	144 Å²	144	66%	0.661	81%	0.811	S	S	*	*			trans	-98.3	144.6	-157.3	0	0	0	0	0	116.9
233	K	38.3	Very low	33.2	Very low	205 Å²	205	139.1 Å²	139.1	89%	0.891	80%	0.803	S	S	*	*				27.9	98.2	129.9	-172	179.7	-179.8	173	0	118
234	T	32.2	Very low	32.8	Very low	124 Å²	124	141.8 Å²	141.8	76%	0.761	80%	0.804	S	S	*	*			trans	-128.1	116.8	153.4	47.8	0	0	0	0	108
235	Q	30	Very low	32.9	Very low	155 Å²	155	139.1 Å²	139.1	72%	0.724	80%	0.797	S	S	*	*				63.5	106.1	81.8	-169.6	-176.5	18.8	0	0	113.1
236	N	29.7	Very low	32.6	Very low	163 Å²	163	143.3 Å²	143.3	87%	0.872	80%	0.8	S	S	*	*			trans	-136.2	128.5	151.7	-162.2	-15.8	0	0	0	108.1
237	Q	29.6	Very low	32.7	Very low	153 Å²	153	142 Å²	142	72%	0.715	80%	0.796	S	S	*	*			trans	-118	121.7	178.6	-71.6	-175.5	110.3	0	0	108.6
238	L	31.7	Very low	32.8	Very low	182 Å²	182	145.7 Å²	145.7	95%	0.953	80%	0.803	S	S	*	*			trans	-86.4	111.4	160.2	-163.9	72.8	0	0	0	107.9
239	G	28.2	Very low	33.3	Very low	70 Å²	70	144.3 Å²	144.3	72%	0.722	80%	0.797	S	S	*	*			trans	-82.8	140.3	-177	0	0	0	0	0	112.8
240	L	32.8	Very low	33.3	Very low	176 Å²	176	144.6 Å²	144.6	92%	0.921	80%	0.795	S	S	*	*			trans	-141.7	127.1	162.4	-135.7	151.7	0	0	0	107.3
241	A	31	Very low	33.9	Very low	89 Å²	89	143.7 Å²	143.7	74%	0.736	79%	0.792	S	S	*	*			trans	-86.2	149.5	-170.9	0	0	0	0	0	111.9
242	Q	32	Very low	34.9	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.864	79%	0.785	S	S	*	*				173.3	138.9	101.4	-171.7	158.1	-23.2	0	0	111.4
243	D	32.9	Very low	34.9	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	79%	0.792	S	S	*	*			trans	-67.8	150	-177.1	-67.3	-86.3	0	0	0	115
244	H	33.7	Very low	34.8	Very low	180 Å²	180	142.9 Å²	142.9	83%	0.833	80%	0.795	S	S	*	*				-174.3	125.4	102.5	-100.7	71.5	0	0	0	114.7
245	A	33.4	Very low	34.8	Very low	88 Å²	88	140.3 Å²	140.3	73%	0.727	79%	0.793	S	S	*	*			trans	55.8	152.2	141.7	0	0	0	0	0	120.7
246	Q	33.2	Very low	35	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	80%	0.798	S	S	*	*			cis	-160.5	153.8	-0.4	-138.7	177.6	10.7	0	0	110.7
247	A	31.3	Very low	35.2	Very low	86 Å²	86	138.7 Å²	138.7	71%	0.711	79%	0.794	S	S	*	*			trans	56.1	134.8	162.1	0	0	0	0	0	119.1
248	Q	35.3	Very low	35.4	Very low	169 Å²	169	139.7 Å²	139.7	79%	0.79	80%	0.801	S	S	*	*			cis	67	143.8	42	-61.4	-70.7	-11.6	0	0	114.6
249	P	47.1	Very low	35.4	Very low	108 Å²	108	136.2 Å²	136.2	70%	0.701	80%	0.799	S	S	*	*			cis	-136.1	169.2	-9.8	32.7	-10.6	0	0	0	117.1
250	K	33.9	Very low	35.7	Very low	190 Å²	190	137.4 Å²	137.4	83%	0.826	80%	0.802	S	S	*	*			trans	2.2	171.4	135.3	-86.1	-179.3	177.5	176.5	0	121.2
251	P	52.4	Low	36.2	Very low	111 Å²	111	134.2 Å²	134.2	72%	0.721	79%	0.792	S	S	*	*			cis	-138.5	-128.7	-16.6	31.7	-4.3	0	0	0	114.4
252	P	51.9	Low	36.2	Very low	119 Å²	119	136 Å²	136	77%	0.773	79%	0.794	S	S	*	*				-133.2	167.8	-90.9	39.1	-20.5	0	0	0	119.3
253	G	32	Very low	36.3	Very low	77 Å²	77	132.8 Å²	132.8	79%	0.794	79%	0.792	S	S	*	*			trans	91.4	174.4	146.9	0	0	0	0	0	117.9
254	R	36.2	Very low	36.4	Very low	256 Å²	256	135.1 Å²	135.1	97%	0.966	80%	0.797	S	S	*	*			cis	-167.3	145.4	-7.4	-143	-175.3	-167.8	-148.9	5.8	110.7
255	G	31.7	Very low	36	Very low	70 Å²	70	132 Å²	132	72%	0.722	80%	0.796	S	S	*	*			trans	85.8	144	173.5	0	0	0	0	0	114.5
256	A	34.1	Very low	36.1	Very low	99 Å²	99	132 Å²	132	82%	0.818	80%	0.796	S	S	*	*			cis	78.9	132	24.6	0	0	0	0	0	114.5
257	K	35.2	Very low	36.2	Very low	185 Å²	185	130.6 Å²	130.6	80%	0.804	79%	0.794	S	S	*	*			cis	-165.7	162.2	-4.4	-135.7	-178.5	-176.3	-175.1	0	110.4
258	M	34	Very low	36.5	Very low	173 Å²	173	136.3 Å²	136.3	85%	0.852	80%	0.803	S	S	*	*			trans	65.6	116	165.2	-53	-61.4	-143.8	0	0	120
259	A	31.8	Very low	36.4	Very low	109 Å²	109	135.1 Å²	135.1	90%	0.901	81%	0.807	S	S	*	*			trans	178.9	151.2	130.9	0	0	0	0	0	111.1
260	A	32.8	Very low	36.2	Very low	95 Å²	95	141 Å²	141	79%	0.785	82%	0.816	S	S	*	*			trans	-148.8	169.4	174.4	0	0	0	0	0	108.4
261	P	45.2	Very low	36.5	Very low	110 Å²	110	142 Å²	142	71%	0.714	82%	0.82	S	S	*	*			cis	-134.1	-179.2	7.3	40.5	-21.9	0	0	0	116.1
262	T	31	Very low	36	Very low	127 Å²	127	141.4 Å²	141.4	78%	0.779	83%	0.825	S	S	*	*			trans	42.2	108.9	151.9	52.4	0	0	0	0	121.3
263	S	33.8	Very low	35.2	Very low	117 Å²	117	144.7 Å²	144.7	82%	0.818	83%	0.827	S	S	*	*				-173.2	156.9	111.8	36.5	0	0	0	0	113.2
264	H	33.2	Very low	35	Very low	184 Å²	184	147.3 Å²	147.3	85%	0.852	83%	0.827	S	S	*	*			trans	-30.8	131.8	-171.6	-53	-88.9	0	0	0	120.5
265	S	27.1	Very low	35	Very low	116 Å²	116	145.7 Å²	145.7	81%	0.811	82%	0.821	S	S	*	*				179	154.5	98.3	46	0	0	0	0	113.7
266	A	35.6	Very low	35.1	Very low	86 Å²	86	149.3 Å²	149.3	71%	0.711	83%	0.829	S	S	*	*			trans	33.4	115.7	163	0	0	0	0	0	121.3
267	D	34	Very low	35	Very low	155 Å²	155	149.8 Å²	149.8	83%	0.829	83%	0.826	S	S	*	*				177.9	125.9	99.8	-98.5	-23.3	0	0	0	112.7
268	F	37.6	Very low	35	Very low	206 Å²	206	146.8 Å²	146.8	90%	0.904	83%	0.828	S	S	*	*			trans	-112.9	112.6	176.1	-84.7	-80	0	0	0	112	R270	F268-R270 PolarHBondContact O-N 3.43Å
269	V	33	Very low	34.9	Very low	144 Å²	144	142 Å²	142	87%	0.873	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-71	119	179.5	179.8	0	0	0	0	110.9
270	R	44.2	Very low	35.3	Very low	233 Å²	233	143.1 Å²	143.1	88%	0.879	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-79.9	129.8	178.2	-53.5	-176.3	-163	-159	4.4	110.3	F268 A272	F268-R270 PolarHBondContact O-N 3.43Å; R270-A272 PolarHBondContact O-N 3.38Å
271	K	40	Very low	35.5	Very low	210 Å²	210	150.1 Å²	150.1	91%	0.913	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-61	129.6	174.8	-68.6	-88	-175.5	169.7	0	110
272	A	41.3	Very low	35.3	Very low	99 Å²	99	150.7 Å²	150.7	82%	0.818	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-75	141	-175.5	0	0	0	0	0	112.8	R270	R270-A272 PolarHBondContact O-N 3.38Å
273	K	34.4	Very low	35.4	Very low	188 Å²	188	152.7 Å²	152.7	82%	0.817	83%	0.832	S	S	*	*			trans	-94.1	108.8	174.7	-175.9	166.3	-174.9	165.4	0	109.9	R275	K273-R275 PolarHBondContact O-N 2.92Å
274	V	28.3	Very low	35.3	Very low	132 Å²	132	150.4 Å²	150.4	80%	0.8	83%	0.827	S	S	*	*			trans	-64.1	126.1	175.9	178.8	0	0	0	0	109.8
275	R	35.6	Very low	35	Very low	222 Å²	222	148.6 Å²	148.6	84%	0.838	82%	0.818	S	S	*	*			trans	-122.4	131.9	162.7	-84.8	-179.3	163	167.8	-5.8	107.5	K273	K273-R275 PolarHBondContact O-N 2.92Å
276	V	33.9	Very low	35.1	Very low	146 Å²	146	148 Å²	148	89%	0.885	82%	0.821	S	S	*	*			trans	-82.5	138.1	168.6	-176	0	0	0	0	107.9
277	S	33	Very low	34.8	Very low	109 Å²	109	152.4 Å²	152.4	76%	0.762	83%	0.828	S	S	*	*			trans	-141	131.3	178.4	55	0	0	0	0	110.8
278	S	34.3	Very low	35.4	Very low	122 Å²	122	149.9 Å²	149.9	85%	0.853	82%	0.82	S	S	*	*			trans	-82.7	159.4	175.8	41.6	0	0	0	0	112.9
279	G	32.3	Very low	35	Very low	72 Å²	72	148 Å²	148	74%	0.742	82%	0.815	S	S	*	*			trans	-74.5	-179.9	-174.5	0	0	0	0	0	116.5
280	P	40.3	Very low	34.8	Very low	132 Å²	132	147.6 Å²	147.6	86%	0.857	81%	0.813	S	S	*	*			trans	-104.4	169.5	-139	38.5	-38.3	0	0	0	116.7
281	R	37.1	Very low	34.1	Very low	242 Å²	242	142.8 Å²	142.8	91%	0.913	81%	0.805	S	S	*	*			trans	-115.2	151.5	159.4	-68	-174.7	179.7	-173.9	1	110.5
282	P	41.7	Very low	33.6	Very low	123 Å²	123	141.4 Å²	141.4	80%	0.799	80%	0.799	S	S	*	*			trans	-85.9	169.2	164	35.2	-33	0	0	0	113.1
283	Q	32.7	Very low	33	Very low	169 Å²	169	145 Å²	145	79%	0.79	80%	0.799	S	S	*	*			trans	-51	158.7	-177.5	-60	162.4	-88.1	0	0	114.6	E285	Q283-E285 PolarHBondContact NE2-OE2 3.48Å
284	G	31.2	Very low	32.9	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	80%	0.8	S	S	*	*			cis	-178.3	-155.2	8.6	0	0	0	0	0	109.8
285	E	28.1	Very low	33.1	Very low	146 Å²	146	146 Å²	146	68%	0.682	80%	0.801	S	S	*	*			cis	-167.6	164	-11	-137.9	77.2	-65.1	0	0	108.6	Q283	Q283-E285 PolarHBondContact NE2-OE2 3.48Å
286	A	29.3	Very low	32.9	Very low	104 Å²	104	142.5 Å²	142.5	86%	0.86	80%	0.799	S	S	*	*			trans	71.1	154	170.3	0	0	0	0	0	121.5
287	M	28.5	Very low	33.3	Very low	177 Å²	177	141.2 Å²	141.2	87%	0.872	79%	0.793	S	S	*	*			trans	-141.5	171.8	178.8	-119.9	-151.9	-148.5	0	0	107.9
288	P	45.7	Very low	33.8	Very low	102 Å²	102	141.9 Å²	141.9	66%	0.662	80%	0.795	S	S	*	*			cis	-143.1	179	31.5	42.7	-22.7	0	0	0	118.1
289	Q	30.8	Very low	34	Very low	167 Å²	167	143.9 Å²	143.9	78%	0.78	80%	0.796	S	S	*	*			trans	26.2	129.6	149.3	-64.1	175.7	-71.9	0	0	121.7
290	T	28.3	Very low	34.8	Very low	136 Å²	136	146.4 Å²	146.4	83%	0.834	80%	0.799	S	S	*	*				-167.9	151.6	99.4	34	0	0	0	0	113.4
291	D	28.7	Very low	34.4	Very low	132 Å²	132	147.3 Å²	147.3	71%	0.706	80%	0.796	S	S	*	*			trans	-14.4	156.9	158.8	-71.9	-88.2	0	0	0	125.3
292	F	31.1	Very low	34.2	Very low	180 Å²	180	142 Å²	142	79%	0.789	80%	0.796	S	S	*	*			trans	83.6	134.4	143	-102.2	-106.3	0	0	0	124.2
293	E	28.5	Very low	33.7	Very low	176 Å²	176	144.5 Å²	144.5	82%	0.822	80%	0.797	S	S	*	*			trans	75.6	173.3	148.8	-126.3	164.4	105.5	0	0	123.3
294	R	32	Very low	34.6	Very low	222 Å²	222	140.4 Å²	140.4	84%	0.838	79%	0.785	S	S	*	*			trans	-126.6	137.9	-149.6	163.1	-160.3	-167.4	171.9	6.8	108.9
295	S	31.4	Very low	34.5	Very low	118 Å²	118	144.9 Å²	144.9	83%	0.825	79%	0.787	S	S	*	*			trans	176.1	165.5	145.2	-83.5	0	0	0	0	113.5
296	D	32.9	Very low	34.7	Very low	149 Å²	149	143.7 Å²	143.7	80%	0.797	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-73.2	163.4	-174	-68.1	-77.7	0	0	0	116.4
297	P	42.3	Very low	34.8	Very low	118 Å²	118	146.8 Å²	146.8	77%	0.766	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-84.5	145.7	-172	32.8	-36.5	0	0	0	115.1
298	P	43.7	Very low	35.2	Very low	123 Å²	123	147.2 Å²	147.2	80%	0.799	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-97.5	155.1	176.5	36.9	-34.6	0	0	0	114.7
299	L	37	Very low	35.2	Very low	165 Å²	165	147.5 Å²	147.5	86%	0.864	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-85.3	147.1	162.1	-65.5	170.4	0	0	0	111
300	P	49.1	Very low	35.1	Very low	124 Å²	124	144.8 Å²	144.8	81%	0.805	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-92.4	138.9	165	34	-30.4	0	0	0	112.5
301	L	31.8	Very low	35.2	Very low	151 Å²	151	143.6 Å²	143.6	79%	0.791	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-81	163.5	173.3	-74.8	83.5	0	0	0	112.5
302	S	33.5	Very low	35.4	Very low	131 Å²	131	142.4 Å²	142.4	92%	0.916	78%	0.775	S	S	*	*			trans	-146.5	154	137.1	-80.2	0	0	0	0	111.7
303	Q	32.3	Very low	35.3	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	77%	0.773	S	S	*	*			trans	-126.9	-175.7	-166.6	-125.4	-169.2	-35.2	0	0	108.2
304	P	49.6	Very low	35.4	Very low	83 Å²	83	135.6 Å²	135.6	54%	0.539	78%	0.775	S	S	.	*			cis	-135.8	-168.2	-20.9	42.5	-26	0	0	0	113.2
305	Q	30.5	Very low	35.4	Very low	164 Å²	164	129.1 Å²	129.1	77%	0.766	77%	0.769	S	S	*	*			trans	68.4	145.4	153.6	-73	-177.3	-85.7	0	0	118.7
306	D	31	Very low	35.5	Very low	121 Å²	121	131.7 Å²	131.7	65%	0.647	77%	0.771	S	S	*	*			cis	-153.8	176.1	-6.9	-135	-37.7	0	0	0	112.9
307	E	32.3	Very low	35.5	Very low	169 Å²	169	129.6 Å²	129.6	79%	0.79	77%	0.769	S	S	*	*			trans	70.4	158.3	160.9	-72.5	-81	53.7	0	0	120.2
308	K	36.3	Very low	35.1	Very low	186 Å²	186	131 Å²	131	81%	0.809	78%	0.775	S	S	*	*			trans	-129	-162.2	-175.2	-44.5	171.9	-178.6	167.9	0	108.5
309	P	46.3	Very low	34.4	Very low	107 Å²	107	128.1 Å²	128.1	70%	0.695	77%	0.767	S	S	*	*			cis	-131.5	178	-23	38	-21.9	0	0	0	114.1
310	S	28.2	Very low	34.1	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	77%	0.768	S	S	*	*			trans	69.4	167.6	143.5	-82.8	0	0	0	0	120.7
311	T	31.1	Very low	33	Very low	112 Å²	112	128.5 Å²	128.5	69%	0.687	77%	0.771	S	S	*	*			cis	-171.5	144.1	-32.6	-89.3	0	0	0	0	108.5
312	S	31.7	Very low	33.1	Very low	107 Å²	107	127.7 Å²	127.7	75%	0.748	77%	0.773	S	S	*	*			trans	63.2	114	161.8	-69.5	0	0	0	0	121.8
313	A	30.2	Very low	33.6	Very low	89 Å²	89	127.2 Å²	127.2	74%	0.736	77%	0.767	S	S	*	*				46.5	128.8	117.4	0	0	0	0	0	121.5
314	S	30.4	Very low	33.4	Very low	124 Å²	124	126.8 Å²	126.8	87%	0.867	77%	0.765	S	S	*	*				-171.3	164.5	96	-80.1	0	0	0	0	113.7
315	A	32.1	Very low	33.4	Very low	86 Å²	86	128.4 Å²	128.4	71%	0.711	78%	0.775	S	S	*	*			trans	-73.2	168.8	-173.7	0	0	0	0	0	115.3
316	I	33.1	Very low	33.5	Very low	171 Å²	171	125.9 Å²	125.9	88%	0.877	78%	0.776	S	S	*	*				-151.7	146.6	123.3	-95.5	146.4	0	0	0	108.7
317	S	32.2	Very low	33.5	Very low	106 Å²	106	123.9 Å²	123.9	74%	0.741	78%	0.783	S	S	*	*			trans	-91.9	151.4	-169.9	-38	0	0	0	0	114.2
318	V	34	Very low	33.6	Very low	148 Å²	148	121.9 Å²	121.9	90%	0.897	79%	0.788	S	S	*	*			trans	-143.7	138.9	140.7	-163.5	0	0	0	0	108.3
319	G	30.5	Very low	33.3	Very low	62 Å²	62	117.7 Å²	117.7	64%	0.639	79%	0.788	S	S	*	*			trans	-104.3	-156.3	170.3	0	0	0	0	0	111.8
320	H	29.6	Very low	32.4	Very low	192 Å²	192	117.7 Å²	117.7	89%	0.889	79%	0.791	S	S	*	*			cis	-166.8	114.7	-2.6	-157.8	-102.8	0	0	0	107.9
321	A	27.3	Very low	32.6	Very low	104 Å²	104	119.9 Å²	119.9	86%	0.86	79%	0.793	S	S	*	*			trans	-163.1	129.2	170.7	0	0	0	0	0	113.6
322	T	32.9	Very low	32.5	Very low	135 Å²	135	123.7 Å²	123.7	83%	0.828	80%	0.803	S	S	*	*			trans	-107.9	-176.3	170.6	38.5	0	0	0	0	109.6
323	P	44	Very low	32.3	Very low	121 Å²	121	122.2 Å²	122.2	79%	0.786	81%	0.805	S	S	*	*			cis	-132.9	-174.7	-5.9	27.3	-2.8	0	0	0	115.6
324	Q	28.8	Very low	32.2	Very low	166 Å²	166	127.9 Å²	127.9	78%	0.776	81%	0.813	S	S	*	*			trans	-63.6	-169.4	152.8	-119.7	-173.7	-14	0	0	112.1
325	P	49.5	Very low	32.2	Very low	116 Å²	116	129.2 Å²	129.2	75%	0.753	81%	0.805	S	S	*	*			cis	-146.1	-173.4	29.1	45.1	-24.1	0	0	0	118.1
326	S	32.6	Very low	32.2	Very low	112 Å²	112	131.6 Å²	131.6	78%	0.783	81%	0.805	S	S	*	*			trans	-85.1	161.3	162.9	-42.9	0	0	0	0	112.1
327	G	30.1	Very low	32.1	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	80%	0.802	S	S	*	*			trans	173.9	146.6	168.2	0	0	0	0	0	114
328	S	34.6	Very low	32.2	Very low	128 Å²	128	131.2 Å²	131.2	90%	0.895	80%	0.8	S	S	*	*			trans	-116.2	144.1	-172.7	-44.9	0	0	0	0	112.4
329	A	30.7	Very low	32.1	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	80%	0.801	S	S	*	*			trans	171.1	140.2	137.6	0	0	0	0	0	115.1
330	S	27.9	Very low	32.1	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	80%	0.803	S	S	*	*			trans	47.8	129.3	142.6	-70.9	0	0	0	0	125.7
331	L	31.2	Very low	32.3	Very low	156 Å²	156	129.7 Å²	129.7	82%	0.817	80%	0.803	S	S	*	*			trans	82.6	133	133.5	-70.3	168.7	0	0	0	122.3
332	E	29.6	Very low	32.4	Very low	192 Å²	192	128.8 Å²	128.8	90%	0.897	80%	0.796	S	S	*	*			trans	53.4	125.7	156.4	-59.5	-167.9	151.1	0	0	121.4
333	G	27.9	Very low	32.6	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	80%	0.798	S	S	*	*			trans	-176.7	127.6	170.3	0	0	0	0	0	111.3
334	F	28.3	Very low	32.2	Very low	207 Å²	207	137 Å²	137	91%	0.908	80%	0.796	S	S	*	*			trans	-98.3	160.4	-172.3	-107.4	-118.7	0	0	0	113.5
335	E	28.8	Very low	32.1	Very low	152 Å²	152	135.8 Å²	135.8	71%	0.71	79%	0.79	S	S	*	*			trans	86.3	143.6	141.1	-105.1	-167	123.8	0	0	124.5
336	L	33.3	Very low	31.1	Very low	136 Å²	136	133.3 Å²	133.3	71%	0.712	79%	0.786	S	S	*	*			trans	68.1	156.9	152	-61.6	162.8	0	0	0	119.9
337	K	31.4	Very low	32.1	Very low	184 Å²	184	133.5 Å²	133.5	80%	0.8	78%	0.784	S	S	*	*			cis	167.3	154.8	-39.7	167.5	177	173.9	-178.8	0	108.2
338	A	34.3	Very low	32.3	Very low	85 Å²	85	136.7 Å²	136.7	70%	0.702	79%	0.788	S	S	*	*			trans	95.6	145.4	158.3	0	0	0	0	0	120.8
339	E	30.7	Very low	32.1	Very low	196 Å²	196	134 Å²	134	92%	0.916	78%	0.78	S	S	*	*			trans	-42	167.1	155.6	-62.1	157.5	83	0	0	115
340	G	31	Very low	32.2	Very low	66 Å²	66	140.4 Å²	140.4	68%	0.68	78%	0.784	S	S	*	*			cis	153.8	-151.6	3.3	0	0	0	0	0	111.5
341	A	33.2	Very low	32.5	Very low	108 Å²	108	140.9 Å²	140.9	89%	0.893	79%	0.787	S	S	*	*			trans	70.1	153.3	176.5	0	0	0	0	0	117.6
342	A	30.4	Very low	32.7	Very low	86 Å²	86	138 Å²	138	71%	0.711	79%	0.786	S	S	*	*			cis	-170.7	147.6	-23	0	0	0	0	0	113.7
343	R	35.6	Very low	32.6	Very low	230 Å²	230	133.1 Å²	133.1	87%	0.868	78%	0.778	S	S	*	*			trans	58.9	166.3	150	-68.6	-173.8	-178.5	-78.8	-0.2	118.4
344	R	36.5	Very low	33	Very low	199 Å²	199	136.2 Å²	136.2	75%	0.751	78%	0.782	S	S	*	*			cis	-149.1	-172.1	15.5	-137.3	167.3	175.9	-141.1	5.3	108.2
345	E	27.1	Very low	34.2	Very low	139 Å²	139	131.4 Å²	131.4	65%	0.65	77%	0.771	S	S	*	*			cis	-150.5	-85	9.5	-173.9	87.9	-99.1	0	0	113.9
346	G	27.1	Very low	34.5	Very low	64 Å²	64	132.3 Å²	132.3	66%	0.66	78%	0.775	S	S	*	*			trans	152.7	-155.6	-164.8	0	0	0	0	0	111
347	P	54.5	Low	34.4	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	78%	0.776	S	S	*	*			cis	-145.9	-167.2	0.7	35.7	-11.3	0	0	0	116.7
348	V	33.7	Very low	34.3	Very low	145 Å²	145	129.2 Å²	129.2	88%	0.879	77%	0.772	S	S	*	*			trans	77.6	132	167.2	-165.7	0	0	0	0	116.4
349	G	31.7	Very low	34.1	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	77%	0.768	S	S	*	*			cis	167.3	-176.3	1.5	0	0	0	0	0	110.5
350	R	32.9	Very low	34.3	Very low	231 Å²	231	126.4 Å²	126.4	87%	0.872	76%	0.759	S	S	*	*			cis	-172.7	108.3	-9.9	176.3	-162.3	174.1	-162.4	-1.2	112
351	S	34.3	Very low	34.2	Very low	119 Å²	119	130.6 Å²	130.6	83%	0.832	76%	0.758	S	S	*	*			trans	67.1	161.6	158.8	-52	0	0	0	0	118.8
352	A	33.7	Very low	34.2	Very low	95 Å²	95	133.7 Å²	133.7	79%	0.785	76%	0.755	S	S	*	*			cis	-142.9	-173.6	7.4	0	0	0	0	0	110.1
353	A	27.8	Very low	34.2	Very low	89 Å²	89	134.6 Å²	134.6	74%	0.736	75%	0.751	S	S	*	*			cis	-154.6	162.2	2.5	0	0	0	0	0	109.4
354	V	36.2	Very low	34	Very low	142 Å²	142	129.7 Å²	129.7	86%	0.861	75%	0.747	S	S	*	*			trans	-146.5	123.8	179.2	-179.4	0	0	0	0	114.1
355	P	53.9	Low	33.6	Very low	105 Å²	105	125.4 Å²	125.4	68%	0.682	75%	0.746	S	S	*	*			trans	-120.6	178.8	142.7	38.9	-28.6	0	0	0	110.3
356	Q	34.4	Very low	33.6	Very low	172 Å²	172	123.2 Å²	123.2	80%	0.804	75%	0.746	S	S	*	*			cis	-173.8	149	-29.8	-97.4	-178.6	-58.3	0	0	103.9
357	L	31.4	Very low	33.8	Very low	137 Å²	137	126.2 Å²	126.2	72%	0.717	75%	0.752	S	S	*	*			cis	-151.8	-172	0.3	-154.4	42	0	0	0	104.5
358	V	29	Very low	32.8	Very low	118 Å²	118	126.3 Å²	126.3	72%	0.715	76%	0.755	S	S	*	*			cis	-148.6	134.4	17.8	-172.1	0	0	0	0	111.3
359	E	31.9	Very low	32.5	Very low	133 Å²	133	127 Å²	127	62%	0.621	75%	0.754	S	S	*	*			trans	3	115.9	139.1	-144.1	168.1	150.6	0	0	118.2	K361	E359-K361 WeakPolarHBondContact OE1-CE 3.46Å; E359-K361 IonicContact OE1-NZ 2.75Å; E359-K361 PolarHBondContact OE1-NZ 3.17Å
360	A	33.8	Very low	32.5	Very low	89 Å²	89	127.9 Å²	127.9	74%	0.736	75%	0.754	S	S	*	*				80	159.2	65.3	0	0	0	0	0	113.8
361	K	29.7	Very low	32.4	Very low	153 Å²	153	123.3 Å²	123.3	67%	0.665	75%	0.752	S	S	*	*			cis	-140.1	159.6	25.9	-65.7	143.7	-173.2	152.1	0	109.5	E359	E359-K361 WeakPolarHBondContact OE1-CE 3.46Å; E359-K361 IonicContact OE1-NZ 2.75Å; E359-K361 PolarHBondContact OE1-NZ 3.17Å
362	Q	32.1	Very low	32.2	Very low	174 Å²	174	122.7 Å²	122.7	81%	0.813	75%	0.754	S	S	*	*				64.3	138	52.1	-120.6	-175.5	8	0	0	112.3
