A0A077Z0S6_TRITR Loading...

RabGAP-TBC domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0S6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 724 aa.

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(Predicted Aligned Error values between residue pairs)

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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	26.6	Very low	26.5	Very low	218 Å²	218	158.9 Å²	158.9	100%	1.074	81%	0.809	S	S	*	*				0	80.4	0	-72.2	-169.4	-77.5	0	0	111.4
2	E	25.7	Very low	26.5	Very low	158 Å²	158	161.7 Å²	161.7	74%	0.738	81%	0.811	S	S	*	*			cis	-168.9	167.2	-21.6	-119.8	118	-107.8	0	0	106
3	D	25.3	Very low	26.3	Very low	142 Å²	142	164.2 Å²	164.2	76%	0.759	82%	0.819	S	S	*	*			trans	69.3	58.2	172.6	-54.6	-11.4	0	0	0	119
4	W	28.7	Very low	26.4	Very low	251 Å²	251	161 Å²	161	95%	0.951	81%	0.812	S	S	*	*			trans	-144.5	72.9	145.9	-71.1	107.7	0	0	0	111.1	I6	W4-I6 PolarHBondContact O-N 3.38Å
5	E	27.7	Very low	26.4	Very low	173 Å²	173	157.7 Å²	157.7	81%	0.808	81%	0.806	S	S	*	*			trans	-68.7	109.8	163.2	-73.2	-178.2	159.6	0	0	109.2	L7	E5-L7 PolarHBondContact O-N 2.97Å
6	I	24.8	Very low	26.1	Very low	149 Å²	149	156.2 Å²	156.2	76%	0.764	81%	0.812	S	S	*	*			trans	-69.3	106.5	155.9	-63.5	170.7	0	0	0	104.6	W4 D8	W4-I6 PolarHBondContact O-N 3.38Å; I6-D8 PolarHBondContact O-N 3Å
7	L	27.1	Very low	26.2	Very low	133 Å²	133	155.1 Å²	155.1	70%	0.696	81%	0.814	S	S	*	*			trans	-70.1	119	174.1	-74.3	172	0	0	0	109.1	E5	E5-L7 PolarHBondContact O-N 2.97Å
8	D	25.4	Very low	26.3	Very low	133 Å²	133	152.4 Å²	152.4	71%	0.711	81%	0.81	S	S	*	*			trans	-66.6	168.1	179.7	-71.8	-55.5	0	0	0	112.9	I6 D10	I6-D8 PolarHBondContact O-N 3Å; D8-D10 PolarHBondContact O-N 3.08Å; D8-D10 VanDerWaalsContact O-N 3.08Å
9	A	27	Very low	26.2	Very low	103 Å²	103	154.3 Å²	154.3	85%	0.851	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	11.7	-166	0	0	0	0	0	116.3
10	D	26.7	Very low	26.1	Very low	149 Å²	149	158.6 Å²	158.6	80%	0.797	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-2.7	-166.9	-75.9	-33.1	0	0	0	115.7	D8 F12	D8-D10 PolarHBondContact O-N 3.08Å; D8-D10 VanDerWaalsContact O-N 3.08Å; D10-F12 VanDerWaalsContact C-N 3.31Å; D10-F12 PolarHBondContact O-N 3.2Å
11	D	26.1	Very low	26.2	Very low	139 Å²	139	159.8 Å²	159.8	74%	0.743	82%	0.82	S	S	*	*			trans	-87.5	28	-172.5	-107.9	-7.4	0	0	0	115.5
12	F	27.3	Very low	26.1	Very low	192 Å²	192	155.5 Å²	155.5	84%	0.842	81%	0.806	S	S	*	*			trans	-129	75.2	173.1	-86.4	-81.8	0	0	0	113.4	D10	D10-F12 VanDerWaalsContact C-N 3.31Å; D10-F12 PolarHBondContact O-N 3.2Å
13	Q	23.8	Very low	25.9	Very low	194 Å²	194	158.8 Å²	158.8	91%	0.907	81%	0.812	S	S	*	*			trans	-85.4	111.3	156.7	-68.2	-171.5	6.9	0	0	110.3
14	V	28	Very low	26.1	Very low	120 Å²	120	162.1 Å²	162.1	73%	0.727	82%	0.82	S	S	*	*			trans	-120.6	131.6	165.3	-178.4	0	0	0	0	108.6
15	P	26.1	Very low	26.1	Very low	112 Å²	112	155.7 Å²	155.7	73%	0.727	81%	0.813	S	S	*	*			trans	-68.7	136.6	-174.8	-18.9	31.9	0	0	0	112.9	V17	P15-V17 PolarHBondContact O-N 3.34Å
16	C	21.6	Very low	25.9	Very low	133 Å²	133	155.8 Å²	155.8	90%	0.899	81%	0.813	S	S	*	*			trans	-59.9	121.7	171.3	-150.1	0	0	0	0	110.5
17	V	27.8	Very low	26	Very low	138 Å²	138	156.4 Å²	156.4	84%	0.836	82%	0.819	S	S	*	*			trans	-106.7	120.8	169.4	179.2	0	0	0	0	108.7	P15	P15-V17 PolarHBondContact O-N 3.34Å
18	S	28	Very low	26	Very low	107 Å²	107	155 Å²	155	75%	0.748	83%	0.826	S	S	*	*			trans	-76.4	153.6	-165.8	56.7	0	0	0	0	115.4	R20	S18-R20 PolarHBondContact O-N 3.43Å
19	E	23.4	Very low	26.1	Very low	187 Å²	187	152.2 Å²	152.2	87%	0.874	83%	0.828	S	S	*	*			trans	-48.6	123	170.7	-53.5	171.3	115.8	0	0	114.8
20	R	25.9	Very low	25.9	Very low	240 Å²	240	153.9 Å²	153.9	91%	0.906	83%	0.828	S	S	*	*			trans	174.1	136.7	151.4	-103	168.2	-171.9	-174.5	3.5	107.3	S18	S18-R20 PolarHBondContact O-N 3.43Å
21	E	27.3	Very low	26.1	Very low	185 Å²	185	154.1 Å²	154.1	86%	0.864	84%	0.835	S	S	*	*			cis	-140.3	163.4	23.2	-64.3	-176.8	124.4	0	0	112.8
22	T	23.7	Very low	26	Very low	127 Å²	127	154.9 Å²	154.9	78%	0.779	84%	0.84	S	S	*	*			trans	-107.6	155.3	172.1	49.1	0	0	0	0	112.1
23	R	23.2	Very low	26.1	Very low	228 Å²	228	156 Å²	156	86%	0.86	84%	0.838	S	S	*	*			trans	86.3	110.5	163.6	-55.8	174.4	168.3	179.8	-4.1	119.4
24	K	28.7	Very low	26.1	Very low	211 Å²	211	152.4 Å²	152.4	92%	0.917	84%	0.835	S	S	*	*				161.2	140.2	126.7	-85.5	154	-174	174.4	0	107.6
25	S	28.2	Very low	26	Very low	117 Å²	117	150.4 Å²	150.4	82%	0.818	84%	0.838	S	S	*	*			cis	-149.7	157.9	2.5	-175.4	0	0	0	0	110.2
26	Q	23.8	Very low	26	Very low	174 Å²	174	152.9 Å²	152.9	81%	0.813	84%	0.843	S	S	*	*			trans	-90.9	176.7	168.6	-72.4	176.9	-35.2	0	0	112
27	N	26.1	Very low	26.2	Very low	163 Å²	163	153.2 Å²	153.2	87%	0.872	84%	0.835	S	S	*	*			trans	80.8	136.8	179.7	-60.3	-15.4	0	0	0	115.2
28	A	28.2	Very low	26.2	Very low	103 Å²	103	153.5 Å²	153.5	85%	0.851	84%	0.837	S	S	*	*			cis	-152.2	170.2	-5.6	0	0	0	0	0	107.5
29	G	26.8	Very low	26.1	Very low	74 Å²	74	154 Å²	154	76%	0.763	83%	0.831	S	S	*	*			cis	179.1	177.4	16.8	0	0	0	0	0	110.5
30	T	24	Very low	26.4	Very low	139 Å²	139	154 Å²	154	85%	0.853	83%	0.828	S	S	*	*			trans	-93.4	141.5	-168.2	48.5	0	0	0	0	115.3
31	T	30.6	Very low	26.5	Very low	154 Å²	154	146.6 Å²	146.6	95%	0.945	83%	0.826	S	S	*	*			trans	-151	163.6	144.7	30	0	0	0	0	111.4
32	N	24.5	Very low	26.5	Very low	155 Å²	155	144 Å²	144	83%	0.829	82%	0.818	S	S	*	*			trans	-135.4	167.8	-157.7	-168.4	-1.8	0	0	0	111.6
33	R	27.5	Very low	27	Very low	214 Å²	214	142.7 Å²	142.7	81%	0.808	81%	0.812	S	S	*	*			trans	92.5	109.5	164.4	-68.6	-177	158.1	-179.1	-6.3	121.8
34	S	25.3	Very low	27.8	Very low	120 Å²	120	137.9 Å²	137.9	84%	0.839	80%	0.797	S	S	*	*				64.4	123	113.7	-50.1	0	0	0	0	121.7
35	G	25.5	Very low	28.4	Very low	77 Å²	77	131.7 Å²	131.7	79%	0.794	77%	0.771	S	S	*	*			trans	169.1	84.9	159.6	0	0	0	0	0	117.8
36	I	25.2	Very low	28.7	Very low	164 Å²	164	128.2 Å²	128.2	84%	0.841	74%	0.744	S	S	*	*			trans	7	124.3	145.7	-62.5	160.9	0	0	0	117.9
37	L	25.7	Very low	29.2	Very low	140 Å²	140	124.2 Å²	124.2	73%	0.733	73%	0.727	S	S	*	*				-163.7	123.7	112.4	-152.2	65.3	0	0	0	112.5	L39	L37-L39 HydrophobicContact CD2-CD1 3.68Å; L37-L39 HydrophobicContact CD2-CG 4.18Å; L37-L39 HydrophobicContact CG-CD1 4.2Å; L37-L39 HydrophobicContact CG-CG 4.18Å
38	V	29	Very low	29.9	Very low	144 Å²	144	121.3 Å²	121.3	87%	0.873	71%	0.711	S	S	*	*			trans	-99.1	109	168.2	174.7	0	0	0	0	107.8
39	L	25.4	Very low	30.4	Very low	118 Å²	118	119.5 Å²	119.5	62%	0.618	69%	0.692	S	S	*	*			trans	-145.2	122.2	171.9	-81.4	-177.8	0	0	0	112	L37	L37-L39 HydrophobicContact CD2-CD1 3.68Å; L37-L39 HydrophobicContact CD2-CG 4.18Å; L37-L39 HydrophobicContact CG-CD1 4.2Å; L37-L39 HydrophobicContact CG-CG 4.18Å
40	F	30.5	Very low	30.4	Very low	187 Å²	187	122.9 Å²	122.9	82%	0.82	69%	0.692	S	S	*	*			trans	60.7	118.7	166.7	-62.8	-71.5	0	0	0	118.7	L42	F40-L42 PolarHBondContact O-N 3.27Å
41	G	27.5	Very low	30.6	Very low	84 Å²	84	124.7 Å²	124.7	87%	0.866	69%	0.69	S	S	*	*			trans	-73.2	109.8	173.9	0	0	0	0	0	111.9
42	L	27.5	Very low	30.5	Very low	132 Å²	132	128.8 Å²	128.8	69%	0.691	69%	0.688	S	S	*	*			trans	-103.9	140.6	156.8	-68.9	170.9	0	0	0	108.1	F40 F44	F40-L42 PolarHBondContact O-N 3.27Å; L42-F44 PolarHBondContact O-N 3.23Å
43	P	34.9	Very low	30.6	Very low	99 Å²	99	126.4 Å²	126.4	64%	0.643	68%	0.684	S	S	*	*			trans	-62.7	137.4	172.9	26.2	-32.2	0	0	0	110.1	H45 D46	P43-H45 PolarHBondContact O-N 3.11Å; P43-D46 PolarHBondContact O-N 3.46Å
44	F	38.6	Very low	30.6	Very low	126 Å²	126	125.1 Å²	125.1	55%	0.553	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-58.9	-15.2	-166.2	-164.6	-100.2	0	0	0	115.2	L42 D46 L47	L42-F44 PolarHBondContact O-N 3.23Å; F44-D46 PolarHBondContact O-N 2.84Å; F44-D46 VanDerWaalsContact O-N 3.16Å; F44-L47 HydrophobicContact CD2-CB 4.23Å; F44-L47 HydrophobicContact CD2-CD1 4.37Å; F44-L47 HydrophobicContact CE2-CB 4.24Å; F44-L47 HydrophobicContact CE2-CD1 4.21Å; F44-L47 HydrophobicContact CE2-CD2 3.74Å; F44-L47 HydrophobicContact CE2-CG 4.27Å; F44-L47 HydrophobicContact CG-CB 4.39Å; F44-L47 HydrophobicContact CZ-CB 4.41Å; F44-L47 HydrophobicContact CZ-CD2 3.74Å; F44-L47 VanDerWaalsContact O-CB 3.22Å; F44-L47 WeakPolarHBondContact O-CB 3.46Å; F44-L47 PolarHBondContact O-N 2.96Å
45	H	41	Very low	30.5	Very low	82 Å²	82	127.2 Å²	127.2	38%	0.38	68%	0.684	S	S	.	*	G	3₁₀ helix	trans	-57.1	-24.8	173.2	179.2	-98.8	0	0	0	114.3	P43 L47 R703	P43-H45 PolarHBondContact O-N 3.11Å; H45-L47 VanDerWaalsContact C-N 3.34Å; H45-R703 VanDerWaalsContact CE1-CZ 3.41Å; H45-R703 PolarHBondContact CE1-NH1 3.48Å; H45-R703 PolarHBondContact CE1-NH2 3.01Å; H45-R703 PolarHBondContact NE2-NH1 3.26Å; H45-R703 PolarHBondContact NE2-NH2 3.26Å
46	D	35.4	Very low	30.7	Very low	44 Å²	44	129.9 Å²	129.9	24%	0.235	69%	0.687	C	S	.	*	G	3₁₀ helix	trans	-77.1	-16.7	172.5	-78.1	-14.9	0	0	0	112.8	P43 F44 L48 C49 R710	P43-D46 PolarHBondContact O-N 3.46Å; F44-D46 PolarHBondContact O-N 2.84Å; F44-D46 VanDerWaalsContact O-N 3.16Å; D46-L48 PolarHBondContact O-N 3.36Å; D46-C49 WeakPolarHBondContact O-CB 3.41Å; D46-C49 PolarHBondContact O-N 3.23Å; D46-R710 IonicContact OD1-NH1 3.11Å; D46-R710 PolarHBondContact OD1-NH1 3.42Å; D46-R710 IonicContact OD2-NH1 3.7Å; D46-R710 PolarHBondContact OD2-NH1 3.33Å
47	L	34.8	Very low	30.9	Very low	89 Å²	89	130.2 Å²	130.2	47%	0.466	69%	0.685	S	S	.	*	G	3₁₀ helix	trans	-72.8	-28	-179	-145.9	110.6	0	0	0	113	F44 H45 C49 L50	F44-L47 HydrophobicContact CD2-CB 4.23Å; F44-L47 HydrophobicContact CD2-CD1 4.37Å; F44-L47 HydrophobicContact CE2-CB 4.24Å; F44-L47 HydrophobicContact CE2-CD1 4.21Å; F44-L47 HydrophobicContact CE2-CD2 3.74Å; F44-L47 HydrophobicContact CE2-CG 4.27Å; F44-L47 HydrophobicContact CG-CB 4.39Å; F44-L47 HydrophobicContact CZ-CB 4.41Å; F44-L47 HydrophobicContact CZ-CD2 3.74Å; F44-L47 VanDerWaalsContact O-CB 3.22Å; F44-L47 WeakPolarHBondContact O-CB 3.46Å; F44-L47 PolarHBondContact O-N 2.96Å; H45-L47 VanDerWaalsContact C-N 3.34Å; L47-C49 PolarHBondContact O-N 3.26Å; L47-L50 PolarHBondContact O-N 2.95Å; L47-L50 VanDerWaalsContact O-N 3.1Å
48	L	39.4	Very low	31.1	Very low	103 Å²	103	130.9 Å²	130.9	54%	0.539	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-60.5	-8.8	170.6	-70.6	172.4	0	0	0	113.6	D46	D46-L48 PolarHBondContact O-N 3.36Å
49	C	38.3	Very low	31.8	Very low	65 Å²	65	129 Å²	129	44%	0.439	68%	0.677	S	S	.	*	G	3₁₀ helix	trans	-100	-0.1	177.5	-54.6	0	0	0	0	114	D46 L47	D46-C49 WeakPolarHBondContact O-CB 3.41Å; D46-C49 PolarHBondContact O-N 3.23Å; L47-C49 PolarHBondContact O-N 3.26Å
50	L	27.3	Very low	32.5	Very low	145 Å²	145	127.7 Å²	127.7	76%	0.759	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	-3.9	-167	-85.6	169.3	0	0	0	117.2	L47	L47-L50 PolarHBondContact O-N 2.95Å; L47-L50 VanDerWaalsContact O-N 3.1Å
51	E	28	Very low	33.1	Very low	176 Å²	176	126 Å²	126	82%	0.822	67%	0.67	S	S	*	*	S	Bend	trans	-100.2	110	170.7	-68.3	-153.2	152.6	0	0	112.9
52	R	29.2	Very low	34	Very low	240 Å²	240	123.9 Å²	123.9	91%	0.906	64%	0.644	S	S	*	*			trans	96.2	100.5	167.3	-70.9	-175.6	162.6	166.5	-2.4	119.9
53	S	26.6	Very low	35.7	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	64%	0.635	S	S	*	*				64	99.7	111.3	-171.4	0	0	0	0	118.5	Q55	S53-Q55 PolarHBondContact O-N 3.49Å
54	E	26.9	Very low	37.5	Very low	187 Å²	187	120.3 Å²	120.3	87%	0.874	62%	0.624	S	S	*	*			trans	16.5	90.4	141.2	-60.2	-176.7	164.5	0	0	117.2
55	Q	24.8	Very low	39.9	Very low	165 Å²	165	118.6 Å²	118.6	77%	0.771	62%	0.617	S	S	*	*				-165.5	137.1	125	-77.4	-128	2.2	0	0	109.6	S53 E57	S53-Q55 PolarHBondContact O-N 3.49Å; Q55-E57 PolarHBondContact O-N 3.09Å
56	P	29.4	Very low	42.3	Very low	133 Å²	133	123.1 Å²	123.1	86%	0.864	64%	0.635	S	S	*	*			trans	-87.4	83.3	177.4	34.5	-32.2	0	0	0	110.7
57	E	28.4	Very low	45.2	Very low	170 Å²	170	123.7 Å²	123.7	79%	0.794	64%	0.642	S	S	*	*			trans	-112	139.9	176.8	-133.8	175.6	-165.2	0	0	113.7	Q55	Q55-E57 PolarHBondContact O-N 3.09Å
58	L	31	Very low	48.1	Very low	155 Å²	155	119.5 Å²	119.5	81%	0.812	62%	0.62	S	S	*	*			trans	-73.9	120.1	-167.8	-116.6	67.8	0	0	0	113.1	P60	L58-P60 VanDerWaalsContact O-CD 3.28Å; L58-P60 WeakPolarHBondContact O-CD 3.26Å; L58-P60 WeakPolarHBondContact O-CG 3.47Å
59	V	42.4	Very low	50.8	Low	103 Å²	103	116 Å²	116	62%	0.624	60%	0.604	S	S	*	*			trans	31.2	75.3	150.1	-162.9	0	0	0	0	117.9	A62	V59-A62 HydrophobicContact CG1-CB 4.22Å
60	P	40.8	Very low	53.4	Low	92 Å²	92	117.1 Å²	117.1	60%	0.597	61%	0.605	S	S	*	*			trans	-107.5	-25.6	170.9	-1.1	23.6	0	0	0	115.3	L58	L58-P60 VanDerWaalsContact O-CD 3.28Å; L58-P60 WeakPolarHBondContact O-CD 3.26Å; L58-P60 WeakPolarHBondContact O-CG 3.47Å
61	E	42.2	Very low	56.6	Low	152 Å²	152	114.4 Å²	114.4	71%	0.71	60%	0.598	S	S	*	*	S	Bend	trans	-103.3	2	-168.9	-72	179.8	122.7	0	0	115.5	L63 Q95	E61-L63 VanDerWaalsContact C-N 3.32Å; E61-Q95 PolarHBondContact O-NE2 3.35Å
62	A	47.8	Very low	59.7	Low	38 Å²	38	108.5 Å²	108.5	31%	0.314	57%	0.571	S	S	.	*	S	Bend	trans	-84.6	-0.5	174.6	0	0	0	0	0	114.1	V59	V59-A62 HydrophobicContact CG1-CB 4.22Å
63	L	61.6	Low	62.9	Low	97 Å²	97	97.8 Å²	97.8	51%	0.508	53%	0.531	S	S	.	.	S	Bend	trans	-82.7	144.7	-173.5	-71.3	169.2	0	0	0	112.9	E61 K65	E61-L63 VanDerWaalsContact C-N 3.32Å; L63-K65 PolarHBondContact O-N 2.99Å
64	S	72.9	Confident	66	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	52%	0.519	S	S	.	.			trans	-55.5	110.4	-177.1	-173.6	0	0	0	0	111.9	Q95	S64-Q95 CarbonylContact C-O 3.58Å; S64-Q95 WeakPolarHBondContact CA-O 3.31Å
65	K	89	Confident	69.2	Low	91 Å²	91	97.4 Å²	97.4	40%	0.396	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-76.9	169.3	169.7	-71.1	-173.7	-178.9	168.6	0	110.4	L63 Q95 G96	L63-K65 PolarHBondContact O-N 2.99Å; K65-Q95 HydrophobicContact CB-CB 4.18Å; K65-Q95 HydrophobicContact CD-CB 4.09Å; K65-Q95 VanDerWaalsContact CD-OE1 3.32Å; K65-Q95 HydrophobicContact CG-CB 4.12Å; K65-Q95 PolarHBondContact N-O 2.96Å; K65-G96 WeakPolarHBondContact O-CA 3.48Å
66	K	92.7	Very high	72.5	Confident	176 Å²	176	90.8 Å²	90.8	77%	0.765	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-63.8	158.9	164.7	-68.1	-177.9	-179.7	178.3	0	109.8	R92	K66-R92 PolarHBondContact O-NH1 2.91Å; K66-R92 PolarHBondContact O-NH2 3.21Å
67	P	95.6	Very high	75.5	Confident	57 Å²	57	86.1 Å²	86.1	37%	0.37	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-51	145.5	170.2	-26.2	35.8	0	0	0	111.7	S69 R92 G96 E99	P67-S69 PolarHBondContact O-N 3.02Å; P67-R92 PolarHBondContact O-NH2 3.34Å; P67-G96 WeakPolarHBondContact CA-O 3.48Å; P67-E99 HydrophobicContact CB-CG 4.02Å
68	L	96.1	Very high	78.6	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-63.8	119.8	174.6	175.5	60.4	0	0	0	109	E72 F73 F76 F89 R92 V93 G97 E99 L102	L68-E72 HydrophobicContact CD1-CB 3.8Å; L68-E72 HydrophobicContact CD1-CG 3.59Å; L68-F73 HydrophobicContact CD2-CD2 4.23Å; L68-F73 HydrophobicContact CG-CB 4.42Å; L68-F76 HydrophobicContact CD1-CE2 4.07Å; L68-F89 HydrophobicContact CD2-CD2 3.93Å; L68-F89 HydrophobicContact CD2-CE2 3.71Å; L68-R92 HydrophobicContact CD1-CG 3.88Å; L68-V93 HydrophobicContact CD2-CG2 3.89Å; L68-G97 WeakPolarHBondContact CB-O 3.27Å; L68-G97 PolarHBondContact N-O 3.16Å; L68-E99 WeakPolarHBondContact O-CG 3.39Å; L68-E99 PolarHBondContact O-N 3.17Å; L68-L102 HydrophobicContact CB-CD2 4.24Å; L68-L102 HydrophobicContact CD2-CD2 3.87Å; L68-L102 HydrophobicContact CG-CD2 3.7Å
69	S	96.3	Very high	81.5	Confident	30 Å²	30	81.3 Å²	81.3	21%	0.21	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-83.6	161.4	179.6	71	0	0	0	0	112.2	P67 S71 E72 F73 E99	P67-S69 PolarHBondContact O-N 3.02Å; S69-S71 VanDerWaalsContact C-N 3.28Å; S69-S71 PolarHBondContact O-N 2.76Å; S69-E72 PolarHBondContact O-N 2.9Å; S69-E72 VanDerWaalsContact OG-CB 3.32Å; S69-E72 WeakPolarHBondContact OG-CB 3.42Å; S69-E72 PolarHBondContact OG-N 3.14Å; S69-F73 WeakPolarHBondContact O-CB 3.28Å; S69-F73 PolarHBondContact O-N 3.26Å; S69-E99 VanDerWaalsContact CA-CD 3.47Å; S69-E99 WeakPolarHBondContact CA-OE2 3.49Å; S69-E99 WeakPolarHBondContact CB-OE1 3.44Å
70	L	92.5	Very high	83.9	Confident	88 Å²	88	81.2 Å²	81.2	46%	0.461	42%	0.423	S	S	.	.	H	α-helix	trans	-61.4	-37.1	175.2	-175.6	63.7	0	0	0	112.3	F73 R74 L102	L70-F73 PolarHBondContact O-N 3.05Å; L70-R74 PolarHBondContact O-N 3.48Å; L70-L102 HydrophobicContact CD1-CD1 4.08Å
71	S	93.3	Very high	86.2	Confident	89 Å²	89	77.2 Å²	77.2	62%	0.622	40%	0.398	S	S	*	.	H	α-helix	trans	-66.8	-45.5	178.2	-51.4	0	0	0	0	111.8	S69 F73 R74	S69-S71 VanDerWaalsContact C-N 3.28Å; S69-S71 PolarHBondContact O-N 2.76Å; S71-F73 VanDerWaalsContact C-N 3.32Å; S71-F73 PolarHBondContact O-N 3.01Å; S71-R74 WeakPolarHBondContact O-CB 3.47Å; S71-R74 PolarHBondContact O-N 3.19Å
72	E	94.9	Very high	88.7	Confident	52 Å²	52	74.8 Å²	74.8	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-68.7	-31	176.7	-174.7	-177.7	-165.5	0	0	111.6	L68 S69 R74 E75 F76 R92	L68-E72 HydrophobicContact CD1-CB 3.8Å; L68-E72 HydrophobicContact CD1-CG 3.59Å; S69-E72 PolarHBondContact O-N 2.9Å; S69-E72 VanDerWaalsContact OG-CB 3.32Å; S69-E72 WeakPolarHBondContact OG-CB 3.42Å; S69-E72 PolarHBondContact OG-N 3.14Å; E72-R74 PolarHBondContact O-N 2.89Å; E72-E75 WeakPolarHBondContact O-CB 3.33Å; E72-E75 PolarHBondContact O-N 3.21Å; E72-F76 HydrophobicContact CG-CE2 4.41Å; E72-F76 VanDerWaalsContact O-CD2 3.31Å; E72-F76 WeakPolarHBondContact O-CD2 3.28Å; E72-F76 WeakPolarHBondContact O-CE2 3.43Å; E72-R92 VanDerWaalsContact CD-NE 3.34Å; E72-R92 IonicContact OE1-CZ 3.99Å; E72-R92 IonicContact OE1-NE 2.86Å; E72-R92 PolarHBondContact OE1-NE 2.9Å; E72-R92 IonicContact OE1-NH2 2.66Å; E72-R92 PolarHBondContact OE1-NH2 3.43Å; E72-R92 IonicContact OE2-CZ 3.84Å; E72-R92 IonicContact OE2-NE 3.13Å; E72-R92 PolarHBondContact OE2-NE 3.5Å; E72-R92 IonicContact OE2-NH2 3.94Å; E72-R92 PolarHBondContact OE2-NH2 3.1Å
73	F	95	Very high	90.7	Very high	15 Å²	15	74.7 Å²	74.7	7%	0.066	38%	0.377	C	S	.	.	H	α-helix	trans	-61.4	-31.4	173.5	177.4	-105.9	0	0	0	112.9	L68 S69 L70 S71 E75 F76 V77 F89 L102 T105 M109	L68-F73 HydrophobicContact CD2-CD2 4.23Å; L68-F73 HydrophobicContact CG-CB 4.42Å; S69-F73 WeakPolarHBondContact O-CB 3.28Å; S69-F73 PolarHBondContact O-N 3.26Å; L70-F73 PolarHBondContact O-N 3.05Å; S71-F73 VanDerWaalsContact C-N 3.32Å; S71-F73 PolarHBondContact O-N 3.01Å; F73-E75 PolarHBondContact O-N 2.71Å; F73-F76 PolarHBondContact O-N 2.98Å; F73-F76 VanDerWaalsContact O-N 3.11Å; F73-V77 HydrophobicContact CE1-CG1 4.31Å; F73-V77 HydrophobicContact CZ-CG1 4.13Å; F73-F89 HydrophobicContact CD2-CD2 4.02Å; F73-F89 AromaticContact CD2-CE2 3.71Å; F73-F89 HydrophobicContact CD2-CE2 3.71Å; F73-F89 AromaticContact CE2-CD2 3.97Å; F73-F89 HydrophobicContact CE2-CD2 3.97Å; F73-F89 AromaticContact CE2-CE2 3.57Å; F73-F89 HydrophobicContact CE2-CE2 3.57Å; F73-F89 HydrophobicContact CE2-CZ 4.22Å; F73-L102 HydrophobicContact CB-CD1 3.97Å; F73-L102 HydrophobicContact CB-CD2 3.88Å; F73-L102 HydrophobicContact CD1-CD1 3.7Å; F73-L102 HydrophobicContact CD2-CD1 4.13Å; F73-L102 HydrophobicContact CD2-CD2 4.3Å; F73-L102 HydrophobicContact CE1-CD1 4.23Å; F73-L102 HydrophobicContact CG-CD1 3.64Å; F73-L102 HydrophobicContact CG-CD2 4.15Å; F73-T105 HydrophobicContact CE1-CG2 4.19Å; F73-T105 HydrophobicContact CZ-CG2 4.33Å; F73-M109 HydrophobicContact CE2-SD 4.25Å; F73-M109 HydrophobicContact CZ-CE 4Å; F73-M109 HydrophobicContact CZ-SD 3.97Å
74	R	93	Very high	92	Very high	127 Å²	127	74.7 Å²	74.7	48%	0.479	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-61.7	-26.8	176.8	-67.7	171.6	174.8	-147.8	-13.6	112.7	L70 S71 E72 F76 V77 D500	L70-R74 PolarHBondContact O-N 3.48Å; S71-R74 WeakPolarHBondContact O-CB 3.47Å; S71-R74 PolarHBondContact O-N 3.19Å; E72-R74 PolarHBondContact O-N 2.89Å; R74-F76 PolarHBondContact O-N 3.01Å; R74-V77 WeakPolarHBondContact O-CG2 3.16Å; R74-V77 PolarHBondContact O-N 3.42Å; R74-D500 IonicContact CZ-OD1 2.71Å; R74-D500 IonicContact CZ-OD2 3.98Å; R74-D500 IonicContact NH1-OD2 3.69Å; R74-D500 PolarHBondContact NH1-OD2 2.84Å; R74-D500 IonicContact NH2-OD1 3.18Å; R74-D500 PolarHBondContact NH2-OD1 3.29Å; R74-D500 VanDerWaalsContact NH2-OD1 3.1Å; R74-D500 IonicContact NH2-OD2 3.83Å; R74-D500 PolarHBondContact NH2-OD2 2.89Å
75	E	94	Very high	92.7	Very high	157 Å²	157	73.7 Å²	73.7	73%	0.734	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-70.4	-15.9	178	-57.7	176.7	-162.5	0	0	113.2	E72 F73	E72-E75 WeakPolarHBondContact O-CB 3.33Å; E72-E75 PolarHBondContact O-N 3.21Å; F73-E75 PolarHBondContact O-N 2.71Å
76	F	93.9	Very high	92.8	Very high	26 Å²	26	72 Å²	72	11%	0.114	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-94.6	-6.2	178.5	-62.3	-84.8	0	0	0	113.6	L68 E72 F73 R74 L83 V84 H88 F89 R92	L68-F76 HydrophobicContact CD1-CE2 4.07Å; E72-F76 HydrophobicContact CG-CE2 4.41Å; E72-F76 VanDerWaalsContact O-CD2 3.31Å; E72-F76 WeakPolarHBondContact O-CD2 3.28Å; E72-F76 WeakPolarHBondContact O-CE2 3.43Å; F73-F76 PolarHBondContact O-N 2.98Å; F73-F76 VanDerWaalsContact O-N 3.11Å; R74-F76 PolarHBondContact O-N 3.01Å; F76-L83 HydrophobicContact CB-CD1 4.01Å; F76-V84 PolarHBondContact O-N 3.27Å; F76-H88 HydrophobicContact CD1-CB 4.39Å; F76-H88 HydrophobicContact CE1-CB 3.89Å; F76-F89 HydrophobicContact CB-CB 4.31Å; F76-F89 HydrophobicContact CD1-CB 3.78Å; F76-F89 HydrophobicContact CE1-CB 4.36Å; F76-F89 HydrophobicContact CG-CB 4.07Å; F76-R92 HydrophobicContact CE1-CB 4.44Å; F76-R92 HydrophobicContact CE2-CB 4.46Å; F76-R92 HydrophobicContact CE2-CG 4.24Å; F76-R92 HydrophobicContact CZ-CB 3.8Å; F76-R92 HydrophobicContact CZ-CG 3.95Å
77	V	92.8	Very high	92.6	Very high	35 Å²	35	67.7 Å²	67.7	21%	0.212	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-117.1	148.2	-178.9	-67.1	0	0	0	0	112	F73 R74 R82 L83	F73-V77 HydrophobicContact CE1-CG1 4.31Å; F73-V77 HydrophobicContact CZ-CG1 4.13Å; R74-V77 WeakPolarHBondContact O-CG2 3.16Å; R74-V77 PolarHBondContact O-N 3.42Å; V77-R82 CarbonylContact C-O 3.36Å; V77-R82 WeakPolarHBondContact CA-O 3.36Å; V77-L83 HydrophobicContact CG1-CD1 4.19Å
78	D	93.5	Very high	92.4	Very high	51 Å²	51	70.1 Å²	70.1	27%	0.273	36%	0.361	S	S	.	.			trans	-81.4	178.6	172.5	61.4	25.7	0	0	0	112	E80 G81 R82 V84	D78-E80 PolarHBondContact O-N 2.98Å; D78-E80 VanDerWaalsContact O-N 3.15Å; D78-E80 PolarHBondContact OD1-N 3.5Å; D78-E80 VanDerWaalsContact OD1-N 3.11Å; D78-G81 WeakPolarHBondContact O-CA 3.22Å; D78-G81 PolarHBondContact O-N 2.87Å; D78-G81 PolarHBondContact OD1-N 3.43Å; D78-R82 PolarHBondContact N-O 3.34Å; D78-R82 WeakPolarHBondContact OD1-CG 3.43Å; D78-R82 PolarHBondContact OD1-N 3.48Å; D78-R82 VanDerWaalsContact OD2-CB 3.27Å; D78-R82 WeakPolarHBondContact OD2-CB 3.46Å; D78-R82 VanDerWaalsContact OD2-CD 3.27Å; D78-R82 WeakPolarHBondContact OD2-CD 3.42Å; D78-R82 WeakPolarHBondContact OD2-CG 3.34Å; D78-R82 IonicContact OD2-NE 3.13Å; D78-V84 HydrophobicContact CB-CG2 3.7Å
79	D	91.5	Very high	92.3	Very high	172 Å²	172	70.2 Å²	70.2	92%	0.92	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.3	-179.6	-61.1	-35.5	0	0	0	113.1
80	E	91.9	Very high	92.3	Very high	101 Å²	101	69.5 Å²	69.5	47%	0.472	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-5.2	171.7	-60.2	99.3	-159.4	0	0	113.3	D78 R82 N119 T120	D78-E80 PolarHBondContact O-N 2.98Å; D78-E80 VanDerWaalsContact O-N 3.15Å; D78-E80 PolarHBondContact OD1-N 3.5Å; D78-E80 VanDerWaalsContact OD1-N 3.11Å; E80-R82 HydrophobicContact CB-CG 4.46Å; E80-R82 IonicContact OE2-CZ 2.74Å; E80-R82 IonicContact OE2-NE 3.87Å; E80-R82 PolarHBondContact OE2-NE 3.35Å; E80-R82 VanDerWaalsContact OE2-NE 3.11Å; E80-R82 IonicContact OE2-NH2 2.71Å; E80-R82 PolarHBondContact OE2-NH2 2.99Å; E80-N119 HydrophobicContact CB-CB 4.08Å; E80-N119 WeakPolarHBondContact O-CB 3.49Å; E80-T120 PolarHBondContact O-N 3.27Å
81	G	90.2	Very high	92.3	Very high	8 Å²	8	69.4 Å²	69.4	8%	0.082	35%	0.354	C	S	.	.			trans	85.7	13.1	179.1	0	0	0	0	0	115.4	D78 T120 R123	D78-G81 WeakPolarHBondContact O-CA 3.22Å; D78-G81 PolarHBondContact O-N 2.87Å; D78-G81 PolarHBondContact OD1-N 3.43Å; G81-T120 WeakPolarHBondContact CA-OG1 3.45Å; G81-R123 PolarHBondContact O-NH1 2.94Å; G81-R123 PolarHBondContact O-NH2 3.12Å
82	R	93.2	Very high	92.4	Very high	101 Å²	101	65.8 Å²	65.8	38%	0.381	33%	0.326	S	S	.	.			trans	-71.6	148.5	172.9	-40.4	171.1	-145.9	-143.8	4.2	108.9	V77 D78 E80 V84 N119	V77-R82 CarbonylContact C-O 3.36Å; V77-R82 WeakPolarHBondContact CA-O 3.36Å; D78-R82 PolarHBondContact N-O 3.34Å; D78-R82 WeakPolarHBondContact OD1-CG 3.43Å; D78-R82 PolarHBondContact OD1-N 3.48Å; D78-R82 VanDerWaalsContact OD2-CB 3.27Å; D78-R82 WeakPolarHBondContact OD2-CB 3.46Å; D78-R82 VanDerWaalsContact OD2-CD 3.27Å; D78-R82 WeakPolarHBondContact OD2-CD 3.42Å; D78-R82 WeakPolarHBondContact OD2-CG 3.34Å; D78-R82 IonicContact OD2-NE 3.13Å; E80-R82 HydrophobicContact CB-CG 4.46Å; E80-R82 IonicContact OE2-CZ 2.74Å; E80-R82 IonicContact OE2-NE 3.87Å; E80-R82 PolarHBondContact OE2-NE 3.35Å; E80-R82 VanDerWaalsContact OE2-NE 3.11Å; E80-R82 IonicContact OE2-NH2 2.71Å; E80-R82 PolarHBondContact OE2-NH2 2.99Å; R82-V84 PolarHBondContact O-N 3.28Å; R82-N119 HydrophobicContact CG-CB 3.8Å
83	L	91.5	Very high	92.5	Very high	36 Å²	36	63.3 Å²	63.3	19%	0.188	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-83.3	104.6	-177.1	-168.3	68.5	0	0	0	109.5	F76 V77 P86 F89 M109	F76-L83 HydrophobicContact CB-CD1 4.01Å; V77-L83 HydrophobicContact CG1-CD1 4.19Å; L83-P86 HydrophobicContact CB-CG 4.49Å; L83-P86 HydrophobicContact CD2-CB 3.85Å; L83-P86 HydrophobicContact CD2-CG 3.99Å; L83-P86 HydrophobicContact CG-CB 4.42Å; L83-P86 HydrophobicContact CG-CG 4.14Å; L83-F89 HydrophobicContact CD1-CB 4.14Å; L83-F89 HydrophobicContact CD1-CD1 4.4Å; L83-F89 HydrophobicContact CD1-CG 4.11Å; L83-F89 HydrophobicContact CD2-CD1 3.94Å; L83-F89 HydrophobicContact CD2-CG 4.39Å; L83-M109 HydrophobicContact CD1-SD 4.48Å; L83-M109 HydrophobicContact CD2-SD 4.43Å
84	V	88.8	Confident	92.5	Very high	98 Å²	98	64.1 Å²	64.1	59%	0.594	32%	0.317	S	S	*	.	S	Bend	trans	-71.8	-38	-170.8	-178.9	0	0	0	0	112	F76 D78 R82	F76-V84 PolarHBondContact O-N 3.27Å; D78-V84 HydrophobicContact CB-CG2 3.7Å; R82-V84 PolarHBondContact O-N 3.28Å
85	S	87.2	Confident	92.6	Very high	38 Å²	38	58.8 Å²	58.8	27%	0.266	30%	0.298	S	S	.	.			trans	-133.6	83.3	176.8	-156.4	0	0	0	0	112	E87 H88 F89	S85-E87 VanDerWaalsContact C-N 3.25Å; S85-E87 PolarHBondContact O-N 2.99Å; S85-H88 PolarHBondContact O-N 3.31Å; S85-H88 PolarHBondContact OG-ND1 3.38Å; S85-F89 PolarHBondContact O-N 3.26Å
86	P	90.3	Very high	92.5	Very high	56 Å²	56	51.6 Å²	51.6	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-57.9	-35.8	-179.9	-25	34.6	0	0	0	113.5	L83 R90	L83-P86 HydrophobicContact CB-CG 4.49Å; L83-P86 HydrophobicContact CD2-CB 3.85Å; L83-P86 HydrophobicContact CD2-CG 3.99Å; L83-P86 HydrophobicContact CG-CB 4.42Å; L83-P86 HydrophobicContact CG-CG 4.14Å; P86-R90 WeakPolarHBondContact O-CB 3.42Å; P86-R90 WeakPolarHBondContact O-CG 3.41Å; P86-R90 PolarHBondContact O-N 3.27Å
87	E	89.2	Confident	92.7	Very high	85 Å²	85	50.4 Å²	50.4	40%	0.397	26%	0.261	S	S	.	.	H	α-helix	trans	-67.5	-46.2	178.8	-62	-175.3	163.5	0	0	112	S85 R90 L91	S85-E87 VanDerWaalsContact C-N 3.25Å; S85-E87 PolarHBondContact O-N 2.99Å; E87-R90 PolarHBondContact O-N 3.32Å; E87-L91 WeakPolarHBondContact O-CB 3.41Å; E87-L91 PolarHBondContact O-N 3.06Å
88	H	92	Very high	92.8	Very high	107 Å²	107	48.9 Å²	48.9	50%	0.495	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-35.6	177.3	-69.6	83.8	0	0	0	111.7	F76 S85 L91 R92	F76-H88 HydrophobicContact CD1-CB 4.39Å; F76-H88 HydrophobicContact CE1-CB 3.89Å; S85-H88 PolarHBondContact O-N 3.31Å; S85-H88 PolarHBondContact OG-ND1 3.38Å; H88-L91 PolarHBondContact O-N 2.94Å; H88-R92 VanDerWaalsContact O-CB 3.29Å; H88-R92 WeakPolarHBondContact O-CB 3.4Å; H88-R92 PolarHBondContact O-N 2.84Å
89	F	94.2	Very high	93	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	26%	0.257	C	S	.	.	H	α-helix	trans	-59.3	-50.5	171.1	165	-107.4	0	0	0	111.1	L68 F73 F76 L83 S85 R92 V93 A106 M109 L110	L68-F89 HydrophobicContact CD2-CD2 3.93Å; L68-F89 HydrophobicContact CD2-CE2 3.71Å; F73-F89 HydrophobicContact CD2-CD2 4.02Å; F73-F89 AromaticContact CD2-CE2 3.71Å; F73-F89 HydrophobicContact CD2-CE2 3.71Å; F73-F89 AromaticContact CE2-CD2 3.97Å; F73-F89 HydrophobicContact CE2-CD2 3.97Å; F73-F89 AromaticContact CE2-CE2 3.57Å; F73-F89 HydrophobicContact CE2-CE2 3.57Å; F73-F89 HydrophobicContact CE2-CZ 4.22Å; F76-F89 HydrophobicContact CB-CB 4.31Å; F76-F89 HydrophobicContact CD1-CB 3.78Å; F76-F89 HydrophobicContact CE1-CB 4.36Å; F76-F89 HydrophobicContact CG-CB 4.07Å; L83-F89 HydrophobicContact CD1-CB 4.14Å; L83-F89 HydrophobicContact CD1-CD1 4.4Å; L83-F89 HydrophobicContact CD1-CG 4.11Å; L83-F89 HydrophobicContact CD2-CD1 3.94Å; L83-F89 HydrophobicContact CD2-CG 4.39Å; S85-F89 PolarHBondContact O-N 3.26Å; F89-R92 PolarHBondContact O-N 3.09Å; F89-V93 HydrophobicContact CD2-CG2 4.26Å; F89-V93 HydrophobicContact CE2-CG2 3.79Å; F89-V93 HydrophobicContact CZ-CG2 3.97Å; F89-V93 WeakPolarHBondContact O-CG2 3.49Å; F89-V93 PolarHBondContact O-N 2.73Å; F89-A106 HydrophobicContact CE2-CB 4.47Å; F89-A106 HydrophobicContact CZ-CB 3.99Å; F89-M109 HydrophobicContact CE1-CB 4.07Å; F89-L110 HydrophobicContact CE1-CD2 3.77Å; F89-L110 HydrophobicContact CE1-CG 4.09Å; F89-L110 HydrophobicContact CZ-CD2 4.23Å; F89-L110 HydrophobicContact CZ-CG 4.26Å
90	R	95	Very high	93.2	Very high	15 Å²	15	49.6 Å²	49.6	6%	0.057	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-48.2	175.4	-79.1	-180	175.7	-114.2	-4	111.5	P86 E87 R92 V93 Y94 M109 L110 D112 W305 A306 L308	P86-R90 WeakPolarHBondContact O-CB 3.42Å; P86-R90 WeakPolarHBondContact O-CG 3.41Å; P86-R90 PolarHBondContact O-N 3.27Å; E87-R90 PolarHBondContact O-N 3.32Å; R90-R92 VanDerWaalsContact C-N 3.26Å; R90-R92 PolarHBondContact O-N 3.2Å; R90-V93 PolarHBondContact O-N 3.05Å; R90-Y94 WeakPolarHBondContact O-CB 3.44Å; R90-Y94 PolarHBondContact O-N 3.39Å; R90-M109 PolarHBondContact NH2-O 3.3Å; R90-L110 HydrophobicContact CG-CD2 4.13Å; R90-L110 PolarHBondContact NH2-O 3.25Å; R90-D112 IonicContact CZ-OD1 3.33Å; R90-D112 IonicContact CZ-OD2 3.44Å; R90-D112 IonicContact NH1-OD2 2.69Å; R90-D112 IonicContact NH2-OD1 3.97Å; R90-D112 PolarHBondContact NH2-OD1 3.33Å; R90-D112 IonicContact NH2-OD2 3.79Å; R90-D112 PolarHBondContact NH2-OD2 2.69Å; R90-W305 PolarHBondContact NH1-O 2.97Å; R90-A306 WeakPolarHBondContact O-CB 3.26Å; R90-L308 PolarHBondContact NH1-O 3.06Å
91	L	93.5	Very high	93.3	Very high	87 Å²	87	55.8 Å²	55.8	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-56.6	-40.4	175.8	179.6	60.3	0	0	0	112.1	E87 H88 Y94 Q95	E87-L91 WeakPolarHBondContact O-CB 3.41Å; E87-L91 PolarHBondContact O-N 3.06Å; H88-L91 PolarHBondContact O-N 2.94Å; L91-Y94 HydrophobicContact CD1-CD1 4.37Å; L91-Y94 WeakPolarHBondContact O-CB 3.38Å; L91-Y94 PolarHBondContact O-N 3.3Å; L91-Q95 WeakPolarHBondContact O-CG 3.32Å; L91-Q95 PolarHBondContact O-N 2.95Å
92	R	94.8	Very high	93.6	Very high	13 Å²	13	55.5 Å²	55.5	5%	0.049	26%	0.261	C	S	.	.	H	α-helix	trans	-70	-37	179.9	-179.7	55.5	-171.9	88.1	5.2	113.1	K66 P67 L68 E72 F76 H88 F89 R90 Q95	K66-R92 PolarHBondContact O-NH1 2.91Å; K66-R92 PolarHBondContact O-NH2 3.21Å; P67-R92 PolarHBondContact O-NH2 3.34Å; L68-R92 HydrophobicContact CD1-CG 3.88Å; E72-R92 VanDerWaalsContact CD-NE 3.34Å; E72-R92 IonicContact OE1-CZ 3.99Å; E72-R92 IonicContact OE1-NE 2.86Å; E72-R92 PolarHBondContact OE1-NE 2.9Å; E72-R92 IonicContact OE1-NH2 2.66Å; E72-R92 PolarHBondContact OE1-NH2 3.43Å; E72-R92 IonicContact OE2-CZ 3.84Å; E72-R92 IonicContact OE2-NE 3.13Å; E72-R92 PolarHBondContact OE2-NE 3.5Å; E72-R92 IonicContact OE2-NH2 3.94Å; E72-R92 PolarHBondContact OE2-NH2 3.1Å; F76-R92 HydrophobicContact CE1-CB 4.44Å; F76-R92 HydrophobicContact CE2-CB 4.46Å; F76-R92 HydrophobicContact CE2-CG 4.24Å; F76-R92 HydrophobicContact CZ-CB 3.8Å; F76-R92 HydrophobicContact CZ-CG 3.95Å; H88-R92 VanDerWaalsContact O-CB 3.29Å; H88-R92 WeakPolarHBondContact O-CB 3.4Å; H88-R92 PolarHBondContact O-N 2.84Å; F89-R92 PolarHBondContact O-N 3.09Å; R90-R92 VanDerWaalsContact C-N 3.26Å; R90-R92 PolarHBondContact O-N 3.2Å; R92-Q95 PolarHBondContact O-N 3.13Å
93	V	96.4	Very high	93.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.1	-44.3	169.9	177	0	0	0	0	110.4	L68 F89 R90 Q95 G96 G97 L110 E302 A306	L68-V93 HydrophobicContact CD2-CG2 3.89Å; F89-V93 HydrophobicContact CD2-CG2 4.26Å; F89-V93 HydrophobicContact CE2-CG2 3.79Å; F89-V93 HydrophobicContact CZ-CG2 3.97Å; F89-V93 WeakPolarHBondContact O-CG2 3.49Å; F89-V93 PolarHBondContact O-N 2.73Å; R90-V93 PolarHBondContact O-N 3.05Å; V93-Q95 PolarHBondContact O-N 3.22Å; V93-G96 PolarHBondContact O-N 2.76Å; V93-G96 VanDerWaalsContact O-N 3.09Å; V93-G97 WeakPolarHBondContact O-CA 3.41Å; V93-G97 PolarHBondContact O-N 2.9Å; V93-L110 HydrophobicContact CB-CD2 4.35Å; V93-L110 HydrophobicContact CG1-CD1 3.89Å; V93-L110 HydrophobicContact CG1-CD2 4.28Å; V93-L110 HydrophobicContact CG2-CD2 4.36Å; V93-E302 HydrophobicContact CG1-CB 4.15Å; V93-A306 HydrophobicContact CB-CB 3.84Å; V93-A306 HydrophobicContact CG1-CB 3.73Å