363	T	30.6	Very low	31.9	Very low	104 Å²	104	121.6 Å²	121.6	64%	0.638	75%	0.751	S	S	*	*			cis	-167.2	144.3	47.5	51.5	0	0	0	0	116.2
364	V	32.3	Very low	32.1	Very low	128 Å²	128	122.8 Å²	122.8	78%	0.776	76%	0.762	S	S	*	*			trans	53	165.7	134.7	-46.6	0	0	0	0	122
365	C	26.6	Very low	31.8	Very low	108 Å²	108	121.8 Å²	121.8	73%	0.73	76%	0.76	S	S	*	*			cis	-164.1	162.1	-6.1	-132.6	0	0	0	0	114.8
366	S	29.1	Very low	30.7	Very low	93 Å²	93	123 Å²	123	65%	0.65	77%	0.77	S	S	*	*			trans	70.3	115.2	136.7	-69.2	0	0	0	0	126.7
367	T	30.8	Very low	30.6	Very low	127 Å²	127	120 Å²	120	78%	0.779	78%	0.775	S	S	*	*				42.7	135	123.4	63.8	0	0	0	0	124.4
368	S	33	Very low	30.4	Very low	119 Å²	119	117.2 Å²	117.2	83%	0.832	78%	0.779	S	S	*	*				172.8	166.8	107.9	61.1	0	0	0	0	115.1
369	D	28.4	Very low	30.4	Very low	159 Å²	159	115.7 Å²	115.7	85%	0.85	79%	0.788	S	S	*	*			trans	-80.6	158.4	-172.6	-53.7	-104.8	0	0	0	118.6
370	A	30.8	Very low	30.2	Very low	90 Å²	90	113.4 Å²	113.4	74%	0.744	80%	0.8	S	S	*	*			trans	-171.2	105.8	144	0	0	0	0	0	110.5
371	V	30.7	Very low	29.8	Very low	136 Å²	136	113.3 Å²	113.3	82%	0.824	81%	0.807	S	S	*	*				63.8	130.1	85.6	-52.9	0	0	0	0	118.9
372	A	30.3	Very low	29.8	Very low	106 Å²	106	110.1 Å²	110.1	88%	0.876	82%	0.818	S	S	*	*			trans	65.1	151.9	168.1	0	0	0	0	0	118.4
373	G	27.9	Very low	29.6	Very low	71 Å²	71	105.1 Å²	105.1	73%	0.732	81%	0.814	S	S	*	*			cis	160.5	166	-9.4	0	0	0	0	0	114.1
374	A	30.6	Very low	29.6	Very low	115 Å²	115	106.8 Å²	106.8	95%	0.95	82%	0.823	S	S	*	*			trans	69.4	136.6	173.8	0	0	0	0	0	118.8
375	C	31.4	Very low	29.4	Very low	121 Å²	121	108.1 Å²	108.1	82%	0.818	83%	0.825	S	S	*	*			trans	-102	151.8	170.5	55.3	0	0	0	0	111.4
376	S	30.2	Very low	29.6	Very low	129 Å²	129	108 Å²	108	90%	0.902	82%	0.821	S	S	*	*			trans	-165.3	153	152.7	-83.2	0	0	0	0	110.4
377	A	32.3	Very low	29.6	Very low	109 Å²	109	112.8 Å²	112.8	90%	0.901	83%	0.833	S	S	*	*			trans	-105.1	166.1	176.7	0	0	0	0	0	111
378	G	27.8	Very low	29.5	Very low	79 Å²	79	113 Å²	113	81%	0.814	83%	0.829	S	S	*	*			trans	133.9	108.2	171.8	0	0	0	0	0	112.5
379	G	27.8	Very low	30	Very low	86 Å²	86	112.5 Å²	112.5	89%	0.887	82%	0.823	S	S	*	*			trans	-89.7	-159.2	178.3	0	0	0	0	0	113.8
380	G	26.9	Very low	30.2	Very low	86 Å²	86	113 Å²	113	89%	0.887	82%	0.821	S	S	*	*			trans	109.9	91.4	177	0	0	0	0	0	112.3
381	G	27	Very low	30.4	Very low	86 Å²	86	116.7 Å²	116.7	89%	0.887	82%	0.822	S	S	*	*			trans	-89.1	-178.3	-179.8	0	0	0	0	0	114.6
382	G	28.1	Very low	30.7	Very low	87 Å²	87	114.3 Å²	114.3	90%	0.897	81%	0.812	S	S	*	*			trans	113.3	120.5	176.1	0	0	0	0	0	112.6
383	G	29.5	Very low	31	Very low	69 Å²	69	116.8 Å²	116.8	71%	0.711	80%	0.803	S	S	*	*			cis	163.5	-152.4	-4	0	0	0	0	0	111.7
384	V	29.6	Very low	31.3	Very low	138 Å²	138	119.9 Å²	119.9	84%	0.836	80%	0.798	S	S	*	*			trans	79	98.7	157.6	-172.1	0	0	0	0	117.5
385	L	29.2	Very low	31.4	Very low	156 Å²	156	122.1 Å²	122.1	82%	0.817	79%	0.789	S	S	*	*				154.7	157	100.5	-153.5	67.6	0	0	0	114.7
386	V	29.5	Very low	31.6	Very low	107 Å²	107	124 Å²	124	65%	0.648	79%	0.786	S	S	*	*			trans	86	92.1	159.2	-165.3	0	0	0	0	120.2
387	E	30.1	Very low	31.9	Very low	193 Å²	193	126 Å²	126	90%	0.902	78%	0.78	S	S	*	*				62.8	149.6	128.6	-59.2	-177.4	153.4	0	0	124.3
388	D	27.5	Very low	32	Very low	131 Å²	131	127 Å²	127	70%	0.701	77%	0.771	S	S	*	*			trans	-139.1	140	-175.5	-178.3	-88.5	0	0	0	108.6
389	P	45	Very low	32	Very low	109 Å²	109	134.1 Å²	134.1	71%	0.708	78%	0.775	S	S	*	*				-141.6	157.5	122.5	28.9	-11	0	0	0	113
390	E	31.6	Very low	32.7	Very low	169 Å²	169	134.1 Å²	134.1	79%	0.79	76%	0.761	S	S	*	*			cis	-156.4	132.5	-1.2	-121.4	169	152.4	0	0	111
391	Q	35.1	Very low	32.9	Very low	168 Å²	168	137.1 Å²	137.1	79%	0.785	76%	0.756	S	S	*	*			trans	23.7	147.6	134.7	-67.9	-167.7	12.2	0	0	122.8
392	S	36.8	Very low	32.9	Very low	86 Å²	86	141.1 Å²	141.1	60%	0.601	75%	0.749	S	S	*	*			cis	-173.5	175.8	-7.6	54.3	0	0	0	0	113.5
393	K	36.3	Very low	32.9	Very low	157 Å²	157	144.3 Å²	144.3	68%	0.683	75%	0.745	S	S	*	*			trans	86.5	149.5	156.5	-71.5	168.1	156.1	-74.3	0	118
394	E	33.9	Very low	33.1	Very low	136 Å²	136	147.6 Å²	147.6	64%	0.636	75%	0.751	S	S	*	*			cis	-165.9	173.3	-25.2	57.6	-156.8	141.4	0	0	108.3
395	E	34.3	Very low	33	Very low	162 Å²	162	152.1 Å²	152.1	76%	0.757	75%	0.753	S	S	*	*			cis	-147	165.3	11.2	-165.2	170.9	174.8	0	0	109.5
396	E	34.3	Very low	33	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.752	75%	0.748	S	S	*	*			trans	-98.2	167.4	-179	-56.9	-176	139.9	0	0	112.6
397	H	36.9	Very low	32.9	Very low	170 Å²	170	156.2 Å²	156.2	79%	0.787	76%	0.762	S	S	*	*				-175.8	151.5	114.2	-89.9	-44.7	0	0	0	113.4
398	N	35.8	Very low	32.7	Very low	131 Å²	131	151.7 Å²	151.7	70%	0.701	76%	0.758	S	S	*	*			trans	-94.9	156.8	-179.4	-102.2	-101.1	0	0	0	111.4
399	Y	27.2	Very low	32.7	Very low	229 Å²	229	152.8 Å²	152.8	90%	0.898	76%	0.762	S	S	*	*				-148.4	130.7	125.1	-92.7	-63	0	0	0	112
400	S	42	Very low	31.7	Very low	85 Å²	85	153.5 Å²	153.5	59%	0.594	77%	0.765	S	S	*	*			trans	-144.3	110.7	168.6	178.7	0	0	0	0	108.8
401	L	30.9	Very low	31.5	Very low	150 Å²	150	152 Å²	152	79%	0.785	76%	0.758	S	S	*	*			trans	-146.3	105.6	172.4	-78	166.8	0	0	0	105.8
402	F	28.5	Very low	31.1	Very low	170 Å²	170	151.1 Å²	151.1	75%	0.746	76%	0.758	S	S	*	*				95	131.9	55.5	-91.3	-58.9	0	0	0	114.2
403	L	27.6	Very low	30.7	Very low	153 Å²	153	152.7 Å²	152.7	80%	0.801	76%	0.756	S	S	*	*			trans	67.5	108.9	165.6	-85.5	75.6	0	0	0	120
404	T	33.8	Very low	30.5	Very low	139 Å²	139	153.4 Å²	153.4	85%	0.853	76%	0.762	S	S	*	*			trans	-60.6	135.5	142.1	49.6	0	0	0	0	112
405	R	27.2	Very low	30.1	Very low	232 Å²	232	153.7 Å²	153.7	88%	0.875	77%	0.767	S	S	*	*			trans	-175.8	107.8	130.4	-164.9	168.5	-167.2	-165.5	4.1	115.4
406	S	29.1	Very low	29.9	Very low	102 Å²	102	152.7 Å²	152.7	71%	0.713	77%	0.767	S	S	*	*			trans	55.9	128.1	142.4	-50	0	0	0	0	124.3
407	R	27.5	Very low	29.7	Very low	248 Å²	248	153.5 Å²	153.5	94%	0.936	77%	0.771	S	S	*	*			trans	85.9	149.9	144.3	-80.6	-175.9	170.9	174.2	-3.2	121.4
408	A	25.2	Very low	29.3	Very low	98 Å²	98	154 Å²	154	81%	0.81	77%	0.774	S	S	*	*			trans	67	126.6	-178.9	0	0	0	0	0	114.7
409	L	27.1	Very low	29	Very low	153 Å²	153	157.2 Å²	157.2	80%	0.801	79%	0.785	S	S	*	*			cis	93.2	92.8	32.8	-173.2	87.1	0	0	0	113.5
410	T	25.6	Very low	28.9	Very low	125 Å²	125	153.7 Å²	153.7	77%	0.767	78%	0.781	S	S	*	*			trans	177.9	129.1	136.7	33	0	0	0	0	105.5
411	Q	25.8	Very low	28.1	Very low	138 Å²	138	156 Å²	156	65%	0.645	79%	0.787	S	S	*	*			cis	83.6	109.7	41	-170.1	176.5	1	0	0	113.3	E413	Q411-E413 WeakPolarHBondContact CG-OE1 3.36Å; Q411-E413 PolarHBondContact NE2-OE1 2.98Å
412	L	26.7	Very low	27.9	Very low	149 Å²	149	157.4 Å²	157.4	78%	0.78	79%	0.79	S	S	*	*			trans	-176.4	125.1	155.7	-91.7	167.3	0	0	0	102.2
413	E	29.9	Very low	28	Very low	119 Å²	119	158 Å²	158	56%	0.556	80%	0.795	S	S	*	*			cis	63.6	139.6	45.5	-51.5	154.5	-176.5	0	0	109.1	Q411	Q411-E413 WeakPolarHBondContact CG-OE1 3.36Å; Q411-E413 PolarHBondContact NE2-OE1 2.98Å
414	E	31.6	Very low	28.3	Very low	171 Å²	171	156.5 Å²	156.5	80%	0.799	79%	0.794	S	S	*	*			cis	-87.7	-171.3	5.9	-52.6	97.4	163.1	0	0	113.9
415	D	26.2	Very low	28.2	Very low	142 Å²	142	157.8 Å²	157.8	76%	0.759	79%	0.791	S	S	*	*			cis	-175.7	167.6	-44.1	-78.4	-10.4	0	0	0	106.9
416	D	29.4	Very low	28.3	Very low	141 Å²	141	156.3 Å²	156.3	75%	0.754	79%	0.794	S	S	*	*			cis	-162.5	-169.7	-47.3	-151.5	-17.3	0	0	0	109.8
417	E	30.1	Very low	28.5	Very low	178 Å²	178	158.5 Å²	158.5	83%	0.832	80%	0.797	S	S	*	*			trans	73.9	124.4	168	-60.2	166.9	-172.9	0	0	118.1
418	E	28.8	Very low	28.9	Very low	182 Å²	182	155.9 Å²	155.9	85%	0.85	80%	0.796	S	S	*	*			cis	85.5	121.9	36.2	-67.4	-160.6	171.9	0	0	117.1
419	E	28.4	Very low	29.1	Very low	198 Å²	198	154.7 Å²	154.7	93%	0.925	79%	0.793	S	S	*	*				179.3	169	117.3	-99.2	-170.6	167.4	0	0	112.1
420	D	26.1	Very low	29.3	Very low	154 Å²	154	154.2 Å²	154.2	82%	0.824	79%	0.791	S	S	*	*			trans	-115.9	-168.2	-155.5	-102.7	-49.4	0	0	0	115.5
421	D	26	Very low	29.9	Very low	135 Å²	135	151 Å²	151	72%	0.722	78%	0.782	S	S	*	*			trans	95.1	109.7	148.8	-69.7	-22.1	0	0	0	123.4
422	E	26.4	Very low	30.3	Very low	178 Å²	178	151.7 Å²	151.7	83%	0.832	79%	0.79	S	S	*	*				58.1	115.7	127.5	-56.5	-165.4	147.7	0	0	122.7
423	E	29.3	Very low	31.1	Very low	182 Å²	182	152.1 Å²	152.1	85%	0.85	79%	0.793	S	S	*	*			trans	-86.3	147.4	148.1	-72.6	-168.3	166.2	0	0	110.9
424	P	33.8	Very low	31.6	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	81%	0.807	S	S	*	*			trans	-105.3	134.8	147.4	33.6	-28.2	0	0	0	112
425	E	31.9	Very low	32.3	Very low	165 Å²	165	153.5 Å²	153.5	77%	0.771	81%	0.809	S	S	*	*			trans	-72.3	153.6	173.9	-57.1	-177.6	176.7	0	0	112.4
426	E	30.7	Very low	33.1	Very low	202 Å²	202	153.1 Å²	153.1	94%	0.944	81%	0.807	S	S	*	*			trans	-132.9	128	143.8	-75	-165.3	160.4	0	0	110.1
427	D	31.6	Very low	34	Very low	147 Å²	147	154.9 Å²	154.9	79%	0.786	81%	0.81	S	S	*	*			trans	-91.8	147.1	168.7	172.4	45	0	0	0	109.6
428	E	36.2	Very low	34.5	Very low	194 Å²	194	154 Å²	154	91%	0.907	81%	0.812	S	S	*	*			trans	-176.4	154.2	139.9	-107.9	-179.3	-165.9	0	0	109.9
429	G	30.5	Very low	35.2	Very low	72 Å²	72	154.5 Å²	154.5	74%	0.742	81%	0.813	S	S	*	*			trans	-143.7	164.7	-179.7	0	0	0	0	0	114
430	D	30.9	Very low	35.8	Very low	143 Å²	143	151.8 Å²	151.8	77%	0.765	81%	0.805	S	S	*	*			trans	-143	161.6	163.1	-150.5	13.5	0	0	0	105.8
431	G	37.1	Very low	37.1	Very low	57 Å²	57	153.3 Å²	153.3	59%	0.588	81%	0.807	S	S	*	*				62	131	64	0	0	0	0	0	110.8
432	L	35.7	Very low	37.7	Very low	154 Å²	154	149.8 Å²	149.8	81%	0.806	80%	0.803	S	S	*	*			cis	-147.4	165.7	18.7	-67.5	165.3	0	0	0	110.1
433	D	42.2	Very low	38.2	Very low	157 Å²	157	150.8 Å²	150.8	84%	0.84	81%	0.805	S	S	*	*			trans	-61.7	132.9	167.5	-58.8	-86.9	0	0	0	111.6
434	L	41.7	Very low	38.3	Very low	164 Å²	164	145.6 Å²	145.6	86%	0.859	80%	0.801	S	S	*	*			trans	-134.3	113.6	149.4	-77.2	-178.9	0	0	0	109.6
435	D	44.9	Very low	38.6	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	79%	0.794	S	S	*	*			trans	-75.7	131.4	163.3	-179.7	36.1	0	0	0	108.3
436	D	42.6	Very low	38.7	Very low	134 Å²	134	144.5 Å²	144.5	72%	0.717	80%	0.795	S	S	*	*			trans	-157.9	108	169.8	-100.8	-29.9	0	0	0	112.8
437	E	48.3	Very low	38.7	Very low	177 Å²	177	142.5 Å²	142.5	83%	0.827	79%	0.786	S	S	*	*			trans	61.1	128.6	144.7	-54	-162	123.4	0	0	122.9
438	D	41.7	Very low	38.9	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	79%	0.789	S	S	*	*			trans	-68.9	135.6	171.4	-69.7	-69	0	0	0	113
439	H	44.4	Very low	38.8	Very low	191 Å²	191	142 Å²	142	88%	0.884	78%	0.782	S	S	*	*			trans	-120	76.2	158.5	-94.8	-58.3	0	0	0	111.5	E441	H439-E441 PolarHBondContact O-N 3.38Å
440	D	39.3	Very low	39	Very low	141 Å²	141	143.9 Å²	143.9	75%	0.754	78%	0.784	S	S	*	*			trans	-75.1	102.4	156.2	177.1	17.9	0	0	0	109.8	G442	D440-G442 PolarHBondContact OD1-N 3.27Å
441	E	54.1	Low	38.9	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	79%	0.791	S	S	*	*			trans	-126.7	86.7	143.4	-76.7	-161	-168.8	0	0	108.8	H439	H439-E441 PolarHBondContact O-N 3.38Å
442	G	39.4	Very low	38.6	Very low	62 Å²	62	150.4 Å²	150.4	64%	0.639	80%	0.799	S	S	*	*			trans	-61.6	136.7	176.9	0	0	0	0	0	113.7	D440	D440-G442 PolarHBondContact OD1-N 3.27Å
443	F	36.3	Very low	38.6	Very low	199 Å²	199	150.8 Å²	150.8	87%	0.873	80%	0.797	S	S	*	*			trans	-106.4	92.8	161.4	-141.5	-90	0	0	0	110.1
444	G	31.5	Very low	38.2	Very low	73 Å²	73	152.6 Å²	152.6	75%	0.753	80%	0.8	S	S	*	*			trans	-81.9	122.1	171	0	0	0	0	0	110.8
445	S	39.4	Very low	38	Very low	93 Å²	93	153.7 Å²	153.7	65%	0.65	80%	0.801	S	S	*	*			trans	-148.5	117.5	154.6	54.6	0	0	0	0	109
446	E	33.9	Very low	37.5	Very low	172 Å²	172	155.9 Å²	155.9	80%	0.804	81%	0.806	S	S	*	*			trans	-59.7	143.5	169.9	52.9	-94.9	71.8	0	0	111.9
447	H	31.1	Very low	37.3	Very low	160 Å²	160	158.6 Å²	158.6	74%	0.741	82%	0.815	S	S	*	*			trans	-150.9	78.6	151.7	-152.5	-107.7	0	0	0	110.2	L449	H447-L449 VanDerWaalsContact CE1-CD1 3.45Å; H447-L449 WeakPolarHBondContact CE1-CD1 3.45Å; H447-L449 PolarHBondContact O-N 2.93Å
448	E	37	Very low	36.7	Very low	185 Å²	185	159.5 Å²	159.5	86%	0.864	82%	0.819	S	S	*	*			trans	-68.5	118.3	160	-62.6	-171.3	145	0	0	108.2
449	L	33.8	Very low	36.5	Very low	145 Å²	145	160.8 Å²	160.8	76%	0.759	82%	0.82	S	S	*	*			trans	-135.6	141.8	153.8	-82.1	-171.6	0	0	0	110	H447	H447-L449 VanDerWaalsContact CE1-CD1 3.45Å; H447-L449 WeakPolarHBondContact CE1-CD1 3.45Å; H447-L449 PolarHBondContact O-N 2.93Å
450	S	33.8	Very low	36.2	Very low	112 Å²	112	161 Å²	161	78%	0.783	82%	0.821	S	S	*	*			trans	-93.6	153	-172	50	0	0	0	0	113.2	N452	S450-N452 PolarHBondContact O-N 3.32Å
451	E	29.7	Very low	36	Very low	196 Å²	196	161.9 Å²	161.9	92%	0.916	83%	0.826	S	S	*	*			trans	-62.1	118.4	162	177.5	-178.2	167.5	0	0	111.3
452	N	29.1	Very low	35.2	Very low	140 Å²	140	161.9 Å²	161.9	75%	0.749	83%	0.826	S	S	*	*			trans	-158.9	159.3	151.7	-154.5	83.3	0	0	0	111.1	S450	S450-N452 PolarHBondContact O-N 3.32Å
453	E	36.4	Very low	35.3	Very low	163 Å²	163	165.4 Å²	165.4	76%	0.762	83%	0.83	S	S	*	*			trans	-74.4	149.3	170.5	-59.4	156.2	120.7	0	0	111.6
454	E	34.7	Very low	35.8	Very low	194 Å²	194	166.3 Å²	166.3	91%	0.907	83%	0.829	S	S	*	*				-171.3	170.5	105.2	-104.9	177.4	141	0	0	110.9
455	E	36.1	Very low	36.7	Very low	188 Å²	188	170.8 Å²	170.8	88%	0.879	83%	0.83	S	S	*	*			trans	-93.5	142.7	176.7	-57.9	174.9	131	0	0	110.2
456	E	36.1	Very low	37.1	Very low	202 Å²	202	170 Å²	170	94%	0.944	83%	0.829	S	S	*	*			trans	-159	156.2	146.2	-119.9	164	-160.8	0	0	111.7
457	E	37.3	Very low	37.7	Very low	191 Å²	191	169 Å²	169	89%	0.893	83%	0.83	S	S	*	*			trans	-104	128.8	-177	-59.1	174.9	134.2	0	0	109.7
458	E	36.2	Very low	39	Very low	195 Å²	195	171.3 Å²	171.3	91%	0.911	84%	0.837	S	S	*	*			trans	-130.1	132.4	161.6	-70.3	-164.7	137.7	0	0	110.3
459	E	36.2	Very low	39.6	Very low	188 Å²	188	169.3 Å²	169.3	88%	0.879	83%	0.833	S	S	*	*			trans	-95.3	134.1	172.7	-60.8	-177.8	138.7	0	0	108.8
460	E	38	Very low	40.5	Very low	196 Å²	196	170.1 Å²	170.1	92%	0.916	84%	0.838	S	S	*	*			trans	-124.1	119	162.4	-76.4	-164.5	129.6	0	0	110.3
461	D	35.2	Very low	41.3	Very low	160 Å²	160	172.1 Å²	172.1	86%	0.856	84%	0.84	S	S	*	*			trans	-80.5	116.8	171.1	-67.8	-60.5	0	0	0	110.2
462	E	38.9	Very low	42.6	Very low	185 Å²	185	172 Å²	172	86%	0.864	84%	0.842	S	S	*	*			trans	-125.9	93	159.4	-74.4	-153.9	140.6	0	0	111.1
463	D	41.2	Very low	43.4	Very low	136 Å²	136	170 Å²	170	73%	0.727	84%	0.839	S	S	*	*			trans	-93.6	119.4	165.2	179.3	12	0	0	0	109.6
464	Y	46	Very low	43.8	Very low	219 Å²	219	168.8 Å²	168.8	86%	0.859	84%	0.837	S	S	*	*			trans	-145.5	77.5	170.3	-100.7	-66.8	0	0	0	111.6
465	E	49.9	Very low	44.4	Very low	166 Å²	166	163.9 Å²	163.9	78%	0.776	83%	0.83	S	S	*	*			trans	35.1	145.9	140.2	-78.2	-74.9	-154.8	0	0	122.3
466	A	49.4	Very low	44.7	Very low	76 Å²	76	163.9 Å²	163.9	63%	0.628	83%	0.828	S	S	*	*			trans	-82.1	154.7	179.2	0	0	0	0	0	113.8
467	D	45.4	Very low	45	Very low	152 Å²	152	159.7 Å²	159.7	81%	0.813	82%	0.821	S	S	*	*				170.2	101.6	124.5	-95.7	-5.8	0	0	0	111.1
468	K	57.5	Low	45.4	Very low	208 Å²	208	159 Å²	159	90%	0.904	82%	0.818	S	S	*	*			trans	-164.1	75.3	147.3	-124.7	173.7	-174.5	174.1	0	114.4
469	D	51.4	Low	46.2	Very low	143 Å²	143	155.8 Å²	155.8	77%	0.765	81%	0.814	S	S	*	*			trans	-67.9	144.4	150.4	-64	-45.7	0	0	0	109.7
470	D	50.9	Low	45.9	Very low	162 Å²	162	150.3 Å²	150.3	87%	0.866	81%	0.807	S	S	*	*				176.3	147.1	121.9	-96.6	-22.2	0	0	0	111.2
471	D	51.8	Low	45.7	Very low	155 Å²	155	146.9 Å²	146.9	83%	0.829	80%	0.803	S	S	*	*			trans	-52.7	145.8	-174.9	-84.2	-55.7	0	0	0	115.8
472	M	55.9	Low	45.7	Very low	193 Å²	193	146.3 Å²	146.3	95%	0.951	80%	0.8	S	S	*	*				-137.8	128.3	128.6	-141.3	176.9	-162.3	0	0	111.5
473	S	46.2	Very low	45.6	Very low	99 Å²	99	144.2 Å²	144.2	69%	0.692	79%	0.792	S	S	*	*			trans	-84.4	165	-162.7	60.5	0	0	0	0	115.3
474	D	45.9	Very low	45.5	Very low	136 Å²	136	145.7 Å²	145.7	73%	0.727	80%	0.795	S	S	*	*			trans	-20.8	135.5	152.5	-178.7	16.3	0	0	0	115.7	F476	D474-F476 PolarHBondContact OD1-N 3.15Å; D474-F476 VanDerWaalsContact OD1-N 3.08Å
475	A	46.4	Very low	45.5	Very low	92 Å²	92	143.2 Å²	143.2	76%	0.76	80%	0.796	S	S	*	*			trans	-148.1	58.6	172.3	0	0	0	0	0	111.3	S477	A475-S477 PolarHBondContact O-N 3.41Å
476	F	42.6	Very low	45.2	Very low	187 Å²	187	143.3 Å²	143.3	82%	0.82	80%	0.798	S	S	*	*			trans	-53.9	116.7	169.3	-135.9	-83.7	0	0	0	111.5	D474	D474-F476 PolarHBondContact OD1-N 3.15Å; D474-F476 VanDerWaalsContact OD1-N 3.08Å
477	S	42.8	Very low	44.7	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	80%	0.803	S	S	*	*			trans	-162	75.3	174.3	-78.3	0	0	0	0	113.8	A475	A475-S477 PolarHBondContact O-N 3.41Å
478	E	46.2	Very low	44.5	Very low	178 Å²	178	146 Å²	146	83%	0.832	80%	0.802	S	S	*	*			trans	-80.8	169	133.4	-70.2	-165.2	143.1	0	0	108.6
479	P	51.7	Low	43.8	Very low	127 Å²	127	143.6 Å²	143.6	83%	0.825	80%	0.797	S	S	*	*			cis	-130.9	179.6	3.6	40.9	-25.2	0	0	0	114.5
480	G	31.4	Very low	43.5	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	80%	0.803	S	S	*	*			trans	159.2	105.4	156.8	0	0	0	0	0	118.5
481	C	31.8	Very low	42.7	Very low	124 Å²	124	142.5 Å²	142.5	84%	0.838	80%	0.8	S	S	*	*			trans	24.9	126.1	134.3	-152.6	0	0	0	0	120.4
482	D	35.6	Very low	42.1	Very low	148 Å²	148	143 Å²	143	79%	0.791	80%	0.802	S	S	*	*				-157.1	173.3	101.9	-146	-0.6	0	0	0	113.9
483	M	37.7	Very low	41.2	Very low	141 Å²	141	140.4 Å²	140.4	70%	0.695	80%	0.797	S	S	*	*			trans	-72.7	152	-163.5	-70.8	171.2	53.8	0	0	118.1
484	E	39.6	Very low	40.6	Very low	167 Å²	167	140.7 Å²	140.7	78%	0.78	81%	0.805	S	S	*	*			trans	13.9	128.5	132	-50.3	175.4	147.3	0	0	119.3
485	L	44.7	Very low	40.1	Very low	168 Å²	168	137.6 Å²	137.6	88%	0.88	81%	0.805	S	S	*	*			trans	-143.8	88.1	145.8	-173.1	63.7	0	0	0	112.7
486	M	43.2	Very low	40.3	Very low	168 Å²	168	140.9 Å²	140.9	83%	0.828	82%	0.815	S	S	*	*			trans	64.9	142	142.7	-160.1	164.7	-179.8	0	0	120.9
487	D	39.4	Very low	40	Very low	138 Å²	138	137.3 Å²	137.3	74%	0.738	81%	0.814	S	S	*	*			trans	-76.1	166.4	-171.3	-45.1	-104.5	0	0	0	115.8
488	D	41.9	Very low	39.7	Very low	145 Å²	145	137 Å²	137	78%	0.775	81%	0.811	S	S	*	*			trans	50.6	116.1	147.4	-77.7	-21.1	0	0	0	120.8
489	I	42.8	Very low	39.9	Very low	158 Å²	158	140.4 Å²	140.4	81%	0.81	82%	0.816	S	S	*	*				-169.7	122.1	96.6	-89.9	152.3	0	0	0	110.4
490	K	45	Very low	39.6	Very low	206 Å²	206	144 Å²	144	90%	0.896	82%	0.819	S	S	*	*			trans	25.7	93.1	155.4	-60	-177.6	179	-177.3	0	118
491	G	33.3	Very low	40.6	Very low	76 Å²	76	152.7 Å²	152.7	78%	0.784	83%	0.83	S	S	*	*			trans	-128.9	75.9	169.2	0	0	0	0	0	113.4
492	L	40.1	Very low	41.7	Very low	167 Å²	167	150.5 Å²	150.5	87%	0.874	83%	0.828	S	S	*	*			trans	-74.8	147.6	170.8	-82.6	166.5	0	0	0	111.6
493	T	36.6	Very low	42.8	Very low	138 Å²	138	152.4 Å²	152.4	85%	0.847	83%	0.829	S	S	*	*			trans	58.3	50.5	171.4	76.8	0	0	0	0	118