94	Y	95.9	Very high	94	Very high	31 Å²	31	51.1 Å²	51.1	12%	0.122	25%	0.247	C	C	.	.	H	α-helix	trans	-56.6	-34.8	175.4	175.9	-101.3	0	0	0	112.5	R90 L91 V303 F649 R696 Y699	R90-Y94 WeakPolarHBondContact O-CB 3.44Å; R90-Y94 PolarHBondContact O-N 3.39Å; L91-Y94 HydrophobicContact CD1-CD1 4.37Å; L91-Y94 WeakPolarHBondContact O-CB 3.38Å; L91-Y94 PolarHBondContact O-N 3.3Å; Y94-V303 HydrophobicContact CD2-CG1 3.71Å; Y94-V303 HydrophobicContact CE2-CG1 4.08Å; Y94-V303 HydrophobicContact CG-CG1 4.45Å; Y94-V303 WeakPolarHBondContact O-CG1 3.45Å; Y94-F649 HydrophobicContact CE2-CD1 4.01Å; Y94-F649 AromaticContact CE2-CD2 3.94Å; Y94-F649 HydrophobicContact CE2-CD2 3.94Å; Y94-F649 AromaticContact CE2-CE1 3.84Å; Y94-F649 HydrophobicContact CE2-CE1 3.84Å; Y94-F649 AromaticContact CE2-CE2 3.77Å; Y94-F649 HydrophobicContact CE2-CE2 3.77Å; Y94-F649 HydrophobicContact CE2-CG 4.06Å; Y94-F649 AromaticContact CE2-CZ 3.72Å; Y94-F649 HydrophobicContact CE2-CZ 3.72Å; Y94-F649 AromaticContact CZ-CE2 3.85Å; Y94-F649 WeakPolarHBondContact OH-CD2 3.39Å; Y94-F649 WeakPolarHBondContact OH-CE2 3.42Å; Y94-R696 HydrophobicContact CE1-CG 4.03Å; Y94-R696 VanDerWaalsContact O-CZ 3.3Å; Y94-R696 PolarHBondContact O-NE 2.88Å; Y94-R696 PolarHBondContact O-NH2 2.92Å; Y94-Y699 WeakPolarHBondContact OH-CD1 3.43Å
95	Q	94.3	Very high	94.3	Very high	16 Å²	16	48.6 Å²	48.6	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-71.7	-25.1	177.5	-78.2	172.2	-22.7	0	0	114.7	E61 S64 K65 L91 R92 V93	E61-Q95 PolarHBondContact O-NE2 3.35Å; S64-Q95 CarbonylContact C-O 3.58Å; S64-Q95 WeakPolarHBondContact CA-O 3.31Å; K65-Q95 HydrophobicContact CB-CB 4.18Å; K65-Q95 HydrophobicContact CD-CB 4.09Å; K65-Q95 VanDerWaalsContact CD-OE1 3.32Å; K65-Q95 HydrophobicContact CG-CB 4.12Å; K65-Q95 PolarHBondContact N-O 2.96Å; L91-Q95 WeakPolarHBondContact O-CG 3.32Å; L91-Q95 PolarHBondContact O-N 2.95Å; R92-Q95 PolarHBondContact O-N 3.13Å; V93-Q95 PolarHBondContact O-N 3.22Å
96	G	93.2	Very high	94.8	Very high	6 Å²	6	46.8 Å²	46.8	6%	0.062	22%	0.219	C	C	.	.	H	α-helix	trans	-156.1	-2.9	-170.6	0	0	0	0	0	118.9	K65 P67 V93	K65-G96 WeakPolarHBondContact O-CA 3.48Å; P67-G96 WeakPolarHBondContact CA-O 3.48Å; V93-G96 PolarHBondContact O-N 2.76Å; V93-G96 VanDerWaalsContact O-N 3.09Å
97	G	96.4	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.201	C	C	.	.			trans	72	-168	-169.7	0	0	0	0	0	113.2	L68 V93 E302	L68-G97 WeakPolarHBondContact CB-O 3.27Å; L68-G97 PolarHBondContact N-O 3.16Å; V93-G97 WeakPolarHBondContact O-CA 3.41Å; V93-G97 PolarHBondContact O-N 2.9Å; G97-E302 WeakPolarHBondContact CA-OE2 3.5Å
98	C	96.7	Very high	95.5	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.027	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-113.8	148.2	179.7	-67.2	0	0	0	0	112.1	L102 R103 E302	C98-L102 HydrophobicContact CB-CD2 4.49Å; C98-R103 HydrophobicContact CB-CG 4.31Å; C98-E302 PolarHBondContact N-OE2 3.49Å
99	E	96.5	Very high	95.6	Very high	82 Å²	82	36.1 Å²	36.1	38%	0.383	17%	0.165	S	C	.	.			trans	-62.2	146	164.8	-77.3	-175.6	172	0	0	111.6	P67 L68 S69 R101 L102 R103	P67-E99 HydrophobicContact CB-CG 4.02Å; L68-E99 WeakPolarHBondContact O-CG 3.39Å; L68-E99 PolarHBondContact O-N 3.17Å; S69-E99 VanDerWaalsContact CA-CD 3.47Å; S69-E99 WeakPolarHBondContact CA-OE2 3.49Å; S69-E99 WeakPolarHBondContact CB-OE1 3.44Å; E99-R101 PolarHBondContact O-N 3.23Å; E99-L102 WeakPolarHBondContact O-CB 3.4Å; E99-L102 PolarHBondContact O-N 3.18Å; E99-R103 PolarHBondContact O-N 3.36Å
100	K	95.6	Very high	95.7	Very high	156 Å²	156	36 Å²	36	68%	0.678	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-35.5	-176	-177	170.5	-178.5	166.2	0	113.8
101	R	94.3	Very high	95.7	Very high	231 Å²	231	35.4 Å²	35.4	87%	0.872	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-28.7	178.4	-67.8	-177	177.2	-176.8	-1.8	113.1	E99	E99-R101 PolarHBondContact O-N 3.23Å
102	L	96.3	Very high	95.8	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-22.8	-178.1	-177.8	61.3	0	0	0	112.9	L68 L70 F73 C98 E99 A104 T105 A106	L68-L102 HydrophobicContact CB-CD2 4.24Å; L68-L102 HydrophobicContact CD2-CD2 3.87Å; L68-L102 HydrophobicContact CG-CD2 3.7Å; L70-L102 HydrophobicContact CD1-CD1 4.08Å; F73-L102 HydrophobicContact CB-CD1 3.97Å; F73-L102 HydrophobicContact CB-CD2 3.88Å; F73-L102 HydrophobicContact CD1-CD1 3.7Å; F73-L102 HydrophobicContact CD2-CD1 4.13Å; F73-L102 HydrophobicContact CD2-CD2 4.3Å; F73-L102 HydrophobicContact CE1-CD1 4.23Å; F73-L102 HydrophobicContact CG-CD1 3.64Å; F73-L102 HydrophobicContact CG-CD2 4.15Å; C98-L102 HydrophobicContact CB-CD2 4.49Å; E99-L102 WeakPolarHBondContact O-CB 3.4Å; E99-L102 PolarHBondContact O-N 3.18Å; L102-A104 PolarHBondContact O-N 3.38Å; L102-T105 PolarHBondContact O-N 2.99Å; L102-A106 HydrophobicContact CG-CB 4.06Å; L102-A106 PolarHBondContact O-N 2.74Å
103	R	97.8	Very high	95.9	Very high	23 Å²	23	31.6 Å²	31.6	9%	0.087	14%	0.143	C	C	.	.	H	α-helix	trans	-51	-47.7	-172.5	-64.1	-171.3	168.4	137.2	2.3	114.4	C98 E99 T105 A106 W107 V218 D295 L298 E302	C98-R103 HydrophobicContact CB-CG 4.31Å; E99-R103 PolarHBondContact O-N 3.36Å; R103-T105 PolarHBondContact O-N 3.02Å; R103-A106 PolarHBondContact O-N 2.78Å; R103-W107 HydrophobicContact CB-CG 4.46Å; R103-W107 WeakPolarHBondContact O-CB 3.35Å; R103-W107 VanDerWaalsContact O-CD1 3.24Å; R103-W107 VanDerWaalsContact O-CG 3.26Å; R103-W107 PolarHBondContact O-N 3.49Å; R103-V218 HydrophobicContact CB-CG1 3.56Å; R103-V218 HydrophobicContact CB-CG2 4.4Å; R103-D295 IonicContact NH1-OD1 3.66Å; R103-L298 VanDerWaalsContact NH1-CD1 3.28Å; R103-E302 VanDerWaalsContact CD-OE1 3.25Å; R103-E302 WeakPolarHBondContact CD-OE1 3.37Å; R103-E302 VanDerWaalsContact CG-OE1 3.28Å; R103-E302 WeakPolarHBondContact CG-OE1 3.49Å; R103-E302 IonicContact CZ-OE1 2.7Å; R103-E302 IonicContact NE-OE1 2.74Å; R103-E302 PolarHBondContact NE-OE1 3.46Å; R103-E302 IonicContact NH2-OE1 3.69Å; R103-E302 IonicContact NH2-OE2 2.78Å
104	A	96.1	Very high	95.8	Very high	22 Å²	22	32.5 Å²	32.5	18%	0.182	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-24.8	-178.6	0	0	0	0	0	113.5	L102 P108 V506	L102-A104 PolarHBondContact O-N 3.38Å; A104-P108 WeakPolarHBondContact O-CD 3.27Å; A104-V506 HydrophobicContact CB-CG2 4.03Å
105	T	94.9	Very high	95.6	Very high	44 Å²	44	32 Å²	32	27%	0.27	15%	0.148	S	C	.	.	H	α-helix	trans	-91.2	-39.9	175.9	-53.7	0	0	0	0	112.1	F73 L102 R103 M109	F73-T105 HydrophobicContact CE1-CG2 4.19Å; F73-T105 HydrophobicContact CZ-CG2 4.33Å; L102-T105 PolarHBondContact O-N 2.99Å; R103-T105 PolarHBondContact O-N 3.02Å; T105-M109 HydrophobicContact CG2-CE 4.07Å
106	A	96.3	Very high	95.3	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-78.2	-37.4	-176.8	0	0	0	0	0	113.6	F89 L102 R103 M109 L110	F89-A106 HydrophobicContact CE2-CB 4.47Å; F89-A106 HydrophobicContact CZ-CB 3.99Å; L102-A106 HydrophobicContact CG-CB 4.06Å; L102-A106 PolarHBondContact O-N 2.74Å; R103-A106 PolarHBondContact O-N 2.78Å; A106-M109 WeakPolarHBondContact O-CB 3.29Å; A106-M109 PolarHBondContact O-N 3.46Å; A106-M109 VanDerWaalsContact O-N 3.08Å; A106-L110 WeakPolarHBondContact O-CG 3.46Å; A106-L110 PolarHBondContact O-N 3.25Å
107	W	97.8	Very high	95	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-42.7	-175.3	-78.3	28	0	0	0	113.5	R103 M109 L110 L111 P214 L215 V218 M219 L298 E302 W305	R103-W107 HydrophobicContact CB-CG 4.46Å; R103-W107 WeakPolarHBondContact O-CB 3.35Å; R103-W107 VanDerWaalsContact O-CD1 3.24Å; R103-W107 VanDerWaalsContact O-CG 3.26Å; R103-W107 PolarHBondContact O-N 3.49Å; W107-M109 PolarHBondContact O-N 3.34Å; W107-L110 PolarHBondContact O-N 3.18Å; W107-L111 WeakPolarHBondContact O-CB 3.47Å; W107-L111 VanDerWaalsContact O-CG 3.32Å; W107-L111 WeakPolarHBondContact O-CG 3.27Å; W107-L111 PolarHBondContact O-N 3.32Å; W107-P214 HydrophobicContact CH2-CB 4.06Å; W107-P214 HydrophobicContact CZ3-CB 4.16Å; W107-L215 HydrophobicContact CE3-CD2 3.84Å; W107-L215 HydrophobicContact CZ3-CD2 3.83Å; W107-V218 HydrophobicContact CD2-CB 4.41Å; W107-V218 HydrophobicContact CD2-CG1 3.91Å; W107-V218 HydrophobicContact CD2-CG2 4.34Å; W107-V218 HydrophobicContact CE3-CB 3.96Å; W107-V218 HydrophobicContact CE3-CG1 3.87Å; W107-V218 HydrophobicContact CE3-CG2 4.04Å; W107-V218 HydrophobicContact CG-CG1 4.32Å; W107-V218 HydrophobicContact CH2-CG2 3.76Å; W107-V218 HydrophobicContact CZ2-CG2 3.99Å; W107-V218 HydrophobicContact CZ3-CB 4.01Å; W107-V218 HydrophobicContact CZ3-CG1 4.4Å; W107-V218 HydrophobicContact CZ3-CG2 3.73Å; W107-M219 HydrophobicContact CB-CE 3.63Å; W107-M219 HydrophobicContact CE3-CE 4.34Å; W107-M219 HydrophobicContact CG-CE 4.46Å; W107-L298 HydrophobicContact CH2-CD2 3.57Å; W107-L298 HydrophobicContact CZ2-CB 4.12Å; W107-L298 HydrophobicContact CZ2-CD2 4.01Å; W107-E302 HydrophobicContact CZ2-CG 4.18Å; W107-E302 VanDerWaalsContact NE1-CG 3.3Å; W107-E302 PolarHBondContact NE1-OE1 3.43Å; W107-W305 HydrophobicContact CD2-CH2 4.49Å; W107-W305 AromaticContact CD2-CZ3 3.84Å; W107-W305 HydrophobicContact CD2-CZ3 3.84Å; W107-W305 HydrophobicContact CE3-CH2 4.07Å; W107-W305 AromaticContact CE3-CZ3 3.85Å; W107-W305 HydrophobicContact CE3-CZ3 3.85Å; W107-W305 HydrophobicContact CG-CZ3 4.25Å; W107-W305 HydrophobicContact CH2-CH2 4.24Å; W107-W305 HydrophobicContact CH2-CZ3 4.35Å; W107-W305 HydrophobicContact CZ2-CZ3 4.41Å; W107-W305 AromaticContact CZ3-CH2 3.96Å; W107-W305 HydrophobicContact CZ3-CH2 3.96Å; W107-W305 HydrophobicContact CZ3-CZ3 4.13Å
108	P	96.5	Very high	94.9	Very high	6 Å²	6	40.8 Å²	40.8	4%	0.039	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-25.8	175.5	-21	35.1	0	0	0	112.8	A104 D112 V113 F114 M219	A104-P108 WeakPolarHBondContact O-CD 3.27Å; P108-D112 PolarHBondContact O-N 2.71Å; P108-V113 HydrophobicContact CB-CB 4.03Å; P108-V113 HydrophobicContact CB-CG1 4.49Å; P108-V113 HydrophobicContact CB-CG2 4Å; P108-V113 VanDerWaalsContact O-CB 3.31Å; P108-V113 WeakPolarHBondContact O-CB 3.41Å; P108-V113 WeakPolarHBondContact O-CG2 3.44Å; P108-V113 PolarHBondContact O-N 3.43Å; P108-F114 HydrophobicContact CB-CD2 4.46Å; P108-F114 HydrophobicContact CB-CE2 3.66Å; P108-F114 HydrophobicContact CB-CZ 3.88Å; P108-M219 HydrophobicContact CG-CE 3.97Å; P108-M219 HydrophobicContact CG-SD 4.4Å
109	M	94.8	Very high	94.8	Very high	18 Å²	18	42.1 Å²	42.1	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-76.8	-39.4	173.7	-54.3	-178.2	-174	0	0	112.2	F73 L83 F89 R90 T105 A106 W107 L111 D112 F114 R123	F73-M109 HydrophobicContact CE2-SD 4.25Å; F73-M109 HydrophobicContact CZ-CE 4Å; F73-M109 HydrophobicContact CZ-SD 3.97Å; L83-M109 HydrophobicContact CD1-SD 4.48Å; L83-M109 HydrophobicContact CD2-SD 4.43Å; F89-M109 HydrophobicContact CE1-CB 4.07Å; R90-M109 PolarHBondContact NH2-O 3.3Å; T105-M109 HydrophobicContact CG2-CE 4.07Å; A106-M109 WeakPolarHBondContact O-CB 3.29Å; A106-M109 PolarHBondContact O-N 3.46Å; A106-M109 VanDerWaalsContact O-N 3.08Å; W107-M109 PolarHBondContact O-N 3.34Å; M109-L111 VanDerWaalsContact C-N 3.31Å; M109-D112 PolarHBondContact O-N 3.11Å; M109-F114 HydrophobicContact CE-CE2 4.46Å; M109-F114 HydrophobicContact CG-CD2 3.98Å; M109-F114 HydrophobicContact CG-CE2 3.85Å; M109-R123 VanDerWaalsContact CE-NH1 3.32Å
110	L	96.1	Very high	94.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-72.6	-23.7	176.6	-65.8	169.1	0	0	0	113.4	F89 R90 V93 A106 W107 W305 A306	F89-L110 HydrophobicContact CE1-CD2 3.77Å; F89-L110 HydrophobicContact CE1-CG 4.09Å; F89-L110 HydrophobicContact CZ-CD2 4.23Å; F89-L110 HydrophobicContact CZ-CG 4.26Å; R90-L110 HydrophobicContact CG-CD2 4.13Å; R90-L110 PolarHBondContact NH2-O 3.25Å; V93-L110 HydrophobicContact CB-CD2 4.35Å; V93-L110 HydrophobicContact CG1-CD1 3.89Å; V93-L110 HydrophobicContact CG1-CD2 4.28Å; V93-L110 HydrophobicContact CG2-CD2 4.36Å; A106-L110 WeakPolarHBondContact O-CG 3.46Å; A106-L110 PolarHBondContact O-N 3.25Å; W107-L110 PolarHBondContact O-N 3.18Å; L110-W305 HydrophobicContact CB-CB 4.44Å; L110-A306 HydrophobicContact CD2-CB 3.98Å
111	L	96.4	Very high	94.5	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	2.5	174.8	-68.1	173.3	0	0	0	112.9	W107 M109 V113 L215 C228 A231 L232 W305	W107-L111 WeakPolarHBondContact O-CB 3.47Å; W107-L111 VanDerWaalsContact O-CG 3.32Å; W107-L111 WeakPolarHBondContact O-CG 3.27Å; W107-L111 PolarHBondContact O-N 3.32Å; M109-L111 VanDerWaalsContact C-N 3.31Å; L111-V113 VanDerWaalsContact C-N 3.34Å; L111-V113 HydrophobicContact CB-CG2 4.27Å; L111-V113 PolarHBondContact O-N 2.87Å; L111-L215 HydrophobicContact CD1-CD2 3.8Å; L111-C228 HydrophobicContact CD1-CB 3.79Å; L111-A231 HydrophobicContact CB-CB 4.17Å; L111-A231 WeakPolarHBondContact O-CB 3.19Å; L111-L232 HydrophobicContact CD2-CB 4.12Å; L111-L232 HydrophobicContact CD2-CD1 3.99Å; L111-W305 HydrophobicContact CD1-CE3 4.49Å; L111-W305 HydrophobicContact CD1-CH2 4.13Å; L111-W305 HydrophobicContact CD1-CZ3 3.95Å; L111-W305 HydrophobicContact CD2-CD2 3.69Å; L111-W305 HydrophobicContact CD2-CE3 3.67Å; L111-W305 HydrophobicContact CD2-CG 4.36Å; L111-W305 HydrophobicContact CD2-CH2 3.95Å; L111-W305 HydrophobicContact CD2-CZ2 3.95Å; L111-W305 HydrophobicContact CD2-CZ3 3.82Å; L111-W305 HydrophobicContact CG-CD2 4.44Å; L111-W305 HydrophobicContact CG-CE3 3.92Å; L111-W305 HydrophobicContact CG-CH2 4.34Å; L111-W305 HydrophobicContact CG-CZ3 3.89Å
112	D	95	Very high	94.6	Very high	19 Å²	19	29.3 Å²	29.3	10%	0.102	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	42.6	178.5	-63.4	-52.9	0	0	0	113.2	R90 P108 M109 D311 P313	R90-D112 IonicContact CZ-OD1 3.33Å; R90-D112 IonicContact CZ-OD2 3.44Å; R90-D112 IonicContact NH1-OD2 2.69Å; R90-D112 IonicContact NH2-OD1 3.97Å; R90-D112 PolarHBondContact NH2-OD1 3.33Å; R90-D112 IonicContact NH2-OD2 3.79Å; R90-D112 PolarHBondContact NH2-OD2 2.69Å; P108-D112 PolarHBondContact O-N 2.71Å; M109-D112 PolarHBondContact O-N 3.11Å; D112-D311 PolarHBondContact OD2-N 2.91Å; D112-D311 VanDerWaalsContact OD2-N 3.14Å; D112-P313 WeakPolarHBondContact O-CD 3.41Å
113	V	96.2	Very high	94.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.183	C	C	.	.			trans	-70.9	-35	176.7	172.1	0	0	0	0	112	P108 L111 Y126 L127 V227 A231 L317	P108-V113 HydrophobicContact CB-CB 4.03Å; P108-V113 HydrophobicContact CB-CG1 4.49Å; P108-V113 HydrophobicContact CB-CG2 4Å; P108-V113 VanDerWaalsContact O-CB 3.31Å; P108-V113 WeakPolarHBondContact O-CB 3.41Å; P108-V113 WeakPolarHBondContact O-CG2 3.44Å; P108-V113 PolarHBondContact O-N 3.43Å; L111-V113 VanDerWaalsContact C-N 3.34Å; L111-V113 HydrophobicContact CB-CG2 4.27Å; L111-V113 PolarHBondContact O-N 2.87Å; V113-Y126 HydrophobicContact CG1-CE1 4.32Å; V113-Y126 VanDerWaalsContact O-CE1 3.3Å; V113-Y126 WeakPolarHBondContact O-CE1 3.44Å; V113-Y126 PolarHBondContact O-OH 2.93Å; V113-L127 HydrophobicContact CG1-CD2 3.98Å; V113-V227 HydrophobicContact CG1-CG1 3.52Å; V113-V227 HydrophobicContact CG2-CG1 4.32Å; V113-A231 HydrophobicContact CG2-CB 3.74Å; V113-L317 HydrophobicContact CG1-CD2 4.28Å
114	F	94.8	Very high	94.4	Very high	19 Å²	19	29.6 Å²	29.6	8%	0.083	18%	0.182	C	C	.	.	S	Bend	trans	-95.6	135.6	-172	-55.4	-64.9	0	0	0	112.5	P108 M109 R123 Y126 L127	P108-F114 HydrophobicContact CB-CD2 4.46Å; P108-F114 HydrophobicContact CB-CE2 3.66Å; P108-F114 HydrophobicContact CB-CZ 3.88Å; M109-F114 HydrophobicContact CE-CE2 4.46Å; M109-F114 HydrophobicContact CG-CD2 3.98Å; M109-F114 HydrophobicContact CG-CE2 3.85Å; F114-R123 HydrophobicContact CD1-CB 3.96Å; F114-R123 HydrophobicContact CD1-CG 3.56Å; F114-R123 HydrophobicContact CD2-CG 4.3Å; F114-R123 HydrophobicContact CE1-CB 3.51Å; F114-R123 HydrophobicContact CE1-CG 3.59Å; F114-R123 HydrophobicContact CE2-CG 4.33Å; F114-R123 HydrophobicContact CG-CG 3.92Å; F114-R123 HydrophobicContact CZ-CB 3.95Å; F114-R123 HydrophobicContact CZ-CG 3.99Å; F114-Y126 AromaticContact CD1-CD1 3.97Å; F114-Y126 HydrophobicContact CD1-CD1 3.97Å; F114-Y126 HydrophobicContact CD1-CE1 4.3Å; F114-Y126 HydrophobicContact CE1-CD1 4.43Å; F114-L127 HydrophobicContact CE1-CD1 3.68Å; F114-L127 HydrophobicContact CE1-CD2 4.22Å; F114-L127 HydrophobicContact CE1-CG 3.78Å; F114-L127 HydrophobicContact CZ-CD1 3.75Å; F114-L127 HydrophobicContact CZ-CG 4.34Å
115	P	92.3	Very high	94.4	Very high	21 Å²	21	33.5 Å²	33.5	14%	0.136	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-54.7	151.7	160.2	-26.6	35.6	0	0	0	112.7	M118 Y126 P313 K315	P115-M118 HydrophobicContact CB-CE 4.05Å; P115-M118 HydrophobicContact CB-SD 4.47Å; P115-M118 HydrophobicContact CG-CE 3.7Å; P115-M118 HydrophobicContact CG-SD 4.32Å; P115-Y126 HydrophobicContact CG-CE2 4.28Å; P115-P313 HydrophobicContact CG-CG 4.35Å; P115-K315 WeakPolarHBondContact CG-O 3.09Å
116	V	87.9	Confident	94.4	Very high	120 Å²	120	32.6 Å²	32.6	73%	0.727	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	139.9	-177.9	-174.7	0	0	0	0	111.4	M118 P312	V116-M118 VanDerWaalsContact C-N 3.34Å; V116-M118 PolarHBondContact O-N 3.28Å; V116-P312 HydrophobicContact CG2-CB 3.81Å; V116-P312 HydrophobicContact CG2-CG 3.35Å
117	G	87.2	Confident	94.4	Very high	49 Å²	49	32.8 Å²	32.8	51%	0.505	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	-5.3	170.2	0	0	0	0	0	116.2	N119	G117-N119 PolarHBondContact O-N 2.87Å
118	M	93.4	Very high	94.3	Very high	37 Å²	37	34.4 Å²	34.4	18%	0.182	21%	0.206	C	C	.	.			trans	-58.1	133.8	175	-75.1	-170.3	169.1	0	0	112.1	P115 V116 D122 R123 Y126	P115-M118 HydrophobicContact CB-CE 4.05Å; P115-M118 HydrophobicContact CB-SD 4.47Å; P115-M118 HydrophobicContact CG-CE 3.7Å; P115-M118 HydrophobicContact CG-SD 4.32Å; V116-M118 VanDerWaalsContact C-N 3.34Å; V116-M118 PolarHBondContact O-N 3.28Å; M118-D122 HydrophobicContact CB-CB 3.92Å; M118-D122 HydrophobicContact CG-CB 4Å; M118-D122 HydrophobicContact SD-CB 4.39Å; M118-R123 HydrophobicContact CB-CG 3.79Å; M118-R123 VanDerWaalsContact O-CZ 3.22Å; M118-R123 PolarHBondContact O-NE 3.28Å; M118-R123 PolarHBondContact O-NH2 3.35Å; M118-R123 HydrophobicContact SD-CG 4.47Å; M118-Y126 HydrophobicContact CE-CD2 3.76Å; M118-Y126 HydrophobicContact CE-CE2 4.24Å; M118-Y126 HydrophobicContact CE-CG 3.96Å; M118-Y126 HydrophobicContact SD-CD1 4.37Å; M118-Y126 HydrophobicContact SD-CD2 4.5Å; M118-Y126 HydrophobicContact SD-CG 4.12Å
119	N	94.4	Very high	94.2	Very high	32 Å²	32	36.2 Å²	36.2	17%	0.171	22%	0.222	C	C	.	.			trans	-82.3	177.9	172.4	74.4	52.6	0	0	0	111.5	E80 R82 G117 V121 D122 R123	E80-N119 HydrophobicContact CB-CB 4.08Å; E80-N119 WeakPolarHBondContact O-CB 3.49Å; R82-N119 HydrophobicContact CG-CB 3.8Å; G117-N119 PolarHBondContact O-N 2.87Å; N119-V121 PolarHBondContact O-N 2.87Å; N119-V121 WeakPolarHBondContact OD1-CA 3.46Å; N119-V121 WeakPolarHBondContact OD1-CB 3.26Å; N119-V121 PolarHBondContact OD1-N 2.87Å; N119-D122 VanDerWaalsContact CG-OD2 3.24Å; N119-D122 PolarHBondContact N-OD2 3.34Å; N119-D122 VanDerWaalsContact N-OD2 3.15Å; N119-D122 PolarHBondContact ND2-OD1 3.15Å; N119-D122 PolarHBondContact ND2-OD2 3.44Å; N119-D122 PolarHBondContact O-N 3.03Å; N119-D122 PolarHBondContact OD1-N 3.47Å; N119-R123 VanDerWaalsContact O-CG 3.3Å; N119-R123 WeakPolarHBondContact O-CG 3.49Å; N119-R123 PolarHBondContact O-N 2.98Å
120	T	92.1	Very high	94.3	Very high	44 Å²	44	35.4 Å²	35.4	27%	0.27	22%	0.217	S	C	.	.	H	α-helix	trans	-59.5	-42.5	-178.7	-66.1	0	0	0	0	113.3	E80 G81 R123 C124	E80-T120 PolarHBondContact O-N 3.27Å; G81-T120 WeakPolarHBondContact CA-OG1 3.45Å; T120-R123 PolarHBondContact O-N 3.18Å; T120-C124 PolarHBondContact O-N 3.33Å; T120-C124 VanDerWaalsContact O-N 3.1Å; T120-C124 PolarHBondContact O-SG 2.95Å; T120-C124 VanDerWaalsContact O-SG 3.39Å
121	V	94.6	Very high	94.3	Very high	91 Å²	91	35.5 Å²	35.5	55%	0.552	22%	0.218	S	C	*	.	H	α-helix	trans	-67.8	-44.2	-179.6	-178.1	0	0	0	0	110.8	N119 R123 C124 N125	N119-V121 PolarHBondContact O-N 2.87Å; N119-V121 WeakPolarHBondContact OD1-CA 3.46Å; N119-V121 WeakPolarHBondContact OD1-CB 3.26Å; N119-V121 PolarHBondContact OD1-N 2.87Å; V121-R123 VanDerWaalsContact C-N 3.33Å; V121-R123 PolarHBondContact O-N 3.2Å; V121-C124 PolarHBondContact O-N 3.04Å; V121-N125 PolarHBondContact O-N 3.3Å; V121-N125 PolarHBondContact O-ND2 2.91Å
122	D	95.4	Very high	94.2	Very high	65 Å²	65	40.6 Å²	40.6	35%	0.348	24%	0.242	S	C	.	.	H	α-helix	trans	-58	-46.4	176.5	-58.6	-18.3	0	0	0	111	M118 N119 C124 N125 Y126	M118-D122 HydrophobicContact CB-CB 3.92Å; M118-D122 HydrophobicContact CG-CB 4Å; M118-D122 HydrophobicContact SD-CB 4.39Å; N119-D122 VanDerWaalsContact CG-OD2 3.24Å; N119-D122 PolarHBondContact N-OD2 3.34Å; N119-D122 VanDerWaalsContact N-OD2 3.15Å; N119-D122 PolarHBondContact ND2-OD1 3.15Å; N119-D122 PolarHBondContact ND2-OD2 3.44Å; N119-D122 PolarHBondContact O-N 3.03Å; N119-D122 PolarHBondContact OD1-N 3.47Å; D122-C124 PolarHBondContact O-N 2.85Å; D122-N125 PolarHBondContact O-N 3.48Å; D122-Y126 WeakPolarHBondContact O-CB 3.4Å; D122-Y126 PolarHBondContact O-N 2.94Å
123	R	95.2	Very high	94.2	Very high	21 Å²	21	43.8 Å²	43.8	8%	0.079	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-40.3	178.4	-71.3	-177.8	-163.1	135.7	7.7	112.4	G81 M109 F114 M118 N119 T120 V121 L127	G81-R123 PolarHBondContact O-NH1 2.94Å; G81-R123 PolarHBondContact O-NH2 3.12Å; M109-R123 VanDerWaalsContact CE-NH1 3.32Å; F114-R123 HydrophobicContact CD1-CB 3.96Å; F114-R123 HydrophobicContact CD1-CG 3.56Å; F114-R123 HydrophobicContact CD2-CG 4.3Å; F114-R123 HydrophobicContact CE1-CB 3.51Å; F114-R123 HydrophobicContact CE1-CG 3.59Å; F114-R123 HydrophobicContact CE2-CG 4.33Å; F114-R123 HydrophobicContact CG-CG 3.92Å; F114-R123 HydrophobicContact CZ-CB 3.95Å; F114-R123 HydrophobicContact CZ-CG 3.99Å; M118-R123 HydrophobicContact CB-CG 3.79Å; M118-R123 VanDerWaalsContact O-CZ 3.22Å; M118-R123 PolarHBondContact O-NE 3.28Å; M118-R123 PolarHBondContact O-NH2 3.35Å; M118-R123 HydrophobicContact SD-CG 4.47Å; N119-R123 VanDerWaalsContact O-CG 3.3Å; N119-R123 WeakPolarHBondContact O-CG 3.49Å; N119-R123 PolarHBondContact O-N 2.98Å; T120-R123 PolarHBondContact O-N 3.18Å; V121-R123 VanDerWaalsContact C-N 3.33Å; V121-R123 PolarHBondContact O-N 3.2Å; R123-L127 WeakPolarHBondContact O-CB 3.18Å; R123-L127 WeakPolarHBondContact O-CG 3.39Å; R123-L127 PolarHBondContact O-N 3.29Å
124	C	94.5	Very high	94.2	Very high	10 Å²	10	43.8 Å²	43.8	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-47.7	175.9	-74.6	0	0	0	0	111.7	T120 V121 D122 Y126 L127 A128 L508	T120-C124 PolarHBondContact O-N 3.33Å; T120-C124 VanDerWaalsContact O-N 3.1Å; T120-C124 PolarHBondContact O-SG 2.95Å; T120-C124 VanDerWaalsContact O-SG 3.39Å; V121-C124 PolarHBondContact O-N 3.04Å; D122-C124 PolarHBondContact O-N 2.85Å; C124-Y126 PolarHBondContact O-N 2.95Å; C124-L127 PolarHBondContact O-N 2.97Å; C124-A128 WeakPolarHBondContact O-CB 3.41Å; C124-A128 PolarHBondContact O-N 3.48Å; C124-L508 HydrophobicContact CB-CD1 3.82Å
125	N	95.8	Very high	94.2	Very high	104 Å²	104	43.8 Å²	43.8	56%	0.556	25%	0.253	S	S	*	.	H	α-helix	trans	-62.4	-42.4	177.5	-69.1	-24.7	0	0	0	111.9	V121 D122 A128 A129	V121-N125 PolarHBondContact O-N 3.3Å; V121-N125 PolarHBondContact O-ND2 2.91Å; D122-N125 PolarHBondContact O-N 3.48Å; N125-A128 PolarHBondContact O-N 3.07Å; N125-A129 PolarHBondContact O-N 3.27Å
126	Y	96	Very high	94.3	Very high	25 Å²	25	47.2 Å²	47.2	10%	0.098	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-45.4	177.2	179	-104.2	0	0	0	112.2	V113 F114 P115 M118 D122 C124 A128 A129 L130 E316 L317	V113-Y126 HydrophobicContact CG1-CE1 4.32Å; V113-Y126 VanDerWaalsContact O-CE1 3.3Å; V113-Y126 WeakPolarHBondContact O-CE1 3.44Å; V113-Y126 PolarHBondContact O-OH 2.93Å; F114-Y126 AromaticContact CD1-CD1 3.97Å; F114-Y126 HydrophobicContact CD1-CD1 3.97Å; F114-Y126 HydrophobicContact CD1-CE1 4.3Å; F114-Y126 HydrophobicContact CE1-CD1 4.43Å; P115-Y126 HydrophobicContact CG-CE2 4.28Å; M118-Y126 HydrophobicContact CE-CD2 3.76Å; M118-Y126 HydrophobicContact CE-CE2 4.24Å; M118-Y126 HydrophobicContact CE-CG 3.96Å; M118-Y126 HydrophobicContact SD-CD1 4.37Å; M118-Y126 HydrophobicContact SD-CD2 4.5Å; M118-Y126 HydrophobicContact SD-CG 4.12Å; D122-Y126 WeakPolarHBondContact O-CB 3.4Å; D122-Y126 PolarHBondContact O-N 2.94Å; C124-Y126 PolarHBondContact O-N 2.95Å; Y126-A128 VanDerWaalsContact C-N 3.34Å; Y126-A128 PolarHBondContact O-N 2.59Å; Y126-A129 PolarHBondContact O-N 2.66Å; Y126-L130 HydrophobicContact CD1-CD1 3.89Å; Y126-L130 HydrophobicContact CE1-CD1 3.42Å; Y126-L130 VanDerWaalsContact CE1-CD1 3.42Å; Y126-L130 HydrophobicContact CE1-CG 4.36Å; Y126-L130 HydrophobicContact CE2-CD1 4.41Å; Y126-L130 WeakPolarHBondContact O-CG 3.44Å; Y126-L130 PolarHBondContact O-N 2.93Å; Y126-E316 HydrophobicContact CE2-CB 4.37Å; Y126-E316 HydrophobicContact CE2-CG 3.88Å; Y126-L317 WeakPolarHBondContact OH-CB 3.41Å; Y126-L317 PolarHBondContact OH-N 3.25Å
127	L	96	Very high	94.6	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-32.4	175.5	-73.5	173.5	0	0	0	113	V113 F114 R123 C124 L130 S131 L224 V227 P505	V113-L127 HydrophobicContact CG1-CD2 3.98Å; F114-L127 HydrophobicContact CE1-CD1 3.68Å; F114-L127 HydrophobicContact CE1-CD2 4.22Å; F114-L127 HydrophobicContact CE1-CG 3.78Å; F114-L127 HydrophobicContact CZ-CD1 3.75Å; F114-L127 HydrophobicContact CZ-CG 4.34Å; R123-L127 WeakPolarHBondContact O-CB 3.18Å; R123-L127 WeakPolarHBondContact O-CG 3.39Å; R123-L127 PolarHBondContact O-N 3.29Å; C124-L127 PolarHBondContact O-N 2.97Å; L127-L130 HydrophobicContact CD2-CD1 4.49Å; L127-S131 VanDerWaalsContact O-CB 3.26Å; L127-S131 WeakPolarHBondContact O-CB 3.38Å; L127-S131 PolarHBondContact O-N 3.17Å; L127-S131 PolarHBondContact O-OG 2.95Å; L127-L224 HydrophobicContact CB-CD2 3.92Å; L127-L224 HydrophobicContact CD1-CD2 4.21Å; L127-L224 HydrophobicContact CD2-CD2 3.97Å; L127-L224 HydrophobicContact CG-CD2 4.24Å; L127-V227 HydrophobicContact CD2-CG1 4.01Å; L127-P505 HydrophobicContact CD1-CB 3.61Å; L127-P505 HydrophobicContact CD1-CG 4.28Å
128	A	95.3	Very high	95	Very high	34 Å²	34	41.5 Å²	41.5	28%	0.281	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-47.1	172.7	0	0	0	0	0	111.3	C124 N125 Y126 S131 E132	C124-A128 WeakPolarHBondContact O-CB 3.41Å; C124-A128 PolarHBondContact O-N 3.48Å; N125-A128 PolarHBondContact O-N 3.07Å; Y126-A128 VanDerWaalsContact C-N 3.34Å; Y126-A128 PolarHBondContact O-N 2.59Å; A128-S131 WeakPolarHBondContact O-CB 3.37Å; A128-S131 PolarHBondContact O-N 3.08Å; A128-S131 VanDerWaalsContact O-N 3.13Å; A128-E132 PolarHBondContact O-N 3Å
129	A	95.6	Very high	94.9	Very high	44 Å²	44	41.4 Å²	41.4	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-61.7	-45.2	176.5	0	0	0	0	0	112.5	N125 Y126 S131 E132 R133	N125-A129 PolarHBondContact O-N 3.27Å; Y126-A129 PolarHBondContact O-N 2.66Å; A129-S131 VanDerWaalsContact C-N 3.26Å; A129-S131 PolarHBondContact O-N 3.39Å; A129-E132 PolarHBondContact O-N 3.08Å; A129-R133 WeakPolarHBondContact O-CG 3.38Å; A129-R133 PolarHBondContact O-N 2.95Å
130	L	95.5	Very high	94.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-34.3	173.6	-70.2	178.7	0	0	0	112.3	Y126 L127 R133 Y134 V227 E316 L319	Y126-L130 HydrophobicContact CD1-CD1 3.89Å; Y126-L130 HydrophobicContact CE1-CD1 3.42Å; Y126-L130 VanDerWaalsContact CE1-CD1 3.42Å; Y126-L130 HydrophobicContact CE1-CG 4.36Å; Y126-L130 HydrophobicContact CE2-CD1 4.41Å; Y126-L130 WeakPolarHBondContact O-CG 3.44Å; Y126-L130 PolarHBondContact O-N 2.93Å; L127-L130 HydrophobicContact CD2-CD1 4.49Å; L130-R133 PolarHBondContact O-N 2.97Å; L130-Y134 PolarHBondContact O-N 3.4Å; L130-V227 HydrophobicContact CB-CG2 3.75Å; L130-V227 HydrophobicContact CD1-CG1 3.88Å; L130-V227 HydrophobicContact CD1-CG2 4.26Å; L130-E316 HydrophobicContact CD2-CG 3.89Å; L130-E316 WeakPolarHBondContact CD2-OE1 3.46Å; L130-L319 HydrophobicContact CB-CD1 4.22Å; L130-L319 HydrophobicContact CD2-CD1 3.74Å; L130-L319 HydrophobicContact CD2-CD2 4.24Å; L130-L319 HydrophobicContact CD2-CG 3.9Å; L130-L319 WeakPolarHBondContact O-CD1 3.47Å
131	S	96	Very high	94.7	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-69.9	-41.2	177.8	-61.7	0	0	0	0	112.4	L127 A128 A129 Y134 I135	L127-S131 VanDerWaalsContact O-CB 3.26Å; L127-S131 WeakPolarHBondContact O-CB 3.38Å; L127-S131 PolarHBondContact O-N 3.17Å; L127-S131 PolarHBondContact O-OG 2.95Å; A128-S131 WeakPolarHBondContact O-CB 3.37Å; A128-S131 PolarHBondContact O-N 3.08Å; A128-S131 VanDerWaalsContact O-N 3.13Å; A129-S131 VanDerWaalsContact C-N 3.26Å; A129-S131 PolarHBondContact O-N 3.39Å; S131-Y134 WeakPolarHBondContact O-CB 3.31Å; S131-Y134 PolarHBondContact O-N 2.99Å; S131-I135 WeakPolarHBondContact O-CG1 3.34Å; S131-I135 PolarHBondContact O-N 3.18Å
132	E	95.1	Very high	94.5	Very high	110 Å²	110	35.1 Å²	35.1	51%	0.514	19%	0.189	S	C	.	.	H	α-helix	trans	-61.1	-45.4	172.5	-175.6	-178.6	-170.4	0	0	111.2	A128 A129 Y134 I135 N136	A128-E132 PolarHBondContact O-N 3Å; A129-E132 PolarHBondContact O-N 3.08Å; E132-Y134 VanDerWaalsContact C-N 3.33Å; E132-Y134 PolarHBondContact O-N 3.37Å; E132-I135 PolarHBondContact O-N 2.95Å; E132-N136 PolarHBondContact O-N 2.75Å; E132-N136 PolarHBondContact O-ND2 3.41Å
133	R	94.6	Very high	94.2	Very high	86 Å²	86	37.6 Å²	37.6	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-56.8	-45.1	174.1	-72.9	178.8	62	161	1.9	112	A129 L130 N136 L137 E316 L319	A129-R133 WeakPolarHBondContact O-CG 3.38Å; A129-R133 PolarHBondContact O-N 2.95Å; L130-R133 PolarHBondContact O-N 2.97Å; R133-N136 PolarHBondContact O-N 2.7Å; R133-L137 VanDerWaalsContact O-CG 3.3Å; R133-L137 WeakPolarHBondContact O-CG 3.01Å; R133-L137 PolarHBondContact O-N 3.36Å; R133-E316 IonicContact CZ-OE1 2.65Å; R133-E316 IonicContact NE-OE1 2.98Å; R133-E316 IonicContact NH1-OE1 3.75Å; R133-E316 PolarHBondContact NH1-OE1 3.44Å; R133-E316 IonicContact NH1-OE2 3.85Å; R133-E316 PolarHBondContact NH1-OE2 3.02Å; R133-L319 HydrophobicContact CB-CD1 3.82Å
134	Y	96.1	Very high	93.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.1	-47	174.6	168.7	-103.8	0	0	0	112.4	L130 S131 E132 N136 L137 R138 N190 V191 T194 E222 A223 Y226	L130-Y134 PolarHBondContact O-N 3.4Å; S131-Y134 WeakPolarHBondContact O-CB 3.31Å; S131-Y134 PolarHBondContact O-N 2.99Å; E132-Y134 VanDerWaalsContact C-N 3.33Å; E132-Y134 PolarHBondContact O-N 3.37Å; Y134-N136 VanDerWaalsContact C-N 3.27Å; Y134-N136 PolarHBondContact O-N 3.41Å; Y134-L137 PolarHBondContact O-N 2.89Å; Y134-R138 HydrophobicContact CE2-CB 4.42Å; Y134-R138 WeakPolarHBondContact O-CB 3.46Å; Y134-R138 PolarHBondContact O-N 3.29Å; Y134-N190 VanDerWaalsContact OH-C 3.32Å; Y134-N190 WeakPolarHBondContact OH-CB 3.46Å; Y134-N190 PolarHBondContact OH-O 2.66Å; Y134-V191 PolarHBondContact OH-N 2.82Å; Y134-T194 HydrophobicContact CD2-CG2 3.98Å; Y134-T194 HydrophobicContact CE2-CG2 3.78Å; Y134-E222 HydrophobicContact CE1-CB 4.39Å; Y134-E222 HydrophobicContact CE1-CG 3.8Å; Y134-E222 VanDerWaalsContact CE1-OE1 3.29Å; Y134-E222 WeakPolarHBondContact CE1-OE1 3.46Å; Y134-E222 WeakPolarHBondContact OH-CG 3.43Å; Y134-E222 PolarHBondContact OH-OE1 3.05Å; Y134-A223 VanDerWaalsContact CD1-CA 3.45Å; Y134-A223 HydrophobicContact CD1-CB 3.5Å; Y134-A223 HydrophobicContact CE1-CB 4.23Å; Y134-A223 HydrophobicContact CG-CB 4.18Å; Y134-Y226 AromaticContact CD2-CD1 3.21Å; Y134-Y226 HydrophobicContact CD2-CD1 3.21Å; Y134-Y226 AromaticContact CD2-CD2 3.74Å; Y134-Y226 HydrophobicContact CD2-CD2 3.74Å; Y134-Y226 AromaticContact CD2-CE1 3.69Å; Y134-Y226 HydrophobicContact CD2-CE1 3.69Å; Y134-Y226 HydrophobicContact CD2-CE2 4.17Å; Y134-Y226 AromaticContact CD2-CG 3.19Å; Y134-Y226 HydrophobicContact CD2-CG 3.19Å; Y134-Y226 AromaticContact CE2-CD1 3.94Å; Y134-Y226 HydrophobicContact CE2-CD1 3.94Å; Y134-Y226 AromaticContact CE2-CD2 3.56Å; Y134-Y226 HydrophobicContact CE2-CD2 3.56Å; Y134-Y226 HydrophobicContact CE2-CE1 4.44Å; Y134-Y226 HydrophobicContact CE2-CE2 4.13Å; Y134-Y226 AromaticContact CE2-CG 3.41Å; Y134-Y226 HydrophobicContact CE2-CG 3.41Å; Y134-Y226 VanDerWaalsContact CE2-CG 3.41Å; Y134-Y226 AromaticContact CG-CD1 3.9Å; Y134-Y226 HydrophobicContact CG-CD1 3.9Å; Y134-Y226 HydrophobicContact CG-CG 4.07Å
135	I	95	Very high	93.3	Very high	19 Å²	19	37.5 Å²	37.5	10%	0.097	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-42.6	178.6	-70	163.7	0	0	0	110.4	S131 E132 R138 N139 L516	S131-I135 WeakPolarHBondContact O-CG1 3.34Å; S131-I135 PolarHBondContact O-N 3.18Å; E132-I135 PolarHBondContact O-N 2.95Å; I135-R138 PolarHBondContact O-N 3.01Å; I135-N139 WeakPolarHBondContact CG2-ND2 3.44Å; I135-N139 VanDerWaalsContact O-CB 3.27Å; I135-N139 WeakPolarHBondContact O-CB 3.49Å; I135-N139 PolarHBondContact O-N 2.83Å; I135-N139 PolarHBondContact O-ND2 2.83Å; I135-N139 PolarHBondContact O-OD1 2.76Å; I135-L516 HydrophobicContact CD1-CD1 4.09Å; I135-L516 HydrophobicContact CG2-CD1 4.32Å
136	N	94.9	Very high	92.8	Very high	93 Å²	93	37.2 Å²	37.2	50%	0.497	19%	0.191	S	C	.	.	H	α-helix	trans	-64	-47.1	176.5	-70.9	-32.1	0	0	0	112.4	E132 R133 Y134 R138 N139 A140	E132-N136 PolarHBondContact O-N 2.75Å; E132-N136 PolarHBondContact O-ND2 3.41Å; R133-N136 PolarHBondContact O-N 2.7Å; Y134-N136 VanDerWaalsContact C-N 3.27Å; Y134-N136 PolarHBondContact O-N 3.41Å; N136-R138 VanDerWaalsContact C-N 3.34Å; N136-R138 PolarHBondContact O-N 3.37Å; N136-N139 PolarHBondContact O-N 3.43Å; N136-A140 WeakPolarHBondContact O-CB 3.39Å; N136-A140 PolarHBondContact O-N 3.17Å; N136-A140 VanDerWaalsContact O-N 3.08Å