494	A	34.7	Very low	43.8	Very low	105 Å²	105	155.9 Å²	155.9	87%	0.868	84%	0.835	S	S	*	*			trans	-82.3	144.2	146	0	0	0	0	0	109.8
495	G	34	Very low	45.3	Very low	71 Å²	71	154.5 Å²	154.5	73%	0.732	82%	0.822	S	S	*	*			cis	170.2	150.4	-8.6	0	0	0	0	0	112.2	S497	G495-S497 PolarHBondContact O-N 2.85Å
496	V	50.4	Low	46.6	Very low	160 Å²	160	153 Å²	153	97%	0.97	81%	0.806	S	S	*	*			trans	-78.2	108.2	172.9	175.3	0	0	0	0	109.6
497	S	36.3	Very low	47.3	Very low	113 Å²	113	154.3 Å²	154.3	79%	0.79	81%	0.807	S	S	*	*			trans	-159	150.3	162.8	-158.6	0	0	0	0	116.3	G495	G495-S497 PolarHBondContact O-N 2.85Å
498	S	36.9	Very low	48.5	Very low	106 Å²	106	156.9 Å²	156.9	74%	0.741	81%	0.807	S	S	*	*			trans	69.9	98.6	154.2	-149.6	0	0	0	0	119.6
499	R	50.8	Low	49.5	Very low	250 Å²	250	152.9 Å²	152.9	94%	0.943	78%	0.784	S	S	*	*			trans	-68.2	124.6	162.9	-50.7	167.4	-168.8	163.4	2.1	109.4
500	K	45.6	Very low	50.3	Low	204 Å²	204	151.5 Å²	151.5	89%	0.887	77%	0.769	S	S	*	*			trans	-126.5	83.4	165	-149.8	170.1	-171.9	177.5	0	111.5	G502	K500-G502 PolarHBondContact O-N 2.87Å
501	R	52.2	Low	51	Low	254 Å²	254	146.3 Å²	146.3	96%	0.958	76%	0.758	S	S	*	*			trans	-54.6	134.7	165.8	-82.1	-173	170.4	-146	1.2	108.6
502	G	54.3	Low	51.7	Low	78 Å²	78	150.5 Å²	150.5	80%	0.804	76%	0.758	S	S	*	*			trans	171.5	-32.3	175	0	0	0	0	0	116.2	K500	K500-G502 PolarHBondContact O-N 2.87Å
503	K	58.9	Low	52.2	Low	187 Å²	187	148.4 Å²	148.4	81%	0.813	74%	0.743	S	S	*	*	S	Bend	trans	-95.3	131.9	172.6	-136.2	74.5	176.1	-173.5	0	110.4	R505	K503-R505 PolarHBondContact O-N 3.13Å
504	R	59.8	Low	52.7	Low	214 Å²	214	148.5 Å²	148.5	81%	0.808	74%	0.738	S	S	*	*			trans	-80.2	96.9	176.5	-172.4	178.1	-167.4	-103.6	8	107.4	Y506	R504-Y506 PolarHBondContact O-N 2.61Å
505	R	69.9	Low	53	Low	139 Å²	139	149.2 Å²	149.2	53%	0.525	73%	0.732	S	S	.	*			trans	-56.4	130.1	-175.1	-68	-161.3	-65.4	-111.5	3.5	111.1	K503 E509	K503-R505 PolarHBondContact O-N 3.13Å; R505-E509 WeakPolarHBondContact CA-OE2 3.38Å; R505-E509 WeakPolarHBondContact CB-OE2 3.3Å; R505-E509 VanDerWaalsContact CG-OE2 3.23Å; R505-E509 WeakPolarHBondContact CG-OE2 3.5Å
506	Y	73.3	Confident	53.2	Low	137 Å²	137	151.3 Å²	151.3	54%	0.537	73%	0.733	S	S	.	*			trans	-81.1	156	177.1	-65.3	-73.8	0	0	0	110.6	R504 W508 E509	R504-Y506 PolarHBondContact O-N 2.61Å; Y506-W508 VanDerWaalsContact CB-CD1 3.47Å; Y506-W508 VanDerWaalsContact CB-NE1 3.3Å; Y506-W508 AromaticContact CG-NE1 3.99Å; Y506-W508 PolarHBondContact O-N 3.09Å; Y506-E509 VanDerWaalsContact CD2-OE1 3.25Å; Y506-E509 WeakPolarHBondContact CD2-OE1 3.5Å; Y506-E509 PolarHBondContact N-OE1 3.07Å; Y506-E509 VanDerWaalsContact N-OE1 3.16Å; Y506-E509 PolarHBondContact N-OE2 2.88Å; Y506-E509 WeakPolarHBondContact O-CB 3.3Å; Y506-E509 PolarHBondContact O-N 3.1Å
507	F	56.5	Low	52.8	Low	194 Å²	194	148.4 Å²	148.4	85%	0.851	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-54	-31.3	-175.2	148.2	-100.9	0	0	0	114	E509 Y510	F507-E509 PolarHBondContact O-N 3.48Å; F507-Y510 WeakPolarHBondContact O-CD2 3.25Å
508	W	64.9	Low	53	Low	192 Å²	192	152.9 Å²	152.9	73%	0.727	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-74.1	-15.5	177.7	54	19.3	0	0	0	115.3	Y506 Y510	Y506-W508 VanDerWaalsContact CB-CD1 3.47Å; Y506-W508 VanDerWaalsContact CB-NE1 3.3Å; Y506-W508 AromaticContact CG-NE1 3.99Å; Y506-W508 PolarHBondContact O-N 3.09Å; W508-Y510 PolarHBondContact O-N 3.29Å
509	E	62.4	Low	53	Low	62 Å²	62	155 Å²	155	29%	0.29	72%	0.722	S	S	.	*	G	3₁₀ helix	trans	-79.6	3.2	-179	-74	159.6	-137.5	0	0	113	R505 Y506 F507	R505-E509 WeakPolarHBondContact CA-OE2 3.38Å; R505-E509 WeakPolarHBondContact CB-OE2 3.3Å; R505-E509 VanDerWaalsContact CG-OE2 3.23Å; R505-E509 WeakPolarHBondContact CG-OE2 3.5Å; Y506-E509 VanDerWaalsContact CD2-OE1 3.25Å; Y506-E509 WeakPolarHBondContact CD2-OE1 3.5Å; Y506-E509 PolarHBondContact N-OE1 3.07Å; Y506-E509 VanDerWaalsContact N-OE1 3.16Å; Y506-E509 PolarHBondContact N-OE2 2.88Å; Y506-E509 WeakPolarHBondContact O-CB 3.3Å; Y506-E509 PolarHBondContact O-N 3.1Å; F507-E509 PolarHBondContact O-N 3.48Å
510	Y	61.3	Low	52.5	Low	129 Å²	129	151.3 Å²	151.3	51%	0.506	72%	0.716	S	S	.	*	G	3₁₀ helix	trans	-88.1	-21.4	-179.9	-75.7	-99.3	0	0	0	113.1	F507 W508 E512	F507-Y510 WeakPolarHBondContact O-CD2 3.25Å; W508-Y510 PolarHBondContact O-N 3.29Å; Y510-E512 PolarHBondContact O-N 3.37Å
511	S	58.9	Low	52.3	Low	96 Å²	96	150.3 Å²	150.3	67%	0.671	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-71.8	-27.1	-179.1	-55.2	0	0	0	0	113.6	Q513 L514	S511-Q513 VanDerWaalsContact C-N 3.29Å; S511-Q513 PolarHBondContact O-N 3.25Å; S511-L514 PolarHBondContact O-N 3.23Å
512	E	47.7	Very low	51.5	Low	165 Å²	165	146.4 Å²	146.4	77%	0.771	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-74.4	-19.2	-177.1	-167.1	174	-137.3	0	0	113.2	Y510	Y510-E512 PolarHBondContact O-N 3.37Å
513	Q	51.2	Low	51.2	Low	122 Å²	122	149.8 Å²	149.8	57%	0.57	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-98.6	2.5	178.3	-75.9	151.1	58.8	0	0	113.2	S511	S511-Q513 VanDerWaalsContact C-N 3.29Å; S511-Q513 PolarHBondContact O-N 3.25Å
514	L	46.9	Very low	50.5	Low	140 Å²	140	149.4 Å²	149.4	73%	0.733	70%	0.699	S	S	*	*			trans	-133.8	60.9	175.6	-68.6	175.1	0	0	0	109.6	S511 P516	S511-L514 PolarHBondContact O-N 3.23Å; L514-P516 WeakPolarHBondContact O-CD 3.39Å
515	T	41.2	Very low	49.6	Very low	121 Å²	121	145 Å²	145	74%	0.742	70%	0.698	S	S	*	*			trans	-61.2	114.7	151.9	38.4	0	0	0	0	107.4	S517	T515-S517 PolarHBondContact O-N 3.15Å; T515-S517 VanDerWaalsContact O-N 3.1Å
516	P	38	Very low	48.8	Very low	115 Å²	115	141.6 Å²	141.6	75%	0.747	70%	0.695	S	S	*	*			trans	-66.1	115.4	167.9	28.5	-31.3	0	0	0	106.6	L514 K518	L514-P516 WeakPolarHBondContact O-CD 3.39Å; P516-K518 PolarHBondContact O-N 3.46Å
517	S	41.6	Very low	47.6	Very low	99 Å²	99	143.7 Å²	143.7	69%	0.692	71%	0.71	S	S	*	*			trans	-56.2	129.1	166.7	43.2	0	0	0	0	107.6	T515 Q519	T515-S517 PolarHBondContact O-N 3.15Å; T515-S517 VanDerWaalsContact O-N 3.1Å; S517-Q519 PolarHBondContact O-N 3.01Å
518	K	40.7	Very low	47.1	Very low	207 Å²	207	140.7 Å²	140.7	90%	0.9	69%	0.693	S	S	*	*			trans	-72.1	66.9	175.6	-72.4	-171.7	175.5	-172.2	0	110	P516 E520	P516-K518 PolarHBondContact O-N 3.46Å; K518-E520 PolarHBondContact O-N 3.24Å
519	Q	37.6	Very low	46.4	Very low	149 Å²	149	135.9 Å²	135.9	70%	0.696	68%	0.682	S	S	*	*			trans	-74.2	86.8	158.1	-78.7	-168.1	-36.4	0	0	107.4	S517 R521	S517-Q519 PolarHBondContact O-N 3.01Å; Q519-R521 PolarHBondContact O-N 2.82Å
520	E	39.3	Very low	46.1	Very low	174 Å²	174	142.7 Å²	142.7	81%	0.813	71%	0.705	S	S	*	*			trans	-66.8	76.8	166	-174.4	149.5	-152.9	0	0	108.2	K518 M522	K518-E520 PolarHBondContact O-N 3.24Å; E520-M522 VanDerWaalsContact C-N 3.29Å; E520-M522 PolarHBondContact O-N 3.41Å
521	R	42.3	Very low	45.5	Very low	182 Å²	182	143.2 Å²	143.2	69%	0.687	71%	0.712	S	S	*	*			trans	-63.1	94.7	176.5	177.8	-175.5	-71.1	93.3	5	107.6	Q519 L523	Q519-R521 PolarHBondContact O-N 2.82Å; R521-L523 PolarHBondContact O-N 3.03Å
522	M	35.5	Very low	45.3	Very low	172 Å²	172	141.5 Å²	141.5	85%	0.847	70%	0.697	S	S	*	*			trans	-55	103.1	169.4	-67.5	-172	77.8	0	0	108.2	E520 K524	E520-M522 VanDerWaalsContact C-N 3.29Å; E520-M522 PolarHBondContact O-N 3.41Å; M522-K524 PolarHBondContact O-N 3.41Å
523	L	47.9	Very low	45.6	Very low	149 Å²	149	136.9 Å²	136.9	78%	0.78	68%	0.677	S	S	*	*			trans	-64.2	118.3	169.1	-63.4	175.3	0	0	0	105.9	R521	R521-L523 PolarHBondContact O-N 3.03Å
524	K	44.8	Very low	45.5	Very low	180 Å²	180	134.2 Å²	134.2	78%	0.783	67%	0.67	S	S	*	*			trans	-45.8	135	171.4	-68	-74.3	-173.1	-175.5	0	107.7	M522 S526	M522-K524 PolarHBondContact O-N 3.41Å; K524-S526 PolarHBondContact O-N 3.14Å
525	P	39.2	Very low	45.7	Very low	122 Å²	122	130.8 Å²	130.8	79%	0.792	66%	0.658	S	S	*	*			trans	-46.6	119.1	179.2	-30.3	35.8	0	0	0	110	E527	P525-E527 PolarHBondContact O-N 2.91Å
526	S	53.7	Low	46.2	Very low	67 Å²	67	126.7 Å²	126.7	47%	0.469	63%	0.632	S	S	.	*			trans	-63.8	116.7	-168	-169.5	0	0	0	0	109.4	K524 W528	K524-S526 PolarHBondContact O-N 3.14Å; S526-W528 VanDerWaalsContact C-N 3.3Å; S526-W528 PolarHBondContact O-N 3.18Å
527	E	49.3	Very low	46.7	Very low	180 Å²	180	127 Å²	127	84%	0.841	63%	0.625	S	S	*	*			trans	-66.9	96.1	165.6	-69.8	-170	157.4	0	0	107.7	P525 D529 T532	P525-E527 PolarHBondContact O-N 2.91Å; E527-D529 PolarHBondContact O-N 2.89Å; E527-T532 PolarHBondContact O-OG1 3.37Å
528	W	45.4	Very low	47	Very low	131 Å²	131	131.1 Å²	131.1	50%	0.496	63%	0.626	S	S	.	*			trans	-74	71.2	178	-64.7	103.3	0	0	0	110.2	S526 T532 L533 P534	S526-W528 VanDerWaalsContact C-N 3.3Å; S526-W528 PolarHBondContact O-N 3.18Å; W528-T532 WeakPolarHBondContact CA-OG1 3.47Å; W528-T532 VanDerWaalsContact CZ3-O 3.28Å; W528-T532 WeakPolarHBondContact CZ3-O 3.42Å; W528-L533 HydrophobicContact CB-CD2 3.96Å; W528-L533 HydrophobicContact CD2-CD2 4.49Å; W528-L533 HydrophobicContact CE3-CD2 4.26Å; W528-L533 HydrophobicContact CG-CD2 4.44Å; W528-P534 HydrophobicContact CH2-CG 3.77Å; W528-P534 VanDerWaalsContact CZ3-CD 3.47Å; W528-P534 HydrophobicContact CZ3-CG 3.7Å
529	D	50.8	Low	47.5	Very low	91 Å²	91	126.3 Å²	126.3	49%	0.487	61%	0.607	S	S	.	*			trans	-52.4	155.9	161.7	175.8	45.1	0	0	0	110.6	E527 H531 T532	E527-D529 PolarHBondContact O-N 2.89Å; D529-H531 PolarHBondContact O-N 2.87Å; D529-H531 WeakPolarHBondContact OD2-CB 3.48Å; D529-H531 IonicContact OD2-CD2 3.16Å; D529-H531 PolarHBondContact OD2-CD2 3.11Å; D529-H531 IonicContact OD2-CG 2.73Å; D529-H531 PolarHBondContact OD2-N 2.87Å; D529-T532 PolarHBondContact N-OG1 3.18Å; D529-T532 VanDerWaalsContact N-OG1 3.09Å; D529-T532 PolarHBondContact O-N 3.33Å; D529-T532 PolarHBondContact O-OG1 3.09Å
530	R	54.3	Low	47.7	Very low	205 Å²	205	125.8 Å²	125.8	77%	0.774	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-10.8	176.5	-162.4	174.2	-172.8	141.1	5.2	113.6	N536	R530-N536 PolarHBondContact O-OD1 2.92Å
531	H	49.5	Very low	48	Very low	141 Å²	141	124 Å²	124	65%	0.653	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	3	175.9	-56.4	-57.5	0	0	0	115.1	D529 N536	D529-H531 PolarHBondContact O-N 2.87Å; D529-H531 WeakPolarHBondContact OD2-CB 3.48Å; D529-H531 IonicContact OD2-CD2 3.16Å; D529-H531 PolarHBondContact OD2-CD2 3.11Å; D529-H531 IonicContact OD2-CG 2.73Å; D529-H531 PolarHBondContact OD2-N 2.87Å; H531-N536 VanDerWaalsContact C-ND2 3.29Å; H531-N536 VanDerWaalsContact C-OD1 3.26Å; H531-N536 WeakPolarHBondContact CA-OD1 3.48Å; H531-N536 PolarHBondContact O-ND2 3.16Å
532	T	53.6	Low	48.2	Very low	59 Å²	59	117.1 Å²	117.1	36%	0.362	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.4	-6.2	173.4	51.2	0	0	0	0	114.5	E527 W528 D529 N536	E527-T532 PolarHBondContact O-OG1 3.37Å; W528-T532 WeakPolarHBondContact CA-OG1 3.47Å; W528-T532 VanDerWaalsContact CZ3-O 3.28Å; W528-T532 WeakPolarHBondContact CZ3-O 3.42Å; D529-T532 PolarHBondContact N-OG1 3.18Å; D529-T532 VanDerWaalsContact N-OG1 3.09Å; D529-T532 PolarHBondContact O-N 3.33Å; D529-T532 PolarHBondContact O-OG1 3.09Å; T532-N536 PolarHBondContact N-OD1 3.41Å
533	L	54.4	Low	48.9	Very low	68 Å²	68	115.6 Å²	115.6	36%	0.356	59%	0.588	S	S	.	*	S	Bend	trans	-56.2	144.8	177.5	-65.9	168.9	0	0	0	112.9	W528 S535 N536 M537	W528-L533 HydrophobicContact CB-CD2 3.96Å; W528-L533 HydrophobicContact CD2-CD2 4.49Å; W528-L533 HydrophobicContact CE3-CD2 4.26Å; W528-L533 HydrophobicContact CG-CD2 4.44Å; L533-S535 PolarHBondContact O-N 3.48Å; L533-S535 VanDerWaalsContact O-N 3.16Å; L533-N536 WeakPolarHBondContact CB-OD1 3.32Å; L533-N536 PolarHBondContact N-OD1 3.5Å; L533-N536 VanDerWaalsContact O-CG 3.3Å; L533-N536 PolarHBondContact O-N 3.31Å; L533-N536 PolarHBondContact O-OD1 3.14Å; L533-M537 PolarHBondContact O-N 3.45Å
534	P	50.3	Low	48.7	Very low	66 Å²	66	116.5 Å²	116.5	43%	0.429	59%	0.592	S	S	.	*	H	α-helix	trans	-61.2	-33.9	-174.2	-22.4	34.2	0	0	0	112.9	W528 N536 M537 Y538	W528-P534 HydrophobicContact CH2-CG 3.77Å; W528-P534 VanDerWaalsContact CZ3-CD 3.47Å; W528-P534 HydrophobicContact CZ3-CG 3.7Å; P534-N536 VanDerWaalsContact C-N 3.32Å; P534-N536 PolarHBondContact O-N 3.07Å; P534-M537 WeakPolarHBondContact O-CB 3.49Å; P534-M537 PolarHBondContact O-N 3.36Å; P534-Y538 VanDerWaalsContact O-CD2 3.29Å; P534-Y538 WeakPolarHBondContact O-CD2 3.38Å
535	S	50.4	Low	48.6	Very low	69 Å²	69	114.3 Å²	114.3	48%	0.483	58%	0.584	S	S	.	*	H	α-helix	trans	-60.9	-37.8	176.7	54.3	0	0	0	0	112.8	L533	L533-S535 PolarHBondContact O-N 3.48Å; L533-S535 VanDerWaalsContact O-N 3.16Å
536	N	51.4	Low	49.2	Very low	35 Å²	35	111.2 Å²	111.2	19%	0.187	58%	0.575	C	S	.	*	H	α-helix	trans	-84.9	-15.1	178.9	82.5	-115.6	0	0	0	113.2	R530 H531 T532 L533 P534 K540	R530-N536 PolarHBondContact O-OD1 2.92Å; H531-N536 VanDerWaalsContact C-ND2 3.29Å; H531-N536 VanDerWaalsContact C-OD1 3.26Å; H531-N536 WeakPolarHBondContact CA-OD1 3.48Å; H531-N536 PolarHBondContact O-ND2 3.16Å; T532-N536 PolarHBondContact N-OD1 3.41Å; L533-N536 WeakPolarHBondContact CB-OD1 3.32Å; L533-N536 PolarHBondContact N-OD1 3.5Å; L533-N536 VanDerWaalsContact O-CG 3.3Å; L533-N536 PolarHBondContact O-N 3.31Å; L533-N536 PolarHBondContact O-OD1 3.14Å; P534-N536 VanDerWaalsContact C-N 3.32Å; P534-N536 PolarHBondContact O-N 3.07Å; N536-K540 PolarHBondContact O-N 2.86Å
537	M	48.8	Very low	48.9	Very low	121 Å²	121	117.5 Å²	117.5	60%	0.596	59%	0.594	S	S	*	*	H	α-helix	trans	-63.3	-46.3	172.8	-70.2	-176.5	66.1	0	0	111	L533 P534 K540	L533-M537 PolarHBondContact O-N 3.45Å; P534-M537 WeakPolarHBondContact O-CB 3.49Å; P534-M537 PolarHBondContact O-N 3.36Å; M537-K540 WeakPolarHBondContact O-CB 3.44Å; M537-K540 PolarHBondContact O-N 2.97Å
538	Y	47.8	Very low	48.7	Very low	185 Å²	185	118.3 Å²	118.3	73%	0.725	59%	0.591	S	S	*	*	H	α-helix	trans	-70.4	-31.6	179.5	-67.4	-76.8	0	0	0	113	P534 K540	P534-Y538 VanDerWaalsContact O-CD2 3.29Å; P534-Y538 WeakPolarHBondContact O-CD2 3.38Å; Y538-K540 PolarHBondContact O-N 3.09Å
539	Q	50.3	Low	48.7	Very low	107 Å²	107	118.5 Å²	118.5	50%	0.5	60%	0.599	S	S	.	*	H	α-helix	trans	-66.1	-20.3	176.1	-71.2	178.7	-8.1	0	0	113.9	N541 Y633	Q539-N541 PolarHBondContact O-N 3.47Å; Q539-N541 VanDerWaalsContact O-N 3.14Å; Q539-Y633 PolarHBondContact NE2-OH 3.37Å; Q539-Y633 VanDerWaalsContact NE2-OH 3.07Å
540	K	43.7	Very low	48.4	Very low	138 Å²	138	122.6 Å²	122.6	60%	0.6	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-19.5	-178.9	-168.1	172	179.2	177.8	0	113.6	N536 M537 Y538 G542	N536-K540 PolarHBondContact O-N 2.86Å; M537-K540 WeakPolarHBondContact O-CB 3.44Å; M537-K540 PolarHBondContact O-N 2.97Å; Y538-K540 PolarHBondContact O-N 3.09Å; K540-G542 PolarHBondContact O-N 2.91Å
541	N	44.1	Very low	48.3	Very low	136 Å²	136	120.8 Å²	120.8	73%	0.727	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	23.3	-177.8	-66.6	-23.8	0	0	0	114.5	Q539	Q539-N541 PolarHBondContact O-N 3.47Å; Q539-N541 VanDerWaalsContact O-N 3.14Å
542	G	46.9	Very low	48.3	Very low	38 Å²	38	124 Å²	124	39%	0.392	63%	0.629	S	S	.	*	S	Bend	trans	-62.7	155.4	171.5	0	0	0	0	0	112.8	K540 L544	K540-G542 PolarHBondContact O-N 2.91Å; G542-L544 PolarHBondContact O-N 2.89Å
543	P	49.4	Very low	48	Very low	140 Å²	140	125.6 Å²	125.6	91%	0.909	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	11.2	-167.8	-24.4	35.6	0	0	0	118.3
544	L	45.3	Very low	48.3	Very low	168 Å²	168	133 Å²	133	88%	0.88	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	0.1	-168.8	-66.2	177.9	0	0	0	115.1	G542 G546	G542-L544 PolarHBondContact O-N 2.89Å; L544-G546 PolarHBondContact O-N 3.31Å
545	H	42.3	Very low	48.4	Very low	133 Å²	133	141.1 Å²	141.1	62%	0.616	69%	0.688	S	S	*	*			trans	-80.9	63.7	179	-148.1	74.4	0	0	0	113.5
546	G	50.6	Low	48.6	Very low	58 Å²	58	141.4 Å²	141.4	60%	0.598	69%	0.688	S	S	*	*			trans	-84.6	148.1	167.9	0	0	0	0	0	112.5	L544	L544-G546 PolarHBondContact O-N 3.31Å
547	K	48.2	Very low	48.9	Very low	199 Å²	199	143.8 Å²	143.8	87%	0.865	70%	0.7	S	S	*	*	S	Bend	trans	119.2	-5.7	162.1	-65.8	-178.3	177.9	-178.2	0	118.7
548	Y	44.3	Very low	49.4	Very low	197 Å²	197	143.1 Å²	143.1	77%	0.773	70%	0.703	S	S	*	*	S	Bend	trans	-123.1	129	168	-73.1	-81	0	0	0	113.3	L550	Y548-L550 PolarHBondContact O-N 3.35Å
549	M	45.8	Very low	50.2	Low	134 Å²	134	140.5 Å²	140.5	66%	0.66	70%	0.697	S	S	*	*			trans	52.4	47.6	168.7	-61.2	-57.2	108.1	0	0	118.9	K551	M549-K551 PolarHBondContact O-N 2.98Å; M549-K551 HydrophobicContact SD-CD 3.78Å; M549-K551 VanDerWaalsContact SD-CE 3.59Å; M549-K551 HydrophobicContact SD-CG 3.95Å
550	L	46.1	Very low	51.7	Low	178 Å²	178	139.3 Å²	139.3	93%	0.932	69%	0.694	S	S	*	*			trans	-73.9	46.1	160.3	-146.1	78.7	0	0	0	112.5	Y548 K552	Y548-L550 PolarHBondContact O-N 3.35Å; L550-K552 VanDerWaalsContact C-N 3.31Å; L550-K552 PolarHBondContact O-N 3.35Å
551	K	51.2	Low	53.9	Low	167 Å²	167	137 Å²	137	73%	0.726	69%	0.688	S	S	*	*			trans	-74	73.8	-177.7	-82.6	-172	172.9	179.5	0	111.7	M549 S553	M549-K551 PolarHBondContact O-N 2.98Å; M549-K551 HydrophobicContact SD-CD 3.78Å; M549-K551 VanDerWaalsContact SD-CE 3.59Å; M549-K551 HydrophobicContact SD-CG 3.95Å; K551-S553 PolarHBondContact O-N 3.45Å
552	K	50.5	Low	56.1	Low	207 Å²	207	133.8 Å²	133.8	90%	0.9	67%	0.673	S	S	*	*			trans	46	29.1	167.7	-71	-173.7	176.4	177.8	0	116.3	L550 R554	L550-K552 VanDerWaalsContact C-N 3.31Å; L550-K552 PolarHBondContact O-N 3.35Å; K552-R554 PolarHBondContact O-N 3.05Å; K552-R554 VanDerWaalsContact O-N 3.14Å
553	S	46.5	Very low	58.3	Low	94 Å²	94	132.1 Å²	132.1	66%	0.657	66%	0.656	S	S	*	*			trans	-61	121	166.1	-171.9	0	0	0	0	107.9	K551 R555	K551-S553 PolarHBondContact O-N 3.45Å; S553-R555 PolarHBondContact O-N 2.95Å
554	R	59.9	Low	60.4	Low	222 Å²	222	128.8 Å²	128.8	84%	0.838	63%	0.63	S	S	*	*			trans	-66.5	127.7	170.1	-65.9	-173.9	-176.3	-142.2	2.9	106.3	K552 T556	K552-R554 PolarHBondContact O-N 3.05Å; K552-R554 VanDerWaalsContact O-N 3.14Å; R554-T556 PolarHBondContact O-N 3.07Å
555	R	52.6	Low	62.8	Low	237 Å²	237	120.9 Å²	120.9	89%	0.894	59%	0.589	S	S	*	*			trans	-60.3	102.3	172.6	-121.4	178.8	173.9	160	-3.3	108.6	S553	S553-R555 PolarHBondContact O-N 2.95Å
556	T	55.7	Low	65.3	Low	76 Å²	76	121.7 Å²	121.7	47%	0.466	59%	0.587	S	S	.	*			trans	-95.3	155.9	175.7	53.8	0	0	0	0	109.3	R554 V558 E559	R554-T556 PolarHBondContact O-N 3.07Å; T556-V558 PolarHBondContact O-N 3.45Å; T556-E559 PolarHBondContact O-N 3.22Å; T556-E559 VanDerWaalsContact O-N 3.15Å
557	D	56.8	Low	67.4	Low	85 Å²	85	122.2 Å²	122.2	46%	0.455	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-52.8	-22.3	178.7	-165.4	-11.5	0	0	0	112	E559 D560 K567 Y619 K623	D557-E559 VanDerWaalsContact C-N 3.29Å; D557-E559 PolarHBondContact O-N 2.92Å; D557-D560 PolarHBondContact O-N 3.41Å; D557-D560 VanDerWaalsContact O-N 3.13Å; D557-K567 IonicContact OD1-NZ 3.33Å; D557-K567 IonicContact OD2-NZ 2.76Å; D557-Y619 PolarHBondContact O-OH 2.9Å; D557-K623 IonicContact OD1-NZ 3.92Å; D557-K623 PolarHBondContact OD1-NZ 2.92Å; D557-K623 VanDerWaalsContact OD1-NZ 3.14Å