137	L	94	Very high	92.3	Very high	21 Å²	21	39.1 Å²	39.1	11%	0.11	21%	0.208	C	C	.	.	H	α-helix	trans	-56.8	-46.8	175.1	-71.6	171.7	0	0	0	111.5	R133 Y134 T194 Y198 Y226 L319	R133-L137 VanDerWaalsContact O-CG 3.3Å; R133-L137 WeakPolarHBondContact O-CG 3.01Å; R133-L137 PolarHBondContact O-N 3.36Å; Y134-L137 PolarHBondContact O-N 2.89Å; L137-T194 HydrophobicContact CB-CG2 3.8Å; L137-Y198 HydrophobicContact CB-CD2 4.07Å; L137-Y198 HydrophobicContact CB-CE2 3.56Å; L137-Y198 HydrophobicContact CD2-CD1 3.81Å; L137-Y198 HydrophobicContact CD2-CD2 3.96Å; L137-Y198 HydrophobicContact CD2-CE1 3.49Å; L137-Y198 VanDerWaalsContact CD2-CE1 3.49Å; L137-Y198 HydrophobicContact CD2-CE2 3.68Å; L137-Y198 HydrophobicContact CD2-CG 4.03Å; L137-Y198 VanDerWaalsContact CD2-CZ 3.41Å; L137-Y198 HydrophobicContact CG-CD2 4.43Å; L137-Y198 HydrophobicContact CG-CE2 4.16Å; L137-Y198 VanDerWaalsContact O-CE2 3.29Å; L137-Y198 WeakPolarHBondContact O-CE2 3.5Å; L137-Y198 PolarHBondContact O-OH 3.29Å; L137-Y226 HydrophobicContact CD1-CE1 4.45Å; L137-L319 HydrophobicContact CD1-CB 4.11Å
138	R	95.1	Very high	91.3	Very high	28 Å²	28	45.5 Å²	45.5	11%	0.106	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-49.9	179.4	-174.1	-159.6	67.6	-166.9	-2.9	112.1	Y134 I135 N136 A140 W141 C142 N190 E222	Y134-R138 HydrophobicContact CE2-CB 4.42Å; Y134-R138 WeakPolarHBondContact O-CB 3.46Å; Y134-R138 PolarHBondContact O-N 3.29Å; I135-R138 PolarHBondContact O-N 3.01Å; N136-R138 VanDerWaalsContact C-N 3.34Å; N136-R138 PolarHBondContact O-N 3.37Å; R138-A140 VanDerWaalsContact C-N 3.27Å; R138-A140 PolarHBondContact O-N 3.09Å; R138-W141 HydrophobicContact CG-CZ2 3.95Å; R138-W141 PolarHBondContact O-N 3.41Å; R138-C142 PolarHBondContact O-N 3.15Å; R138-C142 VanDerWaalsContact O-N 3.08Å; R138-C142 PolarHBondContact O-SG 3.11Å; R138-C142 VanDerWaalsContact O-SG 3.42Å; R138-N190 HydrophobicContact CG-CB 4.43Å; R138-E222 WeakPolarHBondContact CD-OE1 3.41Å; R138-E222 IonicContact CZ-OE1 3.68Å; R138-E222 IonicContact NE-OE1 2.69Å; R138-E222 IonicContact NH1-OE1 3.75Å; R138-E222 PolarHBondContact NH1-OE1 3.01Å
139	N	92	Very high	90.6	Very high	34 Å²	34	48.4 Å²	48.4	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-60.9	-37.8	-178.6	-68.9	-10.1	0	0	0	111.4	I135 N136 C142 I143	I135-N139 WeakPolarHBondContact CG2-ND2 3.44Å; I135-N139 VanDerWaalsContact O-CB 3.27Å; I135-N139 WeakPolarHBondContact O-CB 3.49Å; I135-N139 PolarHBondContact O-N 2.83Å; I135-N139 PolarHBondContact O-ND2 2.83Å; I135-N139 PolarHBondContact O-OD1 2.76Å; N136-N139 PolarHBondContact O-N 3.43Å; N139-C142 PolarHBondContact O-N 2.92Å; N139-I143 WeakPolarHBondContact O-CD1 3.29Å; N139-I143 VanDerWaalsContact O-CG1 3.27Å; N139-I143 WeakPolarHBondContact O-CG1 3.29Å; N139-I143 PolarHBondContact O-N 3.2Å
140	A	90.5	Very high	89.9	Confident	32 Å²	32	47 Å²	47	26%	0.264	23%	0.233	S	C	.	.	H	α-helix	trans	-62.2	-46.6	179.3	0	0	0	0	0	113.4	N136 R138 I143 H144 P327	N136-A140 WeakPolarHBondContact O-CB 3.39Å; N136-A140 PolarHBondContact O-N 3.17Å; N136-A140 VanDerWaalsContact O-N 3.08Å; R138-A140 VanDerWaalsContact C-N 3.27Å; R138-A140 PolarHBondContact O-N 3.09Å; A140-I143 PolarHBondContact O-N 3.16Å; A140-H144 PolarHBondContact O-N 3.11Å; A140-H144 VanDerWaalsContact O-N 3.09Å; A140-P327 HydrophobicContact CB-CB 4.49Å; A140-P327 HydrophobicContact CB-CG 3.9Å
141	W	91.8	Very high	89.6	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-73.1	-32.5	176.6	70.4	-107.1	0	0	0	112.5	R138 I143 H144 L145 F189 A193 T194 L197 L331 L523	R138-W141 HydrophobicContact CG-CZ2 3.95Å; R138-W141 PolarHBondContact O-N 3.41Å; W141-I143 VanDerWaalsContact C-N 3.34Å; W141-I143 PolarHBondContact O-N 2.67Å; W141-H144 PolarHBondContact O-N 3.08Å; W141-L145 HydrophobicContact CE3-CD1 3.57Å; W141-L145 HydrophobicContact CE3-CG 4.14Å; W141-L145 HydrophobicContact CZ3-CD1 3.63Å; W141-L145 WeakPolarHBondContact O-CG 3.35Å; W141-L145 PolarHBondContact O-N 3.13Å; W141-F189 HydrophobicContact CH2-CD1 4.27Å; W141-F189 AromaticContact CH2-CE1 3.73Å; W141-F189 HydrophobicContact CH2-CE1 3.73Å; W141-F189 HydrophobicContact CZ3-CE1 4.14Å; W141-A193 HydrophobicContact CH2-CB 3.94Å; W141-A193 HydrophobicContact CZ2-CB 3.72Å; W141-A193 HydrophobicContact CZ3-CB 4.45Å; W141-T194 PolarHBondContact NE1-OG1 3.08Å; W141-L197 HydrophobicContact CB-CD1 3.66Å; W141-L197 HydrophobicContact CD2-CD1 4.07Å; W141-L197 HydrophobicContact CE3-CD1 4.5Å; W141-L197 HydrophobicContact CG-CD1 3.69Å; W141-L331 HydrophobicContact CB-CD1 4.35Å; W141-L523 HydrophobicContact CZ3-CD1 4.05Å
142	C	90.9	Very high	89.1	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.02	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-44.3	171.7	-78.4	0	0	0	0	112	R138 N139 R146 L523	R138-C142 PolarHBondContact O-N 3.15Å; R138-C142 VanDerWaalsContact O-N 3.08Å; R138-C142 PolarHBondContact O-SG 3.11Å; R138-C142 VanDerWaalsContact O-SG 3.42Å; N139-C142 PolarHBondContact O-N 2.92Å; C142-R146 WeakPolarHBondContact O-CG 3.45Å; C142-R146 PolarHBondContact O-N 2.74Å; C142-R146 VanDerWaalsContact O-N 3.11Å; C142-L523 HydrophobicContact CB-CD1 4.16Å; C142-L523 HydrophobicContact CB-CG 4.46Å
143	I	88.1	Confident	88.8	Confident	117 Å²	117	56.2 Å²	56.2	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-63.8	-43.6	175.4	-69.5	163.7	0	0	0	110.6	N139 A140 W141 R146 S147	N139-I143 WeakPolarHBondContact O-CD1 3.29Å; N139-I143 VanDerWaalsContact O-CG1 3.27Å; N139-I143 WeakPolarHBondContact O-CG1 3.29Å; N139-I143 PolarHBondContact O-N 3.2Å; A140-I143 PolarHBondContact O-N 3.16Å; W141-I143 VanDerWaalsContact C-N 3.34Å; W141-I143 PolarHBondContact O-N 2.67Å; I143-R146 PolarHBondContact O-N 3.2Å; I143-S147 PolarHBondContact O-N 2.73Å
144	H	85	Confident	88.6	Confident	28 Å²	28	52.3 Å²	52.3	13%	0.13	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-46.8	177.5	177.9	73.9	0	0	0	112.4	A140 W141 R146 S147 V149 L331	A140-H144 PolarHBondContact O-N 3.11Å; A140-H144 VanDerWaalsContact O-N 3.09Å; W141-H144 PolarHBondContact O-N 3.08Å; H144-R146 VanDerWaalsContact C-N 3.32Å; H144-R146 PolarHBondContact O-N 2.97Å; H144-S147 VanDerWaalsContact O-CB 3.3Å; H144-S147 WeakPolarHBondContact O-CB 3.17Å; H144-S147 PolarHBondContact O-N 3.21Å; H144-S147 VanDerWaalsContact O-N 3.08Å; H144-S147 PolarHBondContact O-OG 2.98Å; H144-V149 PolarHBondContact CE1-O 2.89Å; H144-V149 PolarHBondContact NE2-O 2.93Å; H144-L331 HydrophobicContact CB-CD1 3.83Å
145	L	86.3	Confident	88.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-40.8	176.1	-71	-173.5	0	0	0	112.2	W141 S147 R148 V150 V154 I158 L523 I531	W141-L145 HydrophobicContact CE3-CD1 3.57Å; W141-L145 HydrophobicContact CE3-CG 4.14Å; W141-L145 HydrophobicContact CZ3-CD1 3.63Å; W141-L145 WeakPolarHBondContact O-CG 3.35Å; W141-L145 PolarHBondContact O-N 3.13Å; L145-S147 PolarHBondContact O-N 2.74Å; L145-R148 PolarHBondContact O-N 2.78Å; L145-V150 HydrophobicContact CD2-CB 4.35Å; L145-V150 HydrophobicContact CD2-CG1 3.64Å; L145-V150 HydrophobicContact CD2-CG2 3.68Å; L145-V154 HydrophobicContact CD2-CG1 3.91Å; L145-I158 HydrophobicContact CD1-CD1 3.94Å; L145-I158 HydrophobicContact CD1-CG1 4.25Å; L145-L523 HydrophobicContact CB-CD1 4.09Å; L145-L523 HydrophobicContact CD1-CD1 4.06Å; L145-I531 HydrophobicContact CB-CD1 4.34Å; L145-I531 HydrophobicContact CB-CG2 4.27Å; L145-I531 VanDerWaalsContact O-CG2 3.31Å; L145-I531 WeakPolarHBondContact O-CG2 3.42Å
146	R	85.4	Confident	88.2	Confident	97 Å²	97	59.4 Å²	59.4	37%	0.366	29%	0.294	S	S	.	.	H	α-helix	trans	-61	-23.4	176.2	-74.8	175.8	175.6	138.7	3.7	113.7	C142 I143 H144 R148 L521 L523	C142-R146 WeakPolarHBondContact O-CG 3.45Å; C142-R146 PolarHBondContact O-N 2.74Å; C142-R146 VanDerWaalsContact O-N 3.11Å; I143-R146 PolarHBondContact O-N 3.2Å; H144-R146 VanDerWaalsContact C-N 3.32Å; H144-R146 PolarHBondContact O-N 2.97Å; R146-R148 PolarHBondContact O-N 2.8Å; R146-L521 PolarHBondContact NH1-O 2.9Å; R146-L521 PolarHBondContact NH2-O 3.32Å; R146-L523 HydrophobicContact CG-CD2 3.84Å
147	S	84.5	Confident	88.2	Confident	66 Å²	66	55.5 Å²	55.5	46%	0.462	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.4	175.5	80	0	0	0	0	114.1	I143 H144 L145 V149	I143-S147 PolarHBondContact O-N 2.73Å; H144-S147 VanDerWaalsContact O-CB 3.3Å; H144-S147 WeakPolarHBondContact O-CB 3.17Å; H144-S147 PolarHBondContact O-N 3.21Å; H144-S147 VanDerWaalsContact O-N 3.08Å; H144-S147 PolarHBondContact O-OG 2.98Å; L145-S147 PolarHBondContact O-N 2.74Å; S147-V149 PolarHBondContact O-N 3.28Å; S147-V149 PolarHBondContact OG-N 3.48Å
148	R	75.7	Confident	88.2	Confident	138 Å²	138	54.5 Å²	54.5	52%	0.521	27%	0.268	S	S	.	.	S	Bend	trans	58.5	6.2	-173.3	-59.7	-173.4	179.2	-115.6	0.7	115.4	L145 R146 V150	L145-R148 PolarHBondContact O-N 2.78Å; R146-R148 PolarHBondContact O-N 2.8Å; R148-V150 PolarHBondContact O-N 3.46Å
149	V	80.1	Confident	88.1	Confident	96 Å²	96	55.3 Å²	55.3	58%	0.582	27%	0.274	S	S	*	.			trans	-99.3	78.4	170.9	-174.4	0	0	0	0	108.6	H144 S147	H144-V149 PolarHBondContact CE1-O 2.89Å; H144-V149 PolarHBondContact NE2-O 2.93Å; S147-V149 PolarHBondContact O-N 3.28Å; S147-V149 PolarHBondContact OG-N 3.48Å
150	V	82.2	Confident	88.2	Confident	14 Å²	14	54 Å²	54	9%	0.085	27%	0.268	C	S	.	.			trans	-114.6	137.5	-173.7	-173.5	0	0	0	0	109.5	L145 R148 V154 I531	L145-V150 HydrophobicContact CD2-CB 4.35Å; L145-V150 HydrophobicContact CD2-CG1 3.64Å; L145-V150 HydrophobicContact CD2-CG2 3.68Å; R148-V150 PolarHBondContact O-N 3.46Å; V150-V154 HydrophobicContact CG1-CB 3.68Å; V150-V154 HydrophobicContact CG1-CG1 3.45Å; V150-V154 VanDerWaalsContact CG1-CG1 3.45Å; V150-I531 HydrophobicContact CG2-CG2 4.26Å
151	S	87.6	Confident	88.5	Confident	33 Å²	33	52.5 Å²	52.5	23%	0.231	26%	0.256	C	S	.	.			trans	-71.8	151.9	176.8	71.8	0	0	0	0	111.9	Q153 V154 C155	S151-Q153 PolarHBondContact O-N 2.88Å; S151-V154 PolarHBondContact O-N 3.01Å; S151-V154 VanDerWaalsContact OG-CG2 3.3Å; S151-V154 WeakPolarHBondContact OG-CG2 3.47Å; S151-V154 PolarHBondContact OG-N 3.42Å; S151-C155 PolarHBondContact O-N 2.97Å
152	E	87.5	Confident	88.7	Confident	164 Å²	164	54.7 Å²	54.7	77%	0.766	26%	0.264	S	S	*	.	H	α-helix	trans	-55	-41.3	178.7	-176.2	177.8	-169	0	0	112	V154 C155 W156	E152-V154 PolarHBondContact O-N 3.45Å; E152-C155 PolarHBondContact O-N 3.08Å; E152-W156 WeakPolarHBondContact O-CB 3.45Å; E152-W156 PolarHBondContact O-N 3.34Å
153	Q	88.5	Confident	88.8	Confident	110 Å²	110	61 Å²	61	51%	0.514	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-41.8	177.1	-172.8	174.7	4.7	0	0	112.3	S151 W156 I157	S151-Q153 PolarHBondContact O-N 2.88Å; Q153-W156 PolarHBondContact O-N 3.24Å; Q153-I157 HydrophobicContact CG-CD1 4.28Å; Q153-I157 VanDerWaalsContact O-CG1 3.31Å; Q153-I157 WeakPolarHBondContact O-CG1 3.39Å; Q153-I157 PolarHBondContact O-N 3.48Å
154	V	90.5	Very high	89.2	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-44.6	176.2	171.7	0	0	0	0	110.5	L145 V150 S151 E152 W156 I157 I158 L197 L331	L145-V154 HydrophobicContact CD2-CG1 3.91Å; V150-V154 HydrophobicContact CG1-CB 3.68Å; V150-V154 HydrophobicContact CG1-CG1 3.45Å; V150-V154 VanDerWaalsContact CG1-CG1 3.45Å; S151-V154 PolarHBondContact O-N 3.01Å; S151-V154 VanDerWaalsContact OG-CG2 3.3Å; S151-V154 WeakPolarHBondContact OG-CG2 3.47Å; S151-V154 PolarHBondContact OG-N 3.42Å; E152-V154 PolarHBondContact O-N 3.45Å; V154-W156 VanDerWaalsContact C-N 3.29Å; V154-W156 PolarHBondContact O-N 3.46Å; V154-I157 PolarHBondContact O-N 3.03Å; V154-I158 HydrophobicContact CG1-CG1 4.12Å; V154-I158 VanDerWaalsContact O-CB 3.31Å; V154-I158 WeakPolarHBondContact O-CB 3.4Å; V154-I158 WeakPolarHBondContact O-CG1 3.47Å; V154-I158 PolarHBondContact O-N 2.92Å; V154-L197 HydrophobicContact CB-CD2 4.49Å; V154-L197 HydrophobicContact CG1-CD2 4.04Å; V154-L197 HydrophobicContact CG2-CD2 3.97Å; V154-L331 HydrophobicContact CG1-CD2 4.41Å; V154-L331 HydrophobicContact CG2-CD2 3.77Å
155	C	90.3	Very high	89.8	Confident	26 Å²	26	54.2 Å²	54.2	18%	0.176	25%	0.253	C	S	.	.	H	α-helix	trans	-58.3	-39.2	173.3	-82.4	0	0	0	0	112.5	S151 E152 N159	S151-C155 PolarHBondContact O-N 2.97Å; E152-C155 PolarHBondContact O-N 3.08Å; C155-N159 VanDerWaalsContact O-CB 3.25Å; C155-N159 WeakPolarHBondContact O-CB 3.27Å; C155-N159 PolarHBondContact O-N 3.43Å; C155-N159 PolarHBondContact O-ND2 3.24Å; C155-N159 VanDerWaalsContact O-ND2 3.14Å
156	W	92.1	Very high	90.1	Very high	143 Å²	143	56.6 Å²	56.6	54%	0.542	27%	0.265	S	S	.	.	H	α-helix	trans	-66.2	-45.1	175.9	-179.8	93	0	0	0	112.4	E152 Q153 V154 S160	E152-W156 WeakPolarHBondContact O-CB 3.45Å; E152-W156 PolarHBondContact O-N 3.34Å; Q153-W156 PolarHBondContact O-N 3.24Å; V154-W156 VanDerWaalsContact C-N 3.29Å; V154-W156 PolarHBondContact O-N 3.46Å; W156-S160 VanDerWaalsContact O-CB 3.26Å; W156-S160 WeakPolarHBondContact O-CB 3.26Å; W156-S160 PolarHBondContact O-N 3.06Å; W156-S160 PolarHBondContact O-OG 3.32Å
157	I	93.7	Very high	90.6	Very high	10 Å²	10	56.8 Å²	56.8	5%	0.051	27%	0.266	C	S	.	.	H	α-helix	trans	-58.6	-53.5	176	-71.7	168.9	0	0	0	109.7	Q153 V154 N159 S160 I161 A196	Q153-I157 HydrophobicContact CG-CD1 4.28Å; Q153-I157 VanDerWaalsContact O-CG1 3.31Å; Q153-I157 WeakPolarHBondContact O-CG1 3.39Å; Q153-I157 PolarHBondContact O-N 3.48Å; V154-I157 PolarHBondContact O-N 3.03Å; I157-N159 PolarHBondContact O-N 3.21Å; I157-S160 PolarHBondContact O-N 3.06Å; I157-S160 VanDerWaalsContact O-N 3.08Å; I157-I161 HydrophobicContact CG2-CD1 3.69Å; I157-I161 HydrophobicContact CG2-CG1 4.5Å; I157-I161 WeakPolarHBondContact O-CG1 3.35Å; I157-I161 PolarHBondContact O-N 3.24Å; I157-A196 HydrophobicContact CG2-CB 3.69Å
158	I	94.2	Very high	91.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-47.8	-177.6	-71.3	-69.3	0	0	0	111.7	L145 V154 S160 I161 R162 F189 A193 L197 I528 C532	L145-I158 HydrophobicContact CD1-CD1 3.94Å; L145-I158 HydrophobicContact CD1-CG1 4.25Å; V154-I158 HydrophobicContact CG1-CG1 4.12Å; V154-I158 VanDerWaalsContact O-CB 3.31Å; V154-I158 WeakPolarHBondContact O-CB 3.4Å; V154-I158 WeakPolarHBondContact O-CG1 3.47Å; V154-I158 PolarHBondContact O-N 2.92Å; I158-S160 VanDerWaalsContact C-N 3.29Å; I158-S160 PolarHBondContact O-N 3.45Å; I158-I161 PolarHBondContact O-N 2.93Å; I158-R162 WeakPolarHBondContact O-CB 3.39Å; I158-R162 PolarHBondContact O-N 2.95Å; I158-F189 HydrophobicContact CD1-CE1 4.38Å; I158-F189 HydrophobicContact CD1-CZ 3.76Å; I158-F189 HydrophobicContact CG2-CE2 4.46Å; I158-F189 HydrophobicContact CG2-CZ 3.99Å; I158-A193 HydrophobicContact CD1-CB 3.95Å; I158-L197 HydrophobicContact CD1-CD1 4.49Å; I158-I528 HydrophobicContact CG2-CG2 3.37Å; I158-C532 VanDerWaalsContact CG2-SG 3.54Å
159	N	93.1	Very high	92.1	Very high	46 Å²	46	48.2 Å²	48.2	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-33.3	176.2	-80.5	-40.3	0	0	0	112.5	C155 I157 R163	C155-N159 VanDerWaalsContact O-CB 3.25Å; C155-N159 WeakPolarHBondContact O-CB 3.27Å; C155-N159 PolarHBondContact O-N 3.43Å; C155-N159 PolarHBondContact O-ND2 3.24Å; C155-N159 VanDerWaalsContact O-ND2 3.14Å; I157-N159 PolarHBondContact O-N 3.21Å; N159-R163 WeakPolarHBondContact O-CG 3.45Å; N159-R163 PolarHBondContact O-N 3.36Å; N159-R163 PolarHBondContact O-NH1 2.88Å
160	S	94.7	Very high	92.8	Very high	7 Å²	7	46.3 Å²	46.3	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-72.1	-41.2	179.2	-59.5	0	0	0	0	112.3	W156 I157 I158 R163 D164	W156-S160 VanDerWaalsContact O-CB 3.26Å; W156-S160 WeakPolarHBondContact O-CB 3.26Å; W156-S160 PolarHBondContact O-N 3.06Å; W156-S160 PolarHBondContact O-OG 3.32Å; I157-S160 PolarHBondContact O-N 3.06Å; I157-S160 VanDerWaalsContact O-N 3.08Å; I158-S160 VanDerWaalsContact C-N 3.29Å; I158-S160 PolarHBondContact O-N 3.45Å; S160-R163 PolarHBondContact O-N 3Å; S160-R163 PolarHBondContact OG-NH2 3.21Å; S160-D164 PolarHBondContact O-N 3.42Å
161	I	97.1	Very high	93.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-51.2	170.5	-65.5	162.7	0	0	0	110	I157 I158 R163 D164 V165 F189 L192 A193 A196 Y204	I157-I161 HydrophobicContact CG2-CD1 3.69Å; I157-I161 HydrophobicContact CG2-CG1 4.5Å; I157-I161 WeakPolarHBondContact O-CG1 3.35Å; I157-I161 PolarHBondContact O-N 3.24Å; I158-I161 PolarHBondContact O-N 2.93Å; I161-R163 VanDerWaalsContact C-N 3.32Å; I161-R163 PolarHBondContact O-N 3.46Å; I161-D164 PolarHBondContact O-N 3.06Å; I161-V165 HydrophobicContact CG2-CG2 3.91Å; I161-V165 WeakPolarHBondContact O-CG2 3.36Å; I161-V165 PolarHBondContact O-N 3.37Å; I161-F189 HydrophobicContact CB-CD2 4.38Å; I161-F189 HydrophobicContact CB-CE2 4.1Å; I161-F189 HydrophobicContact CG2-CD2 3.61Å; I161-F189 HydrophobicContact CG2-CE2 3.79Å; I161-F189 HydrophobicContact CG2-CG 4.36Å; I161-L192 HydrophobicContact CD1-CB 4.41Å; I161-L192 HydrophobicContact CG1-CB 4.37Å; I161-L192 HydrophobicContact CG2-CB 3.65Å; I161-L192 HydrophobicContact CG2-CD1 4.05Å; I161-A193 HydrophobicContact CD1-CB 4.14Å; I161-A196 HydrophobicContact CD1-CB 4.1Å; I161-Y204 HydrophobicContact CD1-CD2 4.24Å; I161-Y204 HydrophobicContact CD1-CG 4.2Å; I161-Y204 HydrophobicContact CG1-CD1 3.78Å; I161-Y204 HydrophobicContact CG1-CD2 3.45Å; I161-Y204 VanDerWaalsContact CG1-CD2 3.45Å; I161-Y204 HydrophobicContact CG1-CE1 4.21Å; I161-Y204 HydrophobicContact CG1-CE2 3.89Å; I161-Y204 HydrophobicContact CG1-CG 3.39Å
162	R	94.7	Very high	93.6	Very high	46 Å²	46	54.4 Å²	54.4	17%	0.174	24%	0.243	C	C	.	.	H	α-helix	trans	-54.9	-46.4	180	-179.3	172.9	-173.1	-116.4	0.9	112.1	I158 D164 V165 I166 F189 L525 N526 Q529	I158-R162 WeakPolarHBondContact O-CB 3.39Å; I158-R162 PolarHBondContact O-N 2.95Å; R162-D164 VanDerWaalsContact C-N 3.26Å; R162-D164 PolarHBondContact O-N 2.86Å; R162-V165 PolarHBondContact O-N 2.96Å; R162-I166 PolarHBondContact O-N 3.3Å; R162-F189 HydrophobicContact CB-CD2 4.38Å; R162-F189 HydrophobicContact CB-CE2 4.1Å; R162-L525 HydrophobicContact CG-CD1 4.02Å; R162-L525 HydrophobicContact CG-CD2 4.46Å; R162-L525 HydrophobicContact CG-CG 4.16Å; R162-L525 PolarHBondContact NE-O 3.06Å; R162-L525 VanDerWaalsContact NE-O 3.12Å; R162-N526 PolarHBondContact NH2-OD1 3.09Å; R162-Q529 VanDerWaalsContact NH1-CD 3.35Å
163	R	94.1	Very high	94	Very high	135 Å²	135	51.8 Å²	51.8	51%	0.509	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-30.4	179	-77.9	-167.9	-47	-81.3	-0.9	113.5	N159 S160 I161 R167	N159-R163 WeakPolarHBondContact O-CG 3.45Å; N159-R163 PolarHBondContact O-N 3.36Å; N159-R163 PolarHBondContact O-NH1 2.88Å; S160-R163 PolarHBondContact O-N 3Å; S160-R163 PolarHBondContact OG-NH2 3.21Å; I161-R163 VanDerWaalsContact C-N 3.32Å; I161-R163 PolarHBondContact O-N 3.46Å; R163-R167 WeakPolarHBondContact O-CD 3.15Å; R163-R167 WeakPolarHBondContact O-CG 3.13Å
164	D	96.4	Very high	94.3	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-84.9	-41.8	176	-89	-25	0	0	0	112.5	S160 I161 R162 I166 R167 T168 Y204 Q206	S160-D164 PolarHBondContact O-N 3.42Å; I161-D164 PolarHBondContact O-N 3.06Å; R162-D164 VanDerWaalsContact C-N 3.26Å; R162-D164 PolarHBondContact O-N 2.86Å; D164-I166 VanDerWaalsContact C-N 3.34Å; D164-I166 PolarHBondContact O-N 3.12Å; D164-R167 PolarHBondContact O-N 2.98Å; D164-R167 IonicContact OD1-CZ 2.7Å; D164-R167 VanDerWaalsContact OD1-CZ 3.32Å; D164-R167 IonicContact OD1-NE 3.84Å; D164-R167 PolarHBondContact OD1-NE 3.49Å; D164-R167 VanDerWaalsContact OD1-NE 3.07Å; D164-R167 IonicContact OD1-NH2 3.13Å; D164-R167 PolarHBondContact OD1-NH2 3.19Å; D164-T168 PolarHBondContact O-N 2.88Å; D164-T168 VanDerWaalsContact O-N 3.17Å; D164-T168 PolarHBondContact O-OG1 3.31Å; D164-Y204 WeakPolarHBondContact CB-OH 3.47Å; D164-Y204 PolarHBondContact OD2-OH 2.84Å; D164-Q206 PolarHBondContact OD1-NE2 3.19Å; D164-Q206 WeakPolarHBondContact OD2-CA 3.33Å; D164-Q206 WeakPolarHBondContact OD2-CG 3.29Å
165	V	96.3	Very high	94.6	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-54.3	-46.4	-178.7	166.7	0	0	0	0	112	I161 R162 R167 T168 L185 L188 F189 L192	I161-V165 HydrophobicContact CG2-CG2 3.91Å; I161-V165 WeakPolarHBondContact O-CG2 3.36Å; I161-V165 PolarHBondContact O-N 3.37Å; R162-V165 PolarHBondContact O-N 2.96Å; V165-R167 PolarHBondContact O-N 3.45Å; V165-R167 VanDerWaalsContact O-N 3.1Å; V165-T168 PolarHBondContact O-N 2.8Å; V165-T168 VanDerWaalsContact O-N 3.09Å; V165-L185 HydrophobicContact CG1-CB 4.14Å; V165-L185 HydrophobicContact CG1-CD2 4.1Å; V165-L185 WeakPolarHBondContact CG1-O 3.44Å; V165-L188 HydrophobicContact CG1-CD2 4.4Å; V165-L188 HydrophobicContact CG2-CD2 4.36Å; V165-L188 HydrophobicContact CG2-CG 4.2Å; V165-F189 HydrophobicContact CG1-CB 4.4Å; V165-F189 HydrophobicContact CG2-CB 4.26Å; V165-L192 HydrophobicContact CG2-CD1 3.83Å
166	I	94	Very high	94.7	Very high	51 Å²	51	48.8 Å²	48.8	26%	0.262	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.1	179.6	63.2	178	0	0	0	113.4	R162 D164 R170 L525	R162-I166 PolarHBondContact O-N 3.3Å; D164-I166 VanDerWaalsContact C-N 3.34Å; D164-I166 PolarHBondContact O-N 3.12Å; I166-R170 WeakPolarHBondContact O-CD 3.36Å; I166-R170 VanDerWaalsContact O-CG 3.3Å; I166-R170 WeakPolarHBondContact O-CG 3.43Å; I166-R170 PolarHBondContact O-NH1 3.07Å; I166-L525 HydrophobicContact CG2-CD2 3.66Å
167	R	94.6	Very high	94.5	Very high	100 Å²	100	44.8 Å²	44.8	38%	0.377	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-14.8	178.8	-22.4	-178.3	-64	128	-2	112.9	R163 D164 V165 D169	R163-R167 WeakPolarHBondContact O-CD 3.15Å; R163-R167 WeakPolarHBondContact O-CG 3.13Å; D164-R167 PolarHBondContact O-N 2.98Å; D164-R167 IonicContact OD1-CZ 2.7Å; D164-R167 VanDerWaalsContact OD1-CZ 3.32Å; D164-R167 IonicContact OD1-NE 3.84Å; D164-R167 PolarHBondContact OD1-NE 3.49Å; D164-R167 VanDerWaalsContact OD1-NE 3.07Å; D164-R167 IonicContact OD1-NH2 3.13Å; D164-R167 PolarHBondContact OD1-NH2 3.19Å; V165-R167 PolarHBondContact O-N 3.45Å; V165-R167 VanDerWaalsContact O-N 3.1Å; R167-D169 PolarHBondContact O-N 3.49Å
168	T	96.2	Very high	94.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.006	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	122.5	-169.1	-65.2	0	0	0	0	111.2	D164 V165 R170 L188 S209	D164-T168 PolarHBondContact O-N 2.88Å; D164-T168 VanDerWaalsContact O-N 3.17Å; D164-T168 PolarHBondContact O-OG1 3.31Å; V165-T168 PolarHBondContact O-N 2.8Å; V165-T168 VanDerWaalsContact O-N 3.09Å; T168-R170 WeakPolarHBondContact O-CD 3.16Å; T168-R170 PolarHBondContact O-N 3.42Å; T168-L188 HydrophobicContact CG2-CD2 3.8Å; T168-S209 WeakPolarHBondContact OG1-CB 3.4Å; T168-S209 PolarHBondContact OG1-OG 2.91Å
169	D	95.7	Very high	93.5	Very high	23 Å²	23	52.6 Å²	52.6	12%	0.123	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	33.1	170	-67.6	-45	0	0	0	116.5	R167 M171 H172 Y175 S213 K289 F294	R167-D169 PolarHBondContact O-N 3.49Å; D169-M171 PolarHBondContact O-N 2.93Å; D169-H172 HydrophobicContact CB-CB 4.37Å; D169-H172 VanDerWaalsContact O-CB 3.25Å; D169-H172 WeakPolarHBondContact O-CB 3.49Å; D169-H172 PolarHBondContact O-N 3.39Å; D169-Y175 HydrophobicContact CB-CD2 3.92Å; D169-Y175 HydrophobicContact CB-CE2 4.38Å; D169-S213 WeakPolarHBondContact OD2-CB 3.49Å; D169-S213 PolarHBondContact OD2-OG 3.21Å; D169-K289 VanDerWaalsContact CG-NZ 3.35Å; D169-K289 IonicContact OD1-NZ 3.97Å; D169-K289 PolarHBondContact OD1-NZ 3.31Å; D169-K289 VanDerWaalsContact OD1-NZ 3.16Å; D169-K289 IonicContact OD2-NZ 3.29Å; D169-K289 PolarHBondContact OD2-NZ 2.95Å; D169-F294 HydrophobicContact CB-CD2 4.45Å; D169-F294 HydrophobicContact CB-CE2 4.34Å
170	R	94.7	Very high	92.6	Very high	57 Å²	57	54.3 Å²	54.3	22%	0.215	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.4	-174.6	-58.5	-58.2	-62	-73.9	-1.2	115.9	I166 T168 H172 Y175 G177 E179	I166-R170 WeakPolarHBondContact O-CD 3.36Å; I166-R170 VanDerWaalsContact O-CG 3.3Å; I166-R170 WeakPolarHBondContact O-CG 3.43Å; I166-R170 PolarHBondContact O-NH1 3.07Å; T168-R170 WeakPolarHBondContact O-CD 3.16Å; T168-R170 PolarHBondContact O-N 3.42Å; R170-H172 VanDerWaalsContact C-N 3.34Å; R170-Y175 WeakPolarHBondContact CD-O 3.43Å; R170-Y175 PolarHBondContact NE-O 3.03Å; R170-G177 PolarHBondContact NH2-O 2.98Å; R170-E179 IonicContact CZ-OE1 2.67Å; R170-E179 IonicContact NH1-OE1 3.32Å; R170-E179 PolarHBondContact NH1-OE1 3.14Å; R170-E179 IonicContact NH2-OE1 2.73Å
171	M	92.5	Very high	91.9	Very high	178 Å²	178	60.3 Å²	60.3	88%	0.877	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.8	171.6	-60.1	-55.1	-58.7	0	0	113.3	D169	D169-M171 PolarHBondContact O-N 2.93Å
172	H	95.4	Very high	91.5	Very high	39 Å²	39	61.3 Å²	61.3	18%	0.181	31%	0.311	C	S	.	.	S	Bend	trans	-84.3	131.5	176.9	-176.4	-97.1	0	0	0	109.4	D169 R170 F174 Y175 A176 V217 F294	D169-H172 HydrophobicContact CB-CB 4.37Å; D169-H172 VanDerWaalsContact O-CB 3.25Å; D169-H172 WeakPolarHBondContact O-CB 3.49Å; D169-H172 PolarHBondContact O-N 3.39Å; R170-H172 VanDerWaalsContact C-N 3.34Å; H172-F174 VanDerWaalsContact ND1-CB 3.28Å; H172-F174 WeakPolarHBondContact ND1-CB 3.34Å; H172-F174 PolarHBondContact ND1-N 3.32Å; H172-F174 PolarHBondContact O-N 3.47Å; H172-Y175 PolarHBondContact O-N 3.43Å; H172-A176 PolarHBondContact O-N 2.89Å; H172-A176 VanDerWaalsContact O-N 3.12Å; H172-V217 VanDerWaalsContact CE1-CG1 3.48Å; H172-V217 WeakPolarHBondContact CE1-CG1 3.23Å; H172-F294 AromaticContact CD2-CD1 3.76Å; H172-F294 AromaticContact CD2-CG 3.87Å; H172-F294 AromaticContact NE2-CD1 3.87Å; H172-F294 AromaticContact NE2-CE1 3.96Å
173	P	94.9	Very high	91.4	Very high	109 Å²	109	62.2 Å²	62.2	71%	0.708	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-53.2	-30.8	-172.1	-30.5	36.1	0	0	0	115.4	Y175 A176	P173-Y175 VanDerWaalsContact C-N 3.29Å; P173-Y175 PolarHBondContact O-N 2.88Å; P173-A176 PolarHBondContact O-N 3.36Å
174	F	95.5	Very high	91.5	Very high	34 Å²	34	58.1 Å²	58.1	15%	0.149	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-63.2	-31	177.4	-166.4	-97.4	0	0	0	113.4	H172 N182 N184 L216 V217 K220	H172-F174 VanDerWaalsContact ND1-CB 3.28Å; H172-F174 WeakPolarHBondContact ND1-CB 3.34Å; H172-F174 PolarHBondContact ND1-N 3.32Å; H172-F174 PolarHBondContact O-N 3.47Å; F174-N182 PolarHBondContact O-ND2 3.18Å; F174-N184 HydrophobicContact CD1-CB 3.69Å; F174-N184 HydrophobicContact CE1-CB 3.48Å; F174-N184 VanDerWaalsContact CE1-CB 3.48Å; F174-N184 HydrophobicContact CG-CB 4.42Å; F174-N184 HydrophobicContact CZ-CB 4.04Å; F174-N184 WeakPolarHBondContact CZ-OD1 3.46Å; F174-N184 WeakPolarHBondContact O-CB 3.42Å; F174-N184 PolarHBondContact O-ND2 3.48Å; F174-L216 HydrophobicContact CE1-CD2 4.22Å; F174-L216 HydrophobicContact CE1-CG 3.92Å; F174-L216 HydrophobicContact CZ-CG 4.2Å; F174-V217 HydrophobicContact CB-CG2 4.07Å; F174-V217 HydrophobicContact CD1-CG2 3.56Å; F174-V217 HydrophobicContact CE1-CG2 4.04Å; F174-V217 HydrophobicContact CG-CG2 3.87Å; F174-K220 HydrophobicContact CE2-CG 4.31Å
175	Y	96.3	Very high	91.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-111	5.6	179	-58.5	-63.2	0	0	0	113.2	D169 R170 H172 P173 N182 N184 L185 L188 S213 L216 V217	D169-Y175 HydrophobicContact CB-CD2 3.92Å; D169-Y175 HydrophobicContact CB-CE2 4.38Å; R170-Y175 WeakPolarHBondContact CD-O 3.43Å; R170-Y175 PolarHBondContact NE-O 3.03Å; H172-Y175 PolarHBondContact O-N 3.43Å; P173-Y175 VanDerWaalsContact C-N 3.29Å; P173-Y175 PolarHBondContact O-N 2.88Å; Y175-N182 WeakPolarHBondContact CA-ND2 3.39Å; Y175-N184 HydrophobicContact CD1-CB 4.1Å; Y175-N184 HydrophobicContact CE1-CB 4.07Å; Y175-L185 HydrophobicContact CD1-CD2 3.76Å; Y175-L185 HydrophobicContact CD1-CG 4.38Å; Y175-L185 HydrophobicContact CG-CD2 4.32Å; Y175-L188 HydrophobicContact CE1-CB 4.27Å; Y175-L188 HydrophobicContact CE1-CD2 4.13Å; Y175-S213 WeakPolarHBondContact CE2-OG 3.32Å; Y175-S213 WeakPolarHBondContact OH-CA 3.49Å; Y175-S213 PolarHBondContact OH-O 3.05Å; Y175-L216 HydrophobicContact CE1-CD2 4.39Å; Y175-V217 HydrophobicContact CD2-CG2 4.41Å; Y175-V217 HydrophobicContact CE2-CG2 3.55Å
176	A	92.7	Very high	91.4	Very high	42 Å²	42	58.8 Å²	58.8	35%	0.347	32%	0.321	S	S	.	.			trans	-73.5	170.1	175.5	0	0	0	0	0	111.6	H172 P173 N182	H172-A176 PolarHBondContact O-N 2.89Å; H172-A176 VanDerWaalsContact O-N 3.12Å; P173-A176 PolarHBondContact O-N 3.36Å; A176-N182 PolarHBondContact O-ND2 3.2Å
177	G	88.6	Confident	91.5	Very high	59 Å²	59	57.4 Å²	57.4	61%	0.608	32%	0.316	S	S	*	.	S	Bend	trans	82.2	-168.9	-177.1	0	0	0	0	0	113.6	R170	R170-G177 PolarHBondContact NH2-O 2.98Å
178	D	85.8	Confident	91.7	Very high	90 Å²	90	52.6 Å²	52.6	48%	0.481	30%	0.298	S	S	.	.			trans	-64.3	139.2	-172.1	-178.7	22.1	0	0	0	113.3	E180 H181 N182	D178-E180 PolarHBondContact OD1-N 3.12Å; D178-H181 IonicContact OD2-CE1 3.72Å; D178-H181 IonicContact OD2-CG 3.63Å; D178-H181 IonicContact OD2-ND1 2.72Å; D178-H181 PolarHBondContact OD2-ND1 2.91Å; D178-N182 WeakPolarHBondContact O-CB 3.44Å; D178-N182 PolarHBondContact O-N 3.37Å; D178-N182 VanDerWaalsContact O-N 3.1Å
179	E	80.9	Confident	91.7	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-34.4	-176.2	-33.6	-152.7	135.7	0	0	112.1	R170	R170-E179 IonicContact CZ-OE1 2.67Å; R170-E179 IonicContact NH1-OE1 3.32Å; R170-E179 PolarHBondContact NH1-OE1 3.14Å; R170-E179 IonicContact NH2-OE1 2.73Å
180	E	73.6	Confident	91.8	Very high	81 Å²	81	51.5 Å²	51.5	38%	0.379	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-31.8	-175.6	-177.6	164.5	-159.4	0	0	112.6	D178 N526	D178-E180 PolarHBondContact OD1-N 3.12Å; E180-N526 PolarHBondContact OE1-ND2 3.41Å; E180-N526 PolarHBondContact OE2-ND2 3.03Å
181	H	79.2	Confident	92	Very high	133 Å²	133	48.9 Å²	48.9	62%	0.616	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-8.6	-173.5	-64.4	93.2	0	0	0	114.5	D178 A183	D178-H181 IonicContact OD2-CE1 3.72Å; D178-H181 IonicContact OD2-CG 3.63Å; D178-H181 IonicContact OD2-ND1 2.72Å; D178-H181 PolarHBondContact OD2-ND1 2.91Å; H181-A183 PolarHBondContact O-N 2.98Å; H181-A183 VanDerWaalsContact O-N 3.11Å
182	N	90.2	Very high	92.3	Very high	21 Å²	21	40.4 Å²	40.4	11%	0.112	24%	0.24	C	C	.	.			trans	-75.8	101.5	176.5	-173.4	-31.5	0	0	0	111.7	F174 Y175 A176 D178 N184 L185 V186	F174-N182 PolarHBondContact O-ND2 3.18Å; Y175-N182 WeakPolarHBondContact CA-ND2 3.39Å; A176-N182 PolarHBondContact O-ND2 3.2Å; D178-N182 WeakPolarHBondContact O-CB 3.44Å; D178-N182 PolarHBondContact O-N 3.37Å; D178-N182 VanDerWaalsContact O-N 3.1Å; N182-N184 PolarHBondContact O-N 2.63Å; N182-N184 VanDerWaalsContact O-N 3.16Å; N182-N184 WeakPolarHBondContact OD1-CA 3.39Å; N182-N184 WeakPolarHBondContact OD1-CB 3.42Å; N182-N184 PolarHBondContact OD1-N 2.98Å; N182-L185 HydrophobicContact CB-CD1 4.07Å; N182-L185 HydrophobicContact CB-CG 4.16Å; N182-L185 WeakPolarHBondContact O-CB 3.29Å; N182-L185 PolarHBondContact O-N 3.13Å; N182-L185 PolarHBondContact OD1-N 2.86Å; N182-V186 PolarHBondContact O-N 2.66Å
183	A	92.7	Very high	92.3	Very high	65 Å²	65	38.5 Å²	38.5	54%	0.537	23%	0.232	S	C	.	.	H	α-helix	trans	-57.9	-25.1	177.2	0	0	0	0	0	114.6	H181 V186 S187	H181-A183 PolarHBondContact O-N 2.98Å; H181-A183 VanDerWaalsContact O-N 3.11Å; A183-V186 PolarHBondContact O-N 3.43Å; A183-S187 PolarHBondContact O-N 3.1Å; A183-S187 PolarHBondContact O-OG 2.99Å
184	N	95.5	Very high	92.4	Very high	49 Å²	49	33.3 Å²	33.3	26%	0.262	20%	0.198	S	C	.	.	H	α-helix	trans	-74.6	-30	176.9	-58.3	-39.9	0	0	0	112.2	F174 Y175 N182 S187 L188	F174-N184 HydrophobicContact CD1-CB 3.69Å; F174-N184 HydrophobicContact CE1-CB 3.48Å; F174-N184 VanDerWaalsContact CE1-CB 3.48Å; F174-N184 HydrophobicContact CG-CB 4.42Å; F174-N184 HydrophobicContact CZ-CB 4.04Å; F174-N184 WeakPolarHBondContact CZ-OD1 3.46Å; F174-N184 WeakPolarHBondContact O-CB 3.42Å; F174-N184 PolarHBondContact O-ND2 3.48Å; Y175-N184 HydrophobicContact CD1-CB 4.1Å; Y175-N184 HydrophobicContact CE1-CB 4.07Å; N182-N184 PolarHBondContact O-N 2.63Å; N182-N184 VanDerWaalsContact O-N 3.16Å; N182-N184 WeakPolarHBondContact OD1-CA 3.39Å; N182-N184 WeakPolarHBondContact OD1-CB 3.42Å; N182-N184 PolarHBondContact OD1-N 2.98Å; N184-S187 PolarHBondContact O-N 2.97Å; N184-L188 WeakPolarHBondContact O-CB 3.45Å; N184-L188 PolarHBondContact O-N 2.92Å
185	L	95.8	Very high	92.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.6	-40.7	169.9	-67.9	176.9	0	0	0	110.8	V165 Y175 N182 S187 L188 F189	V165-L185 HydrophobicContact CG1-CB 4.14Å; V165-L185 HydrophobicContact CG1-CD2 4.1Å; V165-L185 WeakPolarHBondContact CG1-O 3.44Å; Y175-L185 HydrophobicContact CD1-CD2 3.76Å; Y175-L185 HydrophobicContact CD1-CG 4.38Å; Y175-L185 HydrophobicContact CG-CD2 4.32Å; N182-L185 HydrophobicContact CB-CD1 4.07Å; N182-L185 HydrophobicContact CB-CG 4.16Å; N182-L185 WeakPolarHBondContact O-CB 3.29Å; N182-L185 PolarHBondContact O-N 3.13Å; N182-L185 PolarHBondContact OD1-N 2.86Å; L185-S187 VanDerWaalsContact C-N 3.32Å; L185-S187 PolarHBondContact O-N 2.89Å; L185-L188 PolarHBondContact O-N 2.71Å; L185-F189 WeakPolarHBondContact O-CB 3.21Å; L185-F189 PolarHBondContact O-N 3.19Å
186	V	94.7	Very high	92.5	Very high	18 Å²	18	32 Å²	32	11%	0.109	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-42.4	172.9	-180	0	0	0	0	110.7	N182 A183 F189 N190 P522	N182-V186 PolarHBondContact O-N 2.66Å; A183-V186 PolarHBondContact O-N 3.43Å; V186-F189 WeakPolarHBondContact O-CB 3.44Å; V186-F189 PolarHBondContact O-N 2.84Å; V186-N190 WeakPolarHBondContact O-CB 3.47Å; V186-N190 PolarHBondContact O-N 3.07Å; V186-N190 PolarHBondContact O-ND2 2.94Å; V186-P522 HydrophobicContact CG1-CB 4.22Å