558	V	59.1	Low	69.7	Low	107 Å²	107	112.8 Å²	112.8	65%	0.648	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-51.7	-40.3	175.7	-175.9	0	0	0	0	113.4	T556 Y619	T556-V558 PolarHBondContact O-N 3.45Å; V558-Y619 PolarHBondContact O-OH 3.47Å
559	E	65.2	Low	72.1	Confident	130 Å²	130	105.3 Å²	105.3	61%	0.607	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-91.7	-8.6	-178.9	-72.5	-176.4	-172.2	0	0	113.8	T556 D557 L561	T556-E559 PolarHBondContact O-N 3.22Å; T556-E559 VanDerWaalsContact O-N 3.15Å; D557-E559 VanDerWaalsContact C-N 3.29Å; D557-E559 PolarHBondContact O-N 2.92Å; E559-L561 PolarHBondContact O-N 3.08Å; E559-L561 VanDerWaalsContact O-N 3.09Å
560	D	82.6	Confident	74.6	Confident	82 Å²	82	105.2 Å²	105.2	44%	0.439	50%	0.503	S	S	.	.			trans	-85.5	82.3	179.2	-172.7	12.8	0	0	0	111.2	D557 T562 K623	D557-D560 PolarHBondContact O-N 3.41Å; D557-D560 VanDerWaalsContact O-N 3.13Å; D560-T562 PolarHBondContact O-N 2.93Å; D560-T562 VanDerWaalsContact O-N 3.1Å; D560-T562 WeakPolarHBondContact OD1-CB 3.35Å; D560-T562 PolarHBondContact OD1-N 2.91Å; D560-T562 VanDerWaalsContact OD1-N 3.13Å; D560-T562 PolarHBondContact OD1-OG1 3.03Å; D560-K623 WeakPolarHBondContact O-CE 3.49Å; D560-K623 PolarHBondContact O-NZ 2.64Å
561	L	88.5	Confident	77	Confident	90 Å²	90	97.5 Å²	97.5	47%	0.471	46%	0.462	S	S	.	.			trans	-70.1	3.7	176.1	-60.2	178.4	0	0	0	113.9	E559 P563 L626	E559-L561 PolarHBondContact O-N 3.08Å; E559-L561 VanDerWaalsContact O-N 3.09Å; L561-P563 WeakPolarHBondContact O-CD 3.26Å; L561-L626 HydrophobicContact CD1-CD2 4.18Å; L561-L626 HydrophobicContact CD2-CD2 4.48Å
562	T	90.8	Very high	79.1	Confident	67 Å²	67	89.5 Å²	89.5	41%	0.411	43%	0.427	S	S	.	.			trans	-64.6	121.3	178.9	-49.1	0	0	0	0	111.1	D560 K623 L705	D560-T562 PolarHBondContact O-N 2.93Å; D560-T562 VanDerWaalsContact O-N 3.1Å; D560-T562 WeakPolarHBondContact OD1-CB 3.35Å; D560-T562 PolarHBondContact OD1-N 2.91Å; D560-T562 VanDerWaalsContact OD1-N 3.13Å; D560-T562 PolarHBondContact OD1-OG1 3.03Å; T562-K623 WeakPolarHBondContact O-CD 3.3Å; T562-L705 HydrophobicContact CG2-CD1 3.75Å
563	P	92.9	Very high	81.3	Confident	4 Å²	4	81.9 Å²	81.9	3%	0.026	40%	0.398	C	S	.	.			trans	-69.8	134.7	179.2	28.2	-35.6	0	0	0	111.8	L561 K623 V624 W627 L702 L705	L561-P563 WeakPolarHBondContact O-CD 3.26Å; P563-K623 HydrophobicContact CB-CB 4.15Å; P563-V624 HydrophobicContact CB-CB 4.47Å; P563-V624 HydrophobicContact CB-CG2 3.79Å; P563-W627 HydrophobicContact CG-CB 3.85Å; P563-W627 HydrophobicContact CG-CD2 3.74Å; P563-W627 HydrophobicContact CG-CE3 3.71Å; P563-W627 HydrophobicContact CG-CG 3.83Å; P563-W627 HydrophobicContact CG-CZ3 4.49Å; P563-L702 HydrophobicContact CB-CD1 3.98Å; P563-L702 HydrophobicContact CG-CD1 3.87Å; P563-L705 HydrophobicContact CG-CD1 4.14Å; P563-L705 HydrophobicContact CG-CD2 4.23Å
564	N	93.8	Very high	83.8	Confident	70 Å²	70	79.9 Å²	79.9	37%	0.374	38%	0.379	S	S	.	.			trans	-121.4	85.9	174.3	-169.8	-26.4	0	0	0	110.9	R566 K567 L568	N564-R566 PolarHBondContact O-N 3.48Å; N564-R566 PolarHBondContact OD1-N 3.06Å; N564-K567 HydrophobicContact CB-CB 3.78Å; N564-K567 HydrophobicContact CB-CD 4.26Å; N564-K567 VanDerWaalsContact CG-CB 3.4Å; N564-K567 WeakPolarHBondContact O-CB 3.39Å; N564-K567 PolarHBondContact O-N 3.44Å; N564-K567 VanDerWaalsContact O-N 3.07Å; N564-K567 WeakPolarHBondContact OD1-CB 3.4Å; N564-K567 PolarHBondContact OD1-N 3.27Å; N564-L568 PolarHBondContact O-N 3.06Å
565	P	94.6	Very high	85.5	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.013	34%	0.341	C	S	.	.	H	α-helix	trans	-66.7	-23.8	-175.7	27.5	-35	0	0	0	112.8	L569 I689 L702	P565-L569 WeakPolarHBondContact O-CB 3.42Å; P565-L569 PolarHBondContact O-N 3.18Å; P565-I689 HydrophobicContact CB-CG2 3.57Å; P565-I689 HydrophobicContact CG-CG2 4.14Å; P565-L702 HydrophobicContact CG-CD1 4.24Å
566	R	94.9	Very high	87.6	Confident	150 Å²	150	65.4 Å²	65.4	57%	0.566	32%	0.324	S	S	*	.	H	α-helix	trans	-67.2	-43.4	171.1	-64.6	-179	67.5	-155.2	-2.3	112	N564 L569 Q570 T693	N564-R566 PolarHBondContact O-N 3.48Å; N564-R566 PolarHBondContact OD1-N 3.06Å; R566-L569 PolarHBondContact O-N 3.25Å; R566-Q570 WeakPolarHBondContact O-CB 3.29Å; R566-Q570 PolarHBondContact O-N 3.03Å; R566-T693 HydrophobicContact CB-CG2 4.43Å; R566-T693 HydrophobicContact CG-CG2 3.76Å
567	K	94.9	Very high	89.6	Confident	69 Å²	69	68.4 Å²	68.4	30%	0.3	33%	0.331	S	S	.	.	H	α-helix	trans	-61.6	-45.3	174.2	-177.5	179.7	174.2	-166.6	0	110.2	D557 N564 Q570 I571 E620	D557-K567 IonicContact OD1-NZ 3.33Å; D557-K567 IonicContact OD2-NZ 2.76Å; N564-K567 HydrophobicContact CB-CB 3.78Å; N564-K567 HydrophobicContact CB-CD 4.26Å; N564-K567 VanDerWaalsContact CG-CB 3.4Å; N564-K567 WeakPolarHBondContact O-CB 3.39Å; N564-K567 PolarHBondContact O-N 3.44Å; N564-K567 VanDerWaalsContact O-N 3.07Å; N564-K567 WeakPolarHBondContact OD1-CB 3.4Å; N564-K567 PolarHBondContact OD1-N 3.27Å; K567-Q570 PolarHBondContact O-N 2.89Å; K567-I571 HydrophobicContact CG-CD1 4.07Å; K567-I571 WeakPolarHBondContact O-CD1 3.43Å; K567-I571 VanDerWaalsContact O-CG1 3.23Å; K567-I571 WeakPolarHBondContact O-CG1 3.47Å; K567-I571 PolarHBondContact O-N 3.31Å; K567-E620 HydrophobicContact CD-CG 4.02Å; K567-E620 VanDerWaalsContact CE-OE1 3.24Å; K567-E620 WeakPolarHBondContact CE-OE1 3.39Å; K567-E620 HydrophobicContact CG-CG 4.21Å; K567-E620 IonicContact NZ-OE1 3.66Å; K567-E620 PolarHBondContact NZ-OE1 3.45Å
568	L	96.4	Very high	91.5	Very high	1 Å²	1	65 Å²	65	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-59.2	-50.7	174.9	-177.4	58.7	0	0	0	112.4	N564 Q570 I571 G572 A617 E620 A621 V624 V686 L690	N564-L568 PolarHBondContact O-N 3.06Å; L568-Q570 VanDerWaalsContact C-N 3.33Å; L568-Q570 PolarHBondContact O-N 2.69Å; L568-I571 PolarHBondContact O-N 2.71Å; L568-G572 PolarHBondContact O-N 2.89Å; L568-A617 HydrophobicContact CD1-CB 3.99Å; L568-A617 WeakPolarHBondContact CD1-O 3.49Å; L568-E620 HydrophobicContact CB-CB 4.12Å; L568-E620 HydrophobicContact CD1-CB 4.14Å; L568-A621 HydrophobicContact CD1-CB 4.16Å; L568-A621 HydrophobicContact CD2-CB 3.98Å; L568-V624 HydrophobicContact CD2-CG2 4.43Å; L568-V686 HydrophobicContact CD2-CG1 3.81Å; L568-L690 HydrophobicContact CB-CD2 4.23Å; L568-L690 HydrophobicContact CD2-CD1 4.05Å; L568-L690 HydrophobicContact CD2-CD2 4.02Å; L568-L690 HydrophobicContact CD2-CG 4.21Å; L568-L690 HydrophobicContact CG-CD1 4.28Å; L568-L690 HydrophobicContact CG-CD2 3.92Å
569	L	96.1	Very high	93.2	Very high	40 Å²	40	63 Å²	63	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-43.1	177.5	-177.1	63.5	0	0	0	111.8	P565 R566 G572 T573 L690 T693	P565-L569 WeakPolarHBondContact O-CB 3.42Å; P565-L569 PolarHBondContact O-N 3.18Å; R566-L569 PolarHBondContact O-N 3.25Å; L569-G572 CarbonylContact O-C 3.58Å; L569-G572 WeakPolarHBondContact O-CA 3.38Å; L569-G572 PolarHBondContact O-N 2.95Å; L569-T573 WeakPolarHBondContact O-CG2 3.33Å; L569-T573 PolarHBondContact O-N 3.45Å; L569-L690 HydrophobicContact CB-CD2 3.74Å; L569-L690 HydrophobicContact CD1-CD2 4.19Å; L569-T693 HydrophobicContact CB-CG2 4.38Å; L569-T693 HydrophobicContact CD2-CG2 3.77Å
570	Q	96.9	Very high	94.7	Very high	132 Å²	132	63.1 Å²	63.1	62%	0.617	30%	0.297	S	S	*	.	H	α-helix	trans	-61.5	-47.9	178.2	-177	174.1	-5.5	0	0	111.6	R566 K567 L568 G572 T573 E574	R566-Q570 WeakPolarHBondContact O-CB 3.29Å; R566-Q570 PolarHBondContact O-N 3.03Å; K567-Q570 PolarHBondContact O-N 2.89Å; L568-Q570 VanDerWaalsContact C-N 3.33Å; L568-Q570 PolarHBondContact O-N 2.69Å; Q570-G572 VanDerWaalsContact C-N 3.26Å; Q570-G572 PolarHBondContact O-N 2.83Å; Q570-T573 PolarHBondContact O-N 3.21Å; Q570-T573 PolarHBondContact O-OG1 3.27Å; Q570-E574 PolarHBondContact O-N 3.15Å
571	I	96.6	Very high	95.4	Very high	15 Å²	15	62.3 Å²	62.3	8%	0.077	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-41.3	174.5	-65	160.6	0	0	0	110.2	K567 L568 T573 E574 L575 L613 K616 A617 E620	K567-I571 HydrophobicContact CG-CD1 4.07Å; K567-I571 WeakPolarHBondContact O-CD1 3.43Å; K567-I571 VanDerWaalsContact O-CG1 3.23Å; K567-I571 WeakPolarHBondContact O-CG1 3.47Å; K567-I571 PolarHBondContact O-N 3.31Å; L568-I571 PolarHBondContact O-N 2.71Å; I571-T573 VanDerWaalsContact C-N 3.33Å; I571-T573 PolarHBondContact O-N 3.13Å; I571-E574 PolarHBondContact O-N 3.16Å; I571-E574 VanDerWaalsContact O-N 3.09Å; I571-L575 HydrophobicContact CG2-CD1 4.1Å; I571-L575 HydrophobicContact CG2-CG 4.4Å; I571-L575 WeakPolarHBondContact O-CG 3.35Å; I571-L575 PolarHBondContact O-N 3.14Å; I571-L613 HydrophobicContact CG2-CB 4.07Å; I571-L613 HydrophobicContact CG2-CD2 4.09Å; I571-L613 WeakPolarHBondContact CG2-O 3.49Å; I571-K616 HydrophobicContact CD1-CB 4.07Å; I571-A617 HydrophobicContact CG2-CB 3.83Å; I571-E620 HydrophobicContact CD1-CG 4.46Å
572	G	96.4	Very high	95.6	Very high	0 Å²	0	60 Å²	60	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-30.6	173.5	0	0	0	0	0	115.3	L568 L569 Q570 R576	L568-G572 PolarHBondContact O-N 2.89Å; L569-G572 CarbonylContact O-C 3.58Å; L569-G572 WeakPolarHBondContact O-CA 3.38Å; L569-G572 PolarHBondContact O-N 2.95Å; Q570-G572 VanDerWaalsContact C-N 3.26Å; Q570-G572 PolarHBondContact O-N 2.83Å; G572-R576 PolarHBondContact O-N 3.38Å; G572-R576 PolarHBondContact O-NE 2.85Å
573	T	96.8	Very high	95.7	Very high	47 Å²	47	61.4 Å²	61.4	29%	0.288	30%	0.295	S	S	.	.	H	α-helix	trans	-74.4	-32.8	169.9	73	0	0	0	0	112.5	L569 Q570 I571 K577	L569-T573 WeakPolarHBondContact O-CG2 3.33Å; L569-T573 PolarHBondContact O-N 3.45Å; Q570-T573 PolarHBondContact O-N 3.21Å; Q570-T573 PolarHBondContact O-OG1 3.27Å; I571-T573 VanDerWaalsContact C-N 3.33Å; I571-T573 PolarHBondContact O-N 3.13Å; T573-K577 WeakPolarHBondContact O-CD 3.46Å; T573-K577 VanDerWaalsContact O-CG 3.27Å; T573-K577 WeakPolarHBondContact O-CG 3.33Å; T573-K577 PolarHBondContact O-N 2.95Å
574	E	97.6	Very high	95.7	Very high	52 Å²	52	66.5 Å²	66.5	24%	0.243	32%	0.322	C	S	.	.	H	α-helix	trans	-72.4	-42.8	177.6	-166.6	179.8	161.4	0	0	111.4	Q570 I571 R576 K577 L578 R609 L613	Q570-E574 PolarHBondContact O-N 3.15Å; I571-E574 PolarHBondContact O-N 3.16Å; I571-E574 VanDerWaalsContact O-N 3.09Å; E574-R576 PolarHBondContact O-N 3.27Å; E574-K577 WeakPolarHBondContact O-CB 3.26Å; E574-K577 PolarHBondContact O-N 3.21Å; E574-L578 HydrophobicContact CG-CD1 4.3Å; E574-L578 WeakPolarHBondContact O-CG 3.48Å; E574-L578 PolarHBondContact O-N 3.41Å; E574-R609 IonicContact OE1-CZ 3.95Å; E574-R609 IonicContact OE1-NE 2.95Å; E574-R609 PolarHBondContact OE1-NE 2.88Å; E574-R609 IonicContact OE1-NH2 2.69Å; E574-R609 PolarHBondContact OE1-NH2 3.02Å; E574-L613 HydrophobicContact CB-CD1 4.36Å; E574-L613 HydrophobicContact CG-CD1 3.81Å; E574-L613 WeakPolarHBondContact OE1-CD1 3.29Å
575	L	97.4	Very high	95.5	Very high	8 Å²	8	65.3 Å²	65.3	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-55.4	-49.7	173	-78.4	169.4	0	0	0	111.8	Y131 I571 K577 L578 N579 A610 L613 K614 A617	Y131-L575 HydrophobicContact CD2-CD1 3.96Å; Y131-L575 HydrophobicContact CG-CD1 4.37Å; I571-L575 HydrophobicContact CG2-CD1 4.1Å; I571-L575 HydrophobicContact CG2-CG 4.4Å; I571-L575 WeakPolarHBondContact O-CG 3.35Å; I571-L575 PolarHBondContact O-N 3.14Å; L575-K577 VanDerWaalsContact C-N 3.31Å; L575-K577 PolarHBondContact O-N 2.95Å; L575-L578 PolarHBondContact O-N 3.38Å; L575-N579 WeakPolarHBondContact O-CB 3.43Å; L575-N579 PolarHBondContact O-N 3.04Å; L575-N579 PolarHBondContact O-OD1 3.09Å; L575-A610 HydrophobicContact CD2-CB 4.39Å; L575-A610 WeakPolarHBondContact CD2-O 3.47Å; L575-L613 HydrophobicContact CD2-CB 3.65Å; L575-L613 HydrophobicContact CG-CB 3.97Å; L575-K614 HydrophobicContact CD2-CB 4.48Å; L575-A617 HydrophobicContact CD1-CB 4.08Å
576	R	96.2	Very high	95.1	Very high	146 Å²	146	68.3 Å²	68.3	55%	0.551	33%	0.334	S	S	*	.	H	α-helix	trans	-62.4	-35.4	177.1	-74.6	-178	-69.9	155.8	-7.7	113.2	G572 E574 K580	G572-R576 PolarHBondContact O-N 3.38Å; G572-R576 PolarHBondContact O-NE 2.85Å; E574-R576 PolarHBondContact O-N 3.27Å; R576-K580 WeakPolarHBondContact O-CB 3.5Å; R576-K580 PolarHBondContact O-N 2.7Å; R576-K580 VanDerWaalsContact O-N 3.08Å
577	K	97.5	Very high	94.6	Very high	140 Å²	140	63.6 Å²	63.6	61%	0.609	32%	0.323	S	S	*	.	H	α-helix	trans	-65.5	-45.1	173.1	-72.2	165.8	-176.5	173.2	0	111.6	T573 E574 L575 K580 V581	T573-K577 WeakPolarHBondContact O-CD 3.46Å; T573-K577 VanDerWaalsContact O-CG 3.27Å; T573-K577 WeakPolarHBondContact O-CG 3.33Å; T573-K577 PolarHBondContact O-N 2.95Å; E574-K577 WeakPolarHBondContact O-CB 3.26Å; E574-K577 PolarHBondContact O-N 3.21Å; L575-K577 VanDerWaalsContact C-N 3.31Å; L575-K577 PolarHBondContact O-N 2.95Å; K577-K580 PolarHBondContact O-N 3.09Å; K577-V581 WeakPolarHBondContact O-CG2 3.11Å; K577-V581 PolarHBondContact O-N 2.82Å
578	L	96.3	Very high	94	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-67.8	-46	-179.9	-68.5	170.8	0	0	0	112.1	E574 L575 K580 V581 I582 L606 R609 A610 L613	E574-L578 HydrophobicContact CG-CD1 4.3Å; E574-L578 WeakPolarHBondContact O-CG 3.48Å; E574-L578 PolarHBondContact O-N 3.41Å; L575-L578 PolarHBondContact O-N 3.38Å; L578-K580 VanDerWaalsContact C-N 3.29Å; L578-K580 PolarHBondContact O-N 3.41Å; L578-V581 PolarHBondContact O-N 3.36Å; L578-V581 VanDerWaalsContact O-N 3.15Å; L578-I582 WeakPolarHBondContact O-CB 3.47Å; L578-I582 WeakPolarHBondContact O-CD1 3.34Å; L578-I582 VanDerWaalsContact O-CG1 3.24Å; L578-I582 WeakPolarHBondContact O-CG1 3.45Å; L578-I582 PolarHBondContact O-N 3.41Å; L578-L606 HydrophobicContact CD2-CD2 3.93Å; L578-R609 HydrophobicContact CD1-CB 4.19Å; L578-R609 HydrophobicContact CD1-CG 3.68Å; L578-A610 HydrophobicContact CB-CB 4.38Å; L578-A610 HydrophobicContact CD1-CB 4.37Å; L578-L613 HydrophobicContact CD1-CD1 3.36Å
579	N	95.6	Very high	93.4	Very high	65 Å²	65	64.7 Å²	64.7	35%	0.348	34%	0.338	S	S	.	.	H	α-helix	trans	-58.7	-43.4	176.4	-69.2	7.6	0	0	0	110.4	L575 I582 S583	L575-N579 WeakPolarHBondContact O-CB 3.43Å; L575-N579 PolarHBondContact O-N 3.04Å; L575-N579 PolarHBondContact O-OD1 3.09Å; N579-I582 PolarHBondContact O-N 2.95Å; N579-S583 PolarHBondContact O-N 2.85Å; N579-S583 PolarHBondContact O-OG 2.95Å
580	K	96.6	Very high	92.9	Very high	134 Å²	134	69.7 Å²	69.7	58%	0.583	36%	0.36	S	S	*	.	H	α-helix	trans	-57	-51.8	172.3	174.7	164.6	179	169.6	0	112.2	R576 K577 L578 I582 S583 D584	R576-K580 WeakPolarHBondContact O-CB 3.5Å; R576-K580 PolarHBondContact O-N 2.7Å; R576-K580 VanDerWaalsContact O-N 3.08Å; K577-K580 PolarHBondContact O-N 3.09Å; L578-K580 VanDerWaalsContact C-N 3.29Å; L578-K580 PolarHBondContact O-N 3.41Å; K580-I582 VanDerWaalsContact C-N 3.28Å; K580-I582 PolarHBondContact O-N 2.82Å; K580-S583 PolarHBondContact O-N 2.98Å; K580-S583 VanDerWaalsContact O-N 3.16Å; K580-D584 WeakPolarHBondContact CE-OD2 3.45Å; K580-D584 VanDerWaalsContact CG-OD2 3.29Å; K580-D584 WeakPolarHBondContact CG-OD2 3.31Å; K580-D584 IonicContact NZ-OD2 3.14Å; K580-D584 WeakPolarHBondContact O-CB 3.47Å; K580-D584 VanDerWaalsContact O-CG 3.23Å; K580-D584 PolarHBondContact O-N 3.32Å
581	V	95.8	Very high	92.4	Very high	65 Å²	65	65 Å²	65	39%	0.394	34%	0.34	S	S	.	.	H	α-helix	trans	-62.6	-35.6	-179.5	176.8	0	0	0	0	111.9	K577 L578 L585 L606	K577-V581 WeakPolarHBondContact O-CG2 3.11Å; K577-V581 PolarHBondContact O-N 2.82Å; L578-V581 PolarHBondContact O-N 3.36Å; L578-V581 VanDerWaalsContact O-N 3.15Å; V581-L585 VanDerWaalsContact O-CG 3.28Å; V581-L585 WeakPolarHBondContact O-CG 3.22Å; V581-L585 PolarHBondContact O-N 3.23Å; V581-L606 HydrophobicContact CG1-CD1 3.71Å
582	I	93.4	Very high	91.9	Very high	41 Å²	41	68.4 Å²	68.4	21%	0.21	36%	0.363	C	S	.	.	H	α-helix	trans	-64.6	-40.4	176	-68.5	162.7	0	0	0	111.2	L578 N579 K580 L606 A610	L578-I582 WeakPolarHBondContact O-CB 3.47Å; L578-I582 WeakPolarHBondContact O-CD1 3.34Å; L578-I582 VanDerWaalsContact O-CG1 3.24Å; L578-I582 WeakPolarHBondContact O-CG1 3.45Å; L578-I582 PolarHBondContact O-N 3.41Å; N579-I582 PolarHBondContact O-N 2.95Å; K580-I582 VanDerWaalsContact C-N 3.28Å; K580-I582 PolarHBondContact O-N 2.82Å; I582-L606 HydrophobicContact CD1-CB 3.94Å; I582-L606 HydrophobicContact CG1-CB 3.63Å; I582-L606 HydrophobicContact CG1-CD1 4.2Å; I582-A610 HydrophobicContact CD1-CB 4.37Å
583	S	92.6	Very high	91.2	Very high	97 Å²	97	74.9 Å²	74.9	68%	0.678	40%	0.397	S	S	*	.	H	α-helix	trans	-74.6	-36.1	176.2	-60.5	0	0	0	0	113.8	N579 K580 L585	N579-S583 PolarHBondContact O-N 2.85Å; N579-S583 PolarHBondContact O-OG 2.95Å; K580-S583 PolarHBondContact O-N 2.98Å; K580-S583 VanDerWaalsContact O-N 3.16Å; S583-L585 VanDerWaalsContact C-N 3.26Å; S583-L585 PolarHBondContact O-N 3.2Å
584	D	94.1	Very high	90.8	Very high	110 Å²	110	78.8 Å²	78.8	59%	0.588	42%	0.421	S	S	*	.	H	α-helix	trans	-69.8	-22.5	178.5	-71.5	-11.5	0	0	0	112.1	K580	K580-D584 WeakPolarHBondContact CE-OD2 3.45Å; K580-D584 VanDerWaalsContact CG-OD2 3.29Å; K580-D584 WeakPolarHBondContact CG-OD2 3.31Å; K580-D584 IonicContact NZ-OD2 3.14Å; K580-D584 WeakPolarHBondContact O-CB 3.47Å; K580-D584 VanDerWaalsContact O-CG 3.23Å; K580-D584 PolarHBondContact O-N 3.32Å
585	L	90	Very high	90.3	Very high	45 Å²	45	78 Å²	78	24%	0.236	42%	0.423	C	S	.	.	S	Bend	trans	-74.8	126.5	175.8	-77.5	168	0	0	0	111.4	V581 S583 E602 K603 L606	V581-L585 VanDerWaalsContact O-CG 3.28Å; V581-L585 WeakPolarHBondContact O-CG 3.22Å; V581-L585 PolarHBondContact O-N 3.23Å; S583-L585 VanDerWaalsContact C-N 3.26Å; S583-L585 PolarHBondContact O-N 3.2Å; L585-E602 HydrophobicContact CD1-CG 4.42Å; L585-K603 HydrophobicContact CD1-CG 3.95Å; L585-K603 WeakPolarHBondContact O-CE 3.35Å; L585-K603 PolarHBondContact O-NZ 3.09Å; L585-L606 HydrophobicContact CD1-CD1 3.7Å
586	T	84.6	Confident	89.9	Confident	66 Å²	66	81.8 Å²	81.8	41%	0.405	44%	0.437	S	S	.	.			trans	-44.5	135.2	176.5	-45.6	0	0	0	0	112.8	E590 L591 K603	T586-E590 HydrophobicContact CG2-CB 4.01Å; T586-L591 HydrophobicContact CG2-CD2 3.81Å; T586-L591 HydrophobicContact CG2-CG 3.89Å; T586-K603 PolarHBondContact O-NZ 3.37Å
587	P	85	Confident	89.6	Confident	51 Å²	51	78.8 Å²	78.8	33%	0.331	44%	0.436	S	S	.	.			trans	-62.6	147.8	177.2	28.2	-35.6	0	0	0	111.1	S589 E590	P587-S589 PolarHBondContact O-N 2.93Å; P587-E590 HydrophobicContact CG-CB 4.13Å; P587-E590 HydrophobicContact CG-CG 3.85Å; P587-E590 WeakPolarHBondContact CG-OE1 3.35Å; P587-E590 WeakPolarHBondContact CG-OE2 3.33Å; P587-E590 PolarHBondContact O-N 3.4Å; P587-E590 VanDerWaalsContact O-N 3.16Å
588	V	82.4	Confident	89.1	Confident	16 Å²	16	82.1 Å²	82.1	10%	0.097	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.9	-170.8	-175.5	0	0	0	0	111.4	E590 L591 R596 K603	V588-E590 PolarHBondContact O-N 3.04Å; V588-L591 PolarHBondContact O-N 3.32Å; V588-R596 HydrophobicContact CG1-CB 3.79Å; V588-R596 HydrophobicContact CG1-CG 3.81Å; V588-R596 WeakPolarHBondContact O-CD 3.18Å; V588-R596 WeakPolarHBondContact O-CG 3.08Å; V588-R596 PolarHBondContact O-NE 3.35Å; V588-K603 HydrophobicContact CG2-CD 4.35Å