187	S	96.7	Very high	92.5	Very high	22 Å²	22	30.3 Å²	30.3	15%	0.154	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-41.2	176.4	-60.6	0	0	0	0	112.8	A183 N184 L185 F189 N190 V191 E222	A183-S187 PolarHBondContact O-N 3.1Å; A183-S187 PolarHBondContact O-OG 2.99Å; N184-S187 PolarHBondContact O-N 2.97Å; L185-S187 VanDerWaalsContact C-N 3.32Å; L185-S187 PolarHBondContact O-N 2.89Å; S187-F189 VanDerWaalsContact C-N 3.32Å; S187-F189 PolarHBondContact O-N 3.07Å; S187-N190 PolarHBondContact O-N 3.37Å; S187-V191 WeakPolarHBondContact O-CG2 3.25Å; S187-V191 PolarHBondContact O-N 3.41Å; S187-E222 VanDerWaalsContact CA-OE2 3.28Å; S187-E222 WeakPolarHBondContact CA-OE2 3.43Å; S187-E222 PolarHBondContact OG-OE2 3.24Å
188	L	98.1	Very high	92.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-41.1	174.7	-175.9	62.4	0	0	0	111.3	V165 T168 Y175 N184 L185 L192 A212 L216	V165-L188 HydrophobicContact CG1-CD2 4.4Å; V165-L188 HydrophobicContact CG2-CD2 4.36Å; V165-L188 HydrophobicContact CG2-CG 4.2Å; T168-L188 HydrophobicContact CG2-CD2 3.8Å; Y175-L188 HydrophobicContact CE1-CB 4.27Å; Y175-L188 HydrophobicContact CE1-CD2 4.13Å; N184-L188 WeakPolarHBondContact O-CB 3.45Å; N184-L188 PolarHBondContact O-N 2.92Å; L185-L188 PolarHBondContact O-N 2.71Å; L188-L192 HydrophobicContact CD1-CD1 4.27Å; L188-L192 HydrophobicContact CG-CD1 4.15Å; L188-L192 WeakPolarHBondContact O-CD1 2.79Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.44Å; L188-L192 PolarHBondContact O-N 2.9Å; L188-A212 HydrophobicContact CD1-CB 3.71Å; L188-L216 HydrophobicContact CB-CD2 3.85Å; L188-L216 HydrophobicContact CD1-CD2 4.43Å
189	F	97.2	Very high	93.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-49	172.3	179.4	-83.1	0	0	0	111.5	W141 I158 I161 R162 V165 L185 V186 S187 V191 L192 A193 L525 I528	W141-F189 HydrophobicContact CH2-CD1 4.27Å; W141-F189 AromaticContact CH2-CE1 3.73Å; W141-F189 HydrophobicContact CH2-CE1 3.73Å; W141-F189 HydrophobicContact CZ3-CE1 4.14Å; I158-F189 HydrophobicContact CD1-CE1 4.38Å; I158-F189 HydrophobicContact CD1-CZ 3.76Å; I158-F189 HydrophobicContact CG2-CE2 4.46Å; I158-F189 HydrophobicContact CG2-CZ 3.99Å; I161-F189 HydrophobicContact CB-CD2 4.38Å; I161-F189 HydrophobicContact CB-CE2 4.1Å; I161-F189 HydrophobicContact CG2-CD2 3.61Å; I161-F189 HydrophobicContact CG2-CE2 3.79Å; I161-F189 HydrophobicContact CG2-CG 4.36Å; R162-F189 HydrophobicContact CB-CD2 4.38Å; R162-F189 HydrophobicContact CB-CE2 4.1Å; V165-F189 HydrophobicContact CG1-CB 4.4Å; V165-F189 HydrophobicContact CG2-CB 4.26Å; L185-F189 WeakPolarHBondContact O-CB 3.21Å; L185-F189 PolarHBondContact O-N 3.19Å; V186-F189 WeakPolarHBondContact O-CB 3.44Å; V186-F189 PolarHBondContact O-N 2.84Å; S187-F189 VanDerWaalsContact C-N 3.32Å; S187-F189 PolarHBondContact O-N 3.07Å; F189-V191 PolarHBondContact O-N 3.41Å; F189-L192 PolarHBondContact O-N 3.21Å; F189-A193 HydrophobicContact CD1-CB 4.27Å; F189-A193 HydrophobicContact CE1-CB 3.74Å; F189-A193 HydrophobicContact CZ-CB 4.04Å; F189-A193 VanDerWaalsContact O-CB 3.29Å; F189-A193 WeakPolarHBondContact O-CB 3.47Å; F189-A193 PolarHBondContact O-N 2.99Å; F189-L525 HydrophobicContact CB-CD1 4.29Å; F189-L525 HydrophobicContact CD2-CD1 3.88Å; F189-L525 HydrophobicContact CG-CD1 4.08Å; F189-I528 HydrophobicContact CD1-CD1 3.75Å; F189-I528 HydrophobicContact CE1-CD1 3.41Å; F189-I528 VanDerWaalsContact CE1-CD1 3.41Å; F189-I528 HydrophobicContact CE1-CG1 4.4Å; F189-I528 HydrophobicContact CE2-CD1 4.43Å; F189-I528 HydrophobicContact CE2-CG2 4.41Å; F189-I528 HydrophobicContact CG-CD1 4.42Å; F189-I528 HydrophobicContact CZ-CD1 3.81Å; F189-I528 HydrophobicContact CZ-CG2 4.03Å
190	N	97.3	Very high	93.5	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.1	-41.2	-178.4	-71	-21.8	0	0	0	112.5	Y134 R138 V186 S187 T194 E222	Y134-N190 VanDerWaalsContact OH-C 3.32Å; Y134-N190 WeakPolarHBondContact OH-CB 3.46Å; Y134-N190 PolarHBondContact OH-O 2.66Å; R138-N190 HydrophobicContact CG-CB 4.43Å; V186-N190 WeakPolarHBondContact O-CB 3.47Å; V186-N190 PolarHBondContact O-N 3.07Å; V186-N190 PolarHBondContact O-ND2 2.94Å; S187-N190 PolarHBondContact O-N 3.37Å; N190-T194 VanDerWaalsContact O-CB 3.28Å; N190-T194 WeakPolarHBondContact O-CB 3.16Å; N190-T194 PolarHBondContact O-N 2.98Å; N190-T194 PolarHBondContact O-OG1 3.29Å; N190-E222 HydrophobicContact CB-CG 4.31Å; N190-E222 WeakPolarHBondContact CB-OE2 3.48Å; N190-E222 PolarHBondContact ND2-OE2 2.67Å
191	V	98.3	Very high	94.1	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-51.4	175	168.3	0	0	0	0	110.5	Y134 S187 F189 Y195 A212 E222 A225 Y226 F229	Y134-V191 PolarHBondContact OH-N 2.82Å; S187-V191 WeakPolarHBondContact O-CG2 3.25Å; S187-V191 PolarHBondContact O-N 3.41Å; F189-V191 PolarHBondContact O-N 3.41Å; V191-Y195 PolarHBondContact O-N 3.07Å; V191-A212 HydrophobicContact CG1-CB 4.4Å; V191-E222 HydrophobicContact CG2-CG 4.04Å; V191-E222 WeakPolarHBondContact CG2-O 3.31Å; V191-A225 HydrophobicContact CG2-CB 4.32Å; V191-Y226 HydrophobicContact CG1-CD2 4.29Å; V191-F229 HydrophobicContact CG1-CB 4.33Å; V191-F229 HydrophobicContact CG1-CD1 4.28Å; V191-F229 HydrophobicContact CG1-CG 4.41Å
192	L	98.2	Very high	94.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-69.3	-41.5	-176.4	-67.1	169.2	0	0	0	112.9	I161 V165 L188 F189 Y195 A196 Y204 M208 A212 F229	I161-L192 HydrophobicContact CD1-CB 4.41Å; I161-L192 HydrophobicContact CG1-CB 4.37Å; I161-L192 HydrophobicContact CG2-CB 3.65Å; I161-L192 HydrophobicContact CG2-CD1 4.05Å; V165-L192 HydrophobicContact CG2-CD1 3.83Å; L188-L192 HydrophobicContact CD1-CD1 4.27Å; L188-L192 HydrophobicContact CG-CD1 4.15Å; L188-L192 WeakPolarHBondContact O-CD1 2.79Å; L188-L192 VanDerWaalsContact O-CG 3.3Å; L188-L192 WeakPolarHBondContact O-CG 3.44Å; L188-L192 PolarHBondContact O-N 2.9Å; F189-L192 PolarHBondContact O-N 3.21Å; L192-Y195 PolarHBondContact O-N 3.48Å; L192-A196 WeakPolarHBondContact O-CB 3.28Å; L192-A196 PolarHBondContact O-N 3.05Å; L192-Y204 HydrophobicContact CB-CE2 4.5Å; L192-Y204 HydrophobicContact CD1-CE2 4.23Å; L192-Y204 HydrophobicContact CD2-CE2 4.14Å; L192-M208 HydrophobicContact CD2-CB 4.31Å; L192-A212 HydrophobicContact CD2-CB 3.73Å; L192-A212 HydrophobicContact CG-CB 4.25Å; L192-F229 HydrophobicContact CD2-CE1 4.11Å; L192-F229 HydrophobicContact CD2-CZ 3.96Å
193	A	96.7	Very high	94.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.9	-43.6	177.6	0	0	0	0	0	111.4	W141 I158 I161 F189 Y195 A196 L197	W141-A193 HydrophobicContact CH2-CB 3.94Å; W141-A193 HydrophobicContact CZ2-CB 3.72Å; W141-A193 HydrophobicContact CZ3-CB 4.45Å; I158-A193 HydrophobicContact CD1-CB 3.95Å; I161-A193 HydrophobicContact CD1-CB 4.14Å; F189-A193 HydrophobicContact CD1-CB 4.27Å; F189-A193 HydrophobicContact CE1-CB 3.74Å; F189-A193 HydrophobicContact CZ-CB 4.04Å; F189-A193 VanDerWaalsContact O-CB 3.29Å; F189-A193 WeakPolarHBondContact O-CB 3.47Å; F189-A193 PolarHBondContact O-N 2.99Å; A193-Y195 VanDerWaalsContact C-N 3.3Å; A193-Y195 PolarHBondContact O-N 3.46Å; A193-A196 PolarHBondContact O-N 2.97Å; A193-L197 WeakPolarHBondContact O-CB 3.38Å; A193-L197 VanDerWaalsContact O-CG 3.25Å; A193-L197 WeakPolarHBondContact O-CG 3.39Å; A193-L197 PolarHBondContact O-N 3.42Å; A193-L197 VanDerWaalsContact O-N 3.13Å
194	T	96.8	Very high	94.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.3	-37.3	174.2	-47.6	0	0	0	0	110.8	Y134 L137 W141 N190 Y198 Y226	Y134-T194 HydrophobicContact CD2-CG2 3.98Å; Y134-T194 HydrophobicContact CE2-CG2 3.78Å; L137-T194 HydrophobicContact CB-CG2 3.8Å; W141-T194 PolarHBondContact NE1-OG1 3.08Å; N190-T194 VanDerWaalsContact O-CB 3.28Å; N190-T194 WeakPolarHBondContact O-CB 3.16Å; N190-T194 PolarHBondContact O-N 2.98Å; N190-T194 PolarHBondContact O-OG1 3.29Å; T194-Y198 HydrophobicContact CG2-CD2 3.82Å; T194-Y198 HydrophobicContact CG2-CE2 4.02Å; T194-Y198 VanDerWaalsContact O-CD2 3.26Å; T194-Y198 WeakPolarHBondContact O-CD2 3.4Å; T194-Y198 PolarHBondContact O-N 2.91Å; T194-Y226 HydrophobicContact CG2-CE2 3.79Å
195	Y	97.3	Very high	94.5	Very high	4 Å²	4	15.6 Å²	15.6	2%	0.016	9%	0.085	C	C	.	.	H	α-helix	trans	-65.5	-53.3	177.9	-177	-84.2	0	0	0	110.8	V191 L192 A193 L197 Y198 H199 E202 M208 F229 M233	V191-Y195 PolarHBondContact O-N 3.07Å; L192-Y195 PolarHBondContact O-N 3.48Å; A193-Y195 VanDerWaalsContact C-N 3.3Å; A193-Y195 PolarHBondContact O-N 3.46Å; Y195-L197 VanDerWaalsContact C-N 3.33Å; Y195-L197 PolarHBondContact O-N 2.89Å; Y195-Y198 PolarHBondContact O-N 3.25Å; Y195-H199 HydrophobicContact CD1-CB 4.28Å; Y195-H199 AromaticContact CD2-CE1 3.82Å; Y195-H199 AromaticContact CD2-ND1 3.53Å; Y195-H199 HydrophobicContact CE1-CB 3.73Å; Y195-H199 HydrophobicContact CE2-CB 4.38Å; Y195-H199 AromaticContact CE2-CE1 3.75Å; Y195-H199 AromaticContact CE2-CG 3.76Å; Y195-H199 AromaticContact CE2-ND1 3.51Å; Y195-H199 AromaticContact CG-ND1 3.86Å; Y195-H199 AromaticContact CZ-CG 3.63Å; Y195-H199 AromaticContact CZ-ND1 3.8Å; Y195-H199 WeakPolarHBondContact O-CB 3.42Å; Y195-H199 PolarHBondContact O-N 3.48Å; Y195-H199 PolarHBondContact O-ND1 2.69Å; Y195-E202 HydrophobicContact CE1-CB 4.38Å; Y195-M208 HydrophobicContact CD1-CE 3.54Å; Y195-M208 HydrophobicContact CE1-CE 3.62Å; Y195-M208 HydrophobicContact CG-CE 4.5Å; Y195-F229 AromaticContact CD1-CE1 3.97Å; Y195-F229 HydrophobicContact CD1-CE1 3.97Å; Y195-F229 AromaticContact CD2-CD1 3.68Å; Y195-F229 HydrophobicContact CD2-CD1 3.68Å; Y195-F229 AromaticContact CD2-CE1 3.74Å; Y195-F229 HydrophobicContact CD2-CE1 3.74Å; Y195-F229 HydrophobicContact CE2-CD1 4.46Å; Y195-F229 HydrophobicContact CE2-CE1 4.41Å; Y195-F229 AromaticContact CG-CD1 3.83Å; Y195-F229 HydrophobicContact CG-CD1 3.83Å; Y195-F229 AromaticContact CG-CE1 3.5Å; Y195-F229 HydrophobicContact CG-CE1 3.5Å; Y195-M233 HydrophobicContact CD2-CG 4.44Å; Y195-M233 HydrophobicContact CE1-CE 4.03Å; Y195-M233 HydrophobicContact CE1-CG 4.43Å; Y195-M233 HydrophobicContact CE2-CB 3.62Å; Y195-M233 HydrophobicContact CE2-CG 3.78Å; Y195-M233 WeakPolarHBondContact OH-CB 3.42Å
196	A	95.5	Very high	94.4	Very high	1 Å²	1	21 Å²	21	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-64.7	-32.8	-172.4	0	0	0	0	0	114.1	I157 I161 L192 A193 G203	I157-A196 HydrophobicContact CG2-CB 3.69Å; I161-A196 HydrophobicContact CD1-CB 4.1Å; L192-A196 WeakPolarHBondContact O-CB 3.28Å; L192-A196 PolarHBondContact O-N 3.05Å; A193-A196 PolarHBondContact O-N 2.97Å; A196-G203 WeakPolarHBondContact CA-O 3.26Å; A196-G203 WeakPolarHBondContact CB-O 3.49Å
197	L	94.2	Very high	94.3	Very high	8 Å²	8	20.4 Å²	20.4	4%	0.042	11%	0.108	C	C	.	.	H	α-helix	trans	-79.1	-27.7	179	-64	175.8	0	0	0	113.1	W141 V154 I158 A193 Y195 L331	W141-L197 HydrophobicContact CB-CD1 3.66Å; W141-L197 HydrophobicContact CD2-CD1 4.07Å; W141-L197 HydrophobicContact CE3-CD1 4.5Å; W141-L197 HydrophobicContact CG-CD1 3.69Å; V154-L197 HydrophobicContact CB-CD2 4.49Å; V154-L197 HydrophobicContact CG1-CD2 4.04Å; V154-L197 HydrophobicContact CG2-CD2 3.97Å; I158-L197 HydrophobicContact CD1-CD1 4.49Å; A193-L197 WeakPolarHBondContact O-CB 3.38Å; A193-L197 VanDerWaalsContact O-CG 3.25Å; A193-L197 WeakPolarHBondContact O-CG 3.39Å; A193-L197 PolarHBondContact O-N 3.42Å; A193-L197 VanDerWaalsContact O-N 3.13Å; Y195-L197 VanDerWaalsContact C-N 3.33Å; Y195-L197 PolarHBondContact O-N 2.89Å; L197-L331 HydrophobicContact CD2-CD2 4.24Å
198	Y	94.1	Very high	94.3	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-100.2	-1.3	178.7	-68.9	-71.5	0	0	0	114.5	L137 T194 Y195 C320 C321 S324 P327	L137-Y198 HydrophobicContact CB-CD2 4.07Å; L137-Y198 HydrophobicContact CB-CE2 3.56Å; L137-Y198 HydrophobicContact CD2-CD1 3.81Å; L137-Y198 HydrophobicContact CD2-CD2 3.96Å; L137-Y198 HydrophobicContact CD2-CE1 3.49Å; L137-Y198 VanDerWaalsContact CD2-CE1 3.49Å; L137-Y198 HydrophobicContact CD2-CE2 3.68Å; L137-Y198 HydrophobicContact CD2-CG 4.03Å; L137-Y198 VanDerWaalsContact CD2-CZ 3.41Å; L137-Y198 HydrophobicContact CG-CD2 4.43Å; L137-Y198 HydrophobicContact CG-CE2 4.16Å; L137-Y198 VanDerWaalsContact O-CE2 3.29Å; L137-Y198 WeakPolarHBondContact O-CE2 3.5Å; L137-Y198 PolarHBondContact O-OH 3.29Å; T194-Y198 HydrophobicContact CG2-CD2 3.82Å; T194-Y198 HydrophobicContact CG2-CE2 4.02Å; T194-Y198 VanDerWaalsContact O-CD2 3.26Å; T194-Y198 WeakPolarHBondContact O-CD2 3.4Å; T194-Y198 PolarHBondContact O-N 2.91Å; Y195-Y198 PolarHBondContact O-N 3.25Å; Y198-C320 HydrophobicContact CD1-CB 4.24Å; Y198-C320 HydrophobicContact CG-CB 4.26Å; Y198-C321 PolarHBondContact O-N 3.23Å; Y198-C321 PolarHBondContact O-SG 3Å; Y198-C321 VanDerWaalsContact O-SG 3.41Å; Y198-S324 WeakPolarHBondContact CD1-O 3.3Å; Y198-P327 HydrophobicContact CE1-CB 3.93Å; Y198-P327 HydrophobicContact CE1-CG 4.38Å; Y198-P327 WeakPolarHBondContact OH-CB 3.42Å
199	H	92.4	Very high	94.3	Very high	17 Å²	17	19.4 Å²	19.4	8%	0.079	10%	0.101	C	C	.	.			trans	-130.8	69.8	172.4	-56.6	86.4	0	0	0	110.1	Y195 E201 E202 G203 L319	Y195-H199 HydrophobicContact CD1-CB 4.28Å; Y195-H199 AromaticContact CD2-CE1 3.82Å; Y195-H199 AromaticContact CD2-ND1 3.53Å; Y195-H199 HydrophobicContact CE1-CB 3.73Å; Y195-H199 HydrophobicContact CE2-CB 4.38Å; Y195-H199 AromaticContact CE2-CE1 3.75Å; Y195-H199 AromaticContact CE2-CG 3.76Å; Y195-H199 AromaticContact CE2-ND1 3.51Å; Y195-H199 AromaticContact CG-ND1 3.86Å; Y195-H199 AromaticContact CZ-CG 3.63Å; Y195-H199 AromaticContact CZ-ND1 3.8Å; Y195-H199 WeakPolarHBondContact O-CB 3.42Å; Y195-H199 PolarHBondContact O-N 3.48Å; Y195-H199 PolarHBondContact O-ND1 2.69Å; H199-E201 VanDerWaalsContact C-N 3.3Å; H199-E201 PolarHBondContact O-N 2.94Å; H199-E202 PolarHBondContact O-N 3.03Å; H199-G203 WeakPolarHBondContact O-CA 3.4Å; H199-G203 PolarHBondContact O-N 3.25Å; H199-L319 PolarHBondContact CE1-O 2.97Å; H199-L319 VanDerWaalsContact CE1-O 3.23Å
200	P	89.1	Confident	94.3	Very high	36 Å²	36	19.6 Å²	19.6	23%	0.234	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.5	-170.7	30.6	-37.1	0	0	0	115.2	E202 F330	P200-E202 VanDerWaalsContact C-N 3.34Å; P200-F330 HydrophobicContact CB-CD1 4.19Å; P200-F330 HydrophobicContact CB-CD2 4.05Å; P200-F330 HydrophobicContact CB-CE1 3.59Å; P200-F330 HydrophobicContact CB-CE2 3.43Å; P200-F330 VanDerWaalsContact CB-CE2 3.43Å; P200-F330 HydrophobicContact CB-CG 4.4Å; P200-F330 HydrophobicContact CB-CZ 3.19Å; P200-F330 HydrophobicContact CG-CD2 3.85Å; P200-F330 HydrophobicContact CG-CE1 4.44Å; P200-F330 HydrophobicContact CG-CE2 3.52Å; P200-F330 HydrophobicContact CG-CG 4.46Å; P200-F330 HydrophobicContact CG-CZ 3.87Å
201	E	85.5	Confident	94.3	Very high	149 Å²	149	19.6 Å²	19.6	70%	0.696	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-38.3	171.9	-66	-174.6	178.2	0	0	110.8	H199 R237	H199-E201 VanDerWaalsContact C-N 3.3Å; H199-E201 PolarHBondContact O-N 2.94Å; E201-R237 IonicContact OE2-NH1 3.91Å
202	E	88	Confident	94.4	Very high	17 Å²	17	19.6 Å²	19.6	8%	0.079	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-40.3	173.3	-63.3	76.5	-169.2	0	0	112.6	Y195 H199 P200 Y204 R237	Y195-E202 HydrophobicContact CE1-CB 4.38Å; H199-E202 PolarHBondContact O-N 3.03Å; P200-E202 VanDerWaalsContact C-N 3.34Å; E202-Y204 PolarHBondContact O-N 3.05Å; E202-R237 HydrophobicContact CG-CB 3.69Å; E202-R237 WeakPolarHBondContact OE1-CB 3.35Å; E202-R237 WeakPolarHBondContact OE1-CD 3.42Å; E202-R237 IonicContact OE1-CZ 2.66Å; E202-R237 IonicContact OE1-NE 2.75Å; E202-R237 IonicContact OE1-NH1 3.74Å; E202-R237 PolarHBondContact OE1-NH1 2.62Å
203	G	91.1	Very high	94.4	Very high	9 Å²	9	19.6 Å²	19.6	9%	0.093	10%	0.101	C	C	.	.			trans	59.2	-131.6	-173.3	0	0	0	0	0	112.5	A196 H199	A196-G203 WeakPolarHBondContact CA-O 3.26Å; A196-G203 WeakPolarHBondContact CB-O 3.49Å; H199-G203 WeakPolarHBondContact O-CA 3.4Å; H199-G203 PolarHBondContact O-N 3.25Å
204	Y	94.9	Very high	94.5	Very high	10 Å²	10	19.6 Å²	19.6	4%	0.039	10%	0.101	C	C	.	.			trans	-120.8	123	168.3	-178.9	-99	0	0	0	110.4	I161 D164 L192 E202 M208	I161-Y204 HydrophobicContact CD1-CD2 4.24Å; I161-Y204 HydrophobicContact CD1-CG 4.2Å; I161-Y204 HydrophobicContact CG1-CD1 3.78Å; I161-Y204 HydrophobicContact CG1-CD2 3.45Å; I161-Y204 VanDerWaalsContact CG1-CD2 3.45Å; I161-Y204 HydrophobicContact CG1-CE1 4.21Å; I161-Y204 HydrophobicContact CG1-CE2 3.89Å; I161-Y204 HydrophobicContact CG1-CG 3.39Å; D164-Y204 WeakPolarHBondContact CB-OH 3.47Å; D164-Y204 PolarHBondContact OD2-OH 2.84Å; L192-Y204 HydrophobicContact CB-CE2 4.5Å; L192-Y204 HydrophobicContact CD1-CE2 4.23Å; L192-Y204 HydrophobicContact CD2-CE2 4.14Å; E202-Y204 PolarHBondContact O-N 3.05Å; Y204-M208 HydrophobicContact CD2-CB 4.12Å; Y204-M208 HydrophobicContact CD2-SD 4.3Å; Y204-M208 HydrophobicContact CE2-CB 3.7Å
205	C	93.5	Very high	94.5	Very high	31 Å²	31	19.6 Å²	19.6	21%	0.209	10%	0.101	C	C	.	.			trans	-108.6	144.5	169.5	-63.9	0	0	0	0	110.5	G207 M208 F240	C205-G207 PolarHBondContact O-N 3.15Å; C205-M208 HydrophobicContact CB-CG 4.44Å; C205-M208 HydrophobicContact CB-SD 4.07Å; C205-M208 PolarHBondContact N-SD 3.28Å; C205-M208 WeakPolarHBondContact O-CB 3.35Å; C205-M208 WeakPolarHBondContact O-CG 3.36Å; C205-M208 PolarHBondContact O-N 2.81Å; C205-F240 HydrophobicContact CB-CB 4.33Å; C205-F240 HydrophobicContact CB-CD1 3.52Å; C205-F240 HydrophobicContact CB-CE1 4.26Å; C205-F240 HydrophobicContact CB-CG 4.3Å
206	Q	91.9	Very high	94.6	Very high	114 Å²	114	19.5 Å²	19.5	53%	0.533	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	134.2	178.2	173.4	155.1	58.9	0	0	111.2	D164	D164-Q206 PolarHBondContact OD1-NE2 3.19Å; D164-Q206 WeakPolarHBondContact OD2-CA 3.33Å; D164-Q206 WeakPolarHBondContact OD2-CG 3.29Å
207	G	92.8	Very high	94.7	Very high	5 Å²	5	20.3 Å²	20.3	5%	0.052	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	96	-13.1	-176.1	0	0	0	0	0	114.7	C205 S209 D210 L286	C205-G207 PolarHBondContact O-N 3.15Å; G207-S209 PolarHBondContact O-N 3.39Å; G207-S209 VanDerWaalsContact O-N 3.16Å; G207-D210 WeakPolarHBondContact O-CB 3.12Å; G207-D210 PolarHBondContact O-N 3.36Å; G207-L286 WeakPolarHBondContact O-CD2 3.33Å
208	M	97.2	Very high	94.9	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-59.2	-26.8	172	-74.5	175.8	65.5	0	0	112.7	L192 Y195 Y204 C205 D210 L211 A212 F229 M233 F240	L192-M208 HydrophobicContact CD2-CB 4.31Å; Y195-M208 HydrophobicContact CD1-CE 3.54Å; Y195-M208 HydrophobicContact CE1-CE 3.62Å; Y195-M208 HydrophobicContact CG-CE 4.5Å; Y204-M208 HydrophobicContact CD2-CB 4.12Å; Y204-M208 HydrophobicContact CD2-SD 4.3Å; Y204-M208 HydrophobicContact CE2-CB 3.7Å; C205-M208 HydrophobicContact CB-CG 4.44Å; C205-M208 HydrophobicContact CB-SD 4.07Å; C205-M208 PolarHBondContact N-SD 3.28Å; C205-M208 WeakPolarHBondContact O-CB 3.35Å; C205-M208 WeakPolarHBondContact O-CG 3.36Å; C205-M208 PolarHBondContact O-N 2.81Å; M208-D210 VanDerWaalsContact C-N 3.31Å; M208-D210 PolarHBondContact O-N 3.19Å; M208-L211 PolarHBondContact O-N 3.36Å; M208-A212 PolarHBondContact O-N 2.64Å; M208-A212 VanDerWaalsContact O-N 3.1Å; M208-F229 HydrophobicContact CB-CZ 4.32Å; M208-F229 HydrophobicContact CE-CE1 4.02Å; M208-F229 HydrophobicContact CE-CZ 3.77Å; M208-M233 HydrophobicContact CE-CE 3.71Å; M208-M233 HydrophobicContact CE-SD 4.28Å; M208-M233 HydrophobicContact SD-CE 4.41Å; M208-F240 HydrophobicContact CG-CD1 4.12Å; M208-F240 HydrophobicContact CG-CE1 3.73Å; M208-F240 HydrophobicContact CG-CE2 4.38Å; M208-F240 HydrophobicContact CG-CZ 3.88Å; M208-F240 HydrophobicContact SD-CD1 4.49Å
209	S	97.9	Very high	95.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64	-30.8	172.1	67.3	0	0	0	0	114	T168 G207 L211 A212 S213	T168-S209 WeakPolarHBondContact OG1-CB 3.4Å; T168-S209 PolarHBondContact OG1-OG 2.91Å; G207-S209 PolarHBondContact O-N 3.39Å; G207-S209 VanDerWaalsContact O-N 3.16Å; S209-L211 VanDerWaalsContact C-N 3.29Å; S209-L211 PolarHBondContact O-N 2.87Å; S209-A212 PolarHBondContact O-N 3.35Å; S209-S213 VanDerWaalsContact O-CB 3.3Å; S209-S213 WeakPolarHBondContact O-CB 3.47Å; S209-S213 PolarHBondContact O-N 2.87Å
210	D	97.8	Very high	95.3	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-69.3	-29.2	176.4	-68.2	-49.6	0	0	0	112	G207 M208 P214 L286 K289 R290	G207-D210 WeakPolarHBondContact O-CB 3.12Å; G207-D210 PolarHBondContact O-N 3.36Å; M208-D210 VanDerWaalsContact C-N 3.31Å; M208-D210 PolarHBondContact O-N 3.19Å; D210-P214 WeakPolarHBondContact O-CD 3.43Å; D210-L286 HydrophobicContact CB-CD1 4.39Å; D210-K289 HydrophobicContact CB-CG 4.2Å; D210-K289 WeakPolarHBondContact O-CE 3.38Å; D210-K289 WeakPolarHBondContact O-CG 3.35Å; D210-R290 IonicContact OD1-CZ 3.32Å; D210-R290 IonicContact OD1-NE 3.07Å; D210-R290 PolarHBondContact OD1-NE 3.33Å; D210-R290 IonicContact OD1-NH2 2.74Å; D210-R290 PolarHBondContact OD1-NH2 3.46Å; D210-R290 IonicContact OD2-CZ 3.63Å; D210-R290 IonicContact OD2-NE 3.81Å; D210-R290 PolarHBondContact OD2-NE 3.26Å; D210-R290 IonicContact OD2-NH2 2.7Å; D210-R290 PolarHBondContact OD2-NH2 3.23Å
211	L	98.2	Very high	95.6	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-79.2	-38.9	175.5	-65.2	176.3	0	0	0	112.1	M208 S209 F229 L232 L236 F240 L286	M208-L211 PolarHBondContact O-N 3.36Å; S209-L211 VanDerWaalsContact C-N 3.29Å; S209-L211 PolarHBondContact O-N 2.87Å; L211-F229 HydrophobicContact CB-CE2 4.07Å; L211-L232 HydrophobicContact CB-CD2 4.3Å; L211-L236 HydrophobicContact CD1-CD1 3.79Å; L211-L236 HydrophobicContact CD2-CD1 4.13Å; L211-F240 HydrophobicContact CD1-CE2 4Å; L211-F240 HydrophobicContact CD1-CZ 3.69Å; L211-L286 HydrophobicContact CG-CD2 4.37Å
212	A	98.5	Very high	96.2	Very high	1 Å²	1	21 Å²	21	1%	0.008	11%	0.106	C	C	.	.	H	α-helix	trans	-72.3	-31.9	178.3	0	0	0	0	0	113.3	L188 V191 L192 M208 S209 L215 L216 F229	L188-A212 HydrophobicContact CD1-CB 3.71Å; V191-A212 HydrophobicContact CG1-CB 4.4Å; L192-A212 HydrophobicContact CD2-CB 3.73Å; L192-A212 HydrophobicContact CG-CB 4.25Å; M208-A212 PolarHBondContact O-N 2.64Å; M208-A212 VanDerWaalsContact O-N 3.1Å; S209-A212 PolarHBondContact O-N 3.35Å; A212-L215 PolarHBondContact O-N 3.13Å; A212-L216 PolarHBondContact O-N 3.48Å; A212-F229 HydrophobicContact CB-CD2 3.9Å; A212-F229 HydrophobicContact CB-CE2 3.86Å; A212-F229 HydrophobicContact CB-CG 4.42Å; A212-F229 HydrophobicContact CB-CZ 4.36Å
213	S	98.6	Very high	96.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-55	-54	-178.1	155.9	0	0	0	0	114	D169 Y175 S209 L215 L216 V217	D169-S213 WeakPolarHBondContact OD2-CB 3.49Å; D169-S213 PolarHBondContact OD2-OG 3.21Å; Y175-S213 WeakPolarHBondContact CE2-OG 3.32Å; Y175-S213 WeakPolarHBondContact OH-CA 3.49Å; Y175-S213 PolarHBondContact OH-O 3.05Å; S209-S213 VanDerWaalsContact O-CB 3.3Å; S209-S213 WeakPolarHBondContact O-CB 3.47Å; S209-S213 PolarHBondContact O-N 2.87Å; S213-L215 VanDerWaalsContact C-N 3.31Å; S213-L215 PolarHBondContact O-N 3.19Å; S213-L216 PolarHBondContact O-N 2.71Å; S213-V217 WeakPolarHBondContact O-CG2 3.22Å; S213-V217 PolarHBondContact O-N 3.14Å
214	P	98.5	Very high	97	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-52.5	-44.2	174.3	-32.3	38.5	0	0	0	114.3	W107 D210 V217 V218 K289 L298 M301	W107-P214 HydrophobicContact CH2-CB 4.06Å; W107-P214 HydrophobicContact CZ3-CB 4.16Å; D210-P214 WeakPolarHBondContact O-CD 3.43Å; P214-V217 PolarHBondContact O-N 3.09Å; P214-V218 WeakPolarHBondContact O-CB 3.49Å; P214-V218 WeakPolarHBondContact O-CG2 3.48Å; P214-V218 PolarHBondContact O-N 2.74Å; P214-K289 HydrophobicContact CG-CD 3.77Å; P214-L298 HydrophobicContact CB-CD2 3.8Å; P214-M301 HydrophobicContact CB-CE 3.88Å; P214-M301 HydrophobicContact CB-SD 4.04Å; P214-M301 HydrophobicContact CG-CE 3.99Å; P214-M301 HydrophobicContact CG-SD 3.92Å
215	L	98.7	Very high	97.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.4	-46.5	-178.8	-58.6	172.8	0	0	0	110.4	W107 L111 A212 S213 V218 M219 C228 F229 L232 W305	W107-L215 HydrophobicContact CE3-CD2 3.84Å; W107-L215 HydrophobicContact CZ3-CD2 3.83Å; L111-L215 HydrophobicContact CD1-CD2 3.8Å; A212-L215 PolarHBondContact O-N 3.13Å; S213-L215 VanDerWaalsContact C-N 3.31Å; S213-L215 PolarHBondContact O-N 3.19Å; L215-V218 PolarHBondContact O-N 3.24Å; L215-M219 WeakPolarHBondContact O-CB 3.48Å; L215-M219 WeakPolarHBondContact O-CG 3.36Å; L215-M219 PolarHBondContact O-N 2.84Å; L215-C228 HydrophobicContact CD1-CB 4.33Å; L215-C228 HydrophobicContact CD2-CB 4.03Å; L215-F229 VanDerWaalsContact CD1-CA 3.49Å; L215-F229 HydrophobicContact CD1-CB 3.71Å; L215-F229 HydrophobicContact CD1-CD2 3.84Å; L215-F229 HydrophobicContact CD1-CG 4.29Å; L215-L232 HydrophobicContact CD1-CD2 4.11Å; L215-W305 HydrophobicContact CD2-CH2 3.88Å
216	L	98.5	Very high	97.4	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.016	9%	0.089	C	C	.	.	H	α-helix	trans	-67.2	-38.8	179.8	-174.9	63.7	0	0	0	112.5	F174 Y175 L188 A212 S213 K220 A225	F174-L216 HydrophobicContact CE1-CD2 4.22Å; F174-L216 HydrophobicContact CE1-CG 3.92Å; F174-L216 HydrophobicContact CZ-CG 4.2Å; Y175-L216 HydrophobicContact CE1-CD2 4.39Å; L188-L216 HydrophobicContact CB-CD2 3.85Å; L188-L216 HydrophobicContact CD1-CD2 4.43Å; A212-L216 PolarHBondContact O-N 3.48Å; S213-L216 PolarHBondContact O-N 2.71Å; L216-K220 WeakPolarHBondContact O-CA 3.3Å; L216-K220 PolarHBondContact O-N 3.17Å; L216-A225 HydrophobicContact CB-CB 3.95Å; L216-A225 HydrophobicContact CD1-CB 3.63Å; L216-A225 HydrophobicContact CG-CB 4.4Å
217	V	98.3	Very high	97.7	Very high	18 Å²	18	12.9 Å²	12.9	11%	0.109	6%	0.063	C	C	.	.	H	α-helix	trans	-64	-39.2	175.1	170.6	0	0	0	0	112.2	H172 F174 Y175 S213 P214 K220 F294	H172-V217 VanDerWaalsContact CE1-CG1 3.48Å; H172-V217 WeakPolarHBondContact CE1-CG1 3.23Å; F174-V217 HydrophobicContact CB-CG2 4.07Å; F174-V217 HydrophobicContact CD1-CG2 3.56Å; F174-V217 HydrophobicContact CE1-CG2 4.04Å; F174-V217 HydrophobicContact CG-CG2 3.87Å; Y175-V217 HydrophobicContact CD2-CG2 4.41Å; Y175-V217 HydrophobicContact CE2-CG2 3.55Å; S213-V217 WeakPolarHBondContact O-CG2 3.22Å; S213-V217 PolarHBondContact O-N 3.14Å; P214-V217 PolarHBondContact O-N 3.09Å; V217-K220 WeakPolarHBondContact O-CG 3.47Å; V217-F294 HydrophobicContact CB-CE1 4.15Å; V217-F294 HydrophobicContact CB-CZ 3.86Å; V217-F294 HydrophobicContact CG1-CE1 3.75Å; V217-F294 HydrophobicContact CG1-CZ 3.97Å; V217-F294 HydrophobicContact CG2-CE1 4.34Å; V217-F294 HydrophobicContact CG2-CZ 3.72Å
218	V	98.2	Very high	97.9	Very high	20 Å²	20	12.7 Å²	12.7	12%	0.121	6%	0.061	C	C	.	.	H	α-helix	trans	-74.9	-47.4	179.3	166.4	0	0	0	0	111.8	R103 W107 P214 L215 L298	R103-V218 HydrophobicContact CB-CG1 3.56Å; R103-V218 HydrophobicContact CB-CG2 4.4Å; W107-V218 HydrophobicContact CD2-CB 4.41Å; W107-V218 HydrophobicContact CD2-CG1 3.91Å; W107-V218 HydrophobicContact CD2-CG2 4.34Å; W107-V218 HydrophobicContact CE3-CB 3.96Å; W107-V218 HydrophobicContact CE3-CG1 3.87Å; W107-V218 HydrophobicContact CE3-CG2 4.04Å; W107-V218 HydrophobicContact CG-CG1 4.32Å; W107-V218 HydrophobicContact CH2-CG2 3.76Å; W107-V218 HydrophobicContact CZ2-CG2 3.99Å; W107-V218 HydrophobicContact CZ3-CB 4.01Å; W107-V218 HydrophobicContact CZ3-CG1 4.4Å; W107-V218 HydrophobicContact CZ3-CG2 3.73Å; P214-V218 WeakPolarHBondContact O-CB 3.49Å; P214-V218 WeakPolarHBondContact O-CG2 3.48Å; P214-V218 PolarHBondContact O-N 2.74Å; L215-V218 PolarHBondContact O-N 3.24Å; V218-L298 HydrophobicContact CG2-CD1 4.37Å; V218-L298 HydrophobicContact CG2-CD2 4.3Å
219	M	97.5	Very high	98	Very high	3 Å²	3	12.6 Å²	12.6	2%	0.015	6%	0.061	C	C	.	.	H	α-helix	trans	-74.6	-30	-176.3	-62.6	-57.9	153.9	0	0	112.7	W107 P108 L215 N221 L224 A225 C228 V506	W107-M219 HydrophobicContact CB-CE 3.63Å; W107-M219 HydrophobicContact CE3-CE 4.34Å; W107-M219 HydrophobicContact CG-CE 4.46Å; P108-M219 HydrophobicContact CG-CE 3.97Å; P108-M219 HydrophobicContact CG-SD 4.4Å; L215-M219 WeakPolarHBondContact O-CB 3.48Å; L215-M219 WeakPolarHBondContact O-CG 3.36Å; L215-M219 PolarHBondContact O-N 2.84Å; M219-N221 PolarHBondContact O-N 2.85Å; M219-L224 HydrophobicContact CB-CB 4.08Å; M219-L224 HydrophobicContact CG-CB 4.23Å; M219-L224 HydrophobicContact SD-CB 4.46Å; M219-A225 HydrophobicContact CB-CB 4.4Å; M219-C228 HydrophobicContact CE-CB 4.49Å; M219-V506 WeakPolarHBondContact O-CG1 3.48Å
220	K	96.3	Very high	97.9	Very high	162 Å²	162	12.8 Å²	12.8	70%	0.704	6%	0.062	S	C	*	.			trans	51.8	20.7	-173.4	-56.2	-176.1	178.9	-177	0	114.5	F174 L216 V217	F174-K220 HydrophobicContact CE2-CG 4.31Å; L216-K220 WeakPolarHBondContact O-CA 3.3Å; L216-K220 PolarHBondContact O-N 3.17Å; V217-K220 WeakPolarHBondContact O-CG 3.47Å
221	N	96.6	Very high	97.9	Very high	17 Å²	17	12.9 Å²	12.9	9%	0.091	6%	0.064	C	C	.	.	S	Bend	trans	-141	124.5	-178.2	177.4	-61.1	0	0	0	107.6	M219 A223 L224 A225	M219-N221 PolarHBondContact O-N 2.85Å; N221-A223 VanDerWaalsContact C-N 3.32Å; N221-A223 PolarHBondContact O-N 3.49Å; N221-A223 WeakPolarHBondContact OD1-CB 3.46Å; N221-A223 PolarHBondContact OD1-N 3.26Å; N221-L224 HydrophobicContact CB-CB 4.15Å; N221-L224 HydrophobicContact CB-CD1 4.06Å; N221-L224 HydrophobicContact CB-CG 4.12Å; N221-L224 PolarHBondContact O-N 2.95Å; N221-L224 PolarHBondContact OD1-N 3.4Å; N221-A225 VanDerWaalsContact O-CB 3.27Å; N221-A225 WeakPolarHBondContact O-CB 3.35Å; N221-A225 PolarHBondContact O-N 2.9Å
222	E	97.7	Very high	97.8	Very high	26 Å²	26	12.9 Å²	12.9	12%	0.121	6%	0.063	C	C	.	.	H	α-helix	trans	-58.2	-42.5	-175.2	-170	-174.8	89.7	0	0	112.1	Y134 R138 S187 N190 V191 Y226	Y134-E222 HydrophobicContact CE1-CB 4.39Å; Y134-E222 HydrophobicContact CE1-CG 3.8Å; Y134-E222 VanDerWaalsContact CE1-OE1 3.29Å; Y134-E222 WeakPolarHBondContact CE1-OE1 3.46Å; Y134-E222 WeakPolarHBondContact OH-CG 3.43Å; Y134-E222 PolarHBondContact OH-OE1 3.05Å; R138-E222 WeakPolarHBondContact CD-OE1 3.41Å; R138-E222 IonicContact CZ-OE1 3.68Å; R138-E222 IonicContact NE-OE1 2.69Å; R138-E222 IonicContact NH1-OE1 3.75Å; R138-E222 PolarHBondContact NH1-OE1 3.01Å; S187-E222 VanDerWaalsContact CA-OE2 3.28Å; S187-E222 WeakPolarHBondContact CA-OE2 3.43Å; S187-E222 PolarHBondContact OG-OE2 3.24Å; N190-E222 HydrophobicContact CB-CG 4.31Å; N190-E222 WeakPolarHBondContact CB-OE2 3.48Å; N190-E222 PolarHBondContact ND2-OE2 2.67Å; V191-E222 HydrophobicContact CG2-CG 4.04Å; V191-E222 WeakPolarHBondContact CG2-O 3.31Å; E222-Y226 PolarHBondContact O-N 3.4Å
223	A	97.5	Very high	97.6	Very high	4 Å²	4	12.8 Å²	12.8	3%	0.033	6%	0.063	C	C	.	.	H	α-helix	trans	-73.2	-45	-177	0	0	0	0	0	112.4	Y134 N221 A225 Y226 V227	Y134-A223 VanDerWaalsContact CD1-CA 3.45Å; Y134-A223 HydrophobicContact CD1-CB 3.5Å; Y134-A223 HydrophobicContact CE1-CB 4.23Å; Y134-A223 HydrophobicContact CG-CB 4.18Å; N221-A223 VanDerWaalsContact C-N 3.32Å; N221-A223 PolarHBondContact O-N 3.49Å; N221-A223 WeakPolarHBondContact OD1-CB 3.46Å; N221-A223 PolarHBondContact OD1-N 3.26Å; A223-A225 VanDerWaalsContact C-N 3.3Å; A223-A225 PolarHBondContact O-N 3.48Å; A223-Y226 WeakPolarHBondContact O-CB 3.37Å; A223-Y226 PolarHBondContact O-N 2.73Å; A223-V227 WeakPolarHBondContact O-CG2 3.48Å; A223-V227 PolarHBondContact O-N 2.98Å
224	L	97.7	Very high	97.3	Very high	5 Å²	5	17 Å²	17	3%	0.026	8%	0.081	C	C	.	.	H	α-helix	trans	-64.7	-35.5	175.5	-61.8	-178.1	0	0	0	111.9	L127 M219 N221 V227 C228 V506 A509	L127-L224 HydrophobicContact CB-CD2 3.92Å; L127-L224 HydrophobicContact CD1-CD2 4.21Å; L127-L224 HydrophobicContact CD2-CD2 3.97Å; L127-L224 HydrophobicContact CG-CD2 4.24Å; M219-L224 HydrophobicContact CB-CB 4.08Å; M219-L224 HydrophobicContact CG-CB 4.23Å; M219-L224 HydrophobicContact SD-CB 4.46Å; N221-L224 HydrophobicContact CB-CB 4.15Å; N221-L224 HydrophobicContact CB-CD1 4.06Å; N221-L224 HydrophobicContact CB-CG 4.12Å; N221-L224 PolarHBondContact O-N 2.95Å; N221-L224 PolarHBondContact OD1-N 3.4Å; L224-V227 PolarHBondContact O-N 3.04Å; L224-C228 WeakPolarHBondContact O-CB 3.31Å; L224-C228 PolarHBondContact O-N 3.43Å; L224-C228 PolarHBondContact O-SG 3.26Å; L224-V506 HydrophobicContact CD1-CB 4.31Å; L224-V506 HydrophobicContact CD1-CG2 3.94Å; L224-A509 HydrophobicContact CD1-CB 4.1Å; L224-A509 HydrophobicContact CD2-CB 4.3Å; L224-A509 HydrophobicContact CG-CB 4.22Å
225	A	98.5	Very high	96.9	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-63.6	-41.9	173.1	0	0	0	0	0	111.8	V191 L216 M219 N221 A223 C228 F229	V191-A225 HydrophobicContact CG2-CB 4.32Å; L216-A225 HydrophobicContact CB-CB 3.95Å; L216-A225 HydrophobicContact CD1-CB 3.63Å; L216-A225 HydrophobicContact CG-CB 4.4Å; M219-A225 HydrophobicContact CB-CB 4.4Å; N221-A225 VanDerWaalsContact O-CB 3.27Å; N221-A225 WeakPolarHBondContact O-CB 3.35Å; N221-A225 PolarHBondContact O-N 2.9Å; A223-A225 VanDerWaalsContact C-N 3.3Å; A223-A225 PolarHBondContact O-N 3.48Å; A225-C228 PolarHBondContact O-N 3.42Å; A225-F229 VanDerWaalsContact O-CB 3.29Å; A225-F229 WeakPolarHBondContact O-CB 3.38Å; A225-F229 PolarHBondContact O-N 2.91Å
226	Y	98.4	Very high	96.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.2	-47.6	173.9	-179.8	-99.5	0	0	0	112.8	Y134 L137 V191 T194 E222 A223 C228 F229 C230 L319	Y134-Y226 AromaticContact CD2-CD1 3.21Å; Y134-Y226 HydrophobicContact CD2-CD1 3.21Å; Y134-Y226 AromaticContact CD2-CD2 3.74Å; Y134-Y226 HydrophobicContact CD2-CD2 3.74Å; Y134-Y226 AromaticContact CD2-CE1 3.69Å; Y134-Y226 HydrophobicContact CD2-CE1 3.69Å; Y134-Y226 HydrophobicContact CD2-CE2 4.17Å; Y134-Y226 AromaticContact CD2-CG 3.19Å; Y134-Y226 HydrophobicContact CD2-CG 3.19Å; Y134-Y226 AromaticContact CE2-CD1 3.94Å; Y134-Y226 HydrophobicContact CE2-CD1 3.94Å; Y134-Y226 AromaticContact CE2-CD2 3.56Å; Y134-Y226 HydrophobicContact CE2-CD2 3.56Å; Y134-Y226 HydrophobicContact CE2-CE1 4.44Å; Y134-Y226 HydrophobicContact CE2-CE2 4.13Å; Y134-Y226 AromaticContact CE2-CG 3.41Å; Y134-Y226 HydrophobicContact CE2-CG 3.41Å; Y134-Y226 VanDerWaalsContact CE2-CG 3.41Å; Y134-Y226 AromaticContact CG-CD1 3.9Å; Y134-Y226 HydrophobicContact CG-CD1 3.9Å; Y134-Y226 HydrophobicContact CG-CG 4.07Å; L137-Y226 HydrophobicContact CD1-CE1 4.45Å; V191-Y226 HydrophobicContact CG1-CD2 4.29Å; T194-Y226 HydrophobicContact CG2-CE2 3.79Å; E222-Y226 PolarHBondContact O-N 3.4Å; A223-Y226 WeakPolarHBondContact O-CB 3.37Å; A223-Y226 PolarHBondContact O-N 2.73Å; Y226-C228 VanDerWaalsContact C-N 3.32Å; Y226-C228 PolarHBondContact O-N 2.79Å; Y226-F229 WeakPolarHBondContact O-CA 3.34Å; Y226-F229 WeakPolarHBondContact O-CB 3.47Å; Y226-F229 PolarHBondContact O-N 3.44Å; Y226-C230 PolarHBondContact O-N 2.9Å; Y226-L319 HydrophobicContact CD1-CD2 4.37Å; Y226-L319 HydrophobicContact CE1-CB 4.16Å; Y226-L319 HydrophobicContact CE1-CD2 4.17Å; Y226-L319 PolarHBondContact OH-O 3.4Å
227	V	97.8	Very high	96.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-55	-48.5	176.4	167.9	0	0	0	0	111	V113 L127 L130 A223 L224 F229 C230 A231 L317 L319	V113-V227 HydrophobicContact CG1-CG1 3.52Å; V113-V227 HydrophobicContact CG2-CG1 4.32Å; L127-V227 HydrophobicContact CD2-CG1 4.01Å; L130-V227 HydrophobicContact CB-CG2 3.75Å; L130-V227 HydrophobicContact CD1-CG1 3.88Å; L130-V227 HydrophobicContact CD1-CG2 4.26Å; A223-V227 WeakPolarHBondContact O-CG2 3.48Å; A223-V227 PolarHBondContact O-N 2.98Å; L224-V227 PolarHBondContact O-N 3.04Å; V227-F229 VanDerWaalsContact C-N 3.3Å; V227-F229 PolarHBondContact O-N 3.32Å; V227-C230 PolarHBondContact O-N 3.34Å; V227-A231 PolarHBondContact O-N 2.92Å; V227-A231 VanDerWaalsContact O-N 3.13Å; V227-L317 HydrophobicContact CG1-CD2 3.94Å; V227-L319 HydrophobicContact CG2-CD2 4.15Å
228	C	98.2	Very high	96.2	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-67.6	-30.4	177.2	-63.2	0	0	0	0	112.6	L111 L215 M219 L224 A225 Y226 A231 L232	L111-C228 HydrophobicContact CD1-CB 3.79Å; L215-C228 HydrophobicContact CD1-CB 4.33Å; L215-C228 HydrophobicContact CD2-CB 4.03Å; M219-C228 HydrophobicContact CE-CB 4.49Å; L224-C228 WeakPolarHBondContact O-CB 3.31Å; L224-C228 PolarHBondContact O-N 3.43Å; L224-C228 PolarHBondContact O-SG 3.26Å; A225-C228 PolarHBondContact O-N 3.42Å; Y226-C228 VanDerWaalsContact C-N 3.32Å; Y226-C228 PolarHBondContact O-N 2.79Å; C228-A231 PolarHBondContact O-N 3.11Å; C228-L232 WeakPolarHBondContact O-CB 3.45Å; C228-L232 PolarHBondContact O-N 3.11Å
229	F	98.3	Very high	96	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-71.5	-41.5	176.9	-172.5	-114	0	0	0	111.8	V191 L192 Y195 M208 L211 A212 L215 A225 Y226 V227 A231 L232 M233	V191-F229 HydrophobicContact CG1-CB 4.33Å; V191-F229 HydrophobicContact CG1-CD1 4.28Å; V191-F229 HydrophobicContact CG1-CG 4.41Å; L192-F229 HydrophobicContact CD2-CE1 4.11Å; L192-F229 HydrophobicContact CD2-CZ 3.96Å; Y195-F229 AromaticContact CD1-CE1 3.97Å; Y195-F229 HydrophobicContact CD1-CE1 3.97Å; Y195-F229 AromaticContact CD2-CD1 3.68Å; Y195-F229 HydrophobicContact CD2-CD1 3.68Å; Y195-F229 AromaticContact CD2-CE1 3.74Å; Y195-F229 HydrophobicContact CD2-CE1 3.74Å; Y195-F229 HydrophobicContact CE2-CD1 4.46Å; Y195-F229 HydrophobicContact CE2-CE1 4.41Å; Y195-F229 AromaticContact CG-CD1 3.83Å; Y195-F229 HydrophobicContact CG-CD1 3.83Å; Y195-F229 AromaticContact CG-CE1 3.5Å; Y195-F229 HydrophobicContact CG-CE1 3.5Å; M208-F229 HydrophobicContact CB-CZ 4.32Å; M208-F229 HydrophobicContact CE-CE1 4.02Å; M208-F229 HydrophobicContact CE-CZ 3.77Å; L211-F229 HydrophobicContact CB-CE2 4.07Å; A212-F229 HydrophobicContact CB-CD2 3.9Å; A212-F229 HydrophobicContact CB-CE2 3.86Å; A212-F229 HydrophobicContact CB-CG 4.42Å; A212-F229 HydrophobicContact CB-CZ 4.36Å; L215-F229 VanDerWaalsContact CD1-CA 3.49Å; L215-F229 HydrophobicContact CD1-CB 3.71Å; L215-F229 HydrophobicContact CD1-CD2 3.84Å; L215-F229 HydrophobicContact CD1-CG 4.29Å; A225-F229 VanDerWaalsContact O-CB 3.29Å; A225-F229 WeakPolarHBondContact O-CB 3.38Å; A225-F229 PolarHBondContact O-N 2.91Å; Y226-F229 WeakPolarHBondContact O-CA 3.34Å; Y226-F229 WeakPolarHBondContact O-CB 3.47Å; Y226-F229 PolarHBondContact O-N 3.44Å; V227-F229 VanDerWaalsContact C-N 3.3Å; V227-F229 PolarHBondContact O-N 3.32Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 2.92Å; F229-L232 PolarHBondContact O-N 3.2Å; F229-M233 HydrophobicContact CD1-CG 4.24Å; F229-M233 HydrophobicContact CD2-CG 4.28Å; F229-M233 HydrophobicContact CE1-CG 3.94Å; F229-M233 HydrophobicContact CE2-CG 3.99Å; F229-M233 HydrophobicContact CE2-SD 4.22Å; F229-M233 HydrophobicContact CG-CG 4.41Å; F229-M233 HydrophobicContact CZ-CG 3.8Å; F229-M233 HydrophobicContact CZ-SD 4.04Å; F229-M233 VanDerWaalsContact O-CB 3.28Å; F229-M233 WeakPolarHBondContact O-CB 3.19Å; F229-M233 VanDerWaalsContact O-CG 3.23Å; F229-M233 WeakPolarHBondContact O-CG 3.41Å; F229-M233 PolarHBondContact O-N 3.08Å
230	C	97	Very high	95.7	Very high	4 Å²	4	28.1 Å²	28.1	3%	0.027	12%	0.123	C	C	.	.	H	α-helix	trans	-57.3	-45.5	169.9	-75.2	0	0	0	0	111.5	Y226 V227 M233 K234 L319	Y226-C230 PolarHBondContact O-N 2.9Å; V227-C230 PolarHBondContact O-N 3.34Å; C230-M233 PolarHBondContact O-N 2.81Å; C230-K234 PolarHBondContact O-N 3.45Å; C230-L319 HydrophobicContact CB-CD2 4.36Å
231	A	96.2	Very high	95.4	Very high	5 Å²	5	23 Å²	23	4%	0.041	10%	0.101	C	C	.	.	H	α-helix	trans	-63.8	-44.5	177.8	0	0	0	0	0	112.8	L111 V113 V227 C228 F229 M233 K234 L317	L111-A231 HydrophobicContact CB-CB 4.17Å; L111-A231 WeakPolarHBondContact O-CB 3.19Å; V113-A231 HydrophobicContact CG2-CB 3.74Å; V227-A231 PolarHBondContact O-N 2.92Å; V227-A231 VanDerWaalsContact O-N 3.13Å; C228-A231 PolarHBondContact O-N 3.11Å; F229-A231 VanDerWaalsContact C-N 3.33Å; F229-A231 PolarHBondContact O-N 2.92Å; A231-M233 VanDerWaalsContact C-N 3.34Å; A231-M233 PolarHBondContact O-N 3.27Å; A231-K234 PolarHBondContact O-N 3.06Å; A231-L317 HydrophobicContact CB-CD1 4.32Å; A231-L317 HydrophobicContact CB-CD2 4.12Å
232	L	96.7	Very high	94.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.4	-42.7	172.7	-179.7	61.9	0	0	0	111.9	L111 L211 L215 C228 F229 K234 R235 L236 W305	L111-L232 HydrophobicContact CD2-CB 4.12Å; L111-L232 HydrophobicContact CD2-CD1 3.99Å; L211-L232 HydrophobicContact CB-CD2 4.3Å; L215-L232 HydrophobicContact CD1-CD2 4.11Å; C228-L232 WeakPolarHBondContact O-CB 3.45Å; C228-L232 PolarHBondContact O-N 3.11Å; F229-L232 PolarHBondContact O-N 3.2Å; L232-K234 PolarHBondContact O-N 3.19Å; L232-R235 PolarHBondContact O-N 2.85Å; L232-L236 HydrophobicContact CD1-CD1 3.73Å; L232-L236 HydrophobicContact CD1-CG 4.12Å; L232-L236 HydrophobicContact CD2-CD1 4.26Å; L232-L236 HydrophobicContact CG-CD1 3.83Å; L232-L236 HydrophobicContact CG-CG 4.34Å; L232-L236 PolarHBondContact O-N 3.12Å; L232-W305 HydrophobicContact CD1-CZ2 3.77Å; L232-W305 HydrophobicContact CD2-CZ2 4.21Å
233	M	95.3	Very high	94.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-71.4	-25.1	-179.1	-72.7	-62	-64.2	0	0	113.3	Y195 M208 F229 C230 A231 R235 L236 R237 F240	Y195-M233 HydrophobicContact CD2-CG 4.44Å; Y195-M233 HydrophobicContact CE1-CE 4.03Å; Y195-M233 HydrophobicContact CE1-CG 4.43Å; Y195-M233 HydrophobicContact CE2-CB 3.62Å; Y195-M233 HydrophobicContact CE2-CG 3.78Å; Y195-M233 WeakPolarHBondContact OH-CB 3.42Å; M208-M233 HydrophobicContact CE-CE 3.71Å; M208-M233 HydrophobicContact CE-SD 4.28Å; M208-M233 HydrophobicContact SD-CE 4.41Å; F229-M233 HydrophobicContact CD1-CG 4.24Å; F229-M233 HydrophobicContact CD2-CG 4.28Å; F229-M233 HydrophobicContact CE1-CG 3.94Å; F229-M233 HydrophobicContact CE2-CG 3.99Å; F229-M233 HydrophobicContact CE2-SD 4.22Å; F229-M233 HydrophobicContact CG-CG 4.41Å; F229-M233 HydrophobicContact CZ-CG 3.8Å; F229-M233 HydrophobicContact CZ-SD 4.04Å; F229-M233 VanDerWaalsContact O-CB 3.28Å; F229-M233 WeakPolarHBondContact O-CB 3.19Å; F229-M233 VanDerWaalsContact O-CG 3.23Å; F229-M233 WeakPolarHBondContact O-CG 3.41Å; F229-M233 PolarHBondContact O-N 3.08Å; C230-M233 PolarHBondContact O-N 2.81Å; A231-M233 VanDerWaalsContact C-N 3.34Å; A231-M233 PolarHBondContact O-N 3.27Å; M233-R235 PolarHBondContact O-N 3.39Å; M233-R235 VanDerWaalsContact O-N 3.15Å; M233-L236 PolarHBondContact O-N 3.3Å; M233-L236 HydrophobicContact SD-CB 4.33Å; M233-R237 HydrophobicContact CE-CB 4.18Å; M233-R237 WeakPolarHBondContact O-CA 3.43Å; M233-R237 WeakPolarHBondContact O-CB 3.48Å; M233-R237 VanDerWaalsContact O-CG 3.24Å; M233-R237 WeakPolarHBondContact O-CG 3.48Å; M233-R237 PolarHBondContact O-N 2.9Å; M233-F240 HydrophobicContact CE-CD2 3.79Å; M233-F240 HydrophobicContact CE-CE2 4.05Å; M233-F240 HydrophobicContact SD-CD2 4.44Å; M233-F240 HydrophobicContact SD-CE2 4.1Å
234	K	91.9	Very high	94.1	Very high	89 Å²	89	33.9 Å²	33.9	39%	0.387	17%	0.165	S	C	.	.	H	α-helix	trans	-52	-37.6	168.4	-77.7	-168.5	168.3	-164	0	111.7	C230 A231 L232 L317 D318	C230-K234 PolarHBondContact O-N 3.45Å; A231-K234 PolarHBondContact O-N 3.06Å; L232-K234 PolarHBondContact O-N 3.19Å; K234-L317 HydrophobicContact CD-CD1 3.9Å; K234-D318 IonicContact NZ-OD2 2.66Å; K234-D318 PolarHBondContact NZ-OD2 3.18Å
235	R	90.6	Very high	93.8	Very high	69 Å²	69	41.8 Å²	41.8	26%	0.26	19%	0.194	S	C	.	.	H	α-helix	trans	-84.5	-42.3	176.6	-72.7	163.4	42.3	-158.5	-21.2	113.3	L232 M233 L308	L232-R235 PolarHBondContact O-N 2.85Å; M233-R235 PolarHBondContact O-N 3.39Å; M233-R235 VanDerWaalsContact O-N 3.15Å; R235-L308 VanDerWaalsContact CZ-CD1 3.41Å; R235-L308 VanDerWaalsContact NH2-CD1 3.28Å
236	L	93.9	Very high	93.6	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-91.2	-17.4	-172.1	-62.3	-173.6	0	0	0	115.9	L211 L232 M233 K238 N239 F240 E287	L211-L236 HydrophobicContact CD1-CD1 3.79Å; L211-L236 HydrophobicContact CD2-CD1 4.13Å; L232-L236 HydrophobicContact CD1-CD1 3.73Å; L232-L236 HydrophobicContact CD1-CG 4.12Å; L232-L236 HydrophobicContact CD2-CD1 4.26Å; L232-L236 HydrophobicContact CG-CD1 3.83Å; L232-L236 HydrophobicContact CG-CG 4.34Å; L232-L236 PolarHBondContact O-N 3.12Å; M233-L236 PolarHBondContact O-N 3.3Å; M233-L236 HydrophobicContact SD-CB 4.33Å; L236-K238 PolarHBondContact O-N 3.49Å; L236-N239 VanDerWaalsContact O-CB 3.29Å; L236-N239 WeakPolarHBondContact O-CB 3.17Å; L236-N239 PolarHBondContact O-N 3.26Å; L236-F240 HydrophobicContact CB-CE2 4.32Å; L236-F240 WeakPolarHBondContact O-CD2 3.5Å; L236-E287 HydrophobicContact CD1-CG 4.23Å; L236-E287 HydrophobicContact CD2-CG 4.01Å
237	R	92.7	Very high	93.4	Very high	79 Å²	79	43.7 Å²	43.7	30%	0.298	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-51.5	-37.1	-172.6	63.3	-170.2	-159.1	97.2	-4.5	114.8	E201 E202 M233 N239 F240	E201-R237 IonicContact OE2-NH1 3.91Å; E202-R237 HydrophobicContact CG-CB 3.69Å; E202-R237 WeakPolarHBondContact OE1-CB 3.35Å; E202-R237 WeakPolarHBondContact OE1-CD 3.42Å; E202-R237 IonicContact OE1-CZ 2.66Å; E202-R237 IonicContact OE1-NE 2.75Å; E202-R237 IonicContact OE1-NH1 3.74Å; E202-R237 PolarHBondContact OE1-NH1 2.62Å; M233-R237 HydrophobicContact CE-CB 4.18Å; M233-R237 WeakPolarHBondContact O-CA 3.43Å; M233-R237 WeakPolarHBondContact O-CB 3.48Å; M233-R237 VanDerWaalsContact O-CG 3.24Å; M233-R237 WeakPolarHBondContact O-CG 3.48Å; M233-R237 PolarHBondContact O-N 2.9Å; R237-N239 PolarHBondContact O-N 2.84Å; R237-F240 PolarHBondContact O-N 3.32Å
238	K	92.9	Very high	93.3	Very high	103 Å²	103	48.3 Å²	48.3	45%	0.448	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-67.4	-19.3	-179.3	-52.8	-178.9	-178.8	172.9	0	113.3	L236 F240 M246	L236-K238 PolarHBondContact O-N 3.49Å; K238-F240 PolarHBondContact O-N 3.45Å; K238-M246 HydrophobicContact CB-CB 4.35Å; K238-M246 HydrophobicContact CB-CG 3.41Å; K238-M246 VanDerWaalsContact CB-CG 3.41Å; K238-M246 HydrophobicContact CB-SD 4.42Å; K238-M246 HydrophobicContact CD-CG 4.21Å; K238-M246 HydrophobicContact CD-SD 4.18Å; K238-M246 HydrophobicContact CG-CG 4.47Å; K238-M246 WeakPolarHBondContact O-CB 3.32Å
239	N	93.5	Very high	93.1	Very high	8 Å²	8	52.4 Å²	52.4	4%	0.043	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-69.4	-22.6	172.4	-60	-7.3	0	0	0	112.2	L236 R237 M247 K250 L285	L236-N239 VanDerWaalsContact O-CB 3.29Å; L236-N239 WeakPolarHBondContact O-CB 3.17Å; L236-N239 PolarHBondContact O-N 3.26Å; R237-N239 PolarHBondContact O-N 2.84Å; N239-M247 HydrophobicContact CB-SD 4.08Å; N239-K250 WeakPolarHBondContact OD1-CE 3.43Å; N239-L285 HydrophobicContact CB-CD1 3.95Å
240	F	93.1	Very high	93	Very high	12 Å²	12	52.6 Å²	52.6	5%	0.053	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-99	2	-176.5	-61.5	-78.6	0	0	0	113.1	C205 M208 L211 M233 L236 R237 K238 L285	C205-F240 HydrophobicContact CB-CB 4.33Å; C205-F240 HydrophobicContact CB-CD1 3.52Å; C205-F240 HydrophobicContact CB-CE1 4.26Å; C205-F240 HydrophobicContact CB-CG 4.3Å; M208-F240 HydrophobicContact CG-CD1 4.12Å; M208-F240 HydrophobicContact CG-CE1 3.73Å; M208-F240 HydrophobicContact CG-CE2 4.38Å; M208-F240 HydrophobicContact CG-CZ 3.88Å; M208-F240 HydrophobicContact SD-CD1 4.49Å; L211-F240 HydrophobicContact CD1-CE2 4Å; L211-F240 HydrophobicContact CD1-CZ 3.69Å; M233-F240 HydrophobicContact CE-CD2 3.79Å; M233-F240 HydrophobicContact CE-CE2 4.05Å; M233-F240 HydrophobicContact SD-CD2 4.44Å; M233-F240 HydrophobicContact SD-CE2 4.1Å; L236-F240 HydrophobicContact CB-CE2 4.32Å; L236-F240 WeakPolarHBondContact O-CD2 3.5Å; R237-F240 PolarHBondContact O-N 3.32Å; K238-F240 PolarHBondContact O-N 3.45Å; F240-L285 HydrophobicContact CD1-CD1 3.77Å; F240-L285 HydrophobicContact CE1-CD1 3.49Å; F240-L285 VanDerWaalsContact CE1-CD1 3.49Å; F240-L285 HydrophobicContact CE1-CD2 4.17Å; F240-L285 HydrophobicContact CE1-CG 3.87Å; F240-L285 HydrophobicContact CE2-CD1 4.48Å; F240-L285 HydrophobicContact CG-CD1 4.4Å; F240-L285 HydrophobicContact CZ-CD1 3.87Å; F240-L285 HydrophobicContact CZ-CG 4.24Å
241	Q	89.6	Confident	92.9	Very high	54 Å²	54	53.3 Å²	53.3	25%	0.252	25%	0.251	S	S	.	.			trans	-70.2	134	177.7	-73.2	179.6	-31.3	0	0	111.1	D243 G244	Q241-D243 PolarHBondContact O-N 3.42Å; Q241-G244 PolarHBondContact O-N 2.82Å
242	L	85.6	Confident	92.9	Very high	182 Å²	182	58.7 Å²	58.7	95%	0.953	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.4	-177.2	-66.2	174.2	0	0	0	114.4	G244	L242-G244 VanDerWaalsContact C-N 3.26Å; L242-G244 PolarHBondContact O-N 3.24Å
243	D	89.1	Confident	92.8	Very high	68 Å²	68	58.7 Å²	58.7	36%	0.364	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-13.3	174.9	64.8	61.3	0	0	0	114.1	Q241 R245	Q241-D243 PolarHBondContact O-N 3.42Å; D243-R245 HydrophobicContact CB-CG 4.19Å; D243-R245 VanDerWaalsContact CG-CZ 3.44Å; D243-R245 VanDerWaalsContact CG-NH2 3.33Å; D243-R245 PolarHBondContact O-N 3.1Å; D243-R245 WeakPolarHBondContact OD1-CB 3.31Å; D243-R245 VanDerWaalsContact OD1-CG 3.22Å; D243-R245 WeakPolarHBondContact OD1-CG 3.33Å; D243-R245 IonicContact OD1-CZ 2.79Å; D243-R245 PolarHBondContact OD1-N 3.46Å; D243-R245 IonicContact OD1-NE 3.34Å; D243-R245 PolarHBondContact OD1-NE 3.39Å; D243-R245 IonicContact OD1-NH2 2.86Å; D243-R245 IonicContact OD2-CZ 2.63Å; D243-R245 IonicContact OD2-NE 3.17Å; D243-R245 PolarHBondContact OD2-NE 2.98Å; D243-R245 IonicContact OD2-NH2 2.74Å; D243-R245 PolarHBondContact OD2-NH2 3.42Å
244	G	88.6	Confident	92.8	Very high	26 Å²	26	58.7 Å²	58.7	27%	0.268	27%	0.273	S	S	.	.			trans	65.7	-1.9	177.1	0	0	0	0	0	115.9	Q241 L242 M246 M247 T248	Q241-G244 PolarHBondContact O-N 2.82Å; L242-G244 VanDerWaalsContact C-N 3.26Å; L242-G244 PolarHBondContact O-N 3.24Å; G244-M246 VanDerWaalsContact C-N 3.3Å; G244-M246 PolarHBondContact O-N 3.47Å; G244-M246 VanDerWaalsContact O-N 3.16Å; G244-M247 WeakPolarHBondContact O-CA 3.38Å; G244-M247 WeakPolarHBondContact O-CB 3.08Å; G244-M247 PolarHBondContact O-N 3.48Å; G244-T248 PolarHBondContact O-N 3.28Å; G244-T248 PolarHBondContact O-OG1 3.39Å
245	R	93	Very high	93	Very high	170 Å²	170	55.2 Å²	55.2	64%	0.642	26%	0.26	S	S	*	.	H	α-helix	trans	-59.6	-37.4	-165.1	-69.6	176.8	-68.1	-151.1	2.9	113.4	D243 R249	D243-R245 HydrophobicContact CB-CG 4.19Å; D243-R245 VanDerWaalsContact CG-CZ 3.44Å; D243-R245 VanDerWaalsContact CG-NH2 3.33Å; D243-R245 PolarHBondContact O-N 3.1Å; D243-R245 WeakPolarHBondContact OD1-CB 3.31Å; D243-R245 VanDerWaalsContact OD1-CG 3.22Å; D243-R245 WeakPolarHBondContact OD1-CG 3.33Å; D243-R245 IonicContact OD1-CZ 2.79Å; D243-R245 PolarHBondContact OD1-N 3.46Å; D243-R245 IonicContact OD1-NE 3.34Å; D243-R245 PolarHBondContact OD1-NE 3.39Å; D243-R245 IonicContact OD1-NH2 2.86Å; D243-R245 IonicContact OD2-CZ 2.63Å; D243-R245 IonicContact OD2-NE 3.17Å; D243-R245 PolarHBondContact OD2-NE 2.98Å; D243-R245 IonicContact OD2-NH2 2.74Å; D243-R245 PolarHBondContact OD2-NH2 3.42Å; R245-R249 WeakPolarHBondContact O-CB 3.3Å; R245-R249 PolarHBondContact O-N 2.81Å
246	M	93.8	Very high	93.2	Very high	37 Å²	37	55.6 Å²	55.6	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-69.8	-36.9	176.2	-68.6	-54.2	-62.2	0	0	113.1	K238 G244 R249 K250	K238-M246 HydrophobicContact CB-CB 4.35Å; K238-M246 HydrophobicContact CB-CG 3.41Å; K238-M246 VanDerWaalsContact CB-CG 3.41Å; K238-M246 HydrophobicContact CB-SD 4.42Å; K238-M246 HydrophobicContact CD-CG 4.21Å; K238-M246 HydrophobicContact CD-SD 4.18Å; K238-M246 HydrophobicContact CG-CG 4.47Å; K238-M246 WeakPolarHBondContact O-CB 3.32Å; G244-M246 VanDerWaalsContact C-N 3.3Å; G244-M246 PolarHBondContact O-N 3.47Å; G244-M246 VanDerWaalsContact O-N 3.16Å; M246-R249 PolarHBondContact O-N 2.84Å; M246-K250 WeakPolarHBondContact O-CG 3.14Å; M246-K250 PolarHBondContact O-N 3.27Å
247	M	94.1	Very high	93.2	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-67.5	-46.8	175.3	-69.5	-60.5	-64.5	0	0	109.8	N239 G244 R249 K250 F251 Y281 L284 L285	N239-M247 HydrophobicContact CB-SD 4.08Å; G244-M247 WeakPolarHBondContact O-CA 3.38Å; G244-M247 WeakPolarHBondContact O-CB 3.08Å; G244-M247 PolarHBondContact O-N 3.48Å; M247-R249 VanDerWaalsContact C-N 3.27Å; M247-R249 PolarHBondContact O-N 3.4Å; M247-K250 PolarHBondContact O-N 3.13Å; M247-K250 VanDerWaalsContact O-N 3.11Å; M247-K250 HydrophobicContact SD-CD 4.22Å; M247-F251 HydrophobicContact CE-CE2 4.17Å; M247-F251 WeakPolarHBondContact O-CD2 3.49Å; M247-F251 PolarHBondContact O-N 2.66Å; M247-Y281 HydrophobicContact CB-CE2 4.34Å; M247-Y281 HydrophobicContact CE-CD2 3.84Å; M247-Y281 HydrophobicContact CE-CE2 3.69Å; M247-Y281 HydrophobicContact CE-CG 4.27Å; M247-Y281 HydrophobicContact CG-CE2 4.3Å; M247-L284 HydrophobicContact CE-CB 3.68Å; M247-L284 HydrophobicContact SD-CB 4.43Å; M247-L285 HydrophobicContact CE-CB 4.13Å; M247-L285 HydrophobicContact SD-CD1 4.36Å
248	T	95.1	Very high	93.3	Very high	97 Å²	97	51.7 Å²	51.7	60%	0.595	25%	0.25	S	C	*	.	H	α-helix	trans	-54.9	-41.5	172.5	-51.9	0	0	0	0	112.1	G244 K252	G244-T248 PolarHBondContact O-N 3.28Å; G244-T248 PolarHBondContact O-OG1 3.39Å; T248-K252 PolarHBondContact O-N 3.5Å
249	R	94.3	Very high	93.5	Very high	86 Å²	86	50.2 Å²	50.2	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-46.7	174.7	-179.4	65.2	-157.5	-156.8	14.6	112.2	R245 M246 M247 F251 K252 D253	R245-R249 WeakPolarHBondContact O-CB 3.3Å; R245-R249 PolarHBondContact O-N 2.81Å; M246-R249 PolarHBondContact O-N 2.84Å; M247-R249 VanDerWaalsContact C-N 3.27Å; M247-R249 PolarHBondContact O-N 3.4Å; R249-F251 VanDerWaalsContact C-N 3.34Å; R249-F251 PolarHBondContact O-N 2.85Å; R249-K252 PolarHBondContact O-N 3.17Å; R249-D253 IonicContact CZ-OD1 3.29Å; R249-D253 VanDerWaalsContact NE-CG 3.32Å; R249-D253 IonicContact NE-OD1 3.44Å; R249-D253 PolarHBondContact NE-OD1 3.19Å; R249-D253 IonicContact NE-OD2 2.92Å; R249-D253 PolarHBondContact NE-OD2 3.02Å; R249-D253 VanDerWaalsContact NE-OD2 3.13Å; R249-D253 IonicContact NH2-OD1 3.16Å; R249-D253 PolarHBondContact NH2-OD1 3.05Å; R249-D253 IonicContact NH2-OD2 2.75Å; R249-D253 WeakPolarHBondContact O-CB 3.21Å; R249-D253 VanDerWaalsContact O-CG 3.27Å; R249-D253 PolarHBondContact O-N 2.97Å
250	K	95.6	Very high	93.4	Very high	5 Å²	5	53.4 Å²	53.4	2%	0.022	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-40.6	177.7	-75.8	173.2	-180	-69.9	0	112.3	N239 M246 M247 L254 L284 G644 M651	N239-K250 WeakPolarHBondContact OD1-CE 3.43Å; M246-K250 WeakPolarHBondContact O-CG 3.14Å; M246-K250 PolarHBondContact O-N 3.27Å; M247-K250 PolarHBondContact O-N 3.13Å; M247-K250 VanDerWaalsContact O-N 3.11Å; M247-K250 HydrophobicContact SD-CD 4.22Å; K250-L254 VanDerWaalsContact O-CB 3.3Å; K250-L254 WeakPolarHBondContact O-CB 3.39Å; K250-L254 PolarHBondContact O-N 3.13Å; K250-L284 HydrophobicContact CB-CD1 4.1Å; K250-L284 HydrophobicContact CB-CD2 4.5Å; K250-L284 HydrophobicContact CD-CB 4.5Å; K250-G644 WeakPolarHBondContact CG-O 3.47Å; K250-G644 PolarHBondContact NZ-O 2.82Å; K250-M651 HydrophobicContact CB-SD 4.43Å
251	F	96.4	Very high	93.5	Very high	18 Å²	18	55.1 Å²	55.1	8%	0.079	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-50.6	173.7	-78.8	-69	0	0	0	111.7	M247 R249 D253 L254 C255 D276 L277 L278 Y281 L284	M247-F251 HydrophobicContact CE-CE2 4.17Å; M247-F251 WeakPolarHBondContact O-CD2 3.49Å; M247-F251 PolarHBondContact O-N 2.66Å; R249-F251 VanDerWaalsContact C-N 3.34Å; R249-F251 PolarHBondContact O-N 2.85Å; F251-D253 VanDerWaalsContact C-N 3.31Å; F251-D253 PolarHBondContact O-N 3.37Å; F251-L254 WeakPolarHBondContact O-CB 3.21Å; F251-L254 PolarHBondContact O-N 2.87Å; F251-C255 PolarHBondContact O-N 3.12Å; F251-C255 PolarHBondContact O-SG 3.3Å; F251-D276 WeakPolarHBondContact CD1-O 3.44Å; F251-L277 HydrophobicContact CD1-CB 4.22Å; F251-L277 HydrophobicContact CE1-CB 4.4Å; F251-L277 WeakPolarHBondContact CE1-O 3.32Å; F251-L278 HydrophobicContact CD2-CD2 4.5Å; F251-L278 HydrophobicContact CE1-CD2 4.33Å; F251-L278 HydrophobicContact CE2-CD2 4.01Å; F251-L278 HydrophobicContact CZ-CD2 3.88Å; F251-Y281 AromaticContact CE2-CD2 3.68Å; F251-Y281 HydrophobicContact CE2-CD2 3.68Å; F251-Y281 HydrophobicContact CE2-CE2 4.36Å; F251-Y281 AromaticContact CZ-CD2 3.8Å; F251-Y281 HydrophobicContact CZ-CD2 3.8Å; F251-Y281 HydrophobicContact CZ-CG 4.28Å; F251-L284 HydrophobicContact CD1-CD1 3.8Å; F251-L284 HydrophobicContact CD2-CD1 4.36Å; F251-L284 HydrophobicContact CE1-CD1 3.76Å; F251-L284 HydrophobicContact CE2-CD1 4.31Å; F251-L284 HydrophobicContact CG-CD1 4.11Å; F251-L284 HydrophobicContact CZ-CD1 4.05Å
252	K	94.9	Very high	93.8	Very high	119 Å²	119	53.3 Å²	53.3	52%	0.517	26%	0.258	S	S	.	.	H	α-helix	trans	-55.2	-47	177	177.3	169.9	175.3	168.9	0	112.1	T248 R249 L254 C255 E256	T248-K252 PolarHBondContact O-N 3.5Å; R249-K252 PolarHBondContact O-N 3.17Å; K252-L254 VanDerWaalsContact C-N 3.3Å; K252-L254 PolarHBondContact O-N 3Å; K252-C255 PolarHBondContact O-N 3.38Å; K252-E256 WeakPolarHBondContact CE-OE1 3.43Å; K252-E256 WeakPolarHBondContact CG-OE1 3.08Å; K252-E256 IonicContact NZ-OE1 2.76Å; K252-E256 WeakPolarHBondContact O-CG 3.35Å; K252-E256 PolarHBondContact O-N 2.93Å
253	D	94.9	Very high	94.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-38.7	176.4	-72.5	-25.3	0	0	0	112.4	R249 F251 L257 I638 L643 G644	R249-D253 IonicContact CZ-OD1 3.29Å; R249-D253 VanDerWaalsContact NE-CG 3.32Å; R249-D253 IonicContact NE-OD1 3.44Å; R249-D253 PolarHBondContact NE-OD1 3.19Å; R249-D253 IonicContact NE-OD2 2.92Å; R249-D253 PolarHBondContact NE-OD2 3.02Å; R249-D253 VanDerWaalsContact NE-OD2 3.13Å; R249-D253 IonicContact NH2-OD1 3.16Å; R249-D253 PolarHBondContact NH2-OD1 3.05Å; R249-D253 IonicContact NH2-OD2 2.75Å; R249-D253 WeakPolarHBondContact O-CB 3.21Å; R249-D253 VanDerWaalsContact O-CG 3.27Å; R249-D253 PolarHBondContact O-N 2.97Å; F251-D253 VanDerWaalsContact C-N 3.31Å; F251-D253 PolarHBondContact O-N 3.37Å; D253-L257 VanDerWaalsContact O-CG 3.29Å; D253-L257 WeakPolarHBondContact O-CG 3.49Å; D253-L257 PolarHBondContact O-N 2.91Å; D253-L257 VanDerWaalsContact O-N 3.07Å; D253-I638 WeakPolarHBondContact OD1-CD1 3.33Å; D253-L643 HydrophobicContact CB-CD1 3.85Å; D253-G644 WeakPolarHBondContact OD2-CA 3.49Å; D253-G644 PolarHBondContact OD2-N 3.33Å
254	L	96.1	Very high	94.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-71.1	-40.9	178.7	-176.2	59.9	0	0	0	112.4	K250 F251 K252 L257 L258 L277 L284 C654 V655 F658	K250-L254 VanDerWaalsContact O-CB 3.3Å; K250-L254 WeakPolarHBondContact O-CB 3.39Å; K250-L254 PolarHBondContact O-N 3.13Å; F251-L254 WeakPolarHBondContact O-CB 3.21Å; F251-L254 PolarHBondContact O-N 2.87Å; K252-L254 VanDerWaalsContact C-N 3.3Å; K252-L254 PolarHBondContact O-N 3Å; L254-L257 PolarHBondContact O-N 3.24Å; L254-L258 WeakPolarHBondContact O-CB 3.42Å; L254-L258 PolarHBondContact O-N 3.45Å; L254-L277 HydrophobicContact CB-CD1 4.3Å; L254-L277 HydrophobicContact CD2-CD1 3.83Å; L254-L277 HydrophobicContact CG-CD1 3.69Å; L254-L284 HydrophobicContact CD2-CD1 4.23Å; L254-L284 HydrophobicContact CD2-CD2 4.35Å; L254-C654 HydrophobicContact CD1-CB 3.63Å; L254-C654 HydrophobicContact CD2-CB 4.11Å; L254-V655 HydrophobicContact CD1-CG2 3.82Å; L254-F658 HydrophobicContact CD2-CE2 4.2Å
255	C	95.5	Very high	95.2	Very high	15 Å²	15	47.3 Å²	47.3	10%	0.101	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-47.5	173.4	-60	0	0	0	0	111	F251 K252 L257 L258 E259 Y266 D275	F251-C255 PolarHBondContact O-N 3.12Å; F251-C255 PolarHBondContact O-SG 3.3Å; K252-C255 PolarHBondContact O-N 3.38Å; C255-L257 VanDerWaalsContact C-N 3.33Å; C255-L257 PolarHBondContact O-N 3.4Å; C255-L258 PolarHBondContact O-N 3.35Å; C255-L258 VanDerWaalsContact O-N 3.14Å; C255-E259 PolarHBondContact O-N 2.96Å; C255-Y266 HydrophobicContact CB-CE2 3.89Å; C255-D275 PolarHBondContact SG-O 2.82Å
256	E	93.9	Very high	95.4	Very high	78 Å²	78	40.8 Å²	40.8	36%	0.364	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-37.1	178.1	-74	-176	-145.9	0	0	112.6	K252 H260 I638	K252-E256 WeakPolarHBondContact CE-OE1 3.43Å; K252-E256 WeakPolarHBondContact CG-OE1 3.08Å; K252-E256 IonicContact NZ-OE1 2.76Å; K252-E256 WeakPolarHBondContact O-CG 3.35Å; K252-E256 PolarHBondContact O-N 2.93Å; E256-H260 WeakPolarHBondContact O-CB 3.5Å; E256-H260 PolarHBondContact O-N 3.19Å; E256-H260 VanDerWaalsContact O-N 3.08Å; E256-I638 WeakPolarHBondContact OE2-CD1 3.41Å
257	L	94.7	Very high	95.6	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-69.4	-39.7	172.7	-74.2	168.6	0	0	0	112.5	D253 L254 C255 H260 Y261 L643 M651 F652 V655 Y702	D253-L257 VanDerWaalsContact O-CG 3.29Å; D253-L257 WeakPolarHBondContact O-CG 3.49Å; D253-L257 PolarHBondContact O-N 2.91Å; D253-L257 VanDerWaalsContact O-N 3.07Å; L254-L257 PolarHBondContact O-N 3.24Å; C255-L257 VanDerWaalsContact C-N 3.33Å; C255-L257 PolarHBondContact O-N 3.4Å; L257-H260 WeakPolarHBondContact O-CB 3.48Å; L257-H260 PolarHBondContact O-N 3.03Å; L257-Y261 HydrophobicContact CD2-CE2 4.45Å; L257-Y261 WeakPolarHBondContact O-CD2 3.14Å; L257-Y261 PolarHBondContact O-N 3.33Å; L257-L643 HydrophobicContact CD1-CD1 4.03Å; L257-L643 HydrophobicContact CD1-CD2 4.1Å; L257-L643 HydrophobicContact CD1-CG 4.31Å; L257-L643 HydrophobicContact CD2-CD2 4.23Å; L257-L643 HydrophobicContact CG-CD1 4.19Å; L257-M651 HydrophobicContact CD1-CB 3.41Å; L257-M651 VanDerWaalsContact CD1-CB 3.41Å; L257-M651 HydrophobicContact CD1-CG 4.21Å; L257-F652 HydrophobicContact CD1-CE2 4.5Å; L257-F652 HydrophobicContact CD1-CZ 4.42Å; L257-F652 HydrophobicContact CD2-CE1 3.95Å; L257-F652 HydrophobicContact CD2-CZ 3.77Å; L257-V655 HydrophobicContact CB-CG2 3.92Å; L257-Y702 HydrophobicContact CD2-CD2 4.13Å; L257-Y702 HydrophobicContact CD2-CE2 3.78Å
258	L	95.5	Very high	95.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.3	-41.8	-179.8	-165.9	60.9	0	0	0	111.1	L254 C255 H260 Y261 D262 F265 Y266 L269 L277 F658 L659	L254-L258 WeakPolarHBondContact O-CB 3.42Å; L254-L258 PolarHBondContact O-N 3.45Å; C255-L258 PolarHBondContact O-N 3.35Å; C255-L258 VanDerWaalsContact O-N 3.14Å; L258-H260 VanDerWaalsContact C-N 3.26Å; L258-H260 PolarHBondContact O-N 3.24Å; L258-Y261 PolarHBondContact O-N 3.44Å; L258-D262 CarbonylContact O-C 3.46Å; L258-D262 PolarHBondContact O-N 3.18Å; L258-F265 HydrophobicContact CD1-CD1 4.09Å; L258-F265 HydrophobicContact CD1-CE1 4.42Å; L258-F265 HydrophobicContact CD2-CD1 4.26Å; L258-F265 HydrophobicContact CD2-CE1 4.21Å; L258-F265 HydrophobicContact CG-CD1 4.36Å; L258-Y266 HydrophobicContact CB-CD2 4.29Å; L258-Y266 HydrophobicContact CD2-CD2 4.35Å; L258-Y266 HydrophobicContact CG-CD2 4.41Å; L258-L269 HydrophobicContact CD2-CD1 3.57Å; L258-L277 HydrophobicContact CD2-CD1 4.42Å; L258-L277 HydrophobicContact CD2-CD2 4.19Å; L258-F658 HydrophobicContact CD1-CB 3.98Å; L258-F658 HydrophobicContact CD1-CG 4.41Å; L258-F658 HydrophobicContact CD2-CD2 4.36Å; L258-F658 HydrophobicContact CD2-CG 4.31Å; L258-L659 HydrophobicContact CD1-CD2 4.07Å; L258-L659 HydrophobicContact CD1-CG 4.45Å
259	E	95.6	Very high	95.9	Very high	72 Å²	72	39.1 Å²	39.1	34%	0.336	19%	0.189	S	C	.	.	H	α-helix	trans	-57.6	-39	168.7	-171.1	-171	148.2	0	0	111.1	C255 P263 Y266 R635	C255-E259 PolarHBondContact O-N 2.96Å; E259-P263 WeakPolarHBondContact O-CD 3.2Å; E259-P263 VanDerWaalsContact O-CG 3.26Å; E259-P263 WeakPolarHBondContact O-CG 3.22Å; E259-Y266 HydrophobicContact CB-CD1 3.65Å; E259-Y266 HydrophobicContact CB-CE1 4.02Å; E259-Y266 HydrophobicContact CB-CG 3.94Å; E259-Y266 HydrophobicContact CG-CD1 3.81Å; E259-Y266 HydrophobicContact CG-CE1 4.22Å; E259-Y266 HydrophobicContact CG-CG 4.5Å; E259-R635 IonicContact OE1-NH1 2.63Å; E259-R635 IonicContact OE1-NH2 3.13Å; E259-R635 PolarHBondContact OE1-NH2 3.48Å
260	H	92.6	Very high	96	Very high	75 Å²	75	41 Å²	41	35%	0.347	20%	0.196	S	C	.	.	H	α-helix	trans	-68.6	-42.6	179.9	-177.3	34	0	0	0	113.6	E256 L257 L258 Y702	E256-H260 WeakPolarHBondContact O-CB 3.5Å; E256-H260 PolarHBondContact O-N 3.19Å; E256-H260 VanDerWaalsContact O-N 3.08Å; L257-H260 WeakPolarHBondContact O-CB 3.48Å; L257-H260 PolarHBondContact O-N 3.03Å; L258-H260 VanDerWaalsContact C-N 3.26Å; L258-H260 PolarHBondContact O-N 3.24Å; H260-Y702 AromaticContact CD2-CD2 3.92Å; H260-Y702 AromaticContact CD2-CE2 3.93Å
261	Y	94.2	Very high	96.1	Very high	47 Å²	47	47.6 Å²	47.6	18%	0.184	23%	0.227	C	C	.	.	H	α-helix	trans	-86.4	-35.9	-175.1	-85	-80.3	0	0	0	114.2	L257 L258 F652 V655 F698 Y702	L257-Y261 HydrophobicContact CD2-CE2 4.45Å; L257-Y261 WeakPolarHBondContact O-CD2 3.14Å; L257-Y261 PolarHBondContact O-N 3.33Å; L258-Y261 PolarHBondContact O-N 3.44Å; Y261-F652 HydrophobicContact CE2-CD1 4.32Å; Y261-F652 AromaticContact CE2-CE1 3.82Å; Y261-F652 HydrophobicContact CE2-CE1 3.82Å; Y261-V655 HydrophobicContact CD2-CG1 4.32Å; Y261-V655 HydrophobicContact CG-CG1 4.36Å; Y261-F698 AromaticContact CD1-CD1 3.77Å; Y261-F698 HydrophobicContact CD1-CD1 3.77Å; Y261-F698 HydrophobicContact CD1-CE1 4.03Å; Y261-F698 HydrophobicContact CD1-CG 4.23Å; Y261-F698 HydrophobicContact CE1-CB 3.93Å; Y261-F698 AromaticContact CE1-CD1 3.52Å; Y261-F698 HydrophobicContact CE1-CD1 3.52Å; Y261-F698 HydrophobicContact CE1-CE1 4.21Å; Y261-F698 AromaticContact CE1-CG 3.92Å; Y261-F698 HydrophobicContact CE1-CG 3.92Å; Y261-F698 HydrophobicContact CE2-CB 4.47Å; Y261-F698 PolarHBondContact OH-O 3.36Å; Y261-Y702 HydrophobicContact CE2-CD2 4.39Å; Y261-Y702 WeakPolarHBondContact OH-CB 3.2Å
262	D	95.7	Very high	96	Very high	17 Å²	17	47.7 Å²	47.7	9%	0.091	23%	0.232	C	C	.	.			trans	-143.8	87	172.1	-167.3	-22.3	0	0	0	111.3	L258 S264 F265 Y266 L659 R662	L258-D262 CarbonylContact O-C 3.46Å; L258-D262 PolarHBondContact O-N 3.18Å; D262-S264 PolarHBondContact O-N 2.94Å; D262-S264 WeakPolarHBondContact OD1-CA 3.49Å; D262-S264 WeakPolarHBondContact OD1-CB 3.4Å; D262-S264 PolarHBondContact OD1-N 3.17Å; D262-S264 PolarHBondContact OD1-OG 2.89Å; D262-F265 HydrophobicContact CB-CB 3.95Å; D262-F265 VanDerWaalsContact CG-CB 3.49Å; D262-F265 PolarHBondContact O-N 3.48Å; D262-F265 PolarHBondContact OD1-N 3.31Å; D262-Y266 PolarHBondContact O-N 3.18Å; D262-L659 HydrophobicContact CB-CD2 3.64Å; D262-R662 WeakPolarHBondContact OD2-CD 3.41Å; D262-R662 IonicContact OD2-CZ 3.23Å; D262-R662 IonicContact OD2-NE 3.43Å; D262-R662 PolarHBondContact OD2-NE 3.33Å; D262-R662 IonicContact OD2-NH2 3.38Å
263	P	97	Very high	96.1	Very high	83 Å²	83	49.3 Å²	49.3	54%	0.539	24%	0.241	S	C	.	.	H	α-helix	trans	-56.7	-30.6	175.3	-19.8	26.5	0	0	0	113.2	E259 E267	E259-P263 WeakPolarHBondContact O-CD 3.2Å; E259-P263 VanDerWaalsContact O-CG 3.26Å; E259-P263 WeakPolarHBondContact O-CG 3.22Å; P263-E267 VanDerWaalsContact O-CB 3.31Å; P263-E267 WeakPolarHBondContact O-CB 3.33Å; P263-E267 PolarHBondContact O-N 2.82Å
264	S	97.6	Very high	96.1	Very high	66 Å²	66	49.3 Å²	49.3	46%	0.462	24%	0.241	S	C	.	.	H	α-helix	trans	-75.2	-35.8	-177.2	73.3	0	0	0	0	112.4	D262 Y268	D262-S264 PolarHBondContact O-N 2.94Å; D262-S264 WeakPolarHBondContact OD1-CA 3.49Å; D262-S264 WeakPolarHBondContact OD1-CB 3.4Å; D262-S264 PolarHBondContact OD1-N 3.17Å; D262-S264 PolarHBondContact OD1-OG 2.89Å; S264-Y268 PolarHBondContact O-N 2.87Å