589	S	83.1	Confident	88.9	Confident	77 Å²	77	82.2 Å²	82.2	54%	0.538	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-43.1	171.4	47.2	0	0	0	0	113.6	P587 L591 R596	P587-S589 PolarHBondContact O-N 2.93Å; S589-L591 VanDerWaalsContact C-N 3.35Å; S589-R596 PolarHBondContact O-NH2 3.46Å
590	E	85.6	Confident	88.7	Confident	144 Å²	144	81.1 Å²	81.1	67%	0.673	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.9	-176.3	-70.5	169.4	-159.8	0	0	113.5	T586 P587 V588	T586-E590 HydrophobicContact CG2-CB 4.01Å; P587-E590 HydrophobicContact CG-CB 4.13Å; P587-E590 HydrophobicContact CG-CG 3.85Å; P587-E590 WeakPolarHBondContact CG-OE1 3.35Å; P587-E590 WeakPolarHBondContact CG-OE2 3.33Å; P587-E590 PolarHBondContact O-N 3.4Å; P587-E590 VanDerWaalsContact O-N 3.16Å; V588-E590 PolarHBondContact O-N 3.04Å
591	L	86.2	Confident	88.6	Confident	35 Å²	35	83 Å²	83	18%	0.183	45%	0.445	C	S	.	.	S	Bend	trans	-82.1	144.1	-177.6	-71.4	172.4	0	0	0	112.6	T586 V588 S589 R596 S599	T586-L591 HydrophobicContact CG2-CD2 3.81Å; T586-L591 HydrophobicContact CG2-CG 3.89Å; V588-L591 PolarHBondContact O-N 3.32Å; S589-L591 VanDerWaalsContact C-N 3.35Å; L591-R596 HydrophobicContact CB-CG 4.1Å; L591-R596 WeakPolarHBondContact O-CG 3.04Å; L591-R596 PolarHBondContact O-NE 3.3Å; L591-S599 VanDerWaalsContact CD1-OG 3.24Å; L591-S599 WeakPolarHBondContact CD1-OG 3.34Å
592	P	85.9	Confident	88.5	Confident	86 Å²	86	84.9 Å²	84.9	56%	0.558	45%	0.45	S	S	*	.			trans	-55.3	144.1	171.9	-25.2	34.1	0	0	0	112.2	T594 A595 R596	P592-T594 PolarHBondContact O-N 2.8Å; P592-A595 WeakPolarHBondContact O-CA 3.39Å; P592-A595 WeakPolarHBondContact O-CB 3.38Å; P592-A595 PolarHBondContact O-N 3.09Å; P592-R596 PolarHBondContact O-N 3.45Å; P592-R596 VanDerWaalsContact O-N 3.11Å
593	L	83.3	Confident	88.5	Confident	136 Å²	136	84.7 Å²	84.7	71%	0.712	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-36.1	-174.4	-63.4	176.8	0	0	0	113.8	A595 P597	L593-A595 VanDerWaalsContact C-N 3.35Å; L593-A595 PolarHBondContact O-N 2.87Å; L593-P597 WeakPolarHBondContact O-CD 3.44Å
594	T	87.5	Confident	88.6	Confident	129 Å²	129	82.5 Å²	82.5	79%	0.791	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-23.7	177.7	51.9	0	0	0	0	114.1	P592	P592-T594 PolarHBondContact O-N 2.8Å
595	A	87.6	Confident	88.7	Confident	35 Å²	35	85 Å²	85	29%	0.289	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-27.2	178.4	0	0	0	0	0	112.9	P592 L593 R598 S599	P592-A595 WeakPolarHBondContact O-CA 3.39Å; P592-A595 WeakPolarHBondContact O-CB 3.38Å; P592-A595 PolarHBondContact O-N 3.09Å; L593-A595 VanDerWaalsContact C-N 3.35Å; L593-A595 PolarHBondContact O-N 2.87Å; A595-R598 PolarHBondContact O-N 3.25Å; A595-R598 VanDerWaalsContact O-N 3.12Å; A595-S599 PolarHBondContact O-N 3.36Å; A595-S599 VanDerWaalsContact O-N 3.11Å
596	R	89.1	Confident	89.1	Confident	88 Å²	88	84.1 Å²	84.1	33%	0.332	43%	0.429	S	S	.	.	H	α-helix	trans	-49.3	-46.2	-178.9	-67.5	-174	-178	-176.9	-3.9	113.9	V588 S589 L591 P592 R598 S599 R600	V588-R596 HydrophobicContact CG1-CB 3.79Å; V588-R596 HydrophobicContact CG1-CG 3.81Å; V588-R596 WeakPolarHBondContact O-CD 3.18Å; V588-R596 WeakPolarHBondContact O-CG 3.08Å; V588-R596 PolarHBondContact O-NE 3.35Å; S589-R596 PolarHBondContact O-NH2 3.46Å; L591-R596 HydrophobicContact CB-CG 4.1Å; L591-R596 WeakPolarHBondContact O-CG 3.04Å; L591-R596 PolarHBondContact O-NE 3.3Å; P592-R596 PolarHBondContact O-N 3.45Å; P592-R596 VanDerWaalsContact O-N 3.11Å; R596-R598 VanDerWaalsContact C-N 3.35Å; R596-R598 PolarHBondContact O-N 3.43Å; R596-S599 PolarHBondContact O-N 3.43Å; R596-R600 WeakPolarHBondContact O-CB 3.39Å; R596-R600 PolarHBondContact O-N 3.06Å
597	P	89.4	Confident	89.6	Confident	82 Å²	82	83.1 Å²	83.1	53%	0.532	43%	0.428	S	S	.	.	H	α-helix	trans	-64.6	-35.3	-178.9	-23.3	34.9	0	0	0	113.6	L593 K601	L593-P597 WeakPolarHBondContact O-CD 3.44Å; P597-K601 WeakPolarHBondContact O-CB 3.42Å; P597-K601 PolarHBondContact O-N 2.82Å; P597-K601 VanDerWaalsContact O-N 3.08Å
598	R	87.8	Confident	90.1	Very high	211 Å²	211	83.9 Å²	83.9	80%	0.796	43%	0.434	S	S	*	.	H	α-helix	trans	-69.4	-46.6	176.4	-70.4	-169.8	176.2	-151.3	-0.4	110.8	A595 R596 K601 E602	A595-R598 PolarHBondContact O-N 3.25Å; A595-R598 VanDerWaalsContact O-N 3.12Å; R596-R598 VanDerWaalsContact C-N 3.35Å; R596-R598 PolarHBondContact O-N 3.43Å; R598-K601 PolarHBondContact O-N 2.83Å; R598-E602 PolarHBondContact O-N 3.26Å
599	S	91.3	Very high	90.9	Very high	14 Å²	14	89.4 Å²	89.4	10%	0.098	45%	0.453	C	S	.	.	H	α-helix	trans	-61	-45.8	176.6	178.4	0	0	0	0	112.4	L591 A595 R596 K601 E602 K603	L591-S599 VanDerWaalsContact CD1-OG 3.24Å; L591-S599 WeakPolarHBondContact CD1-OG 3.34Å; A595-S599 PolarHBondContact O-N 3.36Å; A595-S599 VanDerWaalsContact O-N 3.11Å; R596-S599 PolarHBondContact O-N 3.43Å; S599-K601 PolarHBondContact O-N 2.9Å; S599-E602 PolarHBondContact O-N 3.46Å; S599-K603 WeakPolarHBondContact O-CB 3.5Å; S599-K603 PolarHBondContact O-N 3.18Å
600	R	91.8	Very high	91.6	Very high	42 Å²	42	86.3 Å²	86.3	16%	0.158	43%	0.432	C	S	.	.	H	α-helix	trans	-61.5	-41.7	176.2	-164.1	-168.6	-78.5	143.7	-12.1	111.6	D150 R596 E602 N604	D150-R600 IonicContact OD1-CZ 2.66Å; D150-R600 IonicContact OD1-NH1 3.74Å; D150-R600 PolarHBondContact OD1-NH1 3.07Å; D150-R600 IonicContact OD1-NH2 2.87Å; D150-R600 PolarHBondContact OD1-NH2 3.28Å; D150-R600 IonicContact OD2-CZ 2.7Å; D150-R600 IonicContact OD2-NH1 3.27Å; D150-R600 PolarHBondContact OD2-NH1 3.27Å; D150-R600 IonicContact OD2-NH2 3.16Å; R596-R600 WeakPolarHBondContact O-CB 3.39Å; R596-R600 PolarHBondContact O-N 3.06Å; R600-E602 PolarHBondContact O-N 2.89Å; R600-N604 WeakPolarHBondContact O-CB 3.49Å; R600-N604 PolarHBondContact O-N 2.95Å
601	K	93.8	Very high	92.1	Very high	173 Å²	173	83.6 Å²	83.6	75%	0.752	43%	0.428	S	S	*	.	H	α-helix	trans	-62.6	-39	176	-172.7	173	-177	174.8	0	112.5	P597 R598 S599 K605	P597-K601 WeakPolarHBondContact O-CB 3.42Å; P597-K601 PolarHBondContact O-N 2.82Å; P597-K601 VanDerWaalsContact O-N 3.08Å; R598-K601 PolarHBondContact O-N 2.83Å; S599-K601 PolarHBondContact O-N 2.9Å; K601-K605 WeakPolarHBondContact O-CB 3.24Å; K601-K605 PolarHBondContact O-N 2.88Å; K601-K605 VanDerWaalsContact O-N 3.14Å
602	E	94.4	Very high	92.7	Very high	104 Å²	104	91 Å²	91	49%	0.486	45%	0.454	S	S	.	.	H	α-helix	trans	-71.6	-47.3	176.6	-176.5	163.1	-159.9	0	0	112.4	L585 R598 S599 R600 N604 K605 L606	L585-E602 HydrophobicContact CD1-CG 4.42Å; R598-E602 PolarHBondContact O-N 3.26Å; S599-E602 PolarHBondContact O-N 3.46Å; R600-E602 PolarHBondContact O-N 2.89Å; E602-N604 VanDerWaalsContact C-N 3.34Å; E602-N604 PolarHBondContact O-N 3.12Å; E602-K605 WeakPolarHBondContact O-CB 3.46Å; E602-K605 PolarHBondContact O-N 2.89Å; E602-K605 VanDerWaalsContact O-N 3.09Å; E602-L606 HydrophobicContact CG-CD1 4.32Å; E602-L606 WeakPolarHBondContact O-CG 3.41Å; E602-L606 PolarHBondContact O-N 3.33Å
603	K	93	Very high	93.2	Very high	38 Å²	38	87.7 Å²	87.7	17%	0.165	43%	0.431	C	S	.	.	H	α-helix	trans	-57	-45.2	174.8	-76	-171.1	166.6	-175	0	111.8	L585 T586 V588 S599 K605 L606 A607	L585-K603 HydrophobicContact CD1-CG 3.95Å; L585-K603 WeakPolarHBondContact O-CE 3.35Å; L585-K603 PolarHBondContact O-NZ 3.09Å; T586-K603 PolarHBondContact O-NZ 3.37Å; V588-K603 HydrophobicContact CG2-CD 4.35Å; S599-K603 WeakPolarHBondContact O-CB 3.5Å; S599-K603 PolarHBondContact O-N 3.18Å; K603-K605 VanDerWaalsContact C-N 3.34Å; K603-K605 PolarHBondContact O-N 2.87Å; K603-L606 PolarHBondContact O-N 3.4Å; K603-A607 VanDerWaalsContact O-CB 3.32Å; K603-A607 WeakPolarHBondContact O-CB 3.34Å; K603-A607 PolarHBondContact O-N 2.76Å
604	N	95.3	Very high	93.9	Very high	50 Å²	50	84.9 Å²	84.9	27%	0.267	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-35.2	176.1	-74.8	-3.6	0	0	0	112.7	R600 E602 S608	R600-N604 WeakPolarHBondContact O-CB 3.49Å; R600-N604 PolarHBondContact O-N 2.95Å; E602-N604 VanDerWaalsContact C-N 3.34Å; E602-N604 PolarHBondContact O-N 3.12Å; N604-S608 WeakPolarHBondContact O-CB 3.25Å; N604-S608 PolarHBondContact O-N 2.71Å; N604-S608 PolarHBondContact O-OG 3.08Å
605	K	96.4	Very high	94.3	Very high	164 Å²	164	86.2 Å²	86.2	71%	0.713	41%	0.408	S	S	*	.	H	α-helix	trans	-64.6	-44.1	173.8	-175.9	-178.3	178.8	-176.5	0	111.6	K601 E602 K603 R609	K601-K605 WeakPolarHBondContact O-CB 3.24Å; K601-K605 PolarHBondContact O-N 2.88Å; K601-K605 VanDerWaalsContact O-N 3.14Å; E602-K605 WeakPolarHBondContact O-CB 3.46Å; E602-K605 PolarHBondContact O-N 2.89Å; E602-K605 VanDerWaalsContact O-N 3.09Å; K603-K605 VanDerWaalsContact C-N 3.34Å; K603-K605 PolarHBondContact O-N 2.87Å; K605-R609 PolarHBondContact O-N 3.13Å
606	L	96.6	Very high	94.6	Very high	25 Å²	25	90.8 Å²	90.8	13%	0.131	42%	0.421	C	S	.	.	H	α-helix	trans	-69.8	-46	178.8	-65.8	173.7	0	0	0	112	L578 V581 I582 L585 E602 K603 S608 R609 A610	L578-L606 HydrophobicContact CD2-CD2 3.93Å; V581-L606 HydrophobicContact CG1-CD1 3.71Å; I582-L606 HydrophobicContact CD1-CB 3.94Å; I582-L606 HydrophobicContact CG1-CB 3.63Å; I582-L606 HydrophobicContact CG1-CD1 4.2Å; L585-L606 HydrophobicContact CD1-CD1 3.7Å; E602-L606 HydrophobicContact CG-CD1 4.32Å; E602-L606 WeakPolarHBondContact O-CG 3.41Å; E602-L606 PolarHBondContact O-N 3.33Å; K603-L606 PolarHBondContact O-N 3.4Å; L606-S608 VanDerWaalsContact C-N 3.32Å; L606-S608 PolarHBondContact O-N 2.89Å; L606-R609 WeakPolarHBondContact O-CB 3.11Å; L606-R609 PolarHBondContact O-N 2.92Å; L606-R609 VanDerWaalsContact O-N 3.11Å; L606-A610 PolarHBondContact O-N 3.18Å
607	A	95.6	Very high	95	Very high	46 Å²	46	86.6 Å²	86.6	38%	0.38	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-40.8	176.3	0	0	0	0	0	111.8	K603 R609 A610 C611	K603-A607 VanDerWaalsContact O-CB 3.32Å; K603-A607 WeakPolarHBondContact O-CB 3.34Å; K603-A607 PolarHBondContact O-N 2.76Å; A607-R609 VanDerWaalsContact C-N 3.32Å; A607-R609 PolarHBondContact O-N 2.97Å; A607-A610 PolarHBondContact O-N 3.17Å; A607-C611 WeakPolarHBondContact O-CB 3.31Å; A607-C611 PolarHBondContact O-N 3.05Å
608	S	96.9	Very high	95.3	Very high	66 Å²	66	85.8 Å²	85.8	46%	0.462	40%	0.395	S	S	.	.	H	α-helix	trans	-61.8	-37.5	174	-63.5	0	0	0	0	112.7	N604 L606 R612	N604-S608 WeakPolarHBondContact O-CB 3.25Å; N604-S608 PolarHBondContact O-N 2.71Å; N604-S608 PolarHBondContact O-OG 3.08Å; L606-S608 VanDerWaalsContact C-N 3.32Å; L606-S608 PolarHBondContact O-N 2.89Å; S608-R612 VanDerWaalsContact O-CG 3.3Å; S608-R612 WeakPolarHBondContact O-CG 3.29Å; S608-R612 PolarHBondContact O-N 3.4Å
609	R	97.8	Very high	95.7	Very high	133 Å²	133	79.9 Å²	79.9	50%	0.502	37%	0.373	S	S	.	.	H	α-helix	trans	-68.6	-45.8	174.6	-175.3	-177.6	174.4	163.7	4.4	111	E574 L578 K605 L606 A607 C611 R612 L613	E574-R609 IonicContact OE1-CZ 3.95Å; E574-R609 IonicContact OE1-NE 2.95Å; E574-R609 PolarHBondContact OE1-NE 2.88Å; E574-R609 IonicContact OE1-NH2 2.69Å; E574-R609 PolarHBondContact OE1-NH2 3.02Å; L578-R609 HydrophobicContact CD1-CB 4.19Å; L578-R609 HydrophobicContact CD1-CG 3.68Å; K605-R609 PolarHBondContact O-N 3.13Å; L606-R609 WeakPolarHBondContact O-CB 3.11Å; L606-R609 PolarHBondContact O-N 2.92Å; L606-R609 VanDerWaalsContact O-N 3.11Å; A607-R609 VanDerWaalsContact C-N 3.32Å; A607-R609 PolarHBondContact O-N 2.97Å; R609-C611 PolarHBondContact O-N 3.03Å; R609-R612 PolarHBondContact O-N 2.9Å; R609-L613 HydrophobicContact CG-CD1 3.92Å; R609-L613 WeakPolarHBondContact O-CG 3.45Å; R609-L613 PolarHBondContact O-N 3.32Å
610	A	97.6	Very high	95.9	Very high	11 Å²	11	79.4 Å²	79.4	9%	0.091	37%	0.369	C	S	.	.	H	α-helix	trans	-60.4	-45.3	177.8	0	0	0	0	0	111.7	L575 L578 I582 L606 A607 R612 L613 K614	L575-A610 HydrophobicContact CD2-CB 4.39Å; L575-A610 WeakPolarHBondContact CD2-O 3.47Å; L578-A610 HydrophobicContact CB-CB 4.38Å; L578-A610 HydrophobicContact CD1-CB 4.37Å; I582-A610 HydrophobicContact CD1-CB 4.37Å; L606-A610 PolarHBondContact O-N 3.18Å; A607-A610 PolarHBondContact O-N 3.17Å; A610-R612 PolarHBondContact O-N 3.32Å; A610-L613 CarbonylContact O-C 3.6Å; A610-L613 PolarHBondContact O-N 3.09Å; A610-L613 VanDerWaalsContact O-N 3.17Å; A610-K614 PolarHBondContact O-N 2.85Å
611	C	97.1	Very high	96.1	Very high	87 Å²	87	77.5 Å²	77.5	59%	0.588	36%	0.363	S	S	*	.	H	α-helix	trans	-57.6	-47.8	174.7	178	0	0	0	0	112.5	A607 R609 L613 K614 K615	A607-C611 WeakPolarHBondContact O-CB 3.31Å; A607-C611 PolarHBondContact O-N 3.05Å; R609-C611 PolarHBondContact O-N 3.03Å; C611-L613 VanDerWaalsContact C-N 3.29Å; C611-L613 PolarHBondContact O-N 3.4Å; C611-K614 PolarHBondContact O-N 2.56Å; C611-K615 PolarHBondContact O-N 2.76Å; C611-K615 VanDerWaalsContact O-N 3.1Å
612	R	97.8	Very high	96.2	Very high	192 Å²	192	72.3 Å²	72.3	73%	0.725	34%	0.343	S	S	*	.	H	α-helix	trans	-61.5	-36.2	176.1	-71.6	174.5	-175.9	-151.6	0.6	112.6	S608 R609 A610 K616	S608-R612 VanDerWaalsContact O-CG 3.3Å; S608-R612 WeakPolarHBondContact O-CG 3.29Å; S608-R612 PolarHBondContact O-N 3.4Å; R609-R612 PolarHBondContact O-N 2.9Å; A610-R612 PolarHBondContact O-N 3.32Å; R612-K616 WeakPolarHBondContact O-CG 3.47Å; R612-K616 PolarHBondContact O-N 3.2Å
613	L	97.4	Very high	96.2	Very high	15 Å²	15	67.6 Å²	67.6	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-74.3	-35.3	176.3	-71	163.1	0	0	0	112.5	I571 E574 L575 L578 R609 A610 C611 K615 K616 A617	I571-L613 HydrophobicContact CG2-CB 4.07Å; I571-L613 HydrophobicContact CG2-CD2 4.09Å; I571-L613 WeakPolarHBondContact CG2-O 3.49Å; E574-L613 HydrophobicContact CB-CD1 4.36Å; E574-L613 HydrophobicContact CG-CD1 3.81Å; E574-L613 WeakPolarHBondContact OE1-CD1 3.29Å; L575-L613 HydrophobicContact CD2-CB 3.65Å; L575-L613 HydrophobicContact CG-CB 3.97Å; L578-L613 HydrophobicContact CD1-CD1 3.36Å; R609-L613 HydrophobicContact CG-CD1 3.92Å; R609-L613 WeakPolarHBondContact O-CG 3.45Å; R609-L613 PolarHBondContact O-N 3.32Å; A610-L613 CarbonylContact O-C 3.6Å; A610-L613 PolarHBondContact O-N 3.09Å; A610-L613 VanDerWaalsContact O-N 3.17Å; C611-L613 VanDerWaalsContact C-N 3.29Å; C611-L613 PolarHBondContact O-N 3.4Å; L613-K615 VanDerWaalsContact C-N 3.34Å; L613-K615 PolarHBondContact O-N 3.03Å; L613-K616 PolarHBondContact O-N 3.36Å; L613-A617 WeakPolarHBondContact O-CB 3.28Å; L613-A617 PolarHBondContact O-N 3.37Å
614	K	97.1	Very high	96.3	Very high	77 Å²	77	65.8 Å²	65.8	34%	0.335	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-45.8	172.7	-174.7	176.9	177.9	177.7	0	110.5	L575 A610 C611 K616 A617 Q618	L575-K614 HydrophobicContact CD2-CB 4.48Å; A610-K614 PolarHBondContact O-N 2.85Å; C611-K614 PolarHBondContact O-N 2.56Å; K614-K616 PolarHBondContact O-N 3.18Å; K614-A617 PolarHBondContact O-N 3.44Å; K614-Q618 WeakPolarHBondContact O-CB 3.39Å; K614-Q618 PolarHBondContact O-N 3.48Å
615	K	96.2	Very high	96.3	Very high	158 Å²	158	64.5 Å²	64.5	69%	0.687	31%	0.305	S	S	*	.	H	α-helix	trans	-63.3	-38	174.1	-171.1	163.8	-175.5	166	0	113.1	C611 L613 Y619	C611-K615 PolarHBondContact O-N 2.76Å; C611-K615 VanDerWaalsContact O-N 3.1Å; L613-K615 VanDerWaalsContact C-N 3.34Å; L613-K615 PolarHBondContact O-N 3.03Å; K615-Y619 PolarHBondContact O-N 3.18Å
616	K	95.4	Very high	96.3	Very high	131 Å²	131	60.9 Å²	60.9	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-67.4	-39.4	173.5	-73.9	-176.4	174.4	-170	0	112.9	I571 R612 L613 K614 Y619 E620	I571-K616 HydrophobicContact CD1-CB 4.07Å; R612-K616 WeakPolarHBondContact O-CG 3.47Å; R612-K616 PolarHBondContact O-N 3.2Å; L613-K616 PolarHBondContact O-N 3.36Å; K614-K616 PolarHBondContact O-N 3.18Å; K616-Y619 PolarHBondContact O-N 2.8Å; K616-E620 PolarHBondContact O-N 3.43Å
617	A	96.7	Very high	96.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-43.7	175.3	0	0	0	0	0	111.2	Y131 L568 I571 L575 L613 K614 Y619 E620 A621	Y131-A617 HydrophobicContact CD2-CB 4.49Å; L568-A617 HydrophobicContact CD1-CB 3.99Å; L568-A617 WeakPolarHBondContact CD1-O 3.49Å; I571-A617 HydrophobicContact CG2-CB 3.83Å; L575-A617 HydrophobicContact CD1-CB 4.08Å; L613-A617 WeakPolarHBondContact O-CB 3.28Å; L613-A617 PolarHBondContact O-N 3.37Å; K614-A617 PolarHBondContact O-N 3.44Å; A617-Y619 PolarHBondContact O-N 2.66Å; A617-E620 PolarHBondContact O-N 2.87Å; A617-A621 WeakPolarHBondContact O-CB 3.4Å; A617-A621 PolarHBondContact O-N 2.73Å
618	Q	95.7	Very high	96.1	Very high	65 Å²	65	61.3 Å²	61.3	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-60.1	-43.7	175	-168.1	-178.9	18.3	0	0	111.7	K614 A621 N622	K614-Q618 WeakPolarHBondContact O-CB 3.39Å; K614-Q618 PolarHBondContact O-N 3.48Å; Q618-A621 PolarHBondContact O-N 2.75Å; Q618-N622 WeakPolarHBondContact O-CB 3.48Å; Q618-N622 PolarHBondContact O-N 3.18Å; Q618-N622 PolarHBondContact O-OD1 3.07Å
619	Y	95.3	Very high	96	Very high	87 Å²	87	61.3 Å²	61.3	34%	0.341	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-47.2	177.2	-177.1	-119.3	0	0	0	112.9	D557 V558 K615 K616 A617 N622 K623	D557-Y619 PolarHBondContact O-OH 2.9Å; V558-Y619 PolarHBondContact O-OH 3.47Å; K615-Y619 PolarHBondContact O-N 3.18Å; K616-Y619 PolarHBondContact O-N 2.8Å; A617-Y619 PolarHBondContact O-N 2.66Å; Y619-N622 PolarHBondContact O-N 3.43Å; Y619-K623 VanDerWaalsContact CZ-CE 3.42Å; Y619-K623 PolarHBondContact O-N 3.46Å
620	E	95.4	Very high	95.8	Very high	3 Å²	3	57.8 Å²	57.8	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-68.8	-34.1	177.1	-69.4	-66	144.8	0	0	112.7	K567 L568 I571 K616 A617 N622 K623 V624	K567-E620 HydrophobicContact CD-CG 4.02Å; K567-E620 VanDerWaalsContact CE-OE1 3.24Å; K567-E620 WeakPolarHBondContact CE-OE1 3.39Å; K567-E620 HydrophobicContact CG-CG 4.21Å; K567-E620 IonicContact NZ-OE1 3.66Å; K567-E620 PolarHBondContact NZ-OE1 3.45Å; L568-E620 HydrophobicContact CB-CB 4.12Å; L568-E620 HydrophobicContact CD1-CB 4.14Å; I571-E620 HydrophobicContact CD1-CG 4.46Å; K616-E620 PolarHBondContact O-N 3.43Å; A617-E620 PolarHBondContact O-N 2.87Å; E620-N622 VanDerWaalsContact C-N 3.35Å; E620-K623 PolarHBondContact O-N 3.27Å; E620-K623 IonicContact OE1-NZ 3.5Å; E620-K623 PolarHBondContact OE1-NZ 3.4Å; E620-V624 WeakPolarHBondContact O-CG2 3.41Å; E620-V624 PolarHBondContact O-N 3.28Å
621	A	96.3	Very high	95.5	Very high	3 Å²	3	59 Å²	59	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-63.4	-41	170.8	0	0	0	0	0	111.2	L568 A617 Q618 K623 V624 K625 V686	L568-A621 HydrophobicContact CD1-CB 4.16Å; L568-A621 HydrophobicContact CD2-CB 3.98Å; A617-A621 WeakPolarHBondContact O-CB 3.4Å; A617-A621 PolarHBondContact O-N 2.73Å; Q618-A621 PolarHBondContact O-N 2.75Å; A621-K623 VanDerWaalsContact C-N 3.34Å; A621-K623 PolarHBondContact O-N 3.27Å; A621-V624 CarbonylContact O-C 3.57Å; A621-V624 WeakPolarHBondContact O-CA 3.17Å; A621-V624 WeakPolarHBondContact O-CB 3.45Å; A621-V624 PolarHBondContact O-N 3.42Å; A621-K625 WeakPolarHBondContact O-CG 3.48Å; A621-K625 PolarHBondContact O-N 2.5Å; A621-V686 HydrophobicContact CB-CG1 4.24Å