265	F	97.9	Very high	96.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-75.1	-37.7	173.1	-178.1	-119.1	0	0	0	111.7	L258 D262 Y268 L269 F658 L659 R662 I665 M666	L258-F265 HydrophobicContact CD1-CD1 4.09Å; L258-F265 HydrophobicContact CD1-CE1 4.42Å; L258-F265 HydrophobicContact CD2-CD1 4.26Å; L258-F265 HydrophobicContact CD2-CE1 4.21Å; L258-F265 HydrophobicContact CG-CD1 4.36Å; D262-F265 HydrophobicContact CB-CB 3.95Å; D262-F265 VanDerWaalsContact CG-CB 3.49Å; D262-F265 PolarHBondContact O-N 3.48Å; D262-F265 PolarHBondContact OD1-N 3.31Å; F265-Y268 HydrophobicContact CD2-CD1 4.41Å; F265-Y268 HydrophobicContact CE2-CD1 4.35Å; F265-Y268 WeakPolarHBondContact O-CB 3.38Å; F265-Y268 PolarHBondContact O-N 3.08Å; F265-L269 HydrophobicContact CD1-CD1 4.2Å; F265-L269 HydrophobicContact CE1-CD1 3.77Å; F265-L269 HydrophobicContact CE1-CG 4.31Å; F265-L269 HydrophobicContact CE2-CD2 4.36Å; F265-L269 HydrophobicContact CE2-CG 4.37Å; F265-L269 HydrophobicContact CZ-CD1 4.04Å; F265-L269 HydrophobicContact CZ-CD2 4.09Å; F265-L269 HydrophobicContact CZ-CG 4.15Å; F265-L269 WeakPolarHBondContact O-CG 3.44Å; F265-L269 PolarHBondContact O-N 3.27Å; F265-F658 HydrophobicContact CE1-CB 4.12Å; F265-F658 HydrophobicContact CE1-CD1 4.04Å; F265-F658 HydrophobicContact CE1-CG 4.43Å; F265-F658 HydrophobicContact CZ-CD1 4.43Å; F265-L659 HydrophobicContact CD1-CD2 4.36Å; F265-R662 HydrophobicContact CB-CB 4.43Å; F265-R662 HydrophobicContact CD1-CB 4.12Å; F265-R662 HydrophobicContact CD2-CB 3.7Å; F265-R662 HydrophobicContact CE1-CB 4.32Å; F265-R662 HydrophobicContact CE2-CB 3.92Å; F265-R662 HydrophobicContact CG-CB 3.81Å; F265-R662 HydrophobicContact CZ-CB 4.22Å; F265-I665 HydrophobicContact CE2-CB 4.12Å; F265-I665 HydrophobicContact CE2-CD1 4.29Å; F265-I665 HydrophobicContact CE2-CG2 3.82Å; F265-I665 HydrophobicContact CZ-CD1 3.95Å; F265-I665 HydrophobicContact CZ-CG2 4.35Å; F265-M666 HydrophobicContact CB-SD 4.35Å; F265-M666 HydrophobicContact CD2-CG 3.87Å; F265-M666 HydrophobicContact CD2-SD 3.85Å; F265-M666 HydrophobicContact CE2-CG 4.31Å
266	Y	97.7	Very high	96	Very high	34 Å²	34	54.3 Å²	54.3	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-41.6	174.8	-173.9	-107.1	0	0	0	112.4	C255 L258 E259 D262 Y268 L269 R270 D275	C255-Y266 HydrophobicContact CB-CE2 3.89Å; L258-Y266 HydrophobicContact CB-CD2 4.29Å; L258-Y266 HydrophobicContact CD2-CD2 4.35Å; L258-Y266 HydrophobicContact CG-CD2 4.41Å; E259-Y266 HydrophobicContact CB-CD1 3.65Å; E259-Y266 HydrophobicContact CB-CE1 4.02Å; E259-Y266 HydrophobicContact CB-CG 3.94Å; E259-Y266 HydrophobicContact CG-CD1 3.81Å; E259-Y266 HydrophobicContact CG-CE1 4.22Å; E259-Y266 HydrophobicContact CG-CG 4.5Å; D262-Y266 PolarHBondContact O-N 3.18Å; Y266-Y268 VanDerWaalsContact C-N 3.34Å; Y266-Y268 PolarHBondContact O-N 3.43Å; Y266-L269 PolarHBondContact O-N 3.37Å; Y266-R270 PolarHBondContact O-N 3.41Å; Y266-D275 HydrophobicContact CE2-CB 4.24Å
267	E	97.8	Very high	96.1	Very high	69 Å²	69	50.6 Å²	50.6	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-43.6	172.7	-172.4	63.5	-123.8	0	0	111.6	P263 L269 R270 E271	P263-E267 VanDerWaalsContact O-CB 3.31Å; P263-E267 WeakPolarHBondContact O-CB 3.33Å; P263-E267 PolarHBondContact O-N 2.82Å; E267-L269 VanDerWaalsContact C-N 3.33Å; E267-L269 PolarHBondContact O-N 2.92Å; E267-R270 WeakPolarHBondContact O-CB 3.47Å; E267-R270 PolarHBondContact O-N 3.15Å; E267-R270 VanDerWaalsContact O-N 3.12Å; E267-R270 IonicContact OE1-CZ 3.51Å; E267-R270 IonicContact OE1-NE 3.61Å; E267-R270 PolarHBondContact OE1-NE 2.93Å; E267-R270 IonicContact OE1-NH2 3.53Å; E267-R270 PolarHBondContact OE1-NH2 2.98Å; E267-R270 IonicContact OE2-CZ 2.98Å; E267-R270 VanDerWaalsContact OE2-CZ 3.24Å; E267-R270 IonicContact OE2-NE 3.1Å; E267-R270 IonicContact OE2-NH1 2.71Å; E267-R270 IonicContact OE2-NH2 3.86Å; E267-R270 PolarHBondContact OE2-NH2 3.01Å; E267-E271 PolarHBondContact O-N 3.26Å
268	Y	98.2	Very high	96.1	Very high	34 Å²	34	54.7 Å²	54.7	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-43.5	173.8	171.1	-84.7	0	0	0	112.5	S264 F265 Y266 R270 E271 A272 I665 M666 K669 M670	S264-Y268 PolarHBondContact O-N 2.87Å; F265-Y268 HydrophobicContact CD2-CD1 4.41Å; F265-Y268 HydrophobicContact CE2-CD1 4.35Å; F265-Y268 WeakPolarHBondContact O-CB 3.38Å; F265-Y268 PolarHBondContact O-N 3.08Å; Y266-Y268 VanDerWaalsContact C-N 3.34Å; Y266-Y268 PolarHBondContact O-N 3.43Å; Y268-R270 VanDerWaalsContact C-N 3.29Å; Y268-R270 PolarHBondContact O-N 2.91Å; Y268-E271 PolarHBondContact O-N 3.39Å; Y268-A272 HydrophobicContact CE1-CB 4.26Å; Y268-A272 VanDerWaalsContact O-CB 3.31Å; Y268-A272 WeakPolarHBondContact O-CB 3.44Å; Y268-A272 PolarHBondContact O-N 3.28Å; Y268-I665 HydrophobicContact CD1-CG2 4.41Å; Y268-I665 HydrophobicContact CE1-CG2 3.72Å; Y268-M666 HydrophobicContact CD1-CG 4.02Å; Y268-M666 HydrophobicContact CD2-CE 4.34Å; Y268-M666 HydrophobicContact CD2-CG 4.03Å; Y268-M666 HydrophobicContact CE1-CG 4.45Å; Y268-M666 HydrophobicContact CE2-CG 4.41Å; Y268-M666 HydrophobicContact CG-CE 4.27Å; Y268-M666 HydrophobicContact CG-CG 3.83Å; Y268-K669 VanDerWaalsContact OH-CA 3.22Å; Y268-K669 WeakPolarHBondContact OH-CA 3.26Å; Y268-M670 PolarHBondContact OH-N 3.04Å; Y268-M670 PolarHBondContact OH-O 3.25Å
269	L	97.7	Very high	96	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-37.8	176.4	-69.6	174.1	0	0	0	111.5	L258 F265 Y266 E267 A272 H273 A274 D275 L277 I675	L258-L269 HydrophobicContact CD2-CD1 3.57Å; F265-L269 HydrophobicContact CD1-CD1 4.2Å; F265-L269 HydrophobicContact CE1-CD1 3.77Å; F265-L269 HydrophobicContact CE1-CG 4.31Å; F265-L269 HydrophobicContact CE2-CD2 4.36Å; F265-L269 HydrophobicContact CE2-CG 4.37Å; F265-L269 HydrophobicContact CZ-CD1 4.04Å; F265-L269 HydrophobicContact CZ-CD2 4.09Å; F265-L269 HydrophobicContact CZ-CG 4.15Å; F265-L269 WeakPolarHBondContact O-CG 3.44Å; F265-L269 PolarHBondContact O-N 3.27Å; Y266-L269 PolarHBondContact O-N 3.37Å; E267-L269 VanDerWaalsContact C-N 3.33Å; E267-L269 PolarHBondContact O-N 2.92Å; L269-A272 CarbonylContact O-C 3.59Å; L269-A272 PolarHBondContact O-N 2.94Å; L269-H273 PolarHBondContact O-N 3.39Å; L269-H273 VanDerWaalsContact O-N 3.11Å; L269-A274 HydrophobicContact CD2-CB 4.09Å; L269-A274 PolarHBondContact O-N 3.3Å; L269-D275 PolarHBondContact O-N 3Å; L269-L277 HydrophobicContact CD1-CD2 3.85Å; L269-I675 HydrophobicContact CD2-CD1 3.63Å
270	R	97.1	Very high	96	Very high	125 Å²	125	52.9 Å²	52.9	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-66.7	-42	175.5	-169.9	175.1	72.1	-178.8	6.9	112.8	Y266 E267 Y268 A272 H273 D275	Y266-R270 PolarHBondContact O-N 3.41Å; E267-R270 WeakPolarHBondContact O-CB 3.47Å; E267-R270 PolarHBondContact O-N 3.15Å; E267-R270 VanDerWaalsContact O-N 3.12Å; E267-R270 IonicContact OE1-CZ 3.51Å; E267-R270 IonicContact OE1-NE 3.61Å; E267-R270 PolarHBondContact OE1-NE 2.93Å; E267-R270 IonicContact OE1-NH2 3.53Å; E267-R270 PolarHBondContact OE1-NH2 2.98Å; E267-R270 IonicContact OE2-CZ 2.98Å; E267-R270 VanDerWaalsContact OE2-CZ 3.24Å; E267-R270 IonicContact OE2-NE 3.1Å; E267-R270 IonicContact OE2-NH1 2.71Å; E267-R270 IonicContact OE2-NH2 3.86Å; E267-R270 PolarHBondContact OE2-NH2 3.01Å; Y268-R270 VanDerWaalsContact C-N 3.29Å; Y268-R270 PolarHBondContact O-N 2.91Å; R270-A272 VanDerWaalsContact C-N 3.26Å; R270-A272 PolarHBondContact O-N 3.26Å; R270-H273 PolarHBondContact O-N 2.9Å; R270-D275 HydrophobicContact CB-CB 4.07Å
271	E	97.1	Very high	96.1	Very high	144 Å²	144	54.4 Å²	54.4	67%	0.673	27%	0.265	S	S	*	.	H	α-helix	trans	-62.8	-33.5	172.1	-70.5	-173.2	165.8	0	0	112.1	E267 Y268 H273	E267-E271 PolarHBondContact O-N 3.26Å; Y268-E271 PolarHBondContact O-N 3.39Å; E271-H273 VanDerWaalsContact C-N 3.32Å
272	A	95.3	Very high	96.2	Very high	21 Å²	21	54.1 Å²	54.1	17%	0.174	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.8	177.2	0	0	0	0	0	114.6	Y268 L269 R270 A274	Y268-A272 HydrophobicContact CE1-CB 4.26Å; Y268-A272 VanDerWaalsContact O-CB 3.31Å; Y268-A272 WeakPolarHBondContact O-CB 3.44Å; Y268-A272 PolarHBondContact O-N 3.28Å; L269-A272 CarbonylContact O-C 3.59Å; L269-A272 PolarHBondContact O-N 2.94Å; R270-A272 VanDerWaalsContact C-N 3.26Å; R270-A272 PolarHBondContact O-N 3.26Å; A272-A274 VanDerWaalsContact C-N 3.29Å; A272-A274 PolarHBondContact O-N 3.15Å
273	H	95.2	Very high	96.3	Very high	152 Å²	152	53.4 Å²	53.4	70%	0.704	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	42.2	-174.5	-55.8	-43.5	0	0	0	113.6	L269 R270 E271	L269-H273 PolarHBondContact O-N 3.39Å; L269-H273 VanDerWaalsContact O-N 3.11Å; R270-H273 PolarHBondContact O-N 2.9Å; E271-H273 VanDerWaalsContact C-N 3.32Å
274	A	96.1	Very high	96.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.234	C	C	.	.			trans	-129.3	14.9	-176.5	0	0	0	0	0	113.4	L269 A272 D276 L277 F279 F672 I675	L269-A274 HydrophobicContact CD2-CB 4.09Å; L269-A274 PolarHBondContact O-N 3.3Å; A272-A274 VanDerWaalsContact C-N 3.29Å; A272-A274 PolarHBondContact O-N 3.15Å; A274-D276 VanDerWaalsContact C-N 3.32Å; A274-L277 PolarHBondContact O-N 2.78Å; A274-F279 HydrophobicContact CB-CE1 4.23Å; A274-F672 HydrophobicContact CB-CB 4.12Å; A274-F672 HydrophobicContact CB-CD2 4.02Å; A274-I675 HydrophobicContact CB-CD1 4.23Å
275	D	94.7	Very high	96.2	Very high	51 Å²	51	47.1 Å²	47.1	27%	0.273	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.6	179.4	56.7	-53.8	0	0	0	114.4	C255 Y266 L269 R270 L277	C255-D275 PolarHBondContact SG-O 2.82Å; Y266-D275 HydrophobicContact CE2-CB 4.24Å; L269-D275 PolarHBondContact O-N 3Å; R270-D275 HydrophobicContact CB-CB 4.07Å; D275-L277 PolarHBondContact O-N 3.32Å
276	D	93.5	Very high	96.1	Very high	70 Å²	70	47.5 Å²	47.5	37%	0.374	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.2	170.9	72.3	14.9	0	0	0	113.7	F251 A274 L278	F251-D276 WeakPolarHBondContact CD1-O 3.44Å; A274-D276 VanDerWaalsContact C-N 3.32Å; D276-L278 HydrophobicContact CB-CD1 4.49Å; D276-L278 HydrophobicContact CB-CG 4.09Å; D276-L278 PolarHBondContact O-N 2.99Å; D276-L278 VanDerWaalsContact O-N 3.08Å; D276-L278 WeakPolarHBondContact OD1-CB 3.45Å; D276-L278 PolarHBondContact OD1-N 3.29Å; D276-L278 WeakPolarHBondContact OD2-CD1 3.48Å
277	L	96.3	Very high	96	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.213	C	C	.	.			trans	53.9	18.7	-177.8	-49.7	177.8	0	0	0	114.7	F251 L254 L258 L269 A274 D275 F279 C280 F658	F251-L277 HydrophobicContact CD1-CB 4.22Å; F251-L277 HydrophobicContact CE1-CB 4.4Å; F251-L277 WeakPolarHBondContact CE1-O 3.32Å; L254-L277 HydrophobicContact CB-CD1 4.3Å; L254-L277 HydrophobicContact CD2-CD1 3.83Å; L254-L277 HydrophobicContact CG-CD1 3.69Å; L258-L277 HydrophobicContact CD2-CD1 4.42Å; L258-L277 HydrophobicContact CD2-CD2 4.19Å; L269-L277 HydrophobicContact CD1-CD2 3.85Å; A274-L277 PolarHBondContact O-N 2.78Å; D275-L277 PolarHBondContact O-N 3.32Å; L277-F279 HydrophobicContact CB-CZ 4.5Å; L277-F279 HydrophobicContact CD2-CE1 4.41Å; L277-F279 HydrophobicContact CD2-CZ 3.96Å; L277-F279 PolarHBondContact O-N 3.36Å; L277-C280 PolarHBondContact O-N 3.17Å; L277-C280 PolarHBondContact O-SG 2.96Å; L277-F658 HydrophobicContact CD1-CE2 4.25Å; L277-F658 HydrophobicContact CD1-CZ 4.39Å; L277-F658 HydrophobicContact CD2-CE1 4.24Å; L277-F658 HydrophobicContact CD2-CE2 4.43Å; L277-F658 HydrophobicContact CD2-CZ 3.84Å; L277-F658 HydrophobicContact CG-CZ 4.49Å
278	L	94.4	Very high	96	Very high	88 Å²	88	42.9 Å²	42.9	46%	0.461	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-60.5	-24.5	-169.5	-74.9	-179.9	0	0	0	114	F251 D276 C280 Y281	F251-L278 HydrophobicContact CD2-CD2 4.5Å; F251-L278 HydrophobicContact CE1-CD2 4.33Å; F251-L278 HydrophobicContact CE2-CD2 4.01Å; F251-L278 HydrophobicContact CZ-CD2 3.88Å; D276-L278 HydrophobicContact CB-CD1 4.49Å; D276-L278 HydrophobicContact CB-CG 4.09Å; D276-L278 PolarHBondContact O-N 2.99Å; D276-L278 VanDerWaalsContact O-N 3.08Å; D276-L278 WeakPolarHBondContact OD1-CB 3.45Å; D276-L278 PolarHBondContact OD1-N 3.29Å; D276-L278 WeakPolarHBondContact OD2-CD1 3.48Å; L278-C280 PolarHBondContact O-N 2.73Å; L278-C280 VanDerWaalsContact O-N 3.17Å; L278-Y281 VanDerWaalsContact O-CB 3.27Å; L278-Y281 WeakPolarHBondContact O-CB 3.42Å; L278-Y281 PolarHBondContact O-N 3.39Å
279	F	94	Very high	96	Very high	34 Å²	34	41.8 Å²	41.8	15%	0.149	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-58.9	-21.7	170.9	57.7	-97.3	0	0	0	113.4	A274 L277 F658 F672 I675 A676 F679	A274-F279 HydrophobicContact CB-CE1 4.23Å; L277-F279 HydrophobicContact CB-CZ 4.5Å; L277-F279 HydrophobicContact CD2-CE1 4.41Å; L277-F279 HydrophobicContact CD2-CZ 3.96Å; L277-F279 PolarHBondContact O-N 3.36Å; F279-F658 AromaticContact CE2-CE1 3.52Å; F279-F658 HydrophobicContact CE2-CE1 3.52Å; F279-F658 AromaticContact CE2-CZ 3.63Å; F279-F658 HydrophobicContact CE2-CZ 3.63Å; F279-F658 AromaticContact CZ-CE1 3.65Å; F279-F658 HydrophobicContact CZ-CE1 3.65Å; F279-F658 AromaticContact CZ-CZ 3.86Å; F279-F658 HydrophobicContact CZ-CZ 3.86Å; F279-F672 HydrophobicContact CB-CZ 4.28Å; F279-F672 HydrophobicContact CD1-CD2 4Å; F279-F672 AromaticContact CD1-CE2 3.74Å; F279-F672 HydrophobicContact CD1-CE2 3.74Å; F279-F672 HydrophobicContact CD1-CZ 4.26Å; F279-I675 HydrophobicContact CD1-CG2 4.41Å; F279-I675 HydrophobicContact CD2-CG2 4.16Å; F279-I675 HydrophobicContact CE1-CG2 4.04Å; F279-I675 HydrophobicContact CE2-CG2 3.76Å; F279-I675 HydrophobicContact CG-CG2 4.48Å; F279-I675 HydrophobicContact CZ-CG2 3.71Å; F279-A676 HydrophobicContact CB-CB 3.68Å; F279-A676 HydrophobicContact CG-CB 4.44Å; F279-F679 HydrophobicContact CD2-CD2 4.3Å; F279-F679 HydrophobicContact CE2-CD2 4.09Å; F279-F679 HydrophobicContact CE2-CE2 4.18Å
280	C	95	Very high	95.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-94	12.2	174.2	88.3	0	0	0	0	114.3	L277 L278 R282 W283 L284 F658	L277-C280 PolarHBondContact O-N 3.17Å; L277-C280 PolarHBondContact O-SG 2.96Å; L278-C280 PolarHBondContact O-N 2.73Å; L278-C280 VanDerWaalsContact O-N 3.17Å; C280-R282 PolarHBondContact O-N 3.34Å; C280-W283 HydrophobicContact CB-CB 4.34Å; C280-W283 HydrophobicContact CB-CD2 3.66Å; C280-W283 HydrophobicContact CB-CE3 3.7Å; C280-W283 HydrophobicContact CB-CG 3.94Å; C280-W283 HydrophobicContact CB-CZ3 4.28Å; C280-W283 WeakPolarHBondContact O-CB 3.48Å; C280-W283 PolarHBondContact O-N 3.48Å; C280-L284 PolarHBondContact O-N 3.25Å; C280-F658 HydrophobicContact CB-CZ 4.37Å
281	Y	95.9	Very high	95.9	Very high	108 Å²	108	38.6 Å²	38.6	42%	0.424	18%	0.182	S	C	.	.	H	α-helix	trans	-50.7	-42.8	177.1	-175.4	-87.3	0	0	0	113.2	M247 F251 L278 W283 L284 L285	M247-Y281 HydrophobicContact CB-CE2 4.34Å; M247-Y281 HydrophobicContact CE-CD2 3.84Å; M247-Y281 HydrophobicContact CE-CE2 3.69Å; M247-Y281 HydrophobicContact CE-CG 4.27Å; M247-Y281 HydrophobicContact CG-CE2 4.3Å; F251-Y281 AromaticContact CE2-CD2 3.68Å; F251-Y281 HydrophobicContact CE2-CD2 3.68Å; F251-Y281 HydrophobicContact CE2-CE2 4.36Å; F251-Y281 AromaticContact CZ-CD2 3.8Å; F251-Y281 HydrophobicContact CZ-CD2 3.8Å; F251-Y281 HydrophobicContact CZ-CG 4.28Å; L278-Y281 VanDerWaalsContact O-CB 3.27Å; L278-Y281 WeakPolarHBondContact O-CB 3.42Å; L278-Y281 PolarHBondContact O-N 3.39Å; Y281-W283 VanDerWaalsContact C-N 3.25Å; Y281-W283 PolarHBondContact O-N 2.96Å; Y281-L284 PolarHBondContact O-N 3.3Å; Y281-L285 HydrophobicContact CD1-CB 4.5Å; Y281-L285 HydrophobicContact CD1-CD2 4.49Å; Y281-L285 HydrophobicContact CE1-CB 4.25Å; Y281-L285 HydrophobicContact CE1-CD2 3.73Å; Y281-L285 HydrophobicContact CE1-CG 4.49Å; Y281-L285 WeakPolarHBondContact O-CB 3.16Å; Y281-L285 PolarHBondContact O-N 3.44Å
282	R	95.8	Very high	95.9	Very high	41 Å²	41	31.9 Å²	31.9	16%	0.155	15%	0.15	C	C	.	.	H	α-helix	trans	-59	-35.1	177.5	-172.6	175.6	69.9	-138.4	0.3	112.8	C280 L286 R290 E291 D680	C280-R282 PolarHBondContact O-N 3.34Å; R282-L286 HydrophobicContact CG-CD1 4.03Å; R282-L286 WeakPolarHBondContact O-CB 3.2Å; R282-L286 PolarHBondContact O-N 2.75Å; R282-R290 HydrophobicContact CG-CB 4.29Å; R282-R290 HydrophobicContact CG-CG 4.35Å; R282-E291 IonicContact CZ-OE1 2.72Å; R282-E291 IonicContact CZ-OE2 3.93Å; R282-E291 IonicContact NE-OE1 2.76Å; R282-E291 PolarHBondContact NE-OE1 3.49Å; R282-E291 IonicContact NE-OE2 3.28Å; R282-E291 IonicContact NH2-OE1 3.96Å; R282-E291 PolarHBondContact NH2-OE1 2.97Å; R282-E291 IonicContact NH2-OE2 3.22Å; R282-E291 PolarHBondContact NH2-OE2 3.37Å; R282-D680 IonicContact CZ-OD1 3.7Å; R282-D680 IonicContact NH1-OD1 3.89Å; R282-D680 PolarHBondContact NH1-OD1 2.95Å; R282-D680 IonicContact NH1-OD2 3.24Å; R282-D680 IonicContact NH2-OD1 2.72Å; R282-D680 PolarHBondContact NH2-OD1 3.27Å
283	W	97.5	Very high	96	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-65.9	-47.1	-178.9	-61.8	6.9	0	0	0	110.9	C280 Y281 E287 L288 E291 C654 L657 F658 F679	C280-W283 HydrophobicContact CB-CB 4.34Å; C280-W283 HydrophobicContact CB-CD2 3.66Å; C280-W283 HydrophobicContact CB-CE3 3.7Å; C280-W283 HydrophobicContact CB-CG 3.94Å; C280-W283 HydrophobicContact CB-CZ3 4.28Å; C280-W283 WeakPolarHBondContact O-CB 3.48Å; C280-W283 PolarHBondContact O-N 3.48Å; Y281-W283 VanDerWaalsContact C-N 3.25Å; Y281-W283 PolarHBondContact O-N 2.96Å; W283-E287 WeakPolarHBondContact O-CA 3.02Å; W283-E287 PolarHBondContact O-N 3.16Å; W283-L288 HydrophobicContact CB-CD2 3.44Å; W283-L288 VanDerWaalsContact CB-CD2 3.44Å; W283-L288 HydrophobicContact CB-CG 4.06Å; W283-L288 HydrophobicContact CD2-CD2 3.63Å; W283-L288 HydrophobicContact CE3-CD2 3.97Å; W283-L288 HydrophobicContact CG-CD2 3.42Å; W283-L288 VanDerWaalsContact CG-CD2 3.42Å; W283-L288 PolarHBondContact O-N 2.92Å; W283-E291 VanDerWaalsContact CD1-CG 3.4Å; W283-E291 HydrophobicContact CD2-CG 4.5Å; W283-E291 HydrophobicContact CG-CG 4.08Å; W283-E291 PolarHBondContact NE1-OE2 2.87Å; W283-E291 VanDerWaalsContact NE1-OE2 3.12Å; W283-C654 HydrophobicContact CE3-CB 4.34Å; W283-L657 HydrophobicContact CE3-CD1 4.1Å; W283-L657 HydrophobicContact CH2-CB 3.86Å; W283-L657 HydrophobicContact CH2-CD1 4.17Å; W283-L657 HydrophobicContact CZ3-CB 3.78Å; W283-L657 HydrophobicContact CZ3-CD1 3.9Å; W283-F658 HydrophobicContact CZ3-CD2 4.37Å; W283-F658 HydrophobicContact CZ3-CE2 4.04Å; W283-F658 HydrophobicContact CZ3-CZ 4.26Å; W283-F679 AromaticContact CH2-CD1 3.69Å; W283-F679 HydrophobicContact CH2-CD1 3.69Å; W283-F679 HydrophobicContact CH2-CD2 4.47Å; W283-F679 AromaticContact CH2-CE1 3.64Å; W283-F679 HydrophobicContact CH2-CE1 3.64Å; W283-F679 HydrophobicContact CH2-CE2 4.42Å; W283-F679 HydrophobicContact CH2-CG 4.13Å; W283-F679 HydrophobicContact CH2-CZ 4.03Å; W283-F679 HydrophobicContact CZ2-CB 4.13Å; W283-F679 AromaticContact CZ2-CD1 3.56Å; W283-F679 HydrophobicContact CZ2-CD1 3.56Å; W283-F679 HydrophobicContact CZ2-CD2 4.45Å; W283-F679 HydrophobicContact CZ2-CE1 4.03Å; W283-F679 AromaticContact CZ2-CG 3.81Å; W283-F679 HydrophobicContact CZ2-CG 3.81Å
284	L	96.6	Very high	96.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-74.4	-37.8	-176.7	-64.7	176.3	0	0	0	112.3	M247 K250 F251 L254 C280 Y281 M651	M247-L284 HydrophobicContact CE-CB 3.68Å; M247-L284 HydrophobicContact SD-CB 4.43Å; K250-L284 HydrophobicContact CB-CD1 4.1Å; K250-L284 HydrophobicContact CB-CD2 4.5Å; K250-L284 HydrophobicContact CD-CB 4.5Å; F251-L284 HydrophobicContact CD1-CD1 3.8Å; F251-L284 HydrophobicContact CD2-CD1 4.36Å; F251-L284 HydrophobicContact CE1-CD1 3.76Å; F251-L284 HydrophobicContact CE2-CD1 4.31Å; F251-L284 HydrophobicContact CG-CD1 4.11Å; F251-L284 HydrophobicContact CZ-CD1 4.05Å; L254-L284 HydrophobicContact CD2-CD1 4.23Å; L254-L284 HydrophobicContact CD2-CD2 4.35Å; C280-L284 PolarHBondContact O-N 3.25Å; Y281-L284 PolarHBondContact O-N 3.3Å; L284-M651 HydrophobicContact CD2-CE 3.51Å; L284-M651 HydrophobicContact CD2-SD 4.15Å
285	L	95.6	Very high	96.1	Very high	17 Å²	17	31.2 Å²	31.2	9%	0.089	15%	0.15	C	C	.	.	H	α-helix	trans	-69.5	-40.4	179.8	-175.9	64.6	0	0	0	112.5	N239 F240 M247 Y281	N239-L285 HydrophobicContact CB-CD1 3.95Å; F240-L285 HydrophobicContact CD1-CD1 3.77Å; F240-L285 HydrophobicContact CE1-CD1 3.49Å; F240-L285 VanDerWaalsContact CE1-CD1 3.49Å; F240-L285 HydrophobicContact CE1-CD2 4.17Å; F240-L285 HydrophobicContact CE1-CG 3.87Å; F240-L285 HydrophobicContact CE2-CD1 4.48Å; F240-L285 HydrophobicContact CG-CD1 4.4Å; F240-L285 HydrophobicContact CZ-CD1 3.87Å; F240-L285 HydrophobicContact CZ-CG 4.24Å; M247-L285 HydrophobicContact CE-CB 4.13Å; M247-L285 HydrophobicContact SD-CD1 4.36Å; Y281-L285 HydrophobicContact CD1-CB 4.5Å; Y281-L285 HydrophobicContact CD1-CD2 4.49Å; Y281-L285 HydrophobicContact CE1-CB 4.25Å; Y281-L285 HydrophobicContact CE1-CD2 3.73Å; Y281-L285 HydrophobicContact CE1-CG 4.49Å; Y281-L285 WeakPolarHBondContact O-CB 3.16Å; Y281-L285 PolarHBondContact O-N 3.44Å
286	L	96.3	Very high	96.3	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.042	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	19.7	-170.7	-54.5	179.5	0	0	0	113.7	G207 D210 L211 R282 L288 K289 R290	G207-L286 WeakPolarHBondContact O-CD2 3.33Å; D210-L286 HydrophobicContact CB-CD1 4.39Å; L211-L286 HydrophobicContact CG-CD2 4.37Å; R282-L286 HydrophobicContact CG-CD1 4.03Å; R282-L286 WeakPolarHBondContact O-CB 3.2Å; R282-L286 PolarHBondContact O-N 2.75Å; L286-L288 PolarHBondContact O-N 3.43Å; L286-L288 VanDerWaalsContact O-N 3.13Å; L286-K289 VanDerWaalsContact O-CB 3.26Å; L286-K289 WeakPolarHBondContact O-CB 3.43Å; L286-K289 PolarHBondContact O-N 3.36Å; L286-R290 HydrophobicContact CD1-CG 3.91Å
287	E	96.4	Very high	96.5	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.028	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	41.2	48.6	-173.9	-58.3	-156.2	124.4	0	0	112.8	L236 W283 K289 N304 W305 N647 L650	L236-E287 HydrophobicContact CD1-CG 4.23Å; L236-E287 HydrophobicContact CD2-CG 4.01Å; W283-E287 WeakPolarHBondContact O-CA 3.02Å; W283-E287 PolarHBondContact O-N 3.16Å; E287-K289 PolarHBondContact O-N 2.95Å; E287-N304 PolarHBondContact OE1-ND2 3.04Å; E287-N304 PolarHBondContact OE2-ND2 3.31Å; E287-W305 PolarHBondContact OE2-NE1 2.77Å; E287-N647 PolarHBondContact OE1-ND2 3.31Å; E287-L650 HydrophobicContact CB-CD1 4.38Å; E287-L650 HydrophobicContact CB-CD2 4.48Å; E287-L650 HydrophobicContact CG-CD2 4.06Å
288	L	97.8	Very high	96.6	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	8	179.5	-69.8	160.9	0	0	0	116.9	W283 L286 R290 E291 F292 L300 L650 I653 L657	W283-L288 HydrophobicContact CB-CD2 3.44Å; W283-L288 VanDerWaalsContact CB-CD2 3.44Å; W283-L288 HydrophobicContact CB-CG 4.06Å; W283-L288 HydrophobicContact CD2-CD2 3.63Å; W283-L288 HydrophobicContact CE3-CD2 3.97Å; W283-L288 HydrophobicContact CG-CD2 3.42Å; W283-L288 VanDerWaalsContact CG-CD2 3.42Å; W283-L288 PolarHBondContact O-N 2.92Å; L286-L288 PolarHBondContact O-N 3.43Å; L286-L288 VanDerWaalsContact O-N 3.13Å; L288-R290 PolarHBondContact O-N 3.33Å; L288-E291 HydrophobicContact CB-CG 4.42Å; L288-E291 HydrophobicContact CD2-CB 4.19Å; L288-E291 HydrophobicContact CD2-CG 3.53Å; L288-E291 PolarHBondContact O-N 3Å; L288-F292 HydrophobicContact CB-CD2 4.26Å; L288-F292 HydrophobicContact CB-CE2 4.11Å; L288-F292 HydrophobicContact CD1-CE2 4.48Å; L288-L300 HydrophobicContact CB-CD2 3.52Å; L288-L300 HydrophobicContact CD1-CD2 4.09Å; L288-L300 HydrophobicContact CG-CD2 4.46Å; L288-L650 HydrophobicContact CD1-CD1 3.94Å; L288-L650 HydrophobicContact CG-CD1 4.35Å; L288-I653 HydrophobicContact CD1-CB 3.97Å; L288-I653 HydrophobicContact CD1-CG2 3.33Å; L288-L657 HydrophobicContact CD1-CD1 3.98Å; L288-L657 HydrophobicContact CD2-CD1 3.51Å; L288-L657 HydrophobicContact CG-CD1 4.42Å
289	K	97	Very high	96.7	Very high	10 Å²	10	25.2 Å²	25.2	4%	0.043	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-32.5	179.5	165.9	61.3	172.8	59.8	0	114.6	D169 D210 P214 L286 E287 A297	D169-K289 VanDerWaalsContact CG-NZ 3.35Å; D169-K289 IonicContact OD1-NZ 3.97Å; D169-K289 PolarHBondContact OD1-NZ 3.31Å; D169-K289 VanDerWaalsContact OD1-NZ 3.16Å; D169-K289 IonicContact OD2-NZ 3.29Å; D169-K289 PolarHBondContact OD2-NZ 2.95Å; D210-K289 HydrophobicContact CB-CG 4.2Å; D210-K289 WeakPolarHBondContact O-CE 3.38Å; D210-K289 WeakPolarHBondContact O-CG 3.35Å; P214-K289 HydrophobicContact CG-CD 3.77Å; L286-K289 VanDerWaalsContact O-CB 3.26Å; L286-K289 WeakPolarHBondContact O-CB 3.43Å; L286-K289 PolarHBondContact O-N 3.36Å; E287-K289 PolarHBondContact O-N 2.95Å; K289-A297 HydrophobicContact CD-CB 3.85Å
290	R	96.1	Very high	96.9	Very high	59 Å²	59	23.7 Å²	23.7	22%	0.223	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-24.3	180	-74.9	-108.6	178.3	-161.4	-5	113.5	D210 R282 L286 L288	D210-R290 IonicContact OD1-CZ 3.32Å; D210-R290 IonicContact OD1-NE 3.07Å; D210-R290 PolarHBondContact OD1-NE 3.33Å; D210-R290 IonicContact OD1-NH2 2.74Å; D210-R290 PolarHBondContact OD1-NH2 3.46Å; D210-R290 IonicContact OD2-CZ 3.63Å; D210-R290 IonicContact OD2-NE 3.81Å; D210-R290 PolarHBondContact OD2-NE 3.26Å; D210-R290 IonicContact OD2-NH2 2.7Å; D210-R290 PolarHBondContact OD2-NH2 3.23Å; R282-R290 HydrophobicContact CG-CB 4.29Å; R282-R290 HydrophobicContact CG-CG 4.35Å; L286-R290 HydrophobicContact CD1-CG 3.91Å; L288-R290 PolarHBondContact O-N 3.33Å
291	E	97.1	Very high	97	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-17	-170.1	-42.6	-43.7	126.2	0	0	113.3	R282 W283 L288 K684	R282-E291 IonicContact CZ-OE1 2.72Å; R282-E291 IonicContact CZ-OE2 3.93Å; R282-E291 IonicContact NE-OE1 2.76Å; R282-E291 PolarHBondContact NE-OE1 3.49Å; R282-E291 IonicContact NE-OE2 3.28Å; R282-E291 IonicContact NH2-OE1 3.96Å; R282-E291 PolarHBondContact NH2-OE1 2.97Å; R282-E291 IonicContact NH2-OE2 3.22Å; R282-E291 PolarHBondContact NH2-OE2 3.37Å; W283-E291 VanDerWaalsContact CD1-CG 3.4Å; W283-E291 HydrophobicContact CD2-CG 4.5Å; W283-E291 HydrophobicContact CG-CG 4.08Å; W283-E291 PolarHBondContact NE1-OE2 2.87Å; W283-E291 VanDerWaalsContact NE1-OE2 3.12Å; L288-E291 HydrophobicContact CB-CG 4.42Å; L288-E291 HydrophobicContact CD2-CB 4.19Å; L288-E291 HydrophobicContact CD2-CG 3.53Å; L288-E291 PolarHBondContact O-N 3Å; E291-K684 VanDerWaalsContact O-CA 3.32Å; E291-K684 WeakPolarHBondContact O-CA 3.34Å; E291-K684 PolarHBondContact O-N 3.3Å
292	F	97.8	Very high	97.1	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.009	9%	0.092	C	C	.	.	S	Bend	trans	-112.7	161.1	-178.4	-68.4	-79.7	0	0	0	112.3	L288 D296 A297 L300 L657 K684 H686 V688 V691	L288-F292 HydrophobicContact CB-CD2 4.26Å; L288-F292 HydrophobicContact CB-CE2 4.11Å; L288-F292 HydrophobicContact CD1-CE2 4.48Å; F292-D296 HydrophobicContact CB-CB 3.91Å; F292-D296 HydrophobicContact CD1-CB 4.36Å; F292-A297 HydrophobicContact CB-CB 4.26Å; F292-L300 HydrophobicContact CD2-CD1 4.29Å; F292-L300 HydrophobicContact CD2-CD2 3.84Å; F292-L300 HydrophobicContact CE2-CD1 3.82Å; F292-L300 HydrophobicContact CE2-CD2 3.77Å; F292-L300 HydrophobicContact CE2-CG 4.41Å; F292-L300 HydrophobicContact CZ-CD1 4.06Å; F292-L657 HydrophobicContact CZ-CD2 4.2Å; F292-K684 WeakPolarHBondContact O-CG 3.19Å; F292-H686 HydrophobicContact CD1-CB 4.06Å; F292-H686 HydrophobicContact CE1-CB 3.52Å; F292-H686 HydrophobicContact CZ-CB 4.11Å; F292-V688 HydrophobicContact CD1-CB 3.76Å; F292-V688 HydrophobicContact CD1-CG2 4.01Å; F292-V688 HydrophobicContact CE1-CB 3.8Å; F292-V688 HydrophobicContact CE1-CG2 3.99Å; F292-V691 HydrophobicContact CZ-CB 4.42Å; F292-V691 HydrophobicContact CZ-CG1 4.27Å; F292-V691 HydrophobicContact CZ-CG2 4.45Å
293	T	97.3	Very high	97.2	Very high	52 Å²	52	16.8 Å²	16.8	32%	0.319	9%	0.085	S	C	.	.			trans	-61.5	164.7	169.6	79	0	0	0	0	110.2	D295 D296 A297 K684	T293-D295 PolarHBondContact O-N 2.89Å; T293-D296 WeakPolarHBondContact CB-OD2 3.49Å; T293-D296 WeakPolarHBondContact CG2-OD2 3.26Å; T293-D296 PolarHBondContact O-N 3.46Å; T293-D296 WeakPolarHBondContact OG1-CB 3.49Å; T293-D296 PolarHBondContact OG1-N 3.29Å; T293-D296 PolarHBondContact OG1-OD2 3.43Å; T293-A297 WeakPolarHBondContact O-CB 3.4Å; T293-A297 PolarHBondContact O-N 3.03Å; T293-K684 HydrophobicContact CG2-CB 4.31Å; T293-K684 WeakPolarHBondContact CG2-O 3.4Å
294	F	97.4	Very high	97.1	Very high	27 Å²	27	16.8 Å²	16.8	12%	0.118	9%	0.085	C	C	.	.	H	α-helix	trans	-59.4	-51.2	-174.3	-166.7	-85.2	0	0	0	112	D169 H172 V217 D296 A297 L298	D169-F294 HydrophobicContact CB-CD2 4.45Å; D169-F294 HydrophobicContact CB-CE2 4.34Å; H172-F294 AromaticContact CD2-CD1 3.76Å; H172-F294 AromaticContact CD2-CG 3.87Å; H172-F294 AromaticContact NE2-CD1 3.87Å; H172-F294 AromaticContact NE2-CE1 3.96Å; V217-F294 HydrophobicContact CB-CE1 4.15Å; V217-F294 HydrophobicContact CB-CZ 3.86Å; V217-F294 HydrophobicContact CG1-CE1 3.75Å; V217-F294 HydrophobicContact CG1-CZ 3.97Å; V217-F294 HydrophobicContact CG2-CE1 4.34Å; V217-F294 HydrophobicContact CG2-CZ 3.72Å; F294-D296 PolarHBondContact O-N 2.76Å; F294-A297 PolarHBondContact O-N 3.19Å; F294-L298 HydrophobicContact CD1-CD1 4.28Å; F294-L298 HydrophobicContact CD1-CD2 4.44Å; F294-L298 HydrophobicContact CD1-CG 4.33Å; F294-L298 HydrophobicContact CE1-CD1 4.1Å; F294-L298 HydrophobicContact CE1-CD2 3.92Å; F294-L298 HydrophobicContact CE1-CG 4.23Å; F294-L298 HydrophobicContact CZ-CD2 4.44Å; F294-L298 WeakPolarHBondContact O-CG 3.39Å; F294-L298 PolarHBondContact O-N 3.03Å
295	D	96.5	Very high	97.1	Very high	81 Å²	81	16.8 Å²	16.8	43%	0.433	9%	0.085	S	C	.	.	H	α-helix	trans	-66.3	-35.1	178.1	-76.9	-68.8	0	0	0	113.3	R103 T293 L298 L299	R103-D295 IonicContact NH1-OD1 3.66Å; T293-D295 PolarHBondContact O-N 2.89Å; D295-L298 WeakPolarHBondContact O-CB 3.33Å; D295-L298 PolarHBondContact O-N 3.48Å; D295-L299 PolarHBondContact O-N 3.39Å
296	D	97.5	Very high	97.1	Very high	48 Å²	48	16.3 Å²	16.3	26%	0.257	8%	0.084	S	C	.	.	H	α-helix	trans	-66.4	-37.9	174.9	-69.2	-37.4	0	0	0	111.6	F292 T293 F294 L298 L299 L300 V688	F292-D296 HydrophobicContact CB-CB 3.91Å; F292-D296 HydrophobicContact CD1-CB 4.36Å; T293-D296 WeakPolarHBondContact CB-OD2 3.49Å; T293-D296 WeakPolarHBondContact CG2-OD2 3.26Å; T293-D296 PolarHBondContact O-N 3.46Å; T293-D296 WeakPolarHBondContact OG1-CB 3.49Å; T293-D296 PolarHBondContact OG1-N 3.29Å; T293-D296 PolarHBondContact OG1-OD2 3.43Å; F294-D296 PolarHBondContact O-N 2.76Å; D296-L298 VanDerWaalsContact C-N 3.33Å; D296-L298 PolarHBondContact O-N 2.74Å; D296-L299 PolarHBondContact O-N 2.7Å; D296-L300 PolarHBondContact O-N 2.95Å; D296-V688 HydrophobicContact CB-CB 3.92Å; D296-V688 HydrophobicContact CB-CG1 3.8Å; D296-V688 HydrophobicContact CB-CG2 4.31Å; D296-V688 WeakPolarHBondContact OD1-CG1 3.44Å
297	A	98	Very high	97	Very high	1 Å²	1	17 Å²	17	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-64.6	-36.6	174.7	0	0	0	0	0	111.6	K289 F292 T293 F294 L299 L300 M301	K289-A297 HydrophobicContact CD-CB 3.85Å; F292-A297 HydrophobicContact CB-CB 4.26Å; T293-A297 WeakPolarHBondContact O-CB 3.4Å; T293-A297 PolarHBondContact O-N 3.03Å; F294-A297 PolarHBondContact O-N 3.19Å; A297-L299 PolarHBondContact O-N 2.78Å; A297-L300 PolarHBondContact O-N 3.4Å; A297-M301 WeakPolarHBondContact O-CB 3.32Å; A297-M301 WeakPolarHBondContact O-CG 3.36Å; A297-M301 PolarHBondContact O-N 2.87Å
298	L	98.1	Very high	96.7	Very high	5 Å²	5	17.3 Å²	17.3	3%	0.026	9%	0.091	C	C	.	.	H	α-helix	trans	-59.6	-45.7	173.2	-55.5	-178.2	0	0	0	111.2	R103 W107 P214 V218 F294 D295 D296 M301 E302	R103-L298 VanDerWaalsContact NH1-CD1 3.28Å; W107-L298 HydrophobicContact CH2-CD2 3.57Å; W107-L298 HydrophobicContact CZ2-CB 4.12Å; W107-L298 HydrophobicContact CZ2-CD2 4.01Å; P214-L298 HydrophobicContact CB-CD2 3.8Å; V218-L298 HydrophobicContact CG2-CD1 4.37Å; V218-L298 HydrophobicContact CG2-CD2 4.3Å; F294-L298 HydrophobicContact CD1-CD1 4.28Å; F294-L298 HydrophobicContact CD1-CD2 4.44Å; F294-L298 HydrophobicContact CD1-CG 4.33Å; F294-L298 HydrophobicContact CE1-CD1 4.1Å; F294-L298 HydrophobicContact CE1-CD2 3.92Å; F294-L298 HydrophobicContact CE1-CG 4.23Å; F294-L298 HydrophobicContact CZ-CD2 4.44Å; F294-L298 WeakPolarHBondContact O-CG 3.39Å; F294-L298 PolarHBondContact O-N 3.03Å; D295-L298 WeakPolarHBondContact O-CB 3.33Å; D295-L298 PolarHBondContact O-N 3.48Å; D296-L298 VanDerWaalsContact C-N 3.33Å; D296-L298 PolarHBondContact O-N 2.74Å; L298-M301 PolarHBondContact O-N 2.72Å; L298-E302 WeakPolarHBondContact O-CB 3.23Å; L298-E302 VanDerWaalsContact O-CG 3.26Å; L298-E302 WeakPolarHBondContact O-CG 3.28Å; L298-E302 PolarHBondContact O-N 3.46Å
299	L	97.9	Very high	96.1	Very high	29 Å²	29	22.4 Å²	22.4	15%	0.152	12%	0.124	C	C	.	.	H	α-helix	trans	-63.1	-41.2	175.7	172.5	62.2	0	0	0	111.9	D295 D296 A297 E302 V303 V688 L692	D295-L299 PolarHBondContact O-N 3.39Å; D296-L299 PolarHBondContact O-N 2.7Å; A297-L299 PolarHBondContact O-N 2.78Å; L299-E302 PolarHBondContact O-N 3.13Å; L299-V303 HydrophobicContact CD1-CG2 4.01Å; L299-V303 WeakPolarHBondContact O-CG2 3.35Å; L299-V303 PolarHBondContact O-N 2.88Å; L299-V688 HydrophobicContact CD2-CG1 3.99Å; L299-L692 HydrophobicContact CD2-CD1 4.33Å; L299-L692 HydrophobicContact CG-CD1 4.05Å
300	L	97.8	Very high	95.6	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-62.1	-46.3	177.6	-160.6	91.2	0	0	0	111.3	L288 F292 D296 A297 V303 N304 I653 V688 L692	L288-L300 HydrophobicContact CB-CD2 3.52Å; L288-L300 HydrophobicContact CD1-CD2 4.09Å; L288-L300 HydrophobicContact CG-CD2 4.46Å; F292-L300 HydrophobicContact CD2-CD1 4.29Å; F292-L300 HydrophobicContact CD2-CD2 3.84Å; F292-L300 HydrophobicContact CE2-CD1 3.82Å; F292-L300 HydrophobicContact CE2-CD2 3.77Å; F292-L300 HydrophobicContact CE2-CG 4.41Å; F292-L300 HydrophobicContact CZ-CD1 4.06Å; D296-L300 PolarHBondContact O-N 2.95Å; A297-L300 PolarHBondContact O-N 3.4Å; L300-V303 PolarHBondContact O-N 2.91Å; L300-N304 WeakPolarHBondContact O-CB 3.38Å; L300-N304 PolarHBondContact O-N 3.28Å; L300-I653 HydrophobicContact CD1-CD1 4.24Å; L300-I653 HydrophobicContact CD1-CG2 4.05Å; L300-I653 HydrophobicContact CG-CD1 4.31Å; L300-V688 HydrophobicContact CB-CG2 4.34Å; L300-V688 HydrophobicContact CD1-CG2 3.78Å; L300-L692 HydrophobicContact CD1-CD1 4.41Å; L300-L692 HydrophobicContact CD1-CD2 3.73Å; L300-L692 HydrophobicContact CD1-CG 3.99Å
301	M	97.9	Very high	95.1	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.02	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-45.6	178.2	-69.3	166.8	78	0	0	111.2	P214 A297 L298 V303 N304 W305	P214-M301 HydrophobicContact CB-CE 3.88Å; P214-M301 HydrophobicContact CB-SD 4.04Å; P214-M301 HydrophobicContact CG-CE 3.99Å; P214-M301 HydrophobicContact CG-SD 3.92Å; A297-M301 WeakPolarHBondContact O-CB 3.32Å; A297-M301 WeakPolarHBondContact O-CG 3.36Å; A297-M301 PolarHBondContact O-N 2.87Å; L298-M301 PolarHBondContact O-N 2.72Å; M301-V303 PolarHBondContact O-N 2.84Å; M301-N304 PolarHBondContact O-N 3.37Å; M301-W305 HydrophobicContact CB-CD2 4.45Å; M301-W305 HydrophobicContact CB-CH2 4.21Å; M301-W305 HydrophobicContact CB-CZ2 3.94Å; M301-W305 HydrophobicContact CE-CH2 3.74Å; M301-W305 HydrophobicContact CE-CZ2 3.41Å; M301-W305 VanDerWaalsContact CE-CZ2 3.41Å; M301-W305 HydrophobicContact CG-CZ2 4.37Å; M301-W305 WeakPolarHBondContact O-CB 3.36Å; M301-W305 VanDerWaalsContact O-CD1 3.31Å; M301-W305 VanDerWaalsContact O-CD2 3.32Å; M301-W305 PolarHBondContact O-N 3.34Å
302	E	97.9	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-55.2	-52.1	175.1	-76.8	165	-178.5	0	0	112.5	V93 G97 C98 R103 W107 L298 L299 A306	V93-E302 HydrophobicContact CG1-CB 4.15Å; G97-E302 WeakPolarHBondContact CA-OE2 3.5Å; C98-E302 PolarHBondContact N-OE2 3.49Å; R103-E302 VanDerWaalsContact CD-OE1 3.25Å; R103-E302 WeakPolarHBondContact CD-OE1 3.37Å; R103-E302 VanDerWaalsContact CG-OE1 3.28Å; R103-E302 WeakPolarHBondContact CG-OE1 3.49Å; R103-E302 IonicContact CZ-OE1 2.7Å; R103-E302 IonicContact NE-OE1 2.74Å; R103-E302 PolarHBondContact NE-OE1 3.46Å; R103-E302 IonicContact NH2-OE1 3.69Å; R103-E302 IonicContact NH2-OE2 2.78Å; W107-E302 HydrophobicContact CZ2-CG 4.18Å; W107-E302 VanDerWaalsContact NE1-CG 3.3Å; W107-E302 PolarHBondContact NE1-OE1 3.43Å; L298-E302 WeakPolarHBondContact O-CB 3.23Å; L298-E302 VanDerWaalsContact O-CG 3.26Å; L298-E302 WeakPolarHBondContact O-CG 3.28Å; L298-E302 PolarHBondContact O-N 3.46Å; L299-E302 PolarHBondContact O-N 3.13Å; E302-A306 WeakPolarHBondContact O-CB 3.24Å; E302-A306 PolarHBondContact O-N 2.76Å
303	V	96.9	Very high	94	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.5	-39	-178.8	174.8	0	0	0	0	111.2	Y94 L299 L300 M301 S307 F649 L692	Y94-V303 HydrophobicContact CD2-CG1 3.71Å; Y94-V303 HydrophobicContact CE2-CG1 4.08Å; Y94-V303 HydrophobicContact CG-CG1 4.45Å; Y94-V303 WeakPolarHBondContact O-CG1 3.45Å; L299-V303 HydrophobicContact CD1-CG2 4.01Å; L299-V303 WeakPolarHBondContact O-CG2 3.35Å; L299-V303 PolarHBondContact O-N 2.88Å; L300-V303 PolarHBondContact O-N 2.91Å; M301-V303 PolarHBondContact O-N 2.84Å; V303-S307 PolarHBondContact O-N 2.95Å; V303-S307 VanDerWaalsContact O-N 3.08Å; V303-F649 HydrophobicContact CG1-CE1 3.79Å; V303-F649 HydrophobicContact CG1-CZ 4.37Å; V303-L692 HydrophobicContact CB-CD1 4.37Å; V303-L692 HydrophobicContact CB-CD2 4.31Å; V303-L692 HydrophobicContact CG1-CD2 3.99Å; V303-L692 HydrophobicContact CG2-CD1 4.19Å
304	N	96.1	Very high	93.2	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.011	21%	0.21	C	C	.	.	H	α-helix	trans	-61.3	-49.7	175.9	-179	51.8	0	0	0	111.4	E287 L300 M301 S307 N647	E287-N304 PolarHBondContact OE1-ND2 3.04Å; E287-N304 PolarHBondContact OE2-ND2 3.31Å; L300-N304 WeakPolarHBondContact O-CB 3.38Å; L300-N304 PolarHBondContact O-N 3.28Å; M301-N304 PolarHBondContact O-N 3.37Å; N304-S307 WeakPolarHBondContact O-CB 3.09Å; N304-S307 PolarHBondContact O-N 2.81Å; N304-S307 PolarHBondContact O-OG 3.19Å; N304-N647 PolarHBondContact ND2-ND2 3.37Å; N304-N647 VanDerWaalsContact ND2-ND2 3.17Å; N304-N647 PolarHBondContact OD1-ND2 3.37Å; N304-N647 PolarHBondContact OD1-OD1 3.22Å
305	W	96.6	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.7	-38.1	179.9	-58.5	-11.2	0	0	0	112.5	R90 W107 L110 L111 L215 L232 E287 M301 S307 L308	R90-W305 PolarHBondContact NH1-O 2.97Å; W107-W305 HydrophobicContact CD2-CH2 4.49Å; W107-W305 AromaticContact CD2-CZ3 3.84Å; W107-W305 HydrophobicContact CD2-CZ3 3.84Å; W107-W305 HydrophobicContact CE3-CH2 4.07Å; W107-W305 AromaticContact CE3-CZ3 3.85Å; W107-W305 HydrophobicContact CE3-CZ3 3.85Å; W107-W305 HydrophobicContact CG-CZ3 4.25Å; W107-W305 HydrophobicContact CH2-CH2 4.24Å; W107-W305 HydrophobicContact CH2-CZ3 4.35Å; W107-W305 HydrophobicContact CZ2-CZ3 4.41Å; W107-W305 AromaticContact CZ3-CH2 3.96Å; W107-W305 HydrophobicContact CZ3-CH2 3.96Å; W107-W305 HydrophobicContact CZ3-CZ3 4.13Å; L110-W305 HydrophobicContact CB-CB 4.44Å; L111-W305 HydrophobicContact CD1-CE3 4.49Å; L111-W305 HydrophobicContact CD1-CH2 4.13Å; L111-W305 HydrophobicContact CD1-CZ3 3.95Å; L111-W305 HydrophobicContact CD2-CD2 3.69Å; L111-W305 HydrophobicContact CD2-CE3 3.67Å; L111-W305 HydrophobicContact CD2-CG 4.36Å; L111-W305 HydrophobicContact CD2-CH2 3.95Å; L111-W305 HydrophobicContact CD2-CZ2 3.95Å; L111-W305 HydrophobicContact CD2-CZ3 3.82Å; L111-W305 HydrophobicContact CG-CD2 4.44Å; L111-W305 HydrophobicContact CG-CE3 3.92Å; L111-W305 HydrophobicContact CG-CH2 4.34Å; L111-W305 HydrophobicContact CG-CZ3 3.89Å; L215-W305 HydrophobicContact CD2-CH2 3.88Å; L232-W305 HydrophobicContact CD1-CZ2 3.77Å; L232-W305 HydrophobicContact CD2-CZ2 4.21Å; E287-W305 PolarHBondContact OE2-NE1 2.77Å; M301-W305 HydrophobicContact CB-CD2 4.45Å; M301-W305 HydrophobicContact CB-CH2 4.21Å; M301-W305 HydrophobicContact CB-CZ2 3.94Å; M301-W305 HydrophobicContact CE-CH2 3.74Å; M301-W305 HydrophobicContact CE-CZ2 3.41Å; M301-W305 VanDerWaalsContact CE-CZ2 3.41Å; M301-W305 HydrophobicContact CG-CZ2 4.37Å; M301-W305 WeakPolarHBondContact O-CB 3.36Å; M301-W305 VanDerWaalsContact O-CD1 3.31Å; M301-W305 VanDerWaalsContact O-CD2 3.32Å; M301-W305 PolarHBondContact O-N 3.34Å; W305-S307 PolarHBondContact O-N 2.91Å; W305-L308 PolarHBondContact O-N 2.91Å
306	A	95.7	Very high	91.9	Very high	7 Å²	7	43.7 Å²	43.7	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-20.8	175.8	0	0	0	0	0	113.8	R90 V93 L110 E302 L308	R90-A306 WeakPolarHBondContact O-CB 3.26Å; V93-A306 HydrophobicContact CB-CB 3.84Å; V93-A306 HydrophobicContact CG1-CB 3.73Å; L110-A306 HydrophobicContact CD2-CB 3.98Å; E302-A306 WeakPolarHBondContact O-CB 3.24Å; E302-A306 PolarHBondContact O-N 2.76Å; A306-L308 VanDerWaalsContact C-N 3.25Å; A306-L308 PolarHBondContact O-N 3.08Å
307	S	93.1	Very high	91.3	Very high	21 Å²	21	41.5 Å²	41.5	15%	0.147	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-11.6	175.2	79.3	0	0	0	0	114.3	V303 N304 W305 F649	V303-S307 PolarHBondContact O-N 2.95Å; V303-S307 VanDerWaalsContact O-N 3.08Å; N304-S307 WeakPolarHBondContact O-CB 3.09Å; N304-S307 PolarHBondContact O-N 2.81Å; N304-S307 PolarHBondContact O-OG 3.19Å; W305-S307 PolarHBondContact O-N 2.91Å; S307-F649 WeakPolarHBondContact OG-CB 3.49Å
308	L	90.7	Very high	90.7	Very high	14 Å²	14	46 Å²	46	7%	0.073	25%	0.247	C	C	.	.	S	Bend	trans	-95	150.2	-174.3	-59.3	175	0	0	0	111.2	R90 R235 W305 A306 N647	R90-L308 PolarHBondContact NH1-O 3.06Å; R235-L308 VanDerWaalsContact CZ-CD1 3.41Å; R235-L308 VanDerWaalsContact NH2-CD1 3.28Å; W305-L308 PolarHBondContact O-N 2.91Å; A306-L308 VanDerWaalsContact C-N 3.25Å; A306-L308 PolarHBondContact O-N 3.08Å; L308-N647 HydrophobicContact CD2-CB 4.12Å
309	P	85.6	Confident	90.2	Very high	106 Å²	106	45.7 Å²	45.7	69%	0.688	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-56.3	145.8	170.2	26.8	-35.1	0	0	0	110.1
310	A	85.7	Confident	89.4	Confident	49 Å²	49	45 Å²	45	41%	0.405	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-71.8	130.3	172.2	0	0	0	0	0	109.4
311	D	86.4	Confident	88.3	Confident	133 Å²	133	46.6 Å²	46.6	71%	0.711	25%	0.254	S	S	*	.			trans	-126.9	60.1	175.9	-168	29.9	0	0	0	110.8	D112	D112-D311 PolarHBondContact OD2-N 2.91Å; D112-D311 VanDerWaalsContact OD2-N 3.14Å
312	P	86.2	Confident	86.2	Confident	40 Å²	40	50.3 Å²	50.3	26%	0.26	29%	0.294	S	S	.	.			trans	-66	140.4	-178.7	28.6	-35	0	0	0	111.4	V116 E314	V116-P312 HydrophobicContact CG2-CB 3.81Å; V116-P312 HydrophobicContact CG2-CG 3.35Å; P312-E314 PolarHBondContact O-N 2.72Å
313	P	84.8	Confident	83.7	Confident	20 Å²	20	54.2 Å²	54.2	13%	0.13	33%	0.326	C	S	.	.			trans	-66.7	137	-176.9	29.2	-37.1	0	0	0	111.2	D112 P115 K315	D112-P313 WeakPolarHBondContact O-CD 3.41Å; P115-P313 HydrophobicContact CG-CG 4.35Å; P313-K315 WeakPolarHBondContact CB-O 3.41Å; P313-K315 PolarHBondContact O-N 3.02Å
314	E	81.6	Confident	81.5	Confident	192 Å²	192	54.4 Å²	54.4	90%	0.897	33%	0.327	S	S	*	.	S	Bend	trans	-61.9	-25.9	174.2	-61.7	-176.3	168.3	0	0	113	P312	P312-E314 PolarHBondContact O-N 2.72Å
315	K	82.2	Confident	79.2	Confident	166 Å²	166	57.5 Å²	57.5	72%	0.722	35%	0.353	S	S	*	.	S	Bend	trans	-136.2	-152.1	-177.9	-60.8	-175.4	-177.6	177.9	0	108.5	P115 P313	P115-K315 WeakPolarHBondContact CG-O 3.09Å; P313-K315 WeakPolarHBondContact CB-O 3.41Å; P313-K315 PolarHBondContact O-N 3.02Å
316	E	83.1	Confident	76.9	Confident	79 Å²	79	59.9 Å²	59.9	37%	0.369	37%	0.365	S	S	.	.			trans	-69.3	150.1	176.6	-167.9	173.9	-173.9	0	0	112.9	Y126 L130 R133 D318	Y126-E316 HydrophobicContact CE2-CB 4.37Å; Y126-E316 HydrophobicContact CE2-CG 3.88Å; L130-E316 HydrophobicContact CD2-CG 3.89Å; L130-E316 WeakPolarHBondContact CD2-OE1 3.46Å; R133-E316 IonicContact CZ-OE1 2.65Å; R133-E316 IonicContact NE-OE1 2.98Å; R133-E316 IonicContact NH1-OE1 3.75Å; R133-E316 PolarHBondContact NH1-OE1 3.44Å; R133-E316 IonicContact NH1-OE2 3.85Å; R133-E316 PolarHBondContact NH1-OE2 3.02Å; E316-D318 PolarHBondContact O-N 3.23Å
317	L	85.5	Confident	74.5	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	37%	0.37	C	S	.	.			trans	-69.1	119.8	173.4	179.2	68.9	0	0	0	110.9	V113 Y126 V227 A231 K234 L319	V113-L317 HydrophobicContact CG1-CD2 4.28Å; Y126-L317 WeakPolarHBondContact OH-CB 3.41Å; Y126-L317 PolarHBondContact OH-N 3.25Å; V227-L317 HydrophobicContact CG1-CD2 3.94Å; A231-L317 HydrophobicContact CB-CD1 4.32Å; A231-L317 HydrophobicContact CB-CD2 4.12Å; K234-L317 HydrophobicContact CD-CD1 3.9Å; L317-L319 HydrophobicContact CD2-CD2 4.38Å; L317-L319 PolarHBondContact O-N 3.05Å; L317-L319 VanDerWaalsContact O-N 3.08Å
318	D	86	Confident	72.2	Confident	94 Å²	94	62.4 Å²	62.4	50%	0.503	38%	0.382	S	S	.	.			trans	-60.5	111.8	173.4	-50.6	-76.2	0	0	0	111.7	K234 E316	K234-D318 IonicContact NZ-OD2 2.66Å; K234-D318 PolarHBondContact NZ-OD2 3.18Å; E316-D318 PolarHBondContact O-N 3.23Å
319	L	86.6	Confident	70.1	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	41%	0.411	C	S	.	.	S	Bend	trans	-87.5	-8.3	172.7	-64.3	-171.3	0	0	0	113.5	L130 R133 L137 H199 Y226 V227 C230 L317	L130-L319 HydrophobicContact CB-CD1 4.22Å; L130-L319 HydrophobicContact CD2-CD1 3.74Å; L130-L319 HydrophobicContact CD2-CD2 4.24Å; L130-L319 HydrophobicContact CD2-CG 3.9Å; L130-L319 WeakPolarHBondContact O-CD1 3.47Å; R133-L319 HydrophobicContact CB-CD1 3.82Å; L137-L319 HydrophobicContact CD1-CB 4.11Å; H199-L319 PolarHBondContact CE1-O 2.97Å; H199-L319 VanDerWaalsContact CE1-O 3.23Å; Y226-L319 HydrophobicContact CD1-CD2 4.37Å; Y226-L319 HydrophobicContact CE1-CB 4.16Å; Y226-L319 HydrophobicContact CE1-CD2 4.17Å; Y226-L319 PolarHBondContact OH-O 3.4Å; V227-L319 HydrophobicContact CG2-CD2 4.15Å; C230-L319 HydrophobicContact CB-CD2 4.36Å; L317-L319 HydrophobicContact CD2-CD2 4.38Å; L317-L319 PolarHBondContact O-N 3.05Å; L317-L319 VanDerWaalsContact O-N 3.08Å
320	C	82	Confident	68.3	Low	14 Å²	14	67 Å²	67	10%	0.095	39%	0.392	C	S	.	.	S	Bend	trans	-152.8	149	177.7	57.4	0	0	0	0	108.9	Y198	Y198-C320 HydrophobicContact CD1-CB 4.24Å; Y198-C320 HydrophobicContact CG-CB 4.26Å
321	C	74.4	Confident	66.7	Low	36 Å²	36	65.3 Å²	65.3	24%	0.243	38%	0.377	C	S	.	.			trans	-63.4	143.1	173.2	74.7	0	0	0	0	110.1	Y198 A323 S324	Y198-C321 PolarHBondContact O-N 3.23Å; Y198-C321 PolarHBondContact O-SG 3Å; Y198-C321 VanDerWaalsContact O-SG 3.41Å; C321-A323 PolarHBondContact O-N 3.16Å; C321-S324 PolarHBondContact O-N 2.87Å; C321-S324 VanDerWaalsContact SG-CB 3.59Å
322	G	53.2	Low	64.7	Low	82 Å²	82	61 Å²	61	85%	0.845	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-11.3	-167.8	0	0	0	0	0	116.5
323	A	45.8	Very low	62.4	Low	81 Å²	81	62.1 Å²	62.1	67%	0.669	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-15.2	173.3	0	0	0	0	0	114.1	C321	C321-A323 PolarHBondContact O-N 3.16Å
324	S	49.5	Very low	60	Low	4 Å²	4	66.3 Å²	66.3	3%	0.028	40%	0.395	C	S	.	.			trans	-101.7	5.9	-173.7	-156.8	0	0	0	0	114.1	Y198 C321 N326	Y198-S324 WeakPolarHBondContact CD1-O 3.3Å; C321-S324 PolarHBondContact O-N 2.87Å; C321-S324 VanDerWaalsContact SG-CB 3.59Å; S324-N326 CarbonylContact O-C 3.43Å; S324-N326 PolarHBondContact O-N 3.49Å
325	A	47.7	Very low	57.7	Low	67 Å²	67	64 Å²	64	55%	0.554	38%	0.378	S	S	*	.	S	Bend	trans	-60.8	-14.3	177.5	0	0	0	0	0	114.3
326	N	48.9	Very low	55.5	Low	50 Å²	50	60.4 Å²	60.4	27%	0.267	37%	0.37	S	S	.	.	S	Bend	trans	-107.4	100.1	166.4	-104.5	-46.8	0	0	0	109.6	S324 C328 Q329 C342	S324-N326 CarbonylContact O-C 3.43Å; S324-N326 PolarHBondContact O-N 3.49Å; N326-C328 PolarHBondContact O-N 2.89Å; N326-C328 VanDerWaalsContact O-N 3.09Å; N326-Q329 PolarHBondContact O-N 3.28Å; N326-C342 WeakPolarHBondContact OD1-CB 3.29Å
327	P	46	Very low	52.9	Low	25 Å²	25	63.6 Å²	63.6	16%	0.162	39%	0.39	C	S	.	.	H	α-helix	trans	-56.4	-31.5	-177.4	14.8	-27.1	0	0	0	113.5	A140 Y198 Q329 F330 L331	A140-P327 HydrophobicContact CB-CB 4.49Å; A140-P327 HydrophobicContact CB-CG 3.9Å; Y198-P327 HydrophobicContact CE1-CB 3.93Å; Y198-P327 HydrophobicContact CE1-CG 4.38Å; Y198-P327 WeakPolarHBondContact OH-CB 3.42Å; P327-Q329 PolarHBondContact O-N 2.65Å; P327-F330 PolarHBondContact O-N 2.98Å; P327-L331 HydrophobicContact CB-CD1 3.91Å; P327-L331 VanDerWaalsContact O-CB 3.25Å; P327-L331 WeakPolarHBondContact O-CB 3.47Å; P327-L331 VanDerWaalsContact O-CG 3.27Å; P327-L331 WeakPolarHBondContact O-CG 3.27Å; P327-L331 PolarHBondContact O-N 3.19Å
328	C	43.9	Very low	50.4	Low	57 Å²	57	67 Å²	67	39%	0.385	41%	0.411	S	S	.	.	H	α-helix	trans	-55.6	-31.4	174.3	-66.3	0	0	0	0	113.6	N326 C332	N326-C328 PolarHBondContact O-N 2.89Å; N326-C328 VanDerWaalsContact O-N 3.09Å; C328-C332 WeakPolarHBondContact O-CA 3.33Å; C328-C332 WeakPolarHBondContact O-CB 3.46Å; C328-C332 PolarHBondContact O-N 2.95Å
329	Q	48.1	Very low	47.8	Very low	145 Å²	145	69 Å²	69	68%	0.678	43%	0.426	S	S	*	.	H	α-helix	trans	-73.4	-33.9	-174.9	-169	167.4	-5	0	0	112.5	N326 P327	N326-Q329 PolarHBondContact O-N 3.28Å; P327-Q329 PolarHBondContact O-N 2.65Å
330	F	47.7	Very low	45.3	Very low	70 Å²	70	71.3 Å²	71.3	31%	0.307	44%	0.442	S	S	.	.	H	α-helix	trans	-89.5	-43.1	177	-145.1	-88.9	0	0	0	112.2	P200 P327 S333	P200-F330 HydrophobicContact CB-CD1 4.19Å; P200-F330 HydrophobicContact CB-CD2 4.05Å; P200-F330 HydrophobicContact CB-CE1 3.59Å; P200-F330 HydrophobicContact CB-CE2 3.43Å; P200-F330 VanDerWaalsContact CB-CE2 3.43Å; P200-F330 HydrophobicContact CB-CG 4.4Å; P200-F330 HydrophobicContact CB-CZ 3.19Å; P200-F330 HydrophobicContact CG-CD2 3.85Å; P200-F330 HydrophobicContact CG-CE1 4.44Å; P200-F330 HydrophobicContact CG-CE2 3.52Å; P200-F330 HydrophobicContact CG-CG 4.46Å; P200-F330 HydrophobicContact CG-CZ 3.87Å; P327-F330 PolarHBondContact O-N 2.98Å; F330-S333 WeakPolarHBondContact O-CB 3.49Å; F330-S333 PolarHBondContact O-N 3.31Å; F330-S333 PolarHBondContact O-OG 2.94Å
331	L	50.4	Low	43.1	Very low	14 Å²	14	75.3 Å²	75.3	7%	0.073	47%	0.47	C	S	.	.	H	α-helix	trans	-71	-36.2	-179.1	-62.6	175.4	0	0	0	112.7	W141 H144 V154 L197 P327	W141-L331 HydrophobicContact CB-CD1 4.35Å; H144-L331 HydrophobicContact CB-CD1 3.83Å; V154-L331 HydrophobicContact CG1-CD2 4.41Å; V154-L331 HydrophobicContact CG2-CD2 3.77Å; L197-L331 HydrophobicContact CD2-CD2 4.24Å; P327-L331 HydrophobicContact CB-CD1 3.91Å; P327-L331 VanDerWaalsContact O-CB 3.25Å; P327-L331 WeakPolarHBondContact O-CB 3.47Å; P327-L331 VanDerWaalsContact O-CG 3.27Å; P327-L331 WeakPolarHBondContact O-CG 3.27Å; P327-L331 PolarHBondContact O-N 3.19Å
332	C	46.1	Very low	41.1	Very low	44 Å²	44	76.5 Å²	76.5	30%	0.297	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	36.3	176.3	-51.5	0	0	0	0	112.4	C328 S334 W335	C328-C332 WeakPolarHBondContact O-CA 3.33Å; C328-C332 WeakPolarHBondContact O-CB 3.46Å; C328-C332 PolarHBondContact O-N 2.95Å; C332-S334 PolarHBondContact O-N 3.24Å; C332-W335 HydrophobicContact CB-CB 4.16Å; C332-W335 PolarHBondContact O-N 2.63Å
333	S	36.1	Very low	40.3	Very low	63 Å²	63	75.3 Å²	75.3	44%	0.441	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-4.5	176.8	37.9	0	0	0	0	114.7	F330	F330-S333 WeakPolarHBondContact O-CB 3.49Å; F330-S333 PolarHBondContact O-N 3.31Å; F330-S333 PolarHBondContact O-OG 2.94Å
334	S	36.1	Very low	39.6	Very low	107 Å²	107	74.2 Å²	74.2	75%	0.748	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	1.2	166	-166.9	0	0	0	0	115	C332	C332-S334 PolarHBondContact O-N 3.24Å
335	W	33.3	Very low	38.7	Very low	143 Å²	143	80 Å²	80	54%	0.542	48%	0.481	S	S	.	.			trans	-120.3	49.1	-176.4	-72.8	87.4	0	0	0	112.7	C332 N337 V338	C332-W335 HydrophobicContact CB-CB 4.16Å; C332-W335 PolarHBondContact O-N 2.63Å; W335-N337 PolarHBondContact O-N 2.97Å; W335-V338 HydrophobicContact CE3-CG2 3.75Å; W335-V338 HydrophobicContact CZ3-CG2 4.15Å; W335-V338 PolarHBondContact O-N 3Å
336	V	34.1	Very low	38.1	Very low	91 Å²	91	80 Å²	80	55%	0.552	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.8	174.8	167.3	0	0	0	0	113.6	F396	V336-F396 HydrophobicContact CG1-CD1 4.44Å; V336-F396 HydrophobicContact CG1-CE1 3.33Å; V336-F396 HydrophobicContact CG1-CE2 4.42Å; V336-F396 HydrophobicContact CG1-CZ 3.33Å
337	N	29	Very low	37.4	Very low	147 Å²	147	84.3 Å²	84.3	79%	0.786	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	15.1	-178.1	-72.8	-9.2	0	0	0	115.5	W335	W335-N337 PolarHBondContact O-N 2.97Å
338	V	32.6	Very low	36.8	Very low	74 Å²	74	89.6 Å²	89.6	45%	0.448	52%	0.518	S	S	.	.	S	Bend	trans	-126.5	108.6	169.9	179.6	0	0	0	0	109.6	W335 C340	W335-V338 HydrophobicContact CE3-CG2 3.75Å; W335-V338 HydrophobicContact CZ3-CG2 4.15Å; W335-V338 PolarHBondContact O-N 3Å; V338-C340 PolarHBondContact O-N 2.91Å
339	T	31.9	Very low	36.2	Very low	135 Å²	135	93.4 Å²	93.4	83%	0.828	53%	0.534	S	S	*	.			trans	-60.7	105	168.6	45.6	0	0	0	0	109.2	S341	T339-S341 PolarHBondContact O-N 2.81Å
340	C	34.3	Very low	35.5	Very low	49 Å²	49	96.3 Å²	96.3	33%	0.331	54%	0.539	S	S	.	.			trans	-64.2	119.1	173.5	-173.9	0	0	0	0	109.2	V338 C342 A343	V338-C340 PolarHBondContact O-N 2.91Å; C340-C342 PolarHBondContact O-N 2.73Å; C340-C342 VanDerWaalsContact SG-SG 3.63Å; C340-A343 WeakPolarHBondContact O-CB 3.43Å; C340-A343 PolarHBondContact O-N 3.07Å
341	S	36	Very low	34.6	Very low	98 Å²	98	100.8 Å²	100.8	69%	0.685	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-13.6	-179.1	-59.9	0	0	0	0	113.8	T339 A343 A344	T339-S341 PolarHBondContact O-N 2.81Å; S341-A343 PolarHBondContact O-N 2.98Å; S341-A344 WeakPolarHBondContact O-CB 3.49Å; S341-A344 PolarHBondContact O-N 3.39Å
342	C	33	Very low	33.6	Very low	61 Å²	61	105.3 Å²	105.3	41%	0.412	59%	0.589	S	S	.	*	H	α-helix	trans	-62.3	-20	169.5	-54.1	0	0	0	0	113.2	N326 C340 A344	N326-C342 WeakPolarHBondContact OD1-CB 3.29Å; C340-C342 PolarHBondContact O-N 2.73Å; C340-C342 VanDerWaalsContact SG-SG 3.63Å; C342-A344 VanDerWaalsContact C-N 3.29Å; C342-A344 PolarHBondContact O-N 3.02Å
343	A	35	Very low	32.6	Very low	57 Å²	57	110.2 Å²	110.2	47%	0.471	61%	0.612	S	S	.	*	H	α-helix	trans	-67.5	-28.2	171.2	0	0	0	0	0	112.7	C340 S341 S346	C340-A343 WeakPolarHBondContact O-CB 3.43Å; C340-A343 PolarHBondContact O-N 3.07Å; S341-A343 PolarHBondContact O-N 2.98Å; A343-S346 PolarHBondContact O-N 3.5Å
344	A	31.6	Very low	32.3	Very low	58 Å²	58	115.1 Å²	115.1	48%	0.479	63%	0.633	S	S	.	*	H	α-helix	trans	-73	-33.2	-178.7	0	0	0	0	0	113.1	S341 C342 S346 Q347 H348	S341-A344 WeakPolarHBondContact O-CB 3.49Å; S341-A344 PolarHBondContact O-N 3.39Å; C342-A344 VanDerWaalsContact C-N 3.29Å; C342-A344 PolarHBondContact O-N 3.02Å; A344-S346 VanDerWaalsContact C-N 3.31Å; A344-S346 PolarHBondContact O-N 3Å; A344-Q347 PolarHBondContact O-N 3.07Å; A344-H348 PolarHBondContact O-N 3.23Å
345	L	31.1	Very low	31.7	Very low	125 Å²	125	115 Å²	115	65%	0.654	63%	0.632	S	S	*	*	H	α-helix	trans	-67.9	-29.9	175.5	-83.7	94.6	0	0	0	112.9	Q347 H348 N349	L345-Q347 VanDerWaalsContact C-N 3.28Å; L345-Q347 PolarHBondContact O-N 2.97Å; L345-H348 PolarHBondContact O-N 2.63Å; L345-N349 PolarHBondContact O-N 3.27Å
346	S	35	Very low	31.4	Very low	66 Å²	66	115.6 Å²	115.6	46%	0.462	64%	0.644	S	S	.	*	H	α-helix	trans	-68.3	-26.6	176.8	-173.7	0	0	0	0	112.9	A343 A344	A343-S346 PolarHBondContact O-N 3.5Å; A344-S346 VanDerWaalsContact C-N 3.31Å; A344-S346 PolarHBondContact O-N 3Å
347	Q	34.4	Very low	31.1	Very low	141 Å²	141	116.7 Å²	116.7	66%	0.659	66%	0.656	S	S	*	*	H	α-helix	trans	-81.4	-39.3	173.1	-69.2	-176.8	-57	0	0	111.7	A344 L345 N349 R350	A344-Q347 PolarHBondContact O-N 3.07Å; L345-Q347 VanDerWaalsContact C-N 3.28Å; L345-Q347 PolarHBondContact O-N 2.97Å; Q347-N349 PolarHBondContact O-N 2.94Å; Q347-R350 PolarHBondContact O-N 3.36Å
348	H	32.5	Very low	30.9	Very low	137 Å²	137	116.9 Å²	116.9	63%	0.634	66%	0.657	S	S	*	*	H	α-helix	trans	-66.4	-35	-176.3	-151.7	-7.3	0	0	0	113.4	A344 L345 R350	A344-H348 PolarHBondContact O-N 3.23Å; L345-H348 PolarHBondContact O-N 2.63Å; H348-R350 PolarHBondContact O-N 2.67Å
349	N	32.8	Very low	30.6	Very low	137 Å²	137	122.1 Å²	122.1	73%	0.733	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	8.4	174.2	-77.1	2.4	0	0	0	114.2	L345 Q347	L345-N349 PolarHBondContact O-N 3.27Å; Q347-N349 PolarHBondContact O-N 2.94Å
350	R	33	Very low	30.4	Very low	206 Å²	206	124.4 Å²	124.4	78%	0.777	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-1.5	174.1	-88.6	-179.1	166.3	147.7	-4	114.2	Q347 H348	Q347-R350 PolarHBondContact O-N 3.36Å; H348-R350 PolarHBondContact O-N 2.67Å
351	E	29.2	Very low	29.9	Very low	163 Å²	163	126.8 Å²	126.8	76%	0.762	70%	0.695	S	S	*	*	S	Bend	trans	-101.9	10.6	179	-68.2	-173.4	153.5	0	0	113.5
352	T	28.7	Very low	29.4	Very low	109 Å²	109	127.5 Å²	127.5	67%	0.669	70%	0.695	S	S	*	*	S	Bend	trans	-121.9	51.7	174.8	52.7	0	0	0	0	112.5
353	D	25.8	Very low	28.9	Very low	147 Å²	147	135.4 Å²	135.4	79%	0.786	72%	0.718	S	S	*	*	S	Bend	trans	-156.5	130.5	149.5	-105.5	-34.1	0	0	0	111.8
354	L	29.4	Very low	28.3	Very low	166 Å²	166	142.7 Å²	142.7	87%	0.869	73%	0.733	S	S	*	*			trans	63.7	105.1	166.1	-60.8	167	0	0	0	119.1
355	S	23.2	Very low	27.9	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	75%	0.745	S	S	*	*			trans	-77.4	152.1	151.6	51.4	0	0	0	0	111.3
356	I	27.5	Very low	27.6	Very low	156 Å²	156	145.2 Å²	145.2	80%	0.8	75%	0.747	S	S	*	*			trans	161.7	129.6	134.8	-83.6	156.3	0	0	0	113.2
357	S	28.2	Very low	27	Very low	114 Å²	114	152.2 Å²	152.2	80%	0.797	77%	0.77	S	S	*	*			trans	70.9	146.7	159.1	63.7	0	0	0	0	122.1
358	N	23.8	Very low	26.5	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	77%	0.77	S	S	*	*			trans	-98.6	-175	-174.3	-67.5	-40.6	0	0	0	112.7
359	E	27.1	Very low	26.2	Very low	183 Å²	183	152.6 Å²	152.6	86%	0.855	78%	0.776	S	S	*	*			trans	83.2	134.2	166.7	-57.9	173.8	177	0	0	114.1
360	E	27.5	Very low	25.9	Very low	183 Å²	183	152 Å²	152	86%	0.855	78%	0.782	S	S	*	*			cis	-149.8	158.8	6.3	-138.5	178.8	178.7	0	0	111.5
361	S	23.6	Very low	25.5	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	79%	0.785	S	S	*	*			trans	-86.9	160.2	175.7	57.1	0	0	0	0	112.9
362	V	25.2	Very low	25.5	Very low	113 Å²	113	150 Å²	150	69%	0.685	79%	0.786	S	S	*	*			trans	160.9	107.8	130.1	155.9	0	0	0	0	114
363	Y	23	Very low	25.3	Very low	227 Å²	227	151.1 Å²	151.1	89%	0.89	79%	0.785	S	S	*	*				165.6	149.9	110.1	-114.8	-58.4	0	0	0	111.6
364	R	22	Very low	25.2	Very low	210 Å²	210	153.7 Å²	153.7	79%	0.792	79%	0.79	S	S	*	*			trans	-139	136.2	-172.1	-156	-172.7	-162.6	167.3	6.4	110.8
365	N	24.1	Very low	24.9	Very low	137 Å²	137	150.1 Å²	150.1	73%	0.733	78%	0.779	S	S	*	*			trans	53	129.2	158.9	-61.6	-1.4	0	0	0	120.9
366	S	22.9	Very low	24.9	Very low	99 Å²	99	154 Å²	154	69%	0.692	78%	0.783	S	S	*	*				163.6	132.1	98.6	-66.2	0	0	0	0	113
367	F	24.1	Very low	24.7	Very low	212 Å²	212	150.2 Å²	150.2	93%	0.93	78%	0.783	S	S	*	*				166.9	163.5	114.4	-105.9	-83.5	0	0	0	113.7
368	N	23.7	Very low	24.5	Very low	124 Å²	124	151.9 Å²	151.9	66%	0.663	78%	0.778	S	S	*	*			trans	-118.9	157.9	-162.7	-130.9	30.3	0	0	0	113.1
369	E	24.8	Very low	24.6	Very low	162 Å²	162	151.2 Å²	151.2	76%	0.757	77%	0.774	S	S	*	*			trans	51.8	124.5	147.7	-66.9	168.4	136.5	0	0	122.4
370	S	26.9	Very low	24.6	Very low	124 Å²	124	150 Å²	150	87%	0.867	77%	0.774	S	S	*	*				170.5	156.2	108	-75.4	0	0	0	0	115.2
371	N	25.7	Very low	24.4	Very low	156 Å²	156	146.1 Å²	146.1	83%	0.834	77%	0.767	S	S	*	*			trans	-82	157.8	-171.3	-64.7	-54.3	0	0	0	116.6
372	H	29.2	Very low	24.7	Very low	172 Å²	172	149.7 Å²	149.7	80%	0.796	78%	0.778	S	S	*	*			trans	170.2	151.1	131.8	-96.9	-80.7	0	0	0	108.1
373	M	23.6	Very low	24.6	Very low	132 Å²	132	151.7 Å²	151.7	65%	0.65	78%	0.784	S	S	*	*			cis	-180	134.2	-18.2	160	174.8	72.7	0	0	108.6
374	F	24.2	Very low	24.8	Very low	201 Å²	201	144.1 Å²	144.1	88%	0.882	77%	0.765	S	S	*	*			trans	-170.8	122.9	139.6	-103	-66.4	0	0	0	111.1
375	S	22.7	Very low	24.9	Very low	92 Å²	92	137.6 Å²	137.6	64%	0.643	76%	0.763	S	S	*	*			trans	-106.6	176.4	163.8	-46.1	0	0	0	0	107.7
376	F	22.4	Very low	24.9	Very low	185 Å²	185	141.5 Å²	141.5	81%	0.811	77%	0.767	S	S	*	*			cis	-156.1	158.9	16.9	-119.3	-72.1	0	0	0	108.4
377	G	24.1	Very low	25	Very low	78 Å²	78	141.1 Å²	141.1	80%	0.804	76%	0.763	S	S	*	*			trans	-168.2	120.8	165	0	0	0	0	0	108.7
378	Q	25.2	Very low	25	Very low	149 Å²	149	138 Å²	138	70%	0.696	75%	0.754	S	S	*	*			trans	-119.5	156.3	-166.4	-141.5	177.1	-37.4	0	0	110.7
379	D	24.4	Very low	25.1	Very low	136 Å²	136	141.8 Å²	141.8	73%	0.727	76%	0.76	S	S	*	*			trans	68.4	141.9	173.6	-43.3	-33	0	0	0	113.9
380	D	28.1	Very low	25	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	76%	0.764	S	S	*	*			cis	-139.1	173.2	22.4	-111.5	-43	0	0	0	113.2
381	S	23.9	Very low	24.9	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	76%	0.761	S	S	*	*			trans	-56.8	144.9	179.8	60.5	0	0	0	0	116
382	L	28	Very low	24.9	Very low	176 Å²	176	142.2 Å²	142.2	92%	0.921	75%	0.751	S	S	*	*			trans	-159.1	151.3	131.3	-108.6	165.7	0	0	0	111.9
383	D	24.3	Very low	24.6	Very low	155 Å²	155	144.8 Å²	144.8	83%	0.829	75%	0.754	S	S	*	*			trans	-94.1	121.9	-167.4	-179.2	20.5	0	0	0	111.1
384	S	27.3	Very low	24.8	Very low	68 Å²	68	144.7 Å²	144.7	48%	0.476	76%	0.756	S	S	.	*			trans	-147	126.4	166.7	72.5	0	0	0	0	112.7	R386 D617	S384-R386 PolarHBondContact O-N 3.13Å; S384-D617 WeakPolarHBondContact CB-OD2 3.47Å; S384-D617 PolarHBondContact OG-OD2 2.95Å
385	G	24.4	Very low	24.8	Very low	73 Å²	73	146.6 Å²	146.6	75%	0.753	76%	0.757	S	S	*	*			trans	-76.3	108.8	-173.4	0	0	0	0	0	113
386	R	24.2	Very low	25	Very low	218 Å²	218	149.7 Å²	149.7	82%	0.823	76%	0.759	S	S	*	*			trans	-75.6	135.8	166.7	-70.8	-173.1	174	-151.2	-3.7	111.3	S384 I388	S384-R386 PolarHBondContact O-N 3.13Å; R386-I388 PolarHBondContact O-N 2.91Å
387	P	25.2	Very low	25.1	Very low	92 Å²	92	148 Å²	148	60%	0.597	76%	0.759	S	S	*	*			trans	-62.7	123.1	163.8	-17.5	30.7	0	0	0	110	Y389	P387-Y389 HydrophobicContact CB-CD2 4.41Å; P387-Y389 PolarHBondContact O-N 3.37Å
388	I	23.3	Very low	25.1	Very low	147 Å²	147	149.2 Å²	149.2	75%	0.754	76%	0.755	S	S	*	*			trans	-75.4	108.7	174.5	-60.2	171.3	0	0	0	108.2	R386 F390	R386-I388 PolarHBondContact O-N 2.91Å; I388-F390 HydrophobicContact CG2-CD2 4.09Å; I388-F390 HydrophobicContact CG2-CE2 4.13Å
389	Y	25.9	Very low	25.2	Very low	203 Å²	203	150 Å²	150	80%	0.796	76%	0.763	S	S	*	*			trans	-113.2	121	161.1	-87.6	-84.1	0	0	0	109.8	P387 Q391	P387-Y389 HydrophobicContact CB-CD2 4.41Å; P387-Y389 PolarHBondContact O-N 3.37Å; Y389-Q391 PolarHBondContact O-N 2.95Å
390	F	23.3	Very low	25.3	Very low	190 Å²	190	148.5 Å²	148.5	83%	0.833	76%	0.763	S	S	*	*			trans	-68.9	109.8	-178.3	-96	-97.3	0	0	0	111.5	I388 S392	I388-F390 HydrophobicContact CG2-CD2 4.09Å; I388-F390 HydrophobicContact CG2-CE2 4.13Å; F390-S392 VanDerWaalsContact C-N 3.32Å; F390-S392 PolarHBondContact O-N 3.19Å
391	Q	23.7	Very low	25.2	Very low	172 Å²	172	146.5 Å²	146.5	80%	0.804	76%	0.762	S	S	*	*			trans	-71.8	88.8	158.3	-94.7	-171.3	-4.4	0	0	109.7	Y389 R393	Y389-Q391 PolarHBondContact O-N 2.95Å; Q391-R393 PolarHBondContact O-N 3.42Å
392	S	25.3	Very low	25.4	Very low	89 Å²	89	146 Å²	146	62%	0.622	76%	0.757	S	S	*	*			trans	-72	77	170.4	172.3	0	0	0	0	111.1	F390 N394	F390-S392 VanDerWaalsContact C-N 3.32Å; F390-S392 PolarHBondContact O-N 3.19Å; S392-N394 VanDerWaalsContact C-N 3.27Å; S392-N394 PolarHBondContact O-N 3.04Å; S392-N394 VanDerWaalsContact O-N 3.17Å; S392-N394 PolarHBondContact OG-ND2 3.01Å
393	R	23.1	Very low	25.5	Very low	226 Å²	226	147.5 Å²	147.5	85%	0.853	76%	0.756	S	S	*	*			trans	-87.3	62.7	174	-145.6	176.7	-173.2	178.4	1.8	110.2	Q391 R395	Q391-R393 PolarHBondContact O-N 3.42Å; R393-R395 PolarHBondContact O-N 3.47Å
394	N	28.9	Very low	25.7	Very low	130 Å²	130	144.7 Å²	144.7	70%	0.695	75%	0.749	S	S	*	*			trans	-83.7	115.6	-174.8	-76.6	-14.4	0	0	0	112.3	S392	S392-N394 VanDerWaalsContact C-N 3.27Å; S392-N394 PolarHBondContact O-N 3.04Å; S392-N394 VanDerWaalsContact O-N 3.17Å; S392-N394 PolarHBondContact OG-ND2 3.01Å
395	R	23.9	Very low	25.8	Very low	240 Å²	240	145.1 Å²	145.1	91%	0.906	75%	0.751	S	S	*	*			trans	-67.3	144	158.6	-68	-179	179.1	-177.6	0.2	108.9	R393	R393-R395 PolarHBondContact O-N 3.47Å
396	F	26.5	Very low	26.2	Very low	158 Å²	158	147.2 Å²	147.2	69%	0.693	75%	0.751	S	S	*	*			trans	-91.6	130.8	169.4	-82.5	-103.1	0	0	0	110.7	V336	V336-F396 HydrophobicContact CG1-CD1 4.44Å; V336-F396 HydrophobicContact CG1-CE1 3.33Å; V336-F396 HydrophobicContact CG1-CE2 4.42Å; V336-F396 HydrophobicContact CG1-CZ 3.33Å
397	D	23.3	Very low	26.6	Very low	150 Å²	150	141.1 Å²	141.1	80%	0.802	75%	0.747	S	S	*	*			trans	-142.8	130.7	155.2	-91.9	-48.1	0	0	0	109.8
398	S	26	Very low	26.9	Very low	102 Å²	102	141.7 Å²	141.7	71%	0.713	75%	0.752	S	S	*	*			trans	55.8	105.6	161	59.6	0	0	0	0	122.7
399	L	26.5	Very low	27.1	Very low	165 Å²	165	144.4 Å²	144.4	86%	0.864	76%	0.759	S	S	*	*				73.3	129.4	120.5	-70.1	166.3	0	0	0	124.4
400	S	26.1	Very low	27.3	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	75%	0.754	S	S	*	*			trans	107.4	106.8	131.4	72.1	0	0	0	0	122.2
401	S	26.4	Very low	27.4	Very low	116 Å²	116	136.1 Å²	136.1	81%	0.811	75%	0.748	S	S	*	*			trans	44.1	120.2	145.6	63.4	0	0	0	0	122.4
402	C	28.7	Very low	27.5	Very low	91 Å²	91	136.5 Å²	136.5	62%	0.615	76%	0.755	S	S	*	*			trans	-139.1	149.3	151.2	-170.4	0	0	0	0	110.7
403	K	28.4	Very low	27.6	Very low	208 Å²	208	136.2 Å²	136.2	90%	0.904	75%	0.753	S	S	*	*			trans	-127.7	78.5	-173.2	-69.9	-176.8	177	-178.6	0	112.3
404	S	30.3	Very low	27.7	Very low	96 Å²	96	130.9 Å²	130.9	67%	0.671	75%	0.75	S	S	*	*			trans	-171.5	65.6	175.5	41.9	0	0	0	0	114.9
405	C	29.3	Very low	27.6	Very low	77 Å²	77	136.1 Å²	136.1	52%	0.52	76%	0.76	S	S	.	*			trans	-113.1	119.6	167.8	-169.9	0	0	0	0	111.3	A407	C405-A407 VanDerWaalsContact C-N 3.27Å; C405-A407 PolarHBondContact O-N 3.1Å
406	P	31.7	Very low	27.5	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-69.5	-16.7	179.7	-22.1	34.4	0	0	0	115.3	C408	P406-C408 PolarHBondContact O-N 3.47Å
407	A	33.5	Very low	27.4	Very low	89 Å²	89	129.8 Å²	129.8	74%	0.736	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-71.6	-6.6	-178.7	0	0	0	0	0	114.1	C405	C405-A407 VanDerWaalsContact C-N 3.27Å; C405-A407 PolarHBondContact O-N 3.1Å
408	C	30.6	Very low	27.4	Very low	104 Å²	104	127.9 Å²	127.9	70%	0.703	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-95.4	6	-179.1	-55.6	0	0	0	0	113.9	P406 A410	P406-C408 PolarHBondContact O-N 3.47Å; C408-A410 PolarHBondContact O-N 3.26Å
409	F	28.2	Very low	27.2	Very low	204 Å²	204	131.2 Å²	131.2	90%	0.895	76%	0.761	S	S	*	*			trans	-96.4	54.2	174.2	-90.9	-85.3	0	0	0	112
410	A	29.2	Very low	27	Very low	84 Å²	84	129.1 Å²	129.1	69%	0.694	76%	0.756	S	S	*	*	S	Bend	trans	-125.7	101.2	162.2	0	0	0	0	0	107.3	C408 L412	C408-A410 PolarHBondContact O-N 3.26Å; A410-L412 PolarHBondContact O-N 2.74Å
411	D	25.6	Very low	26.8	Very low	135 Å²	135	133.4 Å²	133.4	72%	0.722	76%	0.764	S	S	*	*			trans	-69.6	118.7	-173.3	-172	-1.2	0	0	0	111	S413	D411-S413 PolarHBondContact OD1-N 2.79Å; D411-S413 VanDerWaalsContact OD1-N 3.1Å; D411-S413 PolarHBondContact OD1-OG 2.86Å
412	L	26.5	Very low	26.7	Very low	181 Å²	181	133.1 Å²	133.1	95%	0.948	76%	0.762	S	S	*	*			trans	-130.2	70.4	166.4	-89.3	172	0	0	0	109.1	A410	A410-L412 PolarHBondContact O-N 2.74Å
413	S	26.3	Very low	26.4	Very low	83 Å²	83	136.4 Å²	136.4	58%	0.58	77%	0.771	S	S	*	*			trans	-116.2	130.2	163.7	63.4	0	0	0	0	111.3	D411	D411-S413 PolarHBondContact OD1-N 2.79Å; D411-S413 VanDerWaalsContact OD1-N 3.1Å; D411-S413 PolarHBondContact OD1-OG 2.86Å
414	S	25.3	Very low	26.3	Very low	113 Å²	113	134 Å²	134	79%	0.79	77%	0.767	S	S	*	*			trans	66.5	92.7	176.9	73.1	0	0	0	0	118.4
415	R	26.8	Very low	26.1	Very low	240 Å²	240	134.6 Å²	134.6	91%	0.906	77%	0.768	S	S	*	*				-161.6	107.1	113.8	-105.8	167.8	-169.4	-147.4	0.4	111.3
416	S	21.8	Very low	25.9	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	78%	0.783	S	S	*	*			trans	-65	132.7	156.5	177.7	0	0	0	0	108.4