622	N	96.3	Very high	95.4	Very high	63 Å²	63	56.2 Å²	56.2	34%	0.337	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-34.5	176.7	-72.1	5.3	0	0	0	112.3	Q618 Y619 E620 V624 K625 L626	Q618-N622 WeakPolarHBondContact O-CB 3.48Å; Q618-N622 PolarHBondContact O-N 3.18Å; Q618-N622 PolarHBondContact O-OD1 3.07Å; Y619-N622 PolarHBondContact O-N 3.43Å; E620-N622 VanDerWaalsContact C-N 3.35Å; N622-V624 VanDerWaalsContact C-N 3.32Å; N622-V624 PolarHBondContact O-N 3.46Å; N622-K625 PolarHBondContact O-N 2.93Å; N622-L626 VanDerWaalsContact O-CB 3.25Å; N622-L626 WeakPolarHBondContact O-CB 3.2Å; N622-L626 PolarHBondContact O-N 3.07Å
623	K	95.1	Very high	95.2	Very high	5 Å²	5	51.6 Å²	51.6	2%	0.022	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-41.1	169	-62.9	-175.2	-171	-176.4	0	111.4	D557 D560 T562 P563 Y619 E620 A621 W627	D557-K623 IonicContact OD1-NZ 3.92Å; D557-K623 PolarHBondContact OD1-NZ 2.92Å; D557-K623 VanDerWaalsContact OD1-NZ 3.14Å; D560-K623 WeakPolarHBondContact O-CE 3.49Å; D560-K623 PolarHBondContact O-NZ 2.64Å; T562-K623 WeakPolarHBondContact O-CD 3.3Å; P563-K623 HydrophobicContact CB-CB 4.15Å; Y619-K623 VanDerWaalsContact CZ-CE 3.42Å; Y619-K623 PolarHBondContact O-N 3.46Å; E620-K623 PolarHBondContact O-N 3.27Å; E620-K623 IonicContact OE1-NZ 3.5Å; E620-K623 PolarHBondContact OE1-NZ 3.4Å; A621-K623 VanDerWaalsContact C-N 3.34Å; A621-K623 PolarHBondContact O-N 3.27Å; K623-W627 WeakPolarHBondContact O-CB 3.34Å; K623-W627 PolarHBondContact O-N 3.21Å
624	V	95.2	Very high	95	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-66.7	-47.7	175.9	176.4	0	0	0	0	111.5	P563 L568 E620 A621 N622 L626 W627 G628 F685 V686 I689 L702	P563-V624 HydrophobicContact CB-CB 4.47Å; P563-V624 HydrophobicContact CB-CG2 3.79Å; L568-V624 HydrophobicContact CD2-CG2 4.43Å; E620-V624 WeakPolarHBondContact O-CG2 3.41Å; E620-V624 PolarHBondContact O-N 3.28Å; A621-V624 CarbonylContact O-C 3.57Å; A621-V624 WeakPolarHBondContact O-CA 3.17Å; A621-V624 WeakPolarHBondContact O-CB 3.45Å; A621-V624 PolarHBondContact O-N 3.42Å; N622-V624 VanDerWaalsContact C-N 3.32Å; N622-V624 PolarHBondContact O-N 3.46Å; V624-L626 PolarHBondContact O-N 3.49Å; V624-W627 PolarHBondContact O-N 3.36Å; V624-G628 PolarHBondContact O-N 3.37Å; V624-F685 HydrophobicContact CG1-CD1 4.25Å; V624-F685 HydrophobicContact CG1-CE1 3.86Å; V624-V686 HydrophobicContact CB-CG2 4.19Å; V624-V686 HydrophobicContact CG1-CG2 3.9Å; V624-I689 HydrophobicContact CG1-CB 4.26Å; V624-I689 HydrophobicContact CG1-CG1 4.02Å; V624-I689 HydrophobicContact CG1-CG2 4.28Å; V624-L702 HydrophobicContact CG1-CD1 4.44Å; V624-L702 HydrophobicContact CG1-CD2 4.41Å; V624-L702 HydrophobicContact CG2-CD1 4.43Å
625	K	95.5	Very high	94.8	Very high	23 Å²	23	55.1 Å²	55.1	10%	0.1	26%	0.26	C	S	.	.	H	α-helix	trans	-55.5	-49.2	175.6	-68.1	-173.4	172.9	-153.6	0	110.9	D126 A621 N622 W627 G628 L629 T682 V686	D126-K625 PolarHBondContact O-NZ 3.24Å; D126-K625 IonicContact OD2-NZ 3.31Å; D126-K625 PolarHBondContact OD2-NZ 3.13Å; A621-K625 WeakPolarHBondContact O-CG 3.48Å; A621-K625 PolarHBondContact O-N 2.5Å; N622-K625 PolarHBondContact O-N 2.93Å; K625-W627 PolarHBondContact O-N 3.18Å; K625-G628 PolarHBondContact O-N 3.27Å; K625-L629 WeakPolarHBondContact O-CG 3.23Å; K625-L629 PolarHBondContact O-N 3.33Å; K625-T682 VanDerWaalsContact CD-OG1 3.22Å; K625-T682 WeakPolarHBondContact CD-OG1 3.15Å; K625-T682 WeakPolarHBondContact CE-OG1 3.46Å; K625-T682 PolarHBondContact NZ-OG1 2.87Å; K625-V686 HydrophobicContact CD-CG2 4.5Å; K625-V686 HydrophobicContact CG-CG2 3.56Å
626	L	95.2	Very high	94.8	Very high	88 Å²	88	51.2 Å²	51.2	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-59.9	-42.7	178.4	-179.6	62.2	0	0	0	112.7	L561 N622 V624 S630	L561-L626 HydrophobicContact CD1-CD2 4.18Å; L561-L626 HydrophobicContact CD2-CD2 4.48Å; N622-L626 VanDerWaalsContact O-CB 3.25Å; N622-L626 WeakPolarHBondContact O-CB 3.2Å; N622-L626 PolarHBondContact O-N 3.07Å; V624-L626 PolarHBondContact O-N 3.49Å; L626-S630 WeakPolarHBondContact O-CB 3.39Å; L626-S630 PolarHBondContact O-N 3.15Å
627	W	94.3	Very high	94.8	Very high	76 Å²	76	48 Å²	48	29%	0.288	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-41.4	176.8	-170.1	-77.6	0	0	0	112.3	P563 K623 V624 K625 T631 V703 L705	P563-W627 HydrophobicContact CG-CB 3.85Å; P563-W627 HydrophobicContact CG-CD2 3.74Å; P563-W627 HydrophobicContact CG-CE3 3.71Å; P563-W627 HydrophobicContact CG-CG 3.83Å; P563-W627 HydrophobicContact CG-CZ3 4.49Å; K623-W627 WeakPolarHBondContact O-CB 3.34Å; K623-W627 PolarHBondContact O-N 3.21Å; V624-W627 PolarHBondContact O-N 3.36Å; K625-W627 PolarHBondContact O-N 3.18Å; W627-T631 WeakPolarHBondContact O-CB 3.22Å; W627-T631 PolarHBondContact O-N 3.16Å; W627-T631 PolarHBondContact O-OG1 2.8Å; W627-V703 PolarHBondContact NE1-O 2.72Å; W627-L705 HydrophobicContact CH2-CD1 4.41Å; W627-L705 HydrophobicContact CZ2-CB 4.19Å
628	G	94.1	Very high	94.7	Very high	3 Å²	3	53.7 Å²	53.7	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-61	-52.1	175.1	0	0	0	0	0	112.1	V624 K625 S630 T631 E632	V624-G628 PolarHBondContact O-N 3.37Å; K625-G628 PolarHBondContact O-N 3.27Å; G628-S630 PolarHBondContact O-N 3.5Å; G628-T631 WeakPolarHBondContact O-CB 3.41Å; G628-T631 PolarHBondContact O-N 3.25Å; G628-T631 VanDerWaalsContact O-N 3.17Å; G628-E632 PolarHBondContact O-N 3.08Å
629	L	95.1	Very high	94.7	Very high	66 Å²	66	50.9 Å²	50.9	35%	0.346	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-38.9	179.1	-67.3	169	0	0	0	112.7	K625 E632 Y633 V678 A679 T682	K625-L629 WeakPolarHBondContact O-CG 3.23Å; K625-L629 PolarHBondContact O-N 3.33Å; L629-E632 PolarHBondContact O-N 2.91Å; L629-Y633 WeakPolarHBondContact O-CB 3.47Å; L629-Y633 PolarHBondContact O-N 3.02Å; L629-V678 HydrophobicContact CD2-CB 4.17Å; L629-V678 HydrophobicContact CD2-CG1 4Å; L629-V678 HydrophobicContact CG-CG1 4.1Å; L629-A679 HydrophobicContact CD2-CB 4.15Å; L629-T682 HydrophobicContact CD1-CG2 4.41Å; L629-T682 HydrophobicContact CD2-CG2 4.36Å
630	S	93.1	Very high	94.7	Very high	60 Å²	60	51.8 Å²	51.8	42%	0.42	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-41.5	173.5	-168.5	0	0	0	0	111.7	L626 G628 E632 Y633 D634	L626-S630 WeakPolarHBondContact O-CB 3.39Å; L626-S630 PolarHBondContact O-N 3.15Å; G628-S630 PolarHBondContact O-N 3.5Å; S630-E632 VanDerWaalsContact C-N 3.28Å; S630-E632 PolarHBondContact O-N 3.19Å; S630-Y633 PolarHBondContact O-N 2.7Å; S630-D634 VanDerWaalsContact O-CG 3.3Å; S630-D634 PolarHBondContact O-N 3.25Å
631	T	92.4	Very high	94.7	Very high	36 Å²	36	55 Å²	55	22%	0.221	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-32.2	177.6	-57.7	0	0	0	0	111.9	W627 G628 R635	W627-T631 WeakPolarHBondContact O-CB 3.22Å; W627-T631 PolarHBondContact O-N 3.16Å; W627-T631 PolarHBondContact O-OG1 2.8Å; G628-T631 WeakPolarHBondContact O-CB 3.41Å; G628-T631 PolarHBondContact O-N 3.25Å; G628-T631 VanDerWaalsContact O-N 3.17Å; T631-R635 WeakPolarHBondContact O-CD 3.42Å; T631-R635 VanDerWaalsContact O-CG 3.25Å; T631-R635 WeakPolarHBondContact O-CG 3.31Å; T631-R635 PolarHBondContact O-N 2.87Å
632	E	93.4	Very high	94.6	Very high	29 Å²	29	56 Å²	56	14%	0.136	28%	0.282	C	S	.	.	H	α-helix	trans	-73.5	-45.5	173.9	177.5	166.2	-124	0	0	111.9	G628 L629 S630 D634 R635 L636 P677 V678 A679	G628-E632 PolarHBondContact O-N 3.08Å; L629-E632 PolarHBondContact O-N 2.91Å; S630-E632 VanDerWaalsContact C-N 3.28Å; S630-E632 PolarHBondContact O-N 3.19Å; E632-D634 VanDerWaalsContact C-N 3.34Å; E632-D634 PolarHBondContact O-N 3.47Å; E632-R635 WeakPolarHBondContact O-CB 3.42Å; E632-R635 PolarHBondContact O-N 2.85Å; E632-R635 VanDerWaalsContact O-N 3.15Å; E632-L636 HydrophobicContact CG-CD1 3.97Å; E632-L636 WeakPolarHBondContact O-CG 3.45Å; E632-L636 PolarHBondContact O-N 2.72Å; E632-P677 WeakPolarHBondContact OE1-CA 3.2Å; E632-P677 WeakPolarHBondContact OE1-CB 3.16Å; E632-V678 VanDerWaalsContact CD-N 3.32Å; E632-V678 PolarHBondContact OE1-N 2.85Å; E632-V678 WeakPolarHBondContact OE2-CA 3.15Å; E632-V678 WeakPolarHBondContact OE2-CB 3.28Å; E632-V678 PolarHBondContact OE2-N 3.09Å; E632-V678 VanDerWaalsContact OE2-N 3.08Å; E632-A679 PolarHBondContact OE2-N 2.94Å
633	Y	94.4	Very high	94.5	Very high	95 Å²	95	54.1 Å²	54.1	37%	0.373	27%	0.271	S	S	.	.	H	α-helix	trans	-54.6	-47.3	173.5	172.5	-90.5	0	0	0	112.1	Q539 L629 S630 R635 L636 L637	Q539-Y633 PolarHBondContact NE2-OH 3.37Å; Q539-Y633 VanDerWaalsContact NE2-OH 3.07Å; L629-Y633 WeakPolarHBondContact O-CB 3.47Å; L629-Y633 PolarHBondContact O-N 3.02Å; S630-Y633 PolarHBondContact O-N 2.7Å; Y633-R635 VanDerWaalsContact C-N 3.27Å; Y633-R635 PolarHBondContact O-N 2.81Å; Y633-L636 PolarHBondContact O-N 3.12Å; Y633-L637 HydrophobicContact CE1-CD2 3.85Å; Y633-L637 VanDerWaalsContact O-CB 3.29Å; Y633-L637 WeakPolarHBondContact O-CB 3.48Å; Y633-L637 PolarHBondContact O-N 3.17Å
634	D	93.3	Very high	94.4	Very high	93 Å²	93	58.4 Å²	58.4	50%	0.497	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-34.5	179.5	-71.1	-26.7	0	0	0	112.3	S630 E632 F638	S630-D634 VanDerWaalsContact O-CG 3.3Å; S630-D634 PolarHBondContact O-N 3.25Å; E632-D634 VanDerWaalsContact C-N 3.34Å; E632-D634 PolarHBondContact O-N 3.47Å; D634-F638 WeakPolarHBondContact O-CB 3.4Å; D634-F638 PolarHBondContact O-N 3.36Å
635	R	93.4	Very high	94.3	Very high	73 Å²	73	62.7 Å²	62.7	28%	0.275	31%	0.31	S	S	.	.	H	α-helix	trans	-72.8	-43.9	175.7	-69.4	165.9	-175.4	-116	12.6	112.3	T631 E632 Y633 L637 F638 V639 T672 L673	T631-R635 WeakPolarHBondContact O-CD 3.42Å; T631-R635 VanDerWaalsContact O-CG 3.25Å; T631-R635 WeakPolarHBondContact O-CG 3.31Å; T631-R635 PolarHBondContact O-N 2.87Å; E632-R635 WeakPolarHBondContact O-CB 3.42Å; E632-R635 PolarHBondContact O-N 2.85Å; E632-R635 VanDerWaalsContact O-N 3.15Å; Y633-R635 VanDerWaalsContact C-N 3.27Å; Y633-R635 PolarHBondContact O-N 2.81Å; R635-L637 VanDerWaalsContact C-N 3.31Å; R635-F638 WeakPolarHBondContact O-CB 3.49Å; R635-F638 PolarHBondContact O-N 2.82Å; R635-V639 WeakPolarHBondContact O-CG2 3.47Å; R635-V639 PolarHBondContact O-N 3.36Å; R635-T672 HydrophobicContact CB-CG2 3.99Å; R635-T672 WeakPolarHBondContact CD-O 3.43Å; R635-T672 HydrophobicContact CG-CG2 4.24Å; R635-T672 PolarHBondContact NH1-O 3.39Å; R635-L673 HydrophobicContact CB-CD2 3.78Å
636	L	95.1	Very high	94.1	Very high	75 Å²	75	63.4 Å²	63.4	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-44.6	174.9	-72.1	166.3	0	0	0	110.4	E632 Y633 F638 V639 I640 L673	E632-L636 HydrophobicContact CG-CD1 3.97Å; E632-L636 WeakPolarHBondContact O-CG 3.45Å; E632-L636 PolarHBondContact O-N 2.72Å; Y633-L636 PolarHBondContact O-N 3.12Å; L636-F638 VanDerWaalsContact C-N 3.32Å; L636-F638 PolarHBondContact O-N 3.23Å; L636-V639 PolarHBondContact O-N 3.13Å; L636-I640 WeakPolarHBondContact O-CB 3.01Å; L636-I640 WeakPolarHBondContact O-CD1 3.43Å; L636-I640 VanDerWaalsContact O-CG1 3.26Å; L636-I640 WeakPolarHBondContact O-CG1 3.47Å; L636-I640 PolarHBondContact O-N 3.33Å; L636-L673 HydrophobicContact CD2-CD1 3.69Å; L636-L673 HydrophobicContact CD2-CD2 3.99Å; L636-L673 HydrophobicContact CG-CD2 4.26Å
637	L	95.3	Very high	93.9	Very high	63 Å²	63	63 Å²	63	33%	0.33	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-35.5	175.2	-175.1	60.8	0	0	0	112.1	Y633 R635 N641	Y633-L637 HydrophobicContact CE1-CD2 3.85Å; Y633-L637 VanDerWaalsContact O-CB 3.29Å; Y633-L637 WeakPolarHBondContact O-CB 3.48Å; Y633-L637 PolarHBondContact O-N 3.17Å; R635-L637 VanDerWaalsContact C-N 3.31Å; L637-N641 WeakPolarHBondContact CD1-ND2 3.42Å; L637-N641 WeakPolarHBondContact O-CB 3.44Å; L637-N641 PolarHBondContact O-N 2.9Å; L637-N641 PolarHBondContact O-ND2 3.28Å
638	F	95.3	Very high	93.8	Very high	120 Å²	120	62.7 Å²	62.7	53%	0.526	31%	0.314	S	S	.	.	H	α-helix	trans	-62.4	-49.3	171.1	177.3	-91.1	0	0	0	111.9	D634 R635 L636 I640 N641 A642 T672	D634-F638 WeakPolarHBondContact O-CB 3.4Å; D634-F638 PolarHBondContact O-N 3.36Å; R635-F638 WeakPolarHBondContact O-CB 3.49Å; R635-F638 PolarHBondContact O-N 2.82Å; L636-F638 VanDerWaalsContact C-N 3.32Å; L636-F638 PolarHBondContact O-N 3.23Å; F638-I640 PolarHBondContact O-N 3.17Å; F638-N641 PolarHBondContact O-N 3.46Å; F638-A642 HydrophobicContact CE1-CB 4.42Å; F638-A642 VanDerWaalsContact O-CB 3.29Å; F638-A642 WeakPolarHBondContact O-CB 3.44Å; F638-A642 PolarHBondContact O-N 3.5Å; F638-T672 HydrophobicContact CB-CG2 4.49Å; F638-T672 HydrophobicContact CD1-CG2 3.66Å; F638-T672 HydrophobicContact CE1-CG2 4.34Å; F638-T672 HydrophobicContact CG-CG2 4.41Å
639	V	95.3	Very high	93.7	Very high	7 Å²	7	65 Å²	65	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-44.2	178.6	173.6	0	0	0	0	111.4	R635 L636 N641 A642 I643 L665 L668 I669 T672 L673	R635-V639 WeakPolarHBondContact O-CG2 3.47Å; R635-V639 PolarHBondContact O-N 3.36Å; L636-V639 PolarHBondContact O-N 3.13Å; V639-N641 PolarHBondContact O-N 2.9Å; V639-A642 PolarHBondContact O-N 2.98Å; V639-I643 PolarHBondContact O-N 3.2Å; V639-L665 HydrophobicContact CG1-CD1 3.98Å; V639-L668 HydrophobicContact CG1-CB 4.15Å; V639-L668 WeakPolarHBondContact CG2-O 3.44Å; V639-I669 HydrophobicContact CG1-CG1 4.08Å; V639-T672 HydrophobicContact CG2-CG2 4Å; V639-L673 HydrophobicContact CG2-CD2 3.99Å; V639-L673 HydrophobicContact CG2-CG 4.37Å
640	I	95.3	Very high	93.4	Very high	106 Å²	106	64.5 Å²	64.5	54%	0.544	32%	0.321	S	S	.	.	H	α-helix	trans	-62.4	-41.8	178.4	-69.4	164.5	0	0	0	111.4	L636 F638 I643 K644	L636-I640 WeakPolarHBondContact O-CB 3.01Å; L636-I640 WeakPolarHBondContact O-CD1 3.43Å; L636-I640 VanDerWaalsContact O-CG1 3.26Å; L636-I640 WeakPolarHBondContact O-CG1 3.47Å; L636-I640 PolarHBondContact O-N 3.33Å; F638-I640 PolarHBondContact O-N 3.17Å; I640-I643 WeakPolarHBondContact O-CG2 3.47Å; I640-K644 VanDerWaalsContact O-CB 3.32Å; I640-K644 WeakPolarHBondContact O-CB 3.36Å; I640-K644 PolarHBondContact O-N 3.36Å; I640-K644 VanDerWaalsContact O-N 3.14Å
641	N	95.1	Very high	93.2	Very high	70 Å²	70	67.4 Å²	67.4	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-71.4	-43	175.7	-74.9	-64.7	0	0	0	111.7	L637 F638 V639 I643 K644 E645	L637-N641 WeakPolarHBondContact CD1-ND2 3.42Å; L637-N641 WeakPolarHBondContact O-CB 3.44Å; L637-N641 PolarHBondContact O-N 2.9Å; L637-N641 PolarHBondContact O-ND2 3.28Å; F638-N641 PolarHBondContact O-N 3.46Å; V639-N641 PolarHBondContact O-N 2.9Å; N641-I643 PolarHBondContact O-N 2.97Å; N641-K644 WeakPolarHBondContact O-CB 3.34Å; N641-K644 PolarHBondContact O-N 3.29Å; N641-E645 WeakPolarHBondContact O-CG 3.3Å; N641-E645 PolarHBondContact O-N 3.1Å
642	A	94.8	Very high	93.1	Very high	24 Å²	24	73 Å²	73	20%	0.198	36%	0.359	C	S	.	.	H	α-helix	trans	-60.1	-42.5	178.9	0	0	0	0	0	112.4	F638 V639 E645 E646 L668	F638-A642 HydrophobicContact CE1-CB 4.42Å; F638-A642 VanDerWaalsContact O-CB 3.29Å; F638-A642 WeakPolarHBondContact O-CB 3.44Å; F638-A642 PolarHBondContact O-N 3.5Å; V639-A642 PolarHBondContact O-N 2.98Å; A642-E645 PolarHBondContact O-N 3.44Å; A642-E646 WeakPolarHBondContact O-CB 3.45Å; A642-E646 PolarHBondContact O-N 3.31Å; A642-L668 HydrophobicContact CB-CD1 3.84Å; A642-L668 HydrophobicContact CB-CD2 3.93Å
643	I	94	Very high	92.7	Very high	23 Å²	23	76 Å²	76	12%	0.118	38%	0.376	C	S	.	.	H	α-helix	trans	-71	-33.9	176.5	-153.7	73.9	0	0	0	112	V639 I640 N641 E646 I647 M661 T664 L665 L668	V639-I643 PolarHBondContact O-N 3.2Å; I640-I643 WeakPolarHBondContact O-CG2 3.47Å; N641-I643 PolarHBondContact O-N 2.97Å; I643-E646 PolarHBondContact O-N 2.82Å; I643-I647 HydrophobicContact CG1-CD1 4.47Å; I643-I647 WeakPolarHBondContact O-CD1 3.48Å; I643-I647 VanDerWaalsContact O-CG1 3.24Å; I643-I647 WeakPolarHBondContact O-CG1 3.09Å; I643-I647 PolarHBondContact O-N 3.01Å; I643-M661 HydrophobicContact CD1-CE 3.51Å; I643-M661 HydrophobicContact CD1-SD 3.69Å; I643-M661 HydrophobicContact CG1-CE 3.99Å; I643-M661 HydrophobicContact CG1-SD 3.78Å; I643-T664 HydrophobicContact CD1-CG2 4.49Å; I643-L665 HydrophobicContact CB-CD1 4.34Å; I643-L665 HydrophobicContact CD1-CB 3.73Å; I643-L665 HydrophobicContact CD1-CD1 4.22Å; I643-L665 HydrophobicContact CG1-CB 4.29Å; I643-L665 HydrophobicContact CG1-CD1 4.13Å; I643-L665 HydrophobicContact CG2-CD1 4.5Å; I643-L668 HydrophobicContact CB-CD1 4.35Å; I643-L668 HydrophobicContact CD1-CD1 3.89Å
644	K	93.6	Very high	91.7	Very high	96 Å²	96	77.3 Å²	77.3	42%	0.417	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-47.9	172.6	172.3	-177.3	159.9	-80.5	0	111.7	I640 N641 E646 I647 M648	I640-K644 VanDerWaalsContact O-CB 3.32Å; I640-K644 WeakPolarHBondContact O-CB 3.36Å; I640-K644 PolarHBondContact O-N 3.36Å; I640-K644 VanDerWaalsContact O-N 3.14Å; N641-K644 WeakPolarHBondContact O-CB 3.34Å; N641-K644 PolarHBondContact O-N 3.29Å; K644-E646 VanDerWaalsContact C-N 3.35Å; K644-I647 PolarHBondContact O-N 2.77Å; K644-M648 HydrophobicContact CG-SD 4.47Å; K644-M648 WeakPolarHBondContact O-CG 3.49Å; K644-M648 PolarHBondContact O-N 2.63Å
645	E	93.1	Very high	91	Very high	91 Å²	91	76.1 Å²	76.1	43%	0.425	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-44.3	176.8	-61.3	-51	117.5	0	0	110.7	N641 A642 I647 M648 V649	N641-E645 WeakPolarHBondContact O-CG 3.3Å; N641-E645 PolarHBondContact O-N 3.1Å; A642-E645 PolarHBondContact O-N 3.44Å; E645-I647 VanDerWaalsContact C-N 3.29Å; E645-I647 PolarHBondContact O-N 3.48Å; E645-M648 PolarHBondContact O-N 2.88Å; E645-M648 VanDerWaalsContact O-N 3.16Å; E645-M648 WeakPolarHBondContact OE1-CE 3.48Å; E645-M648 WeakPolarHBondContact OE2-CE 3.4Å; E645-V649 WeakPolarHBondContact O-CG2 3.43Å; E645-V649 PolarHBondContact O-N 2.8Å
646	E	91.4	Very high	89.9	Confident	38 Å²	38	79 Å²	79	18%	0.178	43%	0.426	C	S	.	.	H	α-helix	trans	-60	-35.2	175.2	176.8	64.7	-172.2	0	0	113.1	A642 I643 K644 R650 R657 M661 T664	A642-E646 WeakPolarHBondContact O-CB 3.45Å; A642-E646 PolarHBondContact O-N 3.31Å; I643-E646 PolarHBondContact O-N 2.82Å; K644-E646 VanDerWaalsContact C-N 3.35Å; E646-R650 WeakPolarHBondContact O-CB 3.38Å; E646-R650 VanDerWaalsContact O-CG 3.24Å; E646-R650 WeakPolarHBondContact O-CG 3.46Å; E646-R650 PolarHBondContact O-N 3.34Å; E646-R650 VanDerWaalsContact O-N 3.11Å; E646-R650 IonicContact OE1-CZ 3.09Å; E646-R650 IonicContact OE1-NE 2.64Å; E646-R650 PolarHBondContact OE1-NE 2.92Å; E646-R650 IonicContact OE1-NH2 2.92Å; E646-R650 PolarHBondContact OE1-NH2 2.81Å; E646-R657 IonicContact OE1-CZ 3.72Å; E646-R657 IonicContact OE1-NH1 2.75Å; E646-R657 PolarHBondContact OE1-NH1 2.93Å; E646-R657 IonicContact OE2-CZ 3.78Å; E646-R657 IonicContact OE2-NH1 2.69Å; E646-R657 PolarHBondContact OE2-NH1 2.97Å; E646-M661 HydrophobicContact CB-CE 4.19Å; E646-M661 HydrophobicContact CG-CE 3.42Å; E646-M661 VanDerWaalsContact CG-CE 3.42Å; E646-T664 HydrophobicContact CG-CG2 3.98Å
647	I	91.1	Very high	89	Confident	80 Å²	80	79.3 Å²	79.3	41%	0.41	42%	0.422	S	S	.	.	H	α-helix	trans	-68.8	-46.2	173.1	-71.3	163.1	0	0	0	111	I643 K644 E645 V649 R650 V651 M661	I643-I647 HydrophobicContact CG1-CD1 4.47Å; I643-I647 WeakPolarHBondContact O-CD1 3.48Å; I643-I647 VanDerWaalsContact O-CG1 3.24Å; I643-I647 WeakPolarHBondContact O-CG1 3.09Å; I643-I647 PolarHBondContact O-N 3.01Å; K644-I647 PolarHBondContact O-N 2.77Å; E645-I647 VanDerWaalsContact C-N 3.29Å; E645-I647 PolarHBondContact O-N 3.48Å; I647-V649 PolarHBondContact O-N 3.16Å; I647-R650 PolarHBondContact O-N 3.39Å; I647-R650 VanDerWaalsContact O-N 3.14Å; I647-V651 WeakPolarHBondContact O-CG2 3.27Å; I647-V651 PolarHBondContact O-N 3.16Å; I647-M661 HydrophobicContact CD1-SD 4.24Å; I647-M661 HydrophobicContact CG1-CE 4.06Å; I647-M661 HydrophobicContact CG1-SD 3.96Å
648	M	92.3	Very high	88.1	Confident	68 Å²	68	82.5 Å²	82.5	34%	0.335	45%	0.447	S	S	.	.	H	α-helix	trans	-60.9	-46.5	179	-67	-171.8	-45.1	0	0	111.3	K644 E645 R650 V651 E652	K644-M648 HydrophobicContact CG-SD 4.47Å; K644-M648 WeakPolarHBondContact O-CG 3.49Å; K644-M648 PolarHBondContact O-N 2.63Å; E645-M648 PolarHBondContact O-N 2.88Å; E645-M648 VanDerWaalsContact O-N 3.16Å; E645-M648 WeakPolarHBondContact OE1-CE 3.48Å; E645-M648 WeakPolarHBondContact OE2-CE 3.4Å; M648-R650 VanDerWaalsContact C-N 3.27Å; M648-R650 PolarHBondContact O-N 3.47Å; M648-V651 PolarHBondContact O-N 3.32Å; M648-E652 PolarHBondContact O-N 2.87Å
649	V	90.8	Very high	87.5	Confident	52 Å²	52	79 Å²	79	32%	0.315	44%	0.435	S	S	.	.	H	α-helix	trans	-67.3	-26.2	177.2	-168.7	0	0	0	0	111.7	E645 I647 D653	E645-V649 WeakPolarHBondContact O-CG2 3.43Å; E645-V649 PolarHBondContact O-N 2.8Å; I647-V649 PolarHBondContact O-N 3.16Å; V649-D653 WeakPolarHBondContact CG1-OD2 3.46Å; V649-D653 WeakPolarHBondContact O-CA 3.37Å; V649-D653 VanDerWaalsContact O-CB 3.3Å; V649-D653 WeakPolarHBondContact O-CB 3.35Å; V649-D653 PolarHBondContact O-N 3.15Å
650	R	89.9	Confident	87.1	Confident	56 Å²	56	82 Å²	82	21%	0.211	45%	0.451	C	S	.	.	H	α-helix	trans	-73.3	-24.2	170.1	-78	177.2	-165.9	-135.7	6.4	114.1	E646 I647 M648 T659 N660 T664	E646-R650 WeakPolarHBondContact O-CB 3.38Å; E646-R650 VanDerWaalsContact O-CG 3.24Å; E646-R650 WeakPolarHBondContact O-CG 3.46Å; E646-R650 PolarHBondContact O-N 3.34Å; E646-R650 VanDerWaalsContact O-N 3.11Å; E646-R650 IonicContact OE1-CZ 3.09Å; E646-R650 IonicContact OE1-NE 2.64Å; E646-R650 PolarHBondContact OE1-NE 2.92Å; E646-R650 IonicContact OE1-NH2 2.92Å; E646-R650 PolarHBondContact OE1-NH2 2.81Å; I647-R650 PolarHBondContact O-N 3.39Å; I647-R650 VanDerWaalsContact O-N 3.14Å; M648-R650 VanDerWaalsContact C-N 3.27Å; M648-R650 PolarHBondContact O-N 3.47Å; R650-T659 PolarHBondContact NH1-O 3.25Å; R650-T659 PolarHBondContact NH2-O 2.84Å; R650-N660 PolarHBondContact NH1-O 3.11Å; R650-N660 PolarHBondContact NH2-O 3.42Å; R650-T664 PolarHBondContact NH2-OG1 3.15Å; R650-T664 VanDerWaalsContact NH2-OG1 3.08Å
651	V	89.2	Confident	86.8	Confident	120 Å²	120	79.7 Å²	79.7	73%	0.727	44%	0.439	S	S	*	.	H	α-helix	trans	-81.7	-35.2	174.7	171.2	0	0	0	0	110.9	I647 M648	I647-V651 WeakPolarHBondContact O-CG2 3.27Å; I647-V651 PolarHBondContact O-N 3.16Å; M648-V651 PolarHBondContact O-N 3.32Å
652	E	90.1	Very high	86.6	Confident	154 Å²	154	80.2 Å²	80.2	72%	0.72	45%	0.445	S	S	*	.	H	α-helix	trans	-77.1	-52.7	175.7	-66.4	176.4	-179.9	0	0	111.9	M648 S654	M648-E652 PolarHBondContact O-N 2.87Å; E652-S654 PolarHBondContact O-N 3.01Å
653	D	83.2	Confident	86.5	Confident	91 Å²	91	83 Å²	83	49%	0.487	45%	0.453	S	S	.	.			trans	-90.1	90.3	175.9	-71.3	-40	0	0	0	111.5	V649 S655	V649-D653 WeakPolarHBondContact CG1-OD2 3.46Å; V649-D653 WeakPolarHBondContact O-CA 3.37Å; V649-D653 VanDerWaalsContact O-CB 3.3Å; V649-D653 WeakPolarHBondContact O-CB 3.35Å; V649-D653 PolarHBondContact O-N 3.15Å; D653-S655 PolarHBondContact O-N 3.28Å
654	S	75.3	Confident	86.4	Confident	123 Å²	123	82.4 Å²	82.4	86%	0.86	45%	0.451	S	S	*	.			trans	-64.9	22	172	55.8	0	0	0	0	115.5	E652	E652-S654 PolarHBondContact O-N 3.01Å
655	S	77.9	Confident	86.4	Confident	68 Å²	68	80.9 Å²	80.9	48%	0.476	45%	0.447	S	S	.	.	S	Bend	trans	-78.2	145.6	177.7	69.9	0	0	0	0	112.2	D653 R657	D653-S655 PolarHBondContact O-N 3.28Å; S655-R657 PolarHBondContact O-N 3.01Å
656	P	70.3	Confident	86.4	Confident	133 Å²	133	81.5 Å²	81.5	86%	0.864	45%	0.45	S	S	*	.			trans	-70.7	101.9	179	28.1	-34.1	0	0	0	111
657	R	76.7	Confident	86.6	Confident	83 Å²	83	84.3 Å²	84.3	31%	0.313	46%	0.459	S	S	.	.			trans	-76.2	147.1	175.8	-68	-164.7	178.5	-146.5	-3.8	112	E646 S655	E646-R657 IonicContact OE1-CZ 3.72Å; E646-R657 IonicContact OE1-NH1 2.75Å; E646-R657 PolarHBondContact OE1-NH1 2.93Å; E646-R657 IonicContact OE2-CZ 3.78Å; E646-R657 IonicContact OE2-NH1 2.69Å; E646-R657 PolarHBondContact OE2-NH1 2.97Å; S655-R657 PolarHBondContact O-N 3.01Å
658	P	75.7	Confident	86.7	Confident	130 Å²	130	81.8 Å²	81.8	84%	0.844	45%	0.446	S	S	*	.	S	Bend	trans	-79.9	-14.7	-175.8	32.4	-37.3	0	0	0	114.7
659	T	81.6	Confident	86.7	Confident	46 Å²	46	82 Å²	82	28%	0.282	45%	0.448	S	S	.	.	S	Bend	trans	-119.7	140.5	179.4	49.5	0	0	0	0	110.9	R650 E663	R650-T659 PolarHBondContact NH1-O 3.25Å; R650-T659 PolarHBondContact NH2-O 2.84Å; T659-E663 WeakPolarHBondContact CA-OE2 3.14Å; T659-E663 WeakPolarHBondContact CB-OE2 2.83Å
660	N	88.3	Confident	86.8	Confident	71 Å²	71	87.3 Å²	87.3	38%	0.38	47%	0.469	S	S	.	.			trans	-71.7	177.5	178.1	81.9	48.9	0	0	0	111	R650 T662 E663 T664	R650-N660 PolarHBondContact NH1-O 3.11Å; R650-N660 PolarHBondContact NH2-O 3.42Å; N660-T662 WeakPolarHBondContact OD1-CA 3.46Å; N660-T662 VanDerWaalsContact OD1-CB 3.3Å; N660-T662 WeakPolarHBondContact OD1-CB 3.41Å; N660-T662 PolarHBondContact OD1-N 3.19Å; N660-E663 VanDerWaalsContact CG-CD 3.44Å; N660-E663 PolarHBondContact N-OE2 2.87Å; N660-E663 VanDerWaalsContact ND2-CG 3.31Å; N660-E663 WeakPolarHBondContact ND2-CG 3.3Å; N660-E663 PolarHBondContact ND2-OE1 2.98Å; N660-E663 PolarHBondContact OD1-N 3.41Å; N660-T664 PolarHBondContact O-OG1 3.5Å
661	M	88.7	Confident	86.9	Confident	57 Å²	57	91.4 Å²	91.4	28%	0.281	49%	0.491	S	S	.	.	S	Bend	trans	-69.8	-48.6	-177.2	-134.1	-56.9	107.6	0	0	110.9	I643 E646 I647 E663 T664 L665	I643-M661 HydrophobicContact CD1-CE 3.51Å; I643-M661 HydrophobicContact CD1-SD 3.69Å; I643-M661 HydrophobicContact CG1-CE 3.99Å; I643-M661 HydrophobicContact CG1-SD 3.78Å; E646-M661 HydrophobicContact CB-CE 4.19Å; E646-M661 HydrophobicContact CG-CE 3.42Å; E646-M661 VanDerWaalsContact CG-CE 3.42Å; I647-M661 HydrophobicContact CD1-SD 4.24Å; I647-M661 HydrophobicContact CG1-CE 4.06Å; I647-M661 HydrophobicContact CG1-SD 3.96Å; M661-E663 PolarHBondContact O-N 2.71Å; M661-T664 WeakPolarHBondContact O-CA 3.29Å; M661-T664 WeakPolarHBondContact O-CB 3.4Å; M661-T664 PolarHBondContact O-N 3.15Å; M661-L665 PolarHBondContact O-N 2.89Å
662	T	91.1	Very high	86.9	Confident	81 Å²	81	86.7 Å²	86.7	50%	0.497	46%	0.462	S	S	.	.	H	α-helix	trans	-57.2	-49.3	179.8	-36	0	0	0	0	112.2	N660 T664 L665 E666	N660-T662 WeakPolarHBondContact OD1-CA 3.46Å; N660-T662 VanDerWaalsContact OD1-CB 3.3Å; N660-T662 WeakPolarHBondContact OD1-CB 3.41Å; N660-T662 PolarHBondContact OD1-N 3.19Å; T662-T664 PolarHBondContact O-N 3.45Å; T662-L665 PolarHBondContact O-N 3.07Å; T662-E666 HydrophobicContact CG2-CG 4.28Å; T662-E666 WeakPolarHBondContact O-CB 3.34Å; T662-E666 WeakPolarHBondContact O-CG 3.35Å; T662-E666 PolarHBondContact O-N 3.47Å
663	E	92.9	Very high	86.9	Confident	81 Å²	81	81.7 Å²	81.7	38%	0.379	44%	0.44	S	S	.	.	H	α-helix	trans	-58	-15.6	174.2	-76.2	164.5	-169.3	0	0	114.2	T659 N660 M661 R667	T659-E663 WeakPolarHBondContact CA-OE2 3.14Å; T659-E663 WeakPolarHBondContact CB-OE2 2.83Å; N660-E663 VanDerWaalsContact CG-CD 3.44Å; N660-E663 PolarHBondContact N-OE2 2.87Å; N660-E663 VanDerWaalsContact ND2-CG 3.31Å; N660-E663 WeakPolarHBondContact ND2-CG 3.3Å; N660-E663 PolarHBondContact ND2-OE1 2.98Å; N660-E663 PolarHBondContact OD1-N 3.41Å; M661-E663 PolarHBondContact O-N 2.71Å; E663-R667 WeakPolarHBondContact O-CB 3.4Å; E663-R667 PolarHBondContact O-NE 3.41Å; E663-R667 PolarHBondContact O-NH2 3.43Å
664	T	91.3	Very high	86.9	Confident	11 Å²	11	80.8 Å²	80.8	7%	0.067	44%	0.438	C	S	.	.	H	α-helix	trans	-97.8	-35.1	177.2	-48	0	0	0	0	110.8	I643 E646 R650 N660 M661 T662 R667 L668	I643-T664 HydrophobicContact CD1-CG2 4.49Å; E646-T664 HydrophobicContact CG-CG2 3.98Å; R650-T664 PolarHBondContact NH2-OG1 3.15Å; R650-T664 VanDerWaalsContact NH2-OG1 3.08Å; N660-T664 PolarHBondContact O-OG1 3.5Å; M661-T664 WeakPolarHBondContact O-CA 3.29Å; M661-T664 WeakPolarHBondContact O-CB 3.4Å; M661-T664 PolarHBondContact O-N 3.15Å; T662-T664 PolarHBondContact O-N 3.45Å; T664-R667 PolarHBondContact OG1-NH2 3.1Å; T664-L668 WeakPolarHBondContact O-CB 3.46Å; T664-L668 VanDerWaalsContact O-CG 3.29Å; T664-L668 WeakPolarHBondContact O-CG 3.49Å; T664-L668 PolarHBondContact O-N 3.27Å; T664-L668 VanDerWaalsContact O-N 3.1Å
665	L	93.6	Very high	87.2	Confident	64 Å²	64	81.7 Å²	81.7	34%	0.335	44%	0.441	S	S	.	.	H	α-helix	trans	-68.5	-48.8	171	179.4	58.4	0	0	0	112.5	V639 I643 M661 T662 R667 L668 I669	V639-L665 HydrophobicContact CG1-CD1 3.98Å; I643-L665 HydrophobicContact CB-CD1 4.34Å; I643-L665 HydrophobicContact CD1-CB 3.73Å; I643-L665 HydrophobicContact CD1-CD1 4.22Å; I643-L665 HydrophobicContact CG1-CB 4.29Å; I643-L665 HydrophobicContact CG1-CD1 4.13Å; I643-L665 HydrophobicContact CG2-CD1 4.5Å; M661-L665 PolarHBondContact O-N 2.89Å; T662-L665 PolarHBondContact O-N 3.07Å; L665-R667 VanDerWaalsContact C-N 3.3Å; L665-R667 PolarHBondContact O-N 2.96Å; L665-L668 PolarHBondContact O-N 3.42Å; L665-I669 HydrophobicContact CD1-CD1 3.96Å; L665-I669 HydrophobicContact CD1-CG1 4.27Å; L665-I669 HydrophobicContact CG-CD1 3.9Å; L665-I669 WeakPolarHBondContact O-CB 3.48Å; L665-I669 WeakPolarHBondContact O-CG1 3.24Å; L665-I669 PolarHBondContact O-N 3.07Å
666	E	93.6	Very high	87.5	Confident	104 Å²	104	81.5 Å²	81.5	49%	0.486	44%	0.439	S	S	.	.	H	α-helix	trans	-55.6	-46.1	177.2	-71.1	168.1	163.5	0	0	110.7	T662 I669 E670	T662-E666 HydrophobicContact CG2-CG 4.28Å; T662-E666 WeakPolarHBondContact O-CB 3.34Å; T662-E666 WeakPolarHBondContact O-CG 3.35Å; T662-E666 PolarHBondContact O-N 3.47Å; E666-I669 WeakPolarHBondContact O-CB 3.5Å; E666-I669 PolarHBondContact O-N 3.4Å; E666-E670 WeakPolarHBondContact O-CG 3.46Å; E666-E670 PolarHBondContact O-N 2.95Å
667	R	94.1	Very high	88.4	Confident	97 Å²	97	77.6 Å²	77.6	37%	0.366	41%	0.414	S	S	.	.	H	α-helix	trans	-62	-45.8	175.8	-167.2	-166.5	-37.6	142.2	20.3	112.9	E663 T664 L665 I669 E670 E671	E663-R667 WeakPolarHBondContact O-CB 3.4Å; E663-R667 PolarHBondContact O-NE 3.41Å; E663-R667 PolarHBondContact O-NH2 3.43Å; T664-R667 PolarHBondContact OG1-NH2 3.1Å; L665-R667 VanDerWaalsContact C-N 3.3Å; L665-R667 PolarHBondContact O-N 2.96Å; R667-I669 VanDerWaalsContact C-N 3.27Å; R667-I669 PolarHBondContact O-N 3.25Å; R667-E670 PolarHBondContact O-N 3.49Å; R667-E671 HydrophobicContact CG-CG 4.33Å; R667-E671 WeakPolarHBondContact CG-OE1 3.46Å; R667-E671 VanDerWaalsContact O-CB 3.3Å; R667-E671 WeakPolarHBondContact O-CB 3.22Å; R667-E671 VanDerWaalsContact O-CG 3.3Å; R667-E671 WeakPolarHBondContact O-CG 3.37Å; R667-E671 PolarHBondContact O-N 3.2Å
668	L	93.8	Very high	89.2	Confident	28 Å²	28	74.2 Å²	74.2	15%	0.147	40%	0.403	C	S	.	.	H	α-helix	trans	-63.3	-34.6	176.8	-77.3	167.8	0	0	0	111.9	V639 A642 I643 T664 L665 T672	V639-L668 HydrophobicContact CG1-CB 4.15Å; V639-L668 WeakPolarHBondContact CG2-O 3.44Å; A642-L668 HydrophobicContact CB-CD1 3.84Å; A642-L668 HydrophobicContact CB-CD2 3.93Å; I643-L668 HydrophobicContact CB-CD1 4.35Å; I643-L668 HydrophobicContact CD1-CD1 3.89Å; T664-L668 WeakPolarHBondContact O-CB 3.46Å; T664-L668 VanDerWaalsContact O-CG 3.29Å; T664-L668 WeakPolarHBondContact O-CG 3.49Å; T664-L668 PolarHBondContact O-N 3.27Å; T664-L668 VanDerWaalsContact O-N 3.1Å; L665-L668 PolarHBondContact O-N 3.42Å; L668-T672 WeakPolarHBondContact O-CB 3.47Å; L668-T672 PolarHBondContact O-N 3.47Å; L668-T672 VanDerWaalsContact O-N 3.17Å; L668-T672 PolarHBondContact O-OG1 3.16Å
669	I	93.3	Very high	89.9	Confident	73 Å²	73	70.7 Å²	70.7	37%	0.374	38%	0.384	S	S	.	.	H	α-helix	trans	-64.7	-53.1	173	-74.4	168.1	0	0	0	110.4	V639 L665 E666 R667 E671 T672 L673	V639-I669 HydrophobicContact CG1-CG1 4.08Å; L665-I669 HydrophobicContact CD1-CD1 3.96Å; L665-I669 HydrophobicContact CD1-CG1 4.27Å; L665-I669 HydrophobicContact CG-CD1 3.9Å; L665-I669 WeakPolarHBondContact O-CB 3.48Å; L665-I669 WeakPolarHBondContact O-CG1 3.24Å; L665-I669 PolarHBondContact O-N 3.07Å; E666-I669 WeakPolarHBondContact O-CB 3.5Å; E666-I669 PolarHBondContact O-N 3.4Å; R667-I669 VanDerWaalsContact C-N 3.27Å; R667-I669 PolarHBondContact O-N 3.25Å; I669-E671 PolarHBondContact O-N 2.7Å; I669-T672 PolarHBondContact O-N 3.13Å; I669-L673 HydrophobicContact CG1-CD1 4.34Å; I669-L673 HydrophobicContact CG2-CD1 4.11Å; I669-L673 HydrophobicContact CG2-CG 4.5Å; I669-L673 WeakPolarHBondContact O-CB 3.45Å; I669-L673 PolarHBondContact O-N 3.44Å
670	E	92.5	Very high	90.4	Very high	163 Å²	163	72.2 Å²	72.2	76%	0.762	41%	0.409	S	S	*	.	H	α-helix	trans	-63.6	-36.3	-179.7	-72.4	-176.1	166.6	0	0	113.5	E666 R667	E666-E670 WeakPolarHBondContact O-CG 3.46Å; E666-E670 PolarHBondContact O-N 2.95Å; R667-E670 PolarHBondContact O-N 3.49Å
671	E	90.9	Very high	90.7	Very high	141 Å²	141	72.3 Å²	72.3	66%	0.659	41%	0.408	S	S	*	.	H	α-helix	trans	-77.4	-27.4	179.8	-72.8	177.5	-176	0	0	113.2	R667 I669	R667-E671 HydrophobicContact CG-CG 4.33Å; R667-E671 WeakPolarHBondContact CG-OE1 3.46Å; R667-E671 VanDerWaalsContact O-CB 3.3Å; R667-E671 WeakPolarHBondContact O-CB 3.22Å; R667-E671 VanDerWaalsContact O-CG 3.3Å; R667-E671 WeakPolarHBondContact O-CG 3.37Å; R667-E671 PolarHBondContact O-N 3.2Å; I669-E671 PolarHBondContact O-N 2.7Å
672	T	90	Very high	90.9	Very high	22 Å²	22	70.5 Å²	70.5	14%	0.135	40%	0.4	C	S	.	.	H	α-helix	trans	-109.8	-42.4	-169.8	-44.1	0	0	0	0	114.2	R635 F638 V639 L668 I669	R635-T672 HydrophobicContact CB-CG2 3.99Å; R635-T672 WeakPolarHBondContact CD-O 3.43Å; R635-T672 HydrophobicContact CG-CG2 4.24Å; R635-T672 PolarHBondContact NH1-O 3.39Å; F638-T672 HydrophobicContact CB-CG2 4.49Å; F638-T672 HydrophobicContact CD1-CG2 3.66Å; F638-T672 HydrophobicContact CE1-CG2 4.34Å; F638-T672 HydrophobicContact CG-CG2 4.41Å; V639-T672 HydrophobicContact CG2-CG2 4Å; L668-T672 WeakPolarHBondContact O-CB 3.47Å; L668-T672 PolarHBondContact O-N 3.47Å; L668-T672 VanDerWaalsContact O-N 3.17Å; L668-T672 PolarHBondContact O-OG1 3.16Å; I669-T672 PolarHBondContact O-N 3.13Å
673	L	89.8	Confident	91.1	Very high	48 Å²	48	67.9 Å²	67.9	25%	0.251	39%	0.385	S	S	.	.	S	Bend	trans	-82.2	162.6	-171.7	-54	-167	0	0	0	111.3	R635 L636 V639 I669	R635-L673 HydrophobicContact CB-CD2 3.78Å; L636-L673 HydrophobicContact CD2-CD1 3.69Å; L636-L673 HydrophobicContact CD2-CD2 3.99Å; L636-L673 HydrophobicContact CG-CD2 4.26Å; V639-L673 HydrophobicContact CG2-CD2 3.99Å; V639-L673 HydrophobicContact CG2-CG 4.37Å; I669-L673 HydrophobicContact CG1-CD1 4.34Å; I669-L673 HydrophobicContact CG2-CD1 4.11Å; I669-L673 HydrophobicContact CG2-CG 4.5Å; I669-L673 WeakPolarHBondContact O-CB 3.45Å; I669-L673 PolarHBondContact O-N 3.44Å
674	V	84.3	Confident	91.2	Very high	73 Å²	73	69 Å²	69	44%	0.442	39%	0.393	S	S	.	.			trans	-90.2	134.5	174.6	-173.3	0	0	0	0	108.1	S676	V674-S676 WeakPolarHBondContact CG1-O 3.2Å; V674-S676 CarbonylContact O-C 3.57Å; V674-S676 PolarHBondContact O-N 3.01Å
675	P	80.2	Confident	91.4	Very high	142 Å²	142	70.6 Å²	70.6	92%	0.922	40%	0.399	S	S	*	.	S	Bend	trans	-61.3	-15.3	-179.6	-27.4	35.7	0	0	0	115.8
676	S	85	Confident	91.5	Very high	63 Å²	63	67.5 Å²	67.5	44%	0.441	38%	0.383	S	S	.	.	S	Bend	trans	-117.4	114.1	167	162	0	0	0	0	106.3	V674 Q681	V674-S676 WeakPolarHBondContact CG1-O 3.2Å; V674-S676 CarbonylContact O-C 3.57Å; V674-S676 PolarHBondContact O-N 3.01Å; S676-Q681 PolarHBondContact OG-OE1 2.72Å
677	P	88.9	Confident	91.5	Very high	51 Å²	51	65.6 Å²	65.6	33%	0.331	38%	0.376	S	S	.	.			trans	-69	156.6	177	29.9	-35	0	0	0	110.6	E632	E632-P677 WeakPolarHBondContact OE1-CA 3.2Å; E632-P677 WeakPolarHBondContact OE1-CB 3.16Å
678	V	93.2	Very high	91.6	Very high	12 Å²	12	66.2 Å²	66.2	7%	0.073	38%	0.381	C	S	.	.	S	Bend	trans	-85	-38.4	173.7	-174.2	0	0	0	0	109.8	L629 E632 G680 Q681 T682 F685	L629-V678 HydrophobicContact CD2-CB 4.17Å; L629-V678 HydrophobicContact CD2-CG1 4Å; L629-V678 HydrophobicContact CG-CG1 4.1Å; E632-V678 VanDerWaalsContact CD-N 3.32Å; E632-V678 PolarHBondContact OE1-N 2.85Å; E632-V678 WeakPolarHBondContact OE2-CA 3.15Å; E632-V678 WeakPolarHBondContact OE2-CB 3.28Å; E632-V678 PolarHBondContact OE2-N 3.09Å; E632-V678 VanDerWaalsContact OE2-N 3.08Å; V678-G680 PolarHBondContact O-N 3.39Å; V678-Q681 CarbonylContact O-C 3.46Å; V678-Q681 PolarHBondContact O-N 3.41Å; V678-T682 HydrophobicContact CG1-CG2 4.48Å; V678-T682 WeakPolarHBondContact O-CG2 3.48Å; V678-T682 PolarHBondContact O-N 3.14Å; V678-F685 HydrophobicContact CG1-CB 4Å; V678-F685 HydrophobicContact CG1-CD1 3.86Å; V678-F685 HydrophobicContact CG1-CD2 4.21Å; V678-F685 HydrophobicContact CG1-CE1 4.4Å; V678-F685 HydrophobicContact CG1-CG 3.75Å; V678-F685 HydrophobicContact CG2-CD2 3.7Å; V678-F685 HydrophobicContact CG2-CE2 3.88Å; V678-F685 HydrophobicContact CG2-CG 4.12Å; V678-F685 HydrophobicContact CG2-CZ 4.45Å
679	A	91.6	Very high	91.7	Very high	56 Å²	56	65.3 Å²	65.3	46%	0.463	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	125.2	170.5	0	0	0	0	0	111.3	L629 E632 Q681	L629-A679 HydrophobicContact CD2-CB 4.15Å; E632-A679 PolarHBondContact OE2-N 2.94Å; A679-Q681 PolarHBondContact O-N 3.47Å
680	G	91.5	Very high	91.8	Very high	78 Å²	78	62.4 Å²	62.4	80%	0.804	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	-3.7	-177.1	0	0	0	0	0	115.9	V678	V678-G680 PolarHBondContact O-N 3.39Å
681	Q	93.8	Very high	91.9	Very high	74 Å²	74	58.9 Å²	58.9	35%	0.346	35%	0.346	S	S	.	.			trans	-130.9	34.9	-179.9	-58.2	178.2	17.5	0	0	110.8	S676 V678 A679 S683 D684 F685	S676-Q681 PolarHBondContact OG-OE1 2.72Å; V678-Q681 CarbonylContact O-C 3.46Å; V678-Q681 PolarHBondContact O-N 3.41Å; A679-Q681 PolarHBondContact O-N 3.47Å; Q681-S683 PolarHBondContact O-N 2.99Å; Q681-D684 PolarHBondContact O-N 3.24Å; Q681-F685 WeakPolarHBondContact O-CB 3.39Å; Q681-F685 PolarHBondContact O-N 3.33Å
682	T	94.6	Very high	92.1	Very high	18 Å²	18	54.3 Å²	54.3	11%	0.11	33%	0.325	C	S	.	.	H	α-helix	trans	-76.4	-26.5	-164.2	80.7	0	0	0	0	113.4	D126 K625 L629 V678 V686	D126-T682 WeakPolarHBondContact OD2-CB 3.35Å; D126-T682 PolarHBondContact OD2-N 3.35Å; D126-T682 PolarHBondContact OD2-OG1 3.46Å; K625-T682 VanDerWaalsContact CD-OG1 3.22Å; K625-T682 WeakPolarHBondContact CD-OG1 3.15Å; K625-T682 WeakPolarHBondContact CE-OG1 3.46Å; K625-T682 PolarHBondContact NZ-OG1 2.87Å; L629-T682 HydrophobicContact CD1-CG2 4.41Å; L629-T682 HydrophobicContact CD2-CG2 4.36Å; V678-T682 HydrophobicContact CG1-CG2 4.48Å; V678-T682 WeakPolarHBondContact O-CG2 3.48Å; V678-T682 PolarHBondContact O-N 3.14Å; T682-V686 VanDerWaalsContact O-CG2 3.3Å; T682-V686 WeakPolarHBondContact O-CG2 3.32Å; T682-V686 PolarHBondContact O-N 2.72Å
683	S	93.6	Very high	92.3	Very high	26 Å²	26	53.9 Å²	53.9	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-52.2	166.7	46.7	0	0	0	0	112.1	D126 Q681 F685 V686 N687	D126-S683 WeakPolarHBondContact OD1-CB 3.47Å; D126-S683 PolarHBondContact OD1-OG 3.46Å; D126-S683 PolarHBondContact OD2-N 3.16Å; Q681-S683 PolarHBondContact O-N 2.99Å; S683-F685 VanDerWaalsContact C-N 3.3Å; S683-F685 PolarHBondContact O-N 2.85Å; S683-V686 PolarHBondContact O-N 3.02Å; S683-V686 VanDerWaalsContact O-N 3.09Å; S683-N687 WeakPolarHBondContact O-CB 3.32Å; S683-N687 VanDerWaalsContact O-CG 3.27Å; S683-N687 PolarHBondContact O-N 3.13Å; S683-N687 PolarHBondContact O-ND2 3.12Å
684	D	94.9	Very high	92.4	Very high	104 Å²	104	54.2 Å²	54.2	56%	0.556	34%	0.338	S	S	*	.	H	α-helix	trans	-59.7	-38.8	178.2	-82.8	-28.4	0	0	0	112.7	Q681 N687 K688	Q681-D684 PolarHBondContact O-N 3.24Å; D684-N687 PolarHBondContact O-N 3.11Å; D684-K688 WeakPolarHBondContact O-CB 3.25Å; D684-K688 PolarHBondContact O-N 2.88Å
685	F	95.4	Very high	92.8	Very high	45 Å²	45	59.9 Å²	59.9	20%	0.197	35%	0.352	C	S	.	.	H	α-helix	trans	-58	-51.9	170.7	178.7	-103.1	0	0	0	111.7	V624 V678 Q681 S683 N687 K688 I689 L702	V624-F685 HydrophobicContact CG1-CD1 4.25Å; V624-F685 HydrophobicContact CG1-CE1 3.86Å; V678-F685 HydrophobicContact CG1-CB 4Å; V678-F685 HydrophobicContact CG1-CD1 3.86Å; V678-F685 HydrophobicContact CG1-CD2 4.21Å; V678-F685 HydrophobicContact CG1-CE1 4.4Å; V678-F685 HydrophobicContact CG1-CG 3.75Å; V678-F685 HydrophobicContact CG2-CD2 3.7Å; V678-F685 HydrophobicContact CG2-CE2 3.88Å; V678-F685 HydrophobicContact CG2-CG 4.12Å; V678-F685 HydrophobicContact CG2-CZ 4.45Å; Q681-F685 WeakPolarHBondContact O-CB 3.39Å; Q681-F685 PolarHBondContact O-N 3.33Å; S683-F685 VanDerWaalsContact C-N 3.3Å; S683-F685 PolarHBondContact O-N 2.85Å; F685-N687 VanDerWaalsContact C-N 3.33Å; F685-N687 PolarHBondContact O-N 3.32Å; F685-K688 WeakPolarHBondContact O-CB 3.15Å; F685-K688 PolarHBondContact O-N 3.42Å; F685-K688 VanDerWaalsContact O-N 3.09Å; F685-I689 HydrophobicContact CD1-CG1 4.41Å; F685-I689 HydrophobicContact CE1-CG1 4.05Å; F685-I689 HydrophobicContact CE2-CD1 4.15Å; F685-I689 HydrophobicContact CE2-CG1 4.34Å; F685-I689 HydrophobicContact CZ-CD1 4.04Å; F685-I689 HydrophobicContact CZ-CG1 4.01Å; F685-I689 WeakPolarHBondContact O-CG1 3.23Å; F685-I689 PolarHBondContact O-N 3.37Å; F685-L702 HydrophobicContact CE1-CD2 4.08Å; F685-L702 HydrophobicContact CZ-CD2 3.68Å
686	V	96.1	Very high	93.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.8	-41	178.2	174.1	0	0	0	0	111.5	P130 L568 A621 V624 K625 T682 S683 K688 I689 L690	P130-V686 HydrophobicContact CG-CB 4.45Å; P130-V686 HydrophobicContact CG-CG1 3.72Å; L568-V686 HydrophobicContact CD2-CG1 3.81Å; A621-V686 HydrophobicContact CB-CG1 4.24Å; V624-V686 HydrophobicContact CB-CG2 4.19Å; V624-V686 HydrophobicContact CG1-CG2 3.9Å; K625-V686 HydrophobicContact CD-CG2 4.5Å; K625-V686 HydrophobicContact CG-CG2 3.56Å; T682-V686 VanDerWaalsContact O-CG2 3.3Å; T682-V686 WeakPolarHBondContact O-CG2 3.32Å; T682-V686 PolarHBondContact O-N 2.72Å; S683-V686 PolarHBondContact O-N 3.02Å; S683-V686 VanDerWaalsContact O-N 3.09Å; V686-K688 VanDerWaalsContact C-N 3.29Å; V686-K688 PolarHBondContact O-N 3.22Å; V686-I689 PolarHBondContact O-N 3.08Å; V686-L690 HydrophobicContact CG1-CD1 3.97Å; V686-L690 HydrophobicContact CG1-CG 4.45Å; V686-L690 WeakPolarHBondContact O-CB 3.4Å; V686-L690 WeakPolarHBondContact O-CG 3.24Å; V686-L690 PolarHBondContact O-N 3.04Å
687	N	95.2	Very high	93.5	Very high	63 Å²	63	55.7 Å²	55.7	34%	0.337	33%	0.331	S	S	.	.	H	α-helix	trans	-57.7	-43.1	173.8	-71.1	-28.4	0	0	0	110.8	P130 S683 D684 F685 L690 E691	P130-N687 WeakPolarHBondContact CB-OD1 3.33Å; S683-N687 WeakPolarHBondContact O-CB 3.32Å; S683-N687 VanDerWaalsContact O-CG 3.27Å; S683-N687 PolarHBondContact O-N 3.13Å; S683-N687 PolarHBondContact O-ND2 3.12Å; D684-N687 PolarHBondContact O-N 3.11Å; F685-N687 VanDerWaalsContact C-N 3.33Å; F685-N687 PolarHBondContact O-N 3.32Å; N687-L690 PolarHBondContact O-N 3.15Å; N687-E691 PolarHBondContact O-N 3.2Å
688	K	95.4	Very high	93.3	Very high	110 Å²	110	56 Å²	56	48%	0.478	33%	0.333	S	S	.	.	H	α-helix	trans	-66.7	-41.9	179.4	-165.2	53.9	166.1	-171.9	0	113.1	D684 F685 V686 L690 E691 N692	D684-K688 WeakPolarHBondContact O-CB 3.25Å; D684-K688 PolarHBondContact O-N 2.88Å; F685-K688 WeakPolarHBondContact O-CB 3.15Å; F685-K688 PolarHBondContact O-N 3.42Å; F685-K688 VanDerWaalsContact O-N 3.09Å; V686-K688 VanDerWaalsContact C-N 3.29Å; V686-K688 PolarHBondContact O-N 3.22Å; K688-L690 VanDerWaalsContact C-N 3.29Å; K688-L690 PolarHBondContact O-N 3.34Å; K688-E691 WeakPolarHBondContact CD-OE2 3.49Å; K688-E691 IonicContact NZ-OE2 2.63Å; K688-E691 PolarHBondContact NZ-OE2 3.22Å; K688-E691 PolarHBondContact O-N 3.29Å; K688-N692 VanDerWaalsContact O-CG 3.23Å; K688-N692 PolarHBondContact O-N 3.4Å; K688-N692 VanDerWaalsContact O-N 3.09Å; K688-N692 PolarHBondContact O-ND2 3.27Å
689	I	95.1	Very high	93	Very high	9 Å²	9	56.4 Å²	56.4	5%	0.046	34%	0.335	C	S	.	.	H	α-helix	trans	-60.3	-41.8	172.8	-59.7	-52.2	0	0	0	110.2	P565 V624 F685 V686 N692 T693 G700 L702	P565-I689 HydrophobicContact CB-CG2 3.57Å; P565-I689 HydrophobicContact CG-CG2 4.14Å; V624-I689 HydrophobicContact CG1-CB 4.26Å; V624-I689 HydrophobicContact CG1-CG1 4.02Å; V624-I689 HydrophobicContact CG1-CG2 4.28Å; F685-I689 HydrophobicContact CD1-CG1 4.41Å; F685-I689 HydrophobicContact CE1-CG1 4.05Å; F685-I689 HydrophobicContact CE2-CD1 4.15Å; F685-I689 HydrophobicContact CE2-CG1 4.34Å; F685-I689 HydrophobicContact CZ-CD1 4.04Å; F685-I689 HydrophobicContact CZ-CG1 4.01Å; F685-I689 WeakPolarHBondContact O-CG1 3.23Å; F685-I689 PolarHBondContact O-N 3.37Å; V686-I689 PolarHBondContact O-N 3.08Å; I689-N692 PolarHBondContact O-N 3.16Å; I689-T693 PolarHBondContact O-N 3.11Å; I689-T693 PolarHBondContact O-OG1 3.49Å; I689-G700 WeakPolarHBondContact CD1-O 3.47Å; I689-L702 HydrophobicContact CD1-CD2 3.68Å; I689-L702 HydrophobicContact CD1-CG 3.92Å; I689-L702 HydrophobicContact CG1-CD2 3.91Å; I689-L702 HydrophobicContact CG1-CG 4.23Å; I689-L702 HydrophobicContact CG2-CD1 4.14Å; I689-L702 HydrophobicContact CG2-CG 4.03Å
690	L	95.9	Very high	92.7	Very high	13 Å²	13	53.8 Å²	53.8	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-68.3	-36.5	177.4	-72.6	171.2	0	0	0	113.8	P130 L568 L569 V686 N687 K688 T693 G694	P130-L690 HydrophobicContact CB-CD1 4.18Å; P130-L690 HydrophobicContact CG-CD1 4.19Å; L568-L690 HydrophobicContact CB-CD2 4.23Å; L568-L690 HydrophobicContact CD2-CD1 4.05Å; L568-L690 HydrophobicContact CD2-CD2 4.02Å; L568-L690 HydrophobicContact CD2-CG 4.21Å; L568-L690 HydrophobicContact CG-CD1 4.28Å; L568-L690 HydrophobicContact CG-CD2 3.92Å; L569-L690 HydrophobicContact CB-CD2 3.74Å; L569-L690 HydrophobicContact CD1-CD2 4.19Å; V686-L690 HydrophobicContact CG1-CD1 3.97Å; V686-L690 HydrophobicContact CG1-CG 4.45Å; V686-L690 WeakPolarHBondContact O-CB 3.4Å; V686-L690 WeakPolarHBondContact O-CG 3.24Å; V686-L690 PolarHBondContact O-N 3.04Å; N687-L690 PolarHBondContact O-N 3.15Å; K688-L690 VanDerWaalsContact C-N 3.29Å; K688-L690 PolarHBondContact O-N 3.34Å; L690-T693 PolarHBondContact O-N 2.82Å; L690-G694 PolarHBondContact O-N 3.04Å
691	E	95.3	Very high	92.4	Very high	89 Å²	89	51.9 Å²	51.9	42%	0.416	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-50.9	170.1	-73.8	-163.2	147.1	0	0	111	N687 K688 T693 G694 R695	N687-E691 PolarHBondContact O-N 3.2Å; K688-E691 WeakPolarHBondContact CD-OE2 3.49Å; K688-E691 IonicContact NZ-OE2 2.63Å; K688-E691 PolarHBondContact NZ-OE2 3.22Å; K688-E691 PolarHBondContact O-N 3.29Å; E691-T693 VanDerWaalsContact C-N 3.32Å; E691-T693 PolarHBondContact O-N 3.22Å; E691-G694 CarbonylContact O-C 3.58Å; E691-G694 PolarHBondContact O-N 3.25Å; E691-G694 VanDerWaalsContact O-N 3.14Å; E691-R695 WeakPolarHBondContact O-CG 3.44Å; E691-R695 PolarHBondContact O-N 2.77Å
692	N	94.1	Very high	92.2	Very high	44 Å²	44	48.7 Å²	48.7	24%	0.235	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-42	-178.6	-66.8	-19.6	0	0	0	110.7	K688 I689 G694 R695 G696 D697 G700	K688-N692 VanDerWaalsContact O-CG 3.23Å; K688-N692 PolarHBondContact O-N 3.4Å; K688-N692 VanDerWaalsContact O-N 3.09Å; K688-N692 PolarHBondContact O-ND2 3.27Å; I689-N692 PolarHBondContact O-N 3.16Å; N692-G694 PolarHBondContact O-N 3.48Å; N692-R695 WeakPolarHBondContact O-CB 3.47Å; N692-R695 PolarHBondContact O-N 2.78Å; N692-R695 VanDerWaalsContact O-N 3.16Å; N692-G696 PolarHBondContact O-N 2.69Å; N692-D697 WeakPolarHBondContact O-CB 3.47Å; N692-D697 PolarHBondContact O-N 3.29Å; N692-D697 VanDerWaalsContact O-N 3.08Å; N692-G700 VanDerWaalsContact CB-C 3.48Å; N692-G700 WeakPolarHBondContact CB-O 3.34Å; N692-G700 PolarHBondContact ND2-O 3.09Å
693	T	94.8	Very high	91.6	Very high	13 Å²	13	52.2 Å²	52.2	8%	0.08	30%	0.3	C	S	.	.	H	α-helix	trans	-64.1	-38.5	173.5	-55.3	0	0	0	0	112.5	R566 L569 I689 L690 E691 R695 G696 D697 G700	R566-T693 HydrophobicContact CB-CG2 4.43Å; R566-T693 HydrophobicContact CG-CG2 3.76Å; L569-T693 HydrophobicContact CB-CG2 4.38Å; L569-T693 HydrophobicContact CD2-CG2 3.77Å; I689-T693 PolarHBondContact O-N 3.11Å; I689-T693 PolarHBondContact O-OG1 3.49Å; L690-T693 PolarHBondContact O-N 2.82Å; E691-T693 VanDerWaalsContact C-N 3.32Å; E691-T693 PolarHBondContact O-N 3.22Å; T693-R695 VanDerWaalsContact C-N 3.27Å; T693-R695 PolarHBondContact O-N 2.75Å; T693-G696 PolarHBondContact O-N 2.85Å; T693-D697 VanDerWaalsContact CA-O 3.29Å; T693-D697 WeakPolarHBondContact CA-O 3.49Å; T693-G700 VanDerWaalsContact OG1-CA 3.31Å; T693-G700 WeakPolarHBondContact OG1-CA 3.36Å
694	G	91.6	Very high	90.9	Very high	56 Å²	56	54 Å²	54	58%	0.577	32%	0.323	S	S	*	.	H	α-helix	trans	-65.1	-28.1	172.9	0	0	0	0	0	113.8	L690 E691 N692 G696	L690-G694 PolarHBondContact O-N 3.04Å; E691-G694 CarbonylContact O-C 3.58Å; E691-G694 PolarHBondContact O-N 3.25Å; E691-G694 VanDerWaalsContact O-N 3.14Å; N692-G694 PolarHBondContact O-N 3.48Å; G694-G696 PolarHBondContact O-N 3.01Å
695	R	93	Very high	90.3	Very high	191 Å²	191	50.2 Å²	50.2	72%	0.721	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.6	172.2	-67.2	169.3	-169.8	-77.6	-1.6	113.5	E691 N692 T693	E691-R695 WeakPolarHBondContact O-CG 3.44Å; E691-R695 PolarHBondContact O-N 2.77Å; N692-R695 WeakPolarHBondContact O-CB 3.47Å; N692-R695 PolarHBondContact O-N 2.78Å; N692-R695 VanDerWaalsContact O-N 3.16Å; T693-R695 VanDerWaalsContact C-N 3.27Å; T693-R695 PolarHBondContact O-N 2.75Å
696	G	89.2	Confident	89.4	Confident	59 Å²	59	58.9 Å²	58.9	61%	0.608	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	3.9	175.1	0	0	0	0	0	115.4	N692 T693 G694 P698	N692-G696 PolarHBondContact O-N 2.69Å; T693-G696 PolarHBondContact O-N 2.85Å; G694-G696 PolarHBondContact O-N 3.01Å; G696-P698 VanDerWaalsContact O-CD 3.26Å; G696-P698 WeakPolarHBondContact O-CD 3.36Å
697	D	90.3	Very high	88.2	Confident	59 Å²	59	61.2 Å²	61.2	32%	0.316	35%	0.348	S	S	.	.			trans	-75.5	113.7	172.7	-178.3	-8.9	0	0	0	110.8	N692 T693 T699 G700 G701	N692-D697 WeakPolarHBondContact O-CB 3.47Å; N692-D697 PolarHBondContact O-N 3.29Å; N692-D697 VanDerWaalsContact O-N 3.08Å; T693-D697 VanDerWaalsContact CA-O 3.29Å; T693-D697 WeakPolarHBondContact CA-O 3.49Å; D697-T699 PolarHBondContact O-N 3.4Å; D697-T699 PolarHBondContact OD1-N 3.32Å; D697-T699 PolarHBondContact OD1-OG1 3.26Å; D697-G700 PolarHBondContact O-N 3.22Å; D697-G700 PolarHBondContact OD1-N 2.92Å; D697-G701 PolarHBondContact OD2-N 2.74Å
698	P	84.3	Confident	86.4	Confident	58 Å²	58	63.9 Å²	63.9	38%	0.377	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.8	-178.5	30.1	-37.6	0	0	0	115.4	G696 V707	G696-P698 VanDerWaalsContact O-CD 3.26Å; G696-P698 WeakPolarHBondContact O-CD 3.36Å; P698-V707 HydrophobicContact CB-CG1 4.13Å; P698-V707 HydrophobicContact CB-CG2 3.75Å; P698-V707 HydrophobicContact CG-CG2 3.77Å
699	T	87.6	Confident	84	Confident	20 Å²	20	64.7 Å²	64.7	12%	0.123	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-8.8	169.1	70.4	0	0	0	0	113.2	D697 G701 L702 L705 V707	D697-T699 PolarHBondContact O-N 3.4Å; D697-T699 PolarHBondContact OD1-N 3.32Å; D697-T699 PolarHBondContact OD1-OG1 3.26Å; T699-G701 PolarHBondContact O-N 2.88Å; T699-G701 PolarHBondContact OG1-N 3.31Å; T699-L702 WeakPolarHBondContact O-CB 3.42Å; T699-L702 WeakPolarHBondContact O-CG 3.32Å; T699-L702 PolarHBondContact O-N 3.36Å; T699-L702 VanDerWaalsContact O-N 3.13Å; T699-L705 HydrophobicContact CG2-CB 4.26Å; T699-L705 HydrophobicContact CG2-CD2 4.33Å; T699-L705 HydrophobicContact CG2-CG 4.31Å; T699-L705 VanDerWaalsContact CG2-O 3.3Å; T699-L705 WeakPolarHBondContact CG2-O 3.38Å; T699-V707 HydrophobicContact CG2-CG2 3.41Å; T699-V707 VanDerWaalsContact CG2-CG2 3.41Å
700	G	85.8	Confident	81.6	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	19.9	-172.9	0	0	0	0	0	114.5	I689 N692 T693 D697	I689-G700 WeakPolarHBondContact CD1-O 3.47Å; N692-G700 VanDerWaalsContact CB-C 3.48Å; N692-G700 WeakPolarHBondContact CB-O 3.34Å; N692-G700 PolarHBondContact ND2-O 3.09Å; T693-G700 VanDerWaalsContact OG1-CA 3.31Å; T693-G700 WeakPolarHBondContact OG1-CA 3.36Å; D697-G700 PolarHBondContact O-N 3.22Å; D697-G700 PolarHBondContact OD1-N 2.92Å
701	G	85.6	Confident	78.9	Confident	38 Å²	38	78.5 Å²	78.5	39%	0.392	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	5.9	-174.7	0	0	0	0	0	114.8	D697 T699 V703	D697-G701 PolarHBondContact OD2-N 2.74Å; T699-G701 PolarHBondContact O-N 2.88Å; T699-G701 PolarHBondContact OG1-N 3.31Å; G701-V703 PolarHBondContact O-N 3.32Å; G701-V703 VanDerWaalsContact O-N 3.09Å
702	L	88.6	Confident	75.7	Confident	8 Å²	8	86.6 Å²	86.6	4%	0.042	50%	0.498	C	S	.	.			trans	-64.8	110.4	174.9	-70.5	175.1	0	0	0	110.9	P563 P565 V624 F685 I689 T699 L705	P563-L702 HydrophobicContact CB-CD1 3.98Å; P563-L702 HydrophobicContact CG-CD1 3.87Å; P565-L702 HydrophobicContact CG-CD1 4.24Å; V624-L702 HydrophobicContact CG1-CD1 4.44Å; V624-L702 HydrophobicContact CG1-CD2 4.41Å; V624-L702 HydrophobicContact CG2-CD1 4.43Å; F685-L702 HydrophobicContact CE1-CD2 4.08Å; F685-L702 HydrophobicContact CZ-CD2 3.68Å; I689-L702 HydrophobicContact CD1-CD2 3.68Å; I689-L702 HydrophobicContact CD1-CG 3.92Å; I689-L702 HydrophobicContact CG1-CD2 3.91Å; I689-L702 HydrophobicContact CG1-CG 4.23Å; I689-L702 HydrophobicContact CG2-CD1 4.14Å; I689-L702 HydrophobicContact CG2-CG 4.03Å; T699-L702 WeakPolarHBondContact O-CB 3.42Å; T699-L702 WeakPolarHBondContact O-CG 3.32Å; T699-L702 PolarHBondContact O-N 3.36Å; T699-L702 VanDerWaalsContact O-N 3.13Å; L702-L705 HydrophobicContact CB-CB 3.95Å; L702-L705 HydrophobicContact CB-CD2 3.97Å; L702-L705 HydrophobicContact CD1-CD2 3.77Å; L702-L705 WeakPolarHBondContact O-CB 3.35Å; L702-L705 PolarHBondContact O-N 2.8Å
703	V	82.1	Confident	74.8	Confident	92 Å²	92	88.8 Å²	88.8	56%	0.558	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	138	179.6	-177.3	0	0	0	0	110.1	W627 G701 L705	W627-V703 PolarHBondContact NE1-O 2.72Å; G701-V703 PolarHBondContact O-N 3.32Å; G701-V703 VanDerWaalsContact O-N 3.09Å; V703-L705 PolarHBondContact O-N 3.08Å; V703-L705 VanDerWaalsContact O-N 3.12Å
704	G	78.7	Confident	73.8	Confident	64 Å²	64	92.7 Å²	92.7	66%	0.66	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-20.7	179	0	0	0	0	0	115.5	R706	G704-R706 PolarHBondContact O-N 3.21Å
705	L	83.1	Confident	72.8	Confident	23 Å²	23	94.8 Å²	94.8	12%	0.12	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-66	116.3	179.7	-175.4	64	0	0	0	110.5	T562 P563 W627 T699 L702 V703	T562-L705 HydrophobicContact CG2-CD1 3.75Å; P563-L705 HydrophobicContact CG-CD1 4.14Å; P563-L705 HydrophobicContact CG-CD2 4.23Å; W627-L705 HydrophobicContact CH2-CD1 4.41Å; W627-L705 HydrophobicContact CZ2-CB 4.19Å; T699-L705 HydrophobicContact CG2-CB 4.26Å; T699-L705 HydrophobicContact CG2-CD2 4.33Å; T699-L705 HydrophobicContact CG2-CG 4.31Å; T699-L705 VanDerWaalsContact CG2-O 3.3Å; T699-L705 WeakPolarHBondContact CG2-O 3.38Å; L702-L705 HydrophobicContact CB-CB 3.95Å; L702-L705 HydrophobicContact CB-CD2 3.97Å; L702-L705 HydrophobicContact CD1-CD2 3.77Å; L702-L705 WeakPolarHBondContact O-CB 3.35Å; L702-L705 PolarHBondContact O-N 2.8Å; V703-L705 PolarHBondContact O-N 3.08Å; V703-L705 VanDerWaalsContact O-N 3.12Å
706	R	76.4	Confident	71.6	Confident	227 Å²	227	89.1 Å²	89.1	86%	0.857	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-92.5	116.6	173.9	-67	-172.3	-174.5	128.6	4.5	110.1	G704 P708	G704-R706 PolarHBondContact O-N 3.21Å; R706-P708 WeakPolarHBondContact O-CD 3.44Å
707	V	69.4	Low	70.5	Confident	50 Å²	50	91 Å²	91	30%	0.303	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-63.7	127.2	168.7	-169.3	0	0	0	0	109	P698 T699 T709	P698-V707 HydrophobicContact CB-CG1 4.13Å; P698-V707 HydrophobicContact CB-CG2 3.75Å; P698-V707 HydrophobicContact CG-CG2 3.77Å; T699-V707 HydrophobicContact CG2-CG2 3.41Å; T699-V707 VanDerWaalsContact CG2-CG2 3.41Å; V707-T709 PolarHBondContact O-N 3.46Å
708	P	57.5	Low	69.2	Low	118 Å²	118	93.1 Å²	93.1	77%	0.766	53%	0.528	S	S	*	.			trans	-63.2	107.1	164.2	-19.4	33	0	0	0	108.4	R706 S710	R706-P708 WeakPolarHBondContact O-CD 3.44Å; P708-S710 PolarHBondContact O-N 3.12Å
709	T	46.3	Very low	68.1	Low	127 Å²	127	95.6 Å²	95.6	78%	0.779	54%	0.538	S	S	*	.			trans	-70.1	95.3	173.5	41.4	0	0	0	0	108.7	V707 K711	V707-T709 PolarHBondContact O-N 3.46Å; T709-K711 PolarHBondContact O-N 3.29Å; T709-K711 VanDerWaalsContact O-N 3.12Å
710	S	45.1	Very low	66.6	Low	114 Å²	114	101.5 Å²	101.5	80%	0.797	57%	0.57	S	S	*	*			trans	-52.5	120.5	166.5	-166.9	0	0	0	0	107.7	P708 M712	P708-S710 PolarHBondContact O-N 3.12Å; S710-M712 PolarHBondContact O-N 3.42Å
711	K	37.3	Very low	65	Low	198 Å²	198	109.9 Å²	109.9	86%	0.861	62%	0.618	S	S	*	*			trans	-67.9	133.5	177.6	-66.5	177.6	-177.4	173	0	108.1	T709	T709-K711 PolarHBondContact O-N 3.29Å; T709-K711 VanDerWaalsContact O-N 3.12Å
712	M	30	Very low	63.1	Low	260 Å²	260	116.5 Å²	116.5	100%	1.281	64%	0.639	S	S	*	*			trans	-84.4	0	163.7	-61.5	175.7	65.1	0	0	109.6	S710	S710-M712 PolarHBondContact O-N 3.42Å

Retrieved 712 of 712 residues in 221.2 ms (Link to these results)

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