417	L	25.3	Very low	25.7	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	78%	0.782	S	S	*	*			trans	-118.6	89.6	165.3	-86.8	168.9	0	0	0	108.5	I419	L417-I419 PolarHBondContact O-N 3.4Å
418	T	23.2	Very low	25.3	Very low	111 Å²	111	138.5 Å²	138.5	68%	0.681	79%	0.787	S	S	*	*			trans	-61.4	126.9	159.5	34	0	0	0	0	109.6	T420	T418-T420 PolarHBondContact O-N 2.96Å
419	I	21.9	Very low	25.2	Very low	172 Å²	172	141.7 Å²	141.7	88%	0.882	79%	0.792	S	S	*	*			trans	-74.8	110.9	171.4	-60.7	171	0	0	0	108	L417	L417-I419 PolarHBondContact O-N 3.4Å
420	T	22.6	Very low	25.2	Very low	121 Å²	121	136.6 Å²	136.6	74%	0.742	78%	0.778	S	S	*	*			trans	-148.2	144	167.3	38.4	0	0	0	0	110.8	T418	T418-T420 PolarHBondContact O-N 2.96Å
421	E	22.1	Very low	25.1	Very low	195 Å²	195	143.4 Å²	143.4	91%	0.911	79%	0.785	S	S	*	*			trans	-72.9	148.8	-169.2	-53.7	163.5	133.7	0	0	114.2
422	S	23.3	Very low	25.2	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	78%	0.778	S	S	*	*			trans	-176.9	128.2	149.6	16.7	0	0	0	0	107.7
423	I	23.5	Very low	25.3	Very low	160 Å²	160	140.1 Å²	140.1	82%	0.821	77%	0.767	S	S	*	*				65.6	112.9	57.6	-56	178.8	0	0	0	112.1
424	I	24.8	Very low	25.4	Very low	157 Å²	157	144.2 Å²	144.2	81%	0.805	78%	0.777	S	S	*	*			trans	-78.1	144.7	-174.5	-59.2	160.9	0	0	0	111.4
425	P	26	Very low	25.3	Very low	109 Å²	109	145.2 Å²	145.2	71%	0.708	78%	0.778	S	S	*	*			trans	-143.3	121	130.7	31	-12.8	0	0	0	116.1
426	T	25.1	Very low	25	Very low	136 Å²	136	139.6 Å²	139.6	83%	0.834	78%	0.775	S	S	*	*			trans	29.8	134.6	132	59.4	0	0	0	0	123.6
427	G	27.6	Very low	25.2	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	78%	0.775	S	S	*	*			trans	116.3	100.3	151.7	0	0	0	0	0	114.1
428	D	26.7	Very low	25.2	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	78%	0.777	S	S	*	*				62	134.4	87	-90.3	-32.2	0	0	0	114.4
429	E	28.3	Very low	25.2	Very low	171 Å²	171	136.6 Å²	136.6	80%	0.799	78%	0.778	S	S	*	*			cis	-140.1	148.7	22.5	-62.1	179.2	133.8	0	0	114
430	T	28.5	Very low	25.3	Very low	98 Å²	98	136.9 Å²	136.9	60%	0.601	78%	0.776	S	S	*	*			trans	33.2	131.8	142.3	68.2	0	0	0	0	120.5
431	W	26.5	Very low	25.6	Very low	226 Å²	226	141.4 Å²	141.4	86%	0.856	79%	0.785	S	S	*	*				-162.1	166.6	58.2	-87.7	76.9	0	0	0	108.6
432	V	26.8	Very low	25.6	Very low	93 Å²	93	142.8 Å²	142.8	56%	0.564	78%	0.782	S	S	*	*			cis	163	138.3	-22.3	133.9	0	0	0	0	104.4
433	Q	28.4	Very low	25.9	Very low	155 Å²	155	144.8 Å²	144.8	72%	0.724	78%	0.779	S	S	*	*			cis	-139.7	-163.4	-3.1	-116.6	166.8	-95.7	0	0	106.8
434	E	28	Very low	26.1	Very low	168 Å²	168	146.6 Å²	146.6	79%	0.785	78%	0.775	S	S	*	*			cis	-150	155.1	11	-149.6	157.7	-145.6	0	0	109.7
435	V	23.6	Very low	26.3	Very low	134 Å²	134	145.2 Å²	145.2	81%	0.812	77%	0.766	S	S	*	*			trans	-126.6	146.5	-160.2	169.8	0	0	0	0	112.7
436	S	21.5	Very low	26.5	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	77%	0.772	S	S	*	*			trans	-86.4	113.5	169.2	-64	0	0	0	0	112.5
437	A	25.8	Very low	26.8	Very low	88 Å²	88	144.5 Å²	144.5	73%	0.727	77%	0.767	S	S	*	*			trans	172.6	150.1	161.5	0	0	0	0	0	109.1
438	S	24.8	Very low	26.9	Very low	125 Å²	125	146 Å²	146	87%	0.874	77%	0.774	S	S	*	*			cis	-161.1	177.6	-17.3	-130	0	0	0	0	109.7
439	S	22.9	Very low	27.2	Very low	101 Å²	101	144.6 Å²	144.6	71%	0.706	77%	0.771	S	S	*	*			trans	-51.5	149.4	-176	-108.3	0	0	0	0	118.7
440	Q	25.3	Very low	27.3	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	77%	0.768	S	S	*	*			trans	71.9	106.1	145.8	-64.2	170.9	11.7	0	0	121.5
441	K	28.4	Very low	27.6	Very low	215 Å²	215	143.5 Å²	143.5	94%	0.935	77%	0.773	S	S	*	*				-161.9	158.3	104.6	-114.9	170	-176.7	168.6	0	114.3
442	R	22.9	Very low	27.7	Very low	224 Å²	224	140.2 Å²	140.2	85%	0.845	77%	0.768	S	S	*	*			trans	-82.6	147.3	-171	-54	166.4	-177.3	171.9	-1.2	112.3
443	H	29.1	Very low	27.9	Very low	151 Å²	151	141.7 Å²	141.7	70%	0.699	77%	0.772	S	S	*	*				166	133	111.9	-97	-76.4	0	0	0	113.3
444	R	27.4	Very low	28	Very low	199 Å²	199	140.6 Å²	140.6	75%	0.751	77%	0.771	S	S	*	*			trans	55	144	143.6	-70	178	151.5	152.9	0.9	119.1
445	E	29.2	Very low	27.9	Very low	128 Å²	128	140.3 Å²	140.3	60%	0.598	77%	0.774	S	S	*	*			cis	-166.3	159.8	6.9	-125.5	156.3	-148.7	0	0	110.5
446	N	31	Very low	28.8	Very low	157 Å²	157	139 Å²	139	84%	0.84	77%	0.768	S	S	*	*			trans	69.5	132.5	162	-48.3	-34.2	0	0	0	119.3
447	G	29.4	Very low	29.1	Very low	72 Å²	72	138.9 Å²	138.9	74%	0.742	76%	0.762	S	S	*	*			cis	172.2	162.1	-8.4	0	0	0	0	0	114.4
448	A	31.1	Very low	29.2	Very low	103 Å²	103	142.5 Å²	142.5	85%	0.851	77%	0.769	S	S	*	*			trans	61.6	141.1	168.2	0	0	0	0	0	118.2
449	T	32.1	Very low	29.3	Very low	128 Å²	128	140.5 Å²	140.5	79%	0.785	77%	0.768	S	S	*	*			cis	-138.6	127.7	19.7	44.6	0	0	0	0	111.9
450	S	31.4	Very low	29.5	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	77%	0.771	S	S	*	*				72.5	134.6	103.9	-118.5	0	0	0	0	115
451	I	33.5	Very low	29.5	Very low	139 Å²	139	139 Å²	139	71%	0.713	77%	0.771	S	S	*	*			cis	-147.5	125.1	22.4	-67.3	178.7	0	0	0	106.7
452	E	29.6	Very low	29.6	Very low	157 Å²	157	133.1 Å²	133.1	73%	0.734	76%	0.763	S	S	*	*				54.7	137.8	94.4	-62.1	172.9	165.5	0	0	114.8
453	D	30.5	Very low	29.6	Very low	124 Å²	124	131 Å²	131	66%	0.663	76%	0.763	S	S	*	*			cis	-160.9	150.8	5.6	-119.2	-4.5	0	0	0	115.6
454	L	30	Very low	29.6	Very low	132 Å²	132	132 Å²	132	69%	0.691	77%	0.767	S	S	*	*			trans	50	101.3	141.1	-59.8	168.5	0	0	0	124.2
455	L	27.2	Very low	29.5	Very low	163 Å²	163	127.1 Å²	127.1	85%	0.853	76%	0.764	S	S	*	*				50.1	156.4	108.5	-68.3	178.9	0	0	0	123.5
456	P	41.9	Very low	29.4	Very low	107 Å²	107	128 Å²	128	70%	0.695	77%	0.773	S	S	*	*			trans	-118.7	-170.9	-145.8	44.9	-35.1	0	0	0	115
457	V	28.2	Very low	29.2	Very low	119 Å²	119	125.8 Å²	125.8	72%	0.721	77%	0.765	S	S	*	*			trans	174.7	140.3	131.2	147.3	0	0	0	0	112.9
458	N	26.8	Very low	29	Very low	163 Å²	163	129 Å²	129	87%	0.872	77%	0.765	S	S	*	*			trans	63.3	136.1	162.4	-68.3	-12.1	0	0	0	122.3
459	G	28.4	Very low	28.9	Very low	83 Å²	83	131.1 Å²	131.1	86%	0.856	76%	0.76	S	S	*	*			trans	163.8	115.1	163	0	0	0	0	0	112.2
460	S	25.9	Very low	28.7	Very low	110 Å²	110	129.2 Å²	129.2	77%	0.769	76%	0.757	S	S	*	*			trans	-115.5	157.2	-167.6	58.6	0	0	0	0	114.5
461	V	26.1	Very low	28.5	Very low	137 Å²	137	131.5 Å²	131.5	83%	0.83	76%	0.761	S	S	*	*			trans	76.1	113	161.8	-168.9	0	0	0	0	117.8
462	A	29.4	Very low	28.1	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	76%	0.763	S	S	*	*				179	147.7	111.6	0	0	0	0	0	112.3
463	E	24.5	Very low	28.1	Very low	179 Å²	179	133.6 Å²	133.6	84%	0.836	77%	0.769	S	S	*	*			trans	-69	172.2	165.7	-63.5	145.4	134.7	0	0	109.8
464	E	27.9	Very low	28	Very low	171 Å²	171	132.8 Å²	132.8	80%	0.799	77%	0.773	S	S	*	*			cis	-171.4	133.2	35.8	-161	173.5	-151.5	0	0	112.7
465	S	25.5	Very low	27.5	Very low	98 Å²	98	135 Å²	135	69%	0.685	79%	0.785	S	S	*	*			trans	58.7	152.5	147.8	81.8	0	0	0	0	125.7
466	L	26.8	Very low	27.3	Very low	147 Å²	147	133.1 Å²	133.1	77%	0.77	78%	0.781	S	S	*	*			trans	91.3	94.7	154.9	-68.2	161.2	0	0	0	121.4
467	T	27	Very low	26.5	Very low	110 Å²	110	136.6 Å²	136.6	68%	0.675	79%	0.787	S	S	*	*				41.7	137.5	118.3	61.3	0	0	0	0	119.9
468	D	25.1	Very low	26.2	Very low	140 Å²	140	143.4 Å²	143.4	75%	0.749	80%	0.8	S	S	*	*			cis	-169	171.4	16.4	-136.2	-29.1	0	0	0	114.2
469	I	28.8	Very low	26	Very low	147 Å²	147	141.2 Å²	141.2	75%	0.754	79%	0.793	S	S	*	*			trans	82.6	120.1	154.8	-64.9	156	0	0	0	121.8
470	A	27.3	Very low	25.8	Very low	87 Å²	87	144.6 Å²	144.6	72%	0.719	79%	0.79	S	S	*	*			trans	67.4	130.8	153.5	0	0	0	0	0	119.5
471	D	29.2	Very low	25.6	Very low	155 Å²	155	147 Å²	147	83%	0.829	79%	0.793	S	S	*	*				-155	165.8	51.8	-139.3	-21	0	0	0	116
472	N	24.6	Very low	25.5	Very low	140 Å²	140	145.7 Å²	145.7	75%	0.749	79%	0.788	S	S	*	*			trans	-71.8	146.7	-175.3	-78.6	-74.9	0	0	0	115.3
473	K	28.9	Very low	25.2	Very low	200 Å²	200	149.3 Å²	149.3	87%	0.87	79%	0.793	S	S	*	*				-172.1	148.8	128.2	-104.3	151.7	-170.9	170.6	0	116.6
474	S	27.9	Very low	25.2	Very low	107 Å²	107	145 Å²	145	75%	0.748	79%	0.789	S	S	*	*			trans	57.1	89.4	162.1	57.9	0	0	0	0	120
475	L	20.9	Very low	25	Very low	180 Å²	180	143.2 Å²	143.2	94%	0.942	79%	0.789	S	S	*	*			trans	-88.2	96.3	147.5	-85.1	162.8	0	0	0	109.7
476	T	22.5	Very low	24.9	Very low	123 Å²	123	146.9 Å²	146.9	76%	0.755	80%	0.795	S	S	*	*			trans	-159.6	92.6	164.4	46.3	0	0	0	0	111.1
477	E	24.8	Very low	24.8	Very low	180 Å²	180	148.1 Å²	148.1	84%	0.841	80%	0.797	S	S	*	*			trans	-170.4	116.2	140.8	-112.7	176.4	153.6	0	0	110.3
478	W	22.1	Very low	24.7	Very low	261 Å²	261	149.1 Å²	149.1	99%	0.989	81%	0.807	S	S	*	*			trans	-96.6	96.9	165.4	-80.9	93	0	0	0	107.7
479	T	23.6	Very low	24.7	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.724	80%	0.804	S	S	*	*			trans	-78.5	124.9	178.8	-48.2	0	0	0	0	110.4	L481	T479-L481 PolarHBondContact O-N 3.43Å
480	I	22.4	Very low	24.6	Very low	154 Å²	154	148 Å²	148	79%	0.79	81%	0.812	S	S	*	*			trans	-66.4	115.2	175.7	-63.4	167.2	0	0	0	108.9	P482	I480-P482 WeakPolarHBondContact O-CD 3.25Å
481	L	21.8	Very low	24.6	Very low	159 Å²	159	148.1 Å²	148.1	83%	0.832	81%	0.807	S	S	*	*			trans	-78.2	120.5	166.4	-96.8	157.9	0	0	0	109.1	T479 L483	T479-L481 PolarHBondContact O-N 3.43Å; L481-L483 PolarHBondContact O-N 2.96Å
482	P	24.1	Very low	24.4	Very low	110 Å²	110	148.6 Å²	148.6	71%	0.714	81%	0.81	S	S	*	*			trans	-75.2	116.7	172.5	30.1	-31.3	0	0	0	109.3	I480 A484	I480-P482 WeakPolarHBondContact O-CD 3.25Å; P482-A484 PolarHBondContact O-N 3.48Å
483	L	23.1	Very low	24.5	Very low	170 Å²	170	148.1 Å²	148.1	89%	0.89	82%	0.816	S	S	*	*			trans	-68.7	97.2	164.2	-82.1	164.3	0	0	0	108.5	L481 V485	L481-L483 PolarHBondContact O-N 2.96Å; L483-V485 PolarHBondContact O-N 3.02Å
484	A	24.9	Very low	24.3	Very low	89 Å²	89	150.7 Å²	150.7	74%	0.736	82%	0.82	S	S	*	*			trans	-66.4	114	165.2	0	0	0	0	0	108.4	P482 E486	P482-A484 PolarHBondContact O-N 3.48Å; A484-E486 PolarHBondContact O-N 3.16Å
485	V	24.3	Very low	24.4	Very low	132 Å²	132	150.2 Å²	150.2	80%	0.8	82%	0.817	S	S	*	*			trans	-80.1	98.2	168	178.7	0	0	0	0	106.9	L483	L483-V485 PolarHBondContact O-N 3.02Å
486	E	23.6	Very low	24.8	Very low	176 Å²	176	147.8 Å²	147.8	82%	0.822	81%	0.809	S	S	*	*			trans	-82.2	123	162.3	-76.7	-165.9	148.7	0	0	109.3	A484 C488	A484-E486 PolarHBondContact O-N 3.16Å; E486-C488 PolarHBondContact O-N 3.17Å; E486-C488 VanDerWaalsContact O-N 3.09Å
487	E	24	Very low	25	Very low	172 Å²	172	149 Å²	149	80%	0.804	81%	0.811	S	S	*	*			trans	-68.4	102.5	175.5	-64.4	179	137.8	0	0	109.8	T489	E487-T489 VanDerWaalsContact C-N 3.33Å; E487-T489 PolarHBondContact O-N 3.39Å
488	C	24.5	Very low	25.2	Very low	132 Å²	132	146.4 Å²	146.4	89%	0.892	81%	0.807	S	S	*	*			trans	-67.1	93.8	166.9	-79.4	0	0	0	0	110	E486	E486-C488 PolarHBondContact O-N 3.17Å; E486-C488 VanDerWaalsContact O-N 3.09Å
489	T	25.5	Very low	25.5	Very low	110 Å²	110	142.1 Å²	142.1	68%	0.675	80%	0.802	S	S	*	*			trans	-72.8	138.9	171	44.9	0	0	0	0	110.7	E487 S491	E487-T489 VanDerWaalsContact C-N 3.33Å; E487-T489 PolarHBondContact O-N 3.39Å; T489-S491 VanDerWaalsContact C-N 3.29Å; T489-S491 PolarHBondContact O-N 3.23Å
490	V	27.5	Very low	25.8	Very low	154 Å²	154	141.1 Å²	141.1	93%	0.933	79%	0.792	S	S	*	*	S	Bend	trans	-79.8	74.4	-174.4	-175	0	0	0	0	110.7
491	S	27.3	Very low	26.3	Very low	89 Å²	89	138.2 Å²	138.2	62%	0.622	79%	0.791	S	S	*	*			trans	-166.1	79.7	170.4	56.2	0	0	0	0	112.9	T489	T489-S491 VanDerWaalsContact C-N 3.29Å; T489-S491 PolarHBondContact O-N 3.23Å
492	D	25.1	Very low	27	Very low	165 Å²	165	135.1 Å²	135.1	88%	0.882	78%	0.782	S	S	*	*			trans	175.2	64.1	138.8	-90.5	-19.1	0	0	0	112.6
493	C	26.3	Very low	27.7	Very low	129 Å²	129	132.2 Å²	132.2	87%	0.872	77%	0.767	S	S	*	*			trans	-116.8	78	168.8	-64	0	0	0	0	110.2
494	R	25.3	Very low	28.9	Very low	255 Å²	255	126.2 Å²	126.2	96%	0.962	74%	0.74	S	S	*	*			trans	-116.8	58.9	167.9	-81.9	-169.3	173.1	-174.8	0.3	111.2
495	S	29.4	Very low	29.9	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	71%	0.712	S	S	*	*			trans	-133.5	121.3	162	51.4	0	0	0	0	108.3
496	V	28.9	Very low	30.9	Very low	130 Å²	130	118.4 Å²	118.4	79%	0.788	68%	0.683	S	S	*	*	S	Bend	trans	-64.2	157.9	166	-171.6	0	0	0	0	107.6
497	D	27.1	Very low	32.1	Very low	148 Å²	148	112.8 Å²	112.8	79%	0.791	67%	0.667	S	S	*	*	S	Bend	trans	92.6	26.6	178	-47.7	-30.3	0	0	0	118.4
498	V	28.6	Very low	33.1	Very low	126 Å²	126	108 Å²	108	76%	0.764	65%	0.646	S	S	*	*			trans	-137.8	79.2	158.3	-167.6	0	0	0	0	111.7
499	I	27.8	Very low	34	Very low	171 Å²	171	101.8 Å²	101.8	88%	0.877	60%	0.604	S	S	*	*			trans	-136.6	60.4	171.3	-43.7	176.9	0	0	0	109.9
500	D	31.1	Very low	35.1	Very low	96 Å²	96	99 Å²	99	51%	0.513	59%	0.593	S	S	.	*			trans	-154.5	28.2	170.1	-146	1.4	0	0	0	114.7	R74 C502	R74-D500 IonicContact CZ-OD1 2.71Å; R74-D500 IonicContact CZ-OD2 3.98Å; R74-D500 IonicContact NH1-OD2 3.69Å; R74-D500 PolarHBondContact NH1-OD2 2.84Å; R74-D500 IonicContact NH2-OD1 3.18Å; R74-D500 PolarHBondContact NH2-OD1 3.29Å; R74-D500 VanDerWaalsContact NH2-OD1 3.1Å; R74-D500 IonicContact NH2-OD2 3.83Å; R74-D500 PolarHBondContact NH2-OD2 2.89Å; D500-C502 PolarHBondContact O-N 2.96Å
501	A	32.3	Very low	36	Very low	94 Å²	94	96.4 Å²	96.4	78%	0.777	57%	0.57	S	S	*	*			trans	-93.7	74.4	163.4	0	0	0	0	0	109.1	A503	A501-A503 VanDerWaalsContact C-N 3.27Å; A501-A503 PolarHBondContact O-N 3.04Å
502	C	36.1	Very low	36.8	Very low	94 Å²	94	94.2 Å²	94.2	64%	0.635	56%	0.558	S	S	*	*			trans	-58.9	95.1	163	-81.5	0	0	0	0	108.5	D500 S504	D500-C502 PolarHBondContact O-N 2.96Å; C502-S504 PolarHBondContact O-N 3.41Å
503	A	38.3	Very low	37.7	Very low	49 Å²	49	89 Å²	89	41%	0.405	53%	0.534	S	S	.	.			trans	-55	107.1	170.7	0	0	0	0	0	107.5	A501 L508	A501-A503 VanDerWaalsContact C-N 3.27Å; A501-A503 PolarHBondContact O-N 3.04Å; A503-L508 HydrophobicContact CB-CD1 3.72Å; A503-L508 HydrophobicContact CB-CG 4.11Å
504	S	49.9	Very low	38.7	Very low	44 Å²	44	87 Å²	87	31%	0.308	52%	0.522	S	S	.	.			trans	-52.5	138.6	-178.6	174.3	0	0	0	0	108.9	C502 V506 A507 L508	C502-S504 PolarHBondContact O-N 3.41Å; S504-V506 PolarHBondContact O-N 3.33Å; S504-V506 PolarHBondContact OG-N 3.28Å; S504-A507 WeakPolarHBondContact O-CA 3.45Å; S504-A507 WeakPolarHBondContact O-CB 3.41Å; S504-A507 PolarHBondContact O-N 3.28Å; S504-L508 PolarHBondContact O-N 2.76Å; S504-L508 VanDerWaalsContact O-N 3.15Å
505	P	44.2	Very low	39.4	Very low	25 Å²	25	82 Å²	82	16%	0.162	51%	0.507	C	S	.	.	H	α-helix	trans	-53.4	-27.7	174	-24.7	32.1	0	0	0	112.3	L127 A509	L127-P505 HydrophobicContact CD1-CB 3.61Å; L127-P505 HydrophobicContact CD1-CG 4.28Å; P505-A509 WeakPolarHBondContact O-CB 3.4Å; P505-A509 PolarHBondContact O-N 3.05Å
506	V	46.7	Very low	39.9	Very low	32 Å²	32	81.7 Å²	81.7	19%	0.194	50%	0.498	C	S	.	.	H	α-helix	trans	-64.5	-40.3	172.4	-174	0	0	0	0	112.5	A104 M219 L224 S504 A510	A104-V506 HydrophobicContact CB-CG2 4.03Å; M219-V506 WeakPolarHBondContact O-CG1 3.48Å; L224-V506 HydrophobicContact CD1-CB 4.31Å; L224-V506 HydrophobicContact CD1-CG2 3.94Å; S504-V506 PolarHBondContact O-N 3.33Å; S504-V506 PolarHBondContact OG-N 3.28Å; V506-A510 VanDerWaalsContact O-CB 3.25Å; V506-A510 WeakPolarHBondContact O-CB 3.25Å; V506-A510 PolarHBondContact O-N 2.97Å
507	A	48.4	Very low	40.1	Very low	57 Å²	57	80 Å²	80	47%	0.471	49%	0.491	S	S	.	.	H	α-helix	trans	-71.4	-46	179.6	0	0	0	0	0	111.6	S504 A510 E511	S504-A507 WeakPolarHBondContact O-CA 3.45Å; S504-A507 WeakPolarHBondContact O-CB 3.41Å; S504-A507 PolarHBondContact O-N 3.28Å; A507-A510 WeakPolarHBondContact O-CB 3.45Å; A507-A510 PolarHBondContact O-N 3.44Å; A507-E511 PolarHBondContact O-N 3.37Å
508	L	45.6	Very low	40.4	Very low	71 Å²	71	79.6 Å²	79.6	37%	0.372	49%	0.494	S	S	.	.	H	α-helix	trans	-64.6	-40.2	175.6	-83.3	159.5	0	0	0	112.2	C124 A503 S504 A510 E511 A512	C124-L508 HydrophobicContact CB-CD1 3.82Å; A503-L508 HydrophobicContact CB-CD1 3.72Å; A503-L508 HydrophobicContact CB-CG 4.11Å; S504-L508 PolarHBondContact O-N 2.76Å; S504-L508 VanDerWaalsContact O-N 3.15Å; L508-A510 VanDerWaalsContact C-N 3.35Å; L508-E511 PolarHBondContact O-N 3.12Å; L508-A512 PolarHBondContact O-N 3.22Å
509	A	43	Very low	40.8	Very low	2 Å²	2	78.9 Å²	78.9	2%	0.017	50%	0.495	C	S	.	.	H	α-helix	trans	-67.9	-32.3	174.1	0	0	0	0	0	112.9	L224 P505 S513	L224-A509 HydrophobicContact CD1-CB 4.1Å; L224-A509 HydrophobicContact CD2-CB 4.3Å; L224-A509 HydrophobicContact CG-CB 4.22Å; P505-A509 WeakPolarHBondContact O-CB 3.4Å; P505-A509 PolarHBondContact O-N 3.05Å; A509-S513 WeakPolarHBondContact O-CB 3.28Å; A509-S513 PolarHBondContact O-N 3.09Å; A509-S513 VanDerWaalsContact O-N 3.07Å; A509-S513 PolarHBondContact O-OG 3.28Å
510	A	48.4	Very low	41.6	Very low	52 Å²	52	72.3 Å²	72.3	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-67.8	-39.4	172	0	0	0	0	0	111.8	V506 A507 L508 S513 S514	V506-A510 VanDerWaalsContact O-CB 3.25Å; V506-A510 WeakPolarHBondContact O-CB 3.25Å; V506-A510 PolarHBondContact O-N 2.97Å; A507-A510 WeakPolarHBondContact O-CB 3.45Å; A507-A510 PolarHBondContact O-N 3.44Å; L508-A510 VanDerWaalsContact C-N 3.35Å; A510-S513 WeakPolarHBondContact O-CB 3.45Å; A510-S513 PolarHBondContact O-N 3.39Å; A510-S514 PolarHBondContact O-N 3.22Å
511	E	45.4	Very low	42.7	Very low	99 Å²	99	74.2 Å²	74.2	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-67.9	-40	175.4	-159.6	-167.4	146.8	0	0	112.3	A507 L508 S513 S514 K515	A507-E511 PolarHBondContact O-N 3.37Å; L508-E511 PolarHBondContact O-N 3.12Å; E511-S513 VanDerWaalsContact C-N 3.26Å; E511-S513 PolarHBondContact O-N 2.9Å; E511-S514 PolarHBondContact O-N 2.9Å; E511-S514 PolarHBondContact O-OG 3.26Å; E511-K515 WeakPolarHBondContact OE1-CE 3.27Å; E511-K515 IonicContact OE1-NZ 3.4Å; E511-K515 PolarHBondContact OE1-NZ 3.38Å
512	A	44	Very low	44.1	Very low	44 Å²	44	72.1 Å²	72.1	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-60.5	-37.4	171.8	0	0	0	0	0	111.9	L508 S514 K515	L508-A512 PolarHBondContact O-N 3.22Å; A512-S514 VanDerWaalsContact C-N 3.29Å; A512-S514 PolarHBondContact O-N 3.38Å; A512-K515 PolarHBondContact O-N 2.83Å
513	S	44.3	Very low	45.4	Very low	54 Å²	54	67.8 Å²	67.8	38%	0.378	42%	0.422	S	S	.	.	H	α-helix	trans	-67.7	-24.8	178.2	-58.3	0	0	0	0	113.6	A509 A510 E511	A509-S513 WeakPolarHBondContact O-CB 3.28Å; A509-S513 PolarHBondContact O-N 3.09Å; A509-S513 VanDerWaalsContact O-N 3.07Å; A509-S513 PolarHBondContact O-OG 3.28Å; A510-S513 WeakPolarHBondContact O-CB 3.45Å; A510-S513 PolarHBondContact O-N 3.39Å; E511-S513 VanDerWaalsContact C-N 3.26Å; E511-S513 PolarHBondContact O-N 2.9Å
514	S	47	Very low	47	Very low	89 Å²	89	70.6 Å²	70.6	62%	0.622	43%	0.425	S	S	*	.	H	α-helix	trans	-80.6	-14.2	-178.7	73.7	0	0	0	0	114.1	A510 E511 A512	A510-S514 PolarHBondContact O-N 3.22Å; E511-S514 PolarHBondContact O-N 2.9Å; E511-S514 PolarHBondContact O-OG 3.26Å; A512-S514 VanDerWaalsContact C-N 3.29Å; A512-S514 PolarHBondContact O-N 3.38Å
515	K	41.7	Very low	48	Very low	148 Å²	148	68.7 Å²	68.7	64%	0.643	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	0.3	-171.7	-65.3	178.3	-173.6	171.5	0	115	E511 A512	E511-K515 WeakPolarHBondContact OE1-CE 3.27Å; E511-K515 IonicContact OE1-NZ 3.4Å; E511-K515 PolarHBondContact OE1-NZ 3.38Å; A512-K515 PolarHBondContact O-N 2.83Å
516	L	39.5	Very low	49.4	Very low	91 Å²	91	70 Å²	70	48%	0.476	42%	0.417	S	S	.	.	S	Bend	trans	-97.1	126.7	179.5	-75.1	164.8	0	0	0	112.1	I135 V518	I135-L516 HydrophobicContact CD1-CD1 4.09Å; I135-L516 HydrophobicContact CG2-CD1 4.32Å; L516-V518 PolarHBondContact O-N 2.83Å
517	S	33.5	Very low	50.6	Low	94 Å²	94	72.2 Å²	72.2	66%	0.657	43%	0.425	S	S	*	.			trans	-85.4	115	-161.1	57.5	0	0	0	0	115.9	S519	S517-S519 PolarHBondContact O-N 3.25Å; S517-S519 PolarHBondContact O-OG 2.98Å
518	V	32.7	Very low	51.7	Low	140 Å²	140	69.5 Å²	69.5	85%	0.848	40%	0.403	S	S	*	.	S	Bend	trans	50.7	-15.9	138.2	-165.4	0	0	0	0	120.9	L516	L516-V518 PolarHBondContact O-N 2.83Å
519	S	37.5	Very low	52.9	Low	111 Å²	111	70.5 Å²	70.5	78%	0.776	41%	0.406	S	S	*	.	S	Bend	trans	-93.5	-0.8	177	62.7	0	0	0	0	113.9	S517	S517-S519 PolarHBondContact O-N 3.25Å; S517-S519 PolarHBondContact O-OG 2.98Å
520	S	44.6	Very low	54.4	Low	33 Å²	33	76.1 Å²	76.1	23%	0.231	43%	0.432	C	S	.	.			trans	-119.9	38.4	-164.2	63.6	0	0	0	0	114.4
521	L	53.7	Low	55.4	Low	136 Å²	136	74.5 Å²	74.5	71%	0.712	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-59.3	129.2	171.2	-85.8	157.6	0	0	0	109.9	R146	R146-L521 PolarHBondContact NH1-O 2.9Å; R146-L521 PolarHBondContact NH2-O 3.32Å
522	P	60.9	Low	56.5	Low	50 Å²	50	70.6 Å²	70.6	33%	0.325	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-62.7	147.2	174.5	27.1	-33.6	0	0	0	109.9	V186 K524	V186-P522 HydrophobicContact CG1-CB 4.22Å; P522-K524 PolarHBondContact O-N 2.99Å
523	L	63.5	Low	57.4	Low	2 Å²	2	71.6 Å²	71.6	1%	0.01	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-62.5	132.1	177.7	-79.1	165.8	0	0	0	110.3	W141 C142 L145 R146 E527 I528 I531	W141-L523 HydrophobicContact CZ3-CD1 4.05Å; C142-L523 HydrophobicContact CB-CD1 4.16Å; C142-L523 HydrophobicContact CB-CG 4.46Å; L145-L523 HydrophobicContact CB-CD1 4.09Å; L145-L523 HydrophobicContact CD1-CD1 4.06Å; R146-L523 HydrophobicContact CG-CD2 3.84Å; L523-E527 WeakPolarHBondContact CA-OE2 3.36Å; L523-E527 HydrophobicContact CD2-CB 4.07Å; L523-E527 WeakPolarHBondContact CD2-OE2 3.26Å; L523-I528 HydrophobicContact CB-CD1 3.86Å; L523-I528 HydrophobicContact CB-CG1 3.77Å; L523-I528 HydrophobicContact CD1-CG1 4.22Å; L523-I531 HydrophobicContact CD2-CD1 3.98Å
524	K	72.2	Confident	57.9	Low	108 Å²	108	73 Å²	73	47%	0.47	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-69.1	151.4	171.1	-67.5	-172.9	176.2	-171.5	0	110.3	P522 N526 E527 I528	P522-K524 PolarHBondContact O-N 2.99Å; K524-N526 PolarHBondContact O-N 3.33Å; K524-N526 VanDerWaalsContact O-N 3.09Å; K524-E527 HydrophobicContact CB-CB 4.4Å; K524-E527 HydrophobicContact CB-CG 4.01Å; K524-E527 PolarHBondContact N-OE2 2.93Å; K524-E527 WeakPolarHBondContact O-CB 3.46Å; K524-E527 PolarHBondContact O-N 3.17Å; K524-I528 WeakPolarHBondContact O-CG1 3.43Å; K524-I528 PolarHBondContact O-N 3.17Å
525	L	72.1	Confident	57.7	Low	4 Å²	4	73.8 Å²	73.8	2%	0.021	42%	0.416	C	S	.	.	H	α-helix	trans	-61.4	-24.1	-178.6	-155.7	68.4	0	0	0	113.2	R162 I166 F189 Q529	R162-L525 HydrophobicContact CG-CD1 4.02Å; R162-L525 HydrophobicContact CG-CD2 4.46Å; R162-L525 HydrophobicContact CG-CG 4.16Å; R162-L525 PolarHBondContact NE-O 3.06Å; R162-L525 VanDerWaalsContact NE-O 3.12Å; I166-L525 HydrophobicContact CG2-CD2 3.66Å; F189-L525 HydrophobicContact CB-CD1 4.29Å; F189-L525 HydrophobicContact CD2-CD1 3.88Å; F189-L525 HydrophobicContact CG-CD1 4.08Å; L525-Q529 PolarHBondContact O-N 3.47Å
526	N	72.1	Confident	57.4	Low	53 Å²	53	73.3 Å²	73.3	28%	0.283	42%	0.42	S	S	.	.	H	α-helix	trans	-85	-34.3	173.7	-74	-7.3	0	0	0	113.5	R162 E180 K524 I528 Q529 E530	R162-N526 PolarHBondContact NH2-OD1 3.09Å; E180-N526 PolarHBondContact OE1-ND2 3.41Å; E180-N526 PolarHBondContact OE2-ND2 3.03Å; K524-N526 PolarHBondContact O-N 3.33Å; K524-N526 VanDerWaalsContact O-N 3.09Å; N526-I528 PolarHBondContact O-N 3.16Å; N526-Q529 WeakPolarHBondContact O-CB 3.3Å; N526-Q529 PolarHBondContact O-N 3.47Å; N526-Q529 VanDerWaalsContact O-N 3.07Å; N526-E530 PolarHBondContact O-N 3.39Å
527	E	72.5	Confident	57.1	Low	78 Å²	78	73.7 Å²	73.7	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-58.5	-39.5	168.9	-68.2	171.6	170.5	0	0	110.5	L523 K524 E530 I531	L523-E527 WeakPolarHBondContact CA-OE2 3.36Å; L523-E527 HydrophobicContact CD2-CB 4.07Å; L523-E527 WeakPolarHBondContact CD2-OE2 3.26Å; K524-E527 HydrophobicContact CB-CB 4.4Å; K524-E527 HydrophobicContact CB-CG 4.01Å; K524-E527 PolarHBondContact N-OE2 2.93Å; K524-E527 WeakPolarHBondContact O-CB 3.46Å; K524-E527 PolarHBondContact O-N 3.17Å; E527-E530 PolarHBondContact O-N 3.3Å; E527-I531 WeakPolarHBondContact O-CD1 3.44Å; E527-I531 VanDerWaalsContact O-CG1 3.24Å; E527-I531 WeakPolarHBondContact O-CG1 3.46Å; E527-I531 PolarHBondContact O-N 2.98Å
528	I	70.8	Confident	56.9	Low	0 Å²	0	75.8 Å²	75.8	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-64.4	-39.8	174.9	-66.1	157.9	0	0	0	111.4	I158 F189 L523 K524 N526 C532	I158-I528 HydrophobicContact CG2-CG2 3.37Å; F189-I528 HydrophobicContact CD1-CD1 3.75Å; F189-I528 HydrophobicContact CE1-CD1 3.41Å; F189-I528 VanDerWaalsContact CE1-CD1 3.41Å; F189-I528 HydrophobicContact CE1-CG1 4.4Å; F189-I528 HydrophobicContact CE2-CD1 4.43Å; F189-I528 HydrophobicContact CE2-CG2 4.41Å; F189-I528 HydrophobicContact CG-CD1 4.42Å; F189-I528 HydrophobicContact CZ-CD1 3.81Å; F189-I528 HydrophobicContact CZ-CG2 4.03Å; L523-I528 HydrophobicContact CB-CD1 3.86Å; L523-I528 HydrophobicContact CB-CG1 3.77Å; L523-I528 HydrophobicContact CD1-CG1 4.22Å; K524-I528 WeakPolarHBondContact O-CG1 3.43Å; K524-I528 PolarHBondContact O-N 3.17Å; N526-I528 PolarHBondContact O-N 3.16Å; I528-C532 WeakPolarHBondContact O-CB 3.37Å; I528-C532 PolarHBondContact O-N 2.7Å
529	Q	71.2	Confident	56.8	Low	93 Å²	93	77.3 Å²	77.3	44%	0.435	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-50	172.9	-177	169.2	-24.9	0	0	111.2	R162 L525 N526 I531 C532 A533	R162-Q529 VanDerWaalsContact NH1-CD 3.35Å; L525-Q529 PolarHBondContact O-N 3.47Å; N526-Q529 WeakPolarHBondContact O-CB 3.3Å; N526-Q529 PolarHBondContact O-N 3.47Å; N526-Q529 VanDerWaalsContact O-N 3.07Å; Q529-I531 VanDerWaalsContact C-N 3.34Å; Q529-I531 PolarHBondContact O-N 3.41Å; Q529-C532 CarbonylContact O-C 3.59Å; Q529-C532 PolarHBondContact O-N 3.35Å; Q529-A533 WeakPolarHBondContact O-CB 3.29Å; Q529-A533 PolarHBondContact O-N 2.98Å
530	E	74.8	Confident	56.4	Low	120 Å²	120	78.4 Å²	78.4	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-62.9	-38.8	-178.6	-71.4	-174.5	-169.8	0	0	113	N526 E527	N526-E530 PolarHBondContact O-N 3.39Å; E527-E530 PolarHBondContact O-N 3.3Å
531	I	70	Confident	55.6	Low	17 Å²	17	82.5 Å²	82.5	9%	0.087	46%	0.463	C	S	.	.	H	α-helix	trans	-63.6	-45	176.3	-70.3	163	0	0	0	110.3	L145 V150 L523 E527 Q529	L145-I531 HydrophobicContact CB-CD1 4.34Å; L145-I531 HydrophobicContact CB-CG2 4.27Å; L145-I531 VanDerWaalsContact O-CG2 3.31Å; L145-I531 WeakPolarHBondContact O-CG2 3.42Å; V150-I531 HydrophobicContact CG2-CG2 4.26Å; L523-I531 HydrophobicContact CD2-CD1 3.98Å; E527-I531 WeakPolarHBondContact O-CD1 3.44Å; E527-I531 VanDerWaalsContact O-CG1 3.24Å; E527-I531 WeakPolarHBondContact O-CG1 3.46Å; E527-I531 PolarHBondContact O-N 2.98Å; Q529-I531 VanDerWaalsContact C-N 3.34Å; Q529-I531 PolarHBondContact O-N 3.41Å
532	C	67	Low	54.2	Low	17 Å²	17	82.1 Å²	82.1	12%	0.115	47%	0.47	C	S	.	.	H	α-helix	trans	-89.3	-3	-175.3	-64.9	0	0	0	0	114.9	I158 I528 Q529	I158-C532 VanDerWaalsContact CG2-SG 3.54Å; I528-C532 WeakPolarHBondContact O-CB 3.37Å; I528-C532 PolarHBondContact O-N 2.7Å; Q529-C532 CarbonylContact O-C 3.59Å; Q529-C532 PolarHBondContact O-N 3.35Å
533	A	64.5	Low	52.6	Low	65 Å²	65	86.2 Å²	86.2	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-93.1	-12.3	177.8	0	0	0	0	0	114	Q529 P535	Q529-A533 WeakPolarHBondContact O-CB 3.29Å; Q529-A533 PolarHBondContact O-N 2.98Å; A533-P535 VanDerWaalsContact O-CD 3.28Å; A533-P535 WeakPolarHBondContact O-CD 3.38Å
534	V	55	Low	51	Low	83 Å²	83	94.1 Å²	94.1	50%	0.503	54%	0.536	S	S	.	.	S	Bend	trans	-71.4	117.4	177.1	-179.4	0	0	0	0	109.3
535	P	41.8	Very low	48.7	Very low	106 Å²	106	95.6 Å²	95.6	69%	0.688	55%	0.554	S	S	*	*			trans	-63	139.9	168.7	-14.4	29.5	0	0	0	108.5	A533 S537	A533-P535 VanDerWaalsContact O-CD 3.28Å; A533-P535 WeakPolarHBondContact O-CD 3.38Å; P535-S537 PolarHBondContact O-N 3.25Å
536	L	36.3	Very low	46.6	Very low	139 Å²	139	99.3 Å²	99.3	73%	0.728	59%	0.593	S	S	*	*			trans	-66	79.6	170.9	-74.3	168.3	0	0	0	109.7	T538	L536-T538 PolarHBondContact O-N 3.2Å; L536-T538 VanDerWaalsContact O-N 3.11Å
537	S	31.5	Very low	44.4	Very low	99 Å²	99	102.2 Å²	102.2	69%	0.692	62%	0.618	S	S	*	*			trans	-62.4	114.5	174	60.3	0	0	0	0	108.2	P535 H539	P535-S537 PolarHBondContact O-N 3.25Å; S537-H539 PolarHBondContact O-N 3.47Å; S537-H539 VanDerWaalsContact O-N 3.11Å
538	T	29.8	Very low	42.3	Very low	137 Å²	137	103.5 Å²	103.5	84%	0.84	64%	0.635	S	S	*	*			trans	-45.2	114.3	-176.5	48.8	0	0	0	0	112.1	L536 N540	L536-T538 PolarHBondContact O-N 3.2Å; L536-T538 VanDerWaalsContact O-N 3.11Å; T538-N540 PolarHBondContact O-N 2.9Å
539	H	31	Very low	40.4	Very low	173 Å²	173	112 Å²	112	80%	0.801	68%	0.675	S	S	*	*			trans	-69.1	106.1	172.3	-113.1	-73.4	0	0	0	109.9	S537	S537-H539 PolarHBondContact O-N 3.47Å; S537-H539 VanDerWaalsContact O-N 3.11Å
540	N	29.4	Very low	38.3	Very low	133 Å²	133	116.3 Å²	116.3	71%	0.711	70%	0.695	S	S	*	*			trans	40.4	99.9	153	-59	-17.5	0	0	0	117.8	T538 C542	T538-N540 PolarHBondContact O-N 2.9Å; N540-C542 PolarHBondContact O-N 3.03Å
541	S	27.4	Very low	36.4	Very low	120 Å²	120	115.2 Å²	115.2	84%	0.839	70%	0.699	S	S	*	*			trans	-53.6	125.2	151.9	-63.4	0	0	0	0	110.3	T543	S541-T543 PolarHBondContact O-N 2.74Å
542	C	24	Very low	34.3	Very low	127 Å²	127	118.9 Å²	118.9	86%	0.858	73%	0.726	S	S	*	*			trans	-60.6	116.9	171.8	-65.3	0	0	0	0	111.2	N540	N540-C542 PolarHBondContact O-N 3.03Å
543	T	27.8	Very low	32.6	Very low	137 Å²	137	128.5 Å²	128.5	84%	0.84	76%	0.76	S	S	*	*			trans	-115.3	108.7	154.5	38.1	0	0	0	0	109.1	S541	S541-T543 PolarHBondContact O-N 2.74Å
544	L	29	Very low	31	Very low	167 Å²	167	132.3 Å²	132.3	87%	0.874	77%	0.766	S	S	*	*			trans	-68.9	150.4	175.1	-83.4	160.9	0	0	0	111
545	T	24.9	Very low	29.8	Very low	140 Å²	140	138.1 Å²	138.1	86%	0.859	78%	0.779	S	S	*	*			trans	-59.4	136.3	-173.5	49.2	0	0	0	0	114.8
546	G	28.7	Very low	29.3	Very low	82 Å²	82	137.7 Å²	137.7	85%	0.845	78%	0.778	S	S	*	*			trans	-143.6	112.3	160.6	0	0	0	0	0	109.7
547	S	25.9	Very low	28.8	Very low	114 Å²	114	136.6 Å²	136.6	80%	0.797	78%	0.781	S	S	*	*			trans	-107.7	135.2	-164.3	51.9	0	0	0	0	114.4
548	S	28.2	Very low	28.6	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	79%	0.791	S	S	*	*			trans	-179	137.6	133.3	57.1	0	0	0	0	114.8
549	E	29.3	Very low	29.2	Very low	178 Å²	178	141.6 Å²	141.6	83%	0.832	78%	0.783	S	S	*	*			trans	64.3	103.3	148.5	-63.9	174.9	176.7	0	0	120.5
550	Q	28.2	Very low	29.3	Very low	184 Å²	184	139.6 Å²	139.6	86%	0.86	78%	0.778	S	S	*	*				78.8	147.2	78.1	-78.9	-93.2	-38.9	0	0	115.3
551	P	33.7	Very low	29.4	Very low	98 Å²	98	139.3 Å²	139.3	64%	0.636	78%	0.777	S	S	*	*				-140.5	-161.1	-119.4	44.6	-26.5	0	0	0	117
552	S	27.3	Very low	29.6	Very low	94 Å²	94	140.6 Å²	140.6	66%	0.657	77%	0.773	S	S	*	*			trans	87	139.7	169.7	89	0	0	0	0	114.3
553	R	30	Very low	30	Very low	219 Å²	219	141.9 Å²	141.9	83%	0.826	77%	0.766	S	S	*	*			cis	-151	176.6	20.9	-51	172.4	-172.7	-171.4	0.8	108.7
554	H	32.5	Very low	30.2	Very low	144 Å²	144	142.7 Å²	142.7	67%	0.667	77%	0.766	S	S	*	*			cis	-161.3	-165.2	4.3	-141.5	25.9	0	0	0	115
555	R	30	Very low	30.3	Very low	206 Å²	206	138 Å²	138	78%	0.777	76%	0.757	S	S	*	*			trans	-34.8	165.9	167.1	-66.9	173.4	-172.6	-162.6	-0.7	119.4
556	S	29.8	Very low	30.5	Very low	97 Å²	97	138 Å²	138	68%	0.678	76%	0.762	S	S	*	*			cis	178.2	149.3	-25	58.2	0	0	0	0	110.7
557	C	25.8	Very low	30.6	Very low	116 Å²	116	137.9 Å²	137.9	78%	0.784	75%	0.752	S	S	*	*			trans	11	149.4	146.9	-56.4	0	0	0	0	121.1
558	R	28.5	Very low	31	Very low	237 Å²	237	139.8 Å²	139.8	89%	0.894	75%	0.753	S	S	*	*			cis	-168.6	-171.1	4.8	-115.6	-162.9	-178.5	-166.1	1.7	109.5
559	P	42.6	Very low	31.1	Very low	104 Å²	104	142.4 Å²	142.4	68%	0.675	75%	0.754	S	S	*	*			trans	-121.8	-153.9	-148.7	40.8	-22.2	0	0	0	117.4
560	N	33.1	Very low	31.2	Very low	131 Å²	131	140.1 Å²	140.1	70%	0.701	75%	0.747	S	S	*	*			trans	94.6	146.4	174	-66.7	41.1	0	0	0	116
561	D	30.1	Very low	31.2	Very low	127 Å²	127	137.1 Å²	137.1	68%	0.679	74%	0.742	S	S	*	*			cis	-166.2	175.7	0.5	-115.8	-28.5	0	0	0	113.1
562	L	32.2	Very low	31	Very low	147 Å²	147	142.6 Å²	142.6	77%	0.77	76%	0.755	S	S	*	*			trans	74.8	157.1	160.1	-59.6	132.3	0	0	0	120.7
563	Q	32.3	Very low	31	Very low	153 Å²	153	144.4 Å²	144.4	72%	0.715	76%	0.762	S	S	*	*			cis	-172.6	169.4	-40	-141.2	173.6	20.8	0	0	110.9
564	N	32.9	Very low	31	Very low	155 Å²	155	144.3 Å²	144.3	83%	0.829	77%	0.768	S	S	*	*			trans	80.7	143.9	168.4	-49.8	-33.7	0	0	0	118.9
565	G	30.2	Very low	30.7	Very low	67 Å²	67	142.3 Å²	142.3	69%	0.691	77%	0.77	S	S	*	*			cis	168.7	158.6	-10	0	0	0	0	0	114.9
566	C	29.9	Very low	30.7	Very low	141 Å²	141	142.8 Å²	142.8	95%	0.953	77%	0.772	S	S	*	*			trans	63.8	158.1	164.9	-68.6	0	0	0	0	120.8
567	A	30.8	Very low	30.7	Very low	79 Å²	79	147.6 Å²	147.6	65%	0.653	78%	0.775	S	S	*	*			cis	-173.7	179.6	-22.1	0	0	0	0	0	111
568	L	34.2	Very low	30.8	Very low	155 Å²	155	148 Å²	148	81%	0.812	77%	0.774	S	S	*	*			trans	72.9	158.3	174	-77.1	93.2	0	0	0	119.3
569	E	30	Very low	30.7	Very low	159 Å²	159	141.2 Å²	141.2	74%	0.743	76%	0.763	S	S	*	*			cis	-170.8	165.6	-43.6	-132.9	168.2	-173.5	0	0	110.2
570	D	30.1	Very low	30	Very low	129 Å²	129	141.6 Å²	141.6	69%	0.69	76%	0.764	S	S	*	*			trans	75	105.1	152.3	-95.4	-31.2	0	0	0	126.7
571	T	28.5	Very low	29.5	Very low	121 Å²	121	141.1 Å²	141.1	74%	0.742	77%	0.766	S	S	*	*				44.7	126	125.5	57.8	0	0	0	0	124.7
572	K	31.1	Very low	29.4	Very low	213 Å²	213	140.7 Å²	140.7	93%	0.926	77%	0.768	S	S	*	*				-160.1	146.1	123.6	-122.5	164	-171.4	159.9	0	116.5
573	V	25.9	Very low	29	Very low	133 Å²	133	140.6 Å²	140.6	81%	0.806	77%	0.768	S	S	*	*			trans	-96.7	146.5	-175.8	170.6	0	0	0	0	112.3
574	K	31.4	Very low	28.6	Very low	216 Å²	216	138.5 Å²	138.5	94%	0.939	77%	0.769	S	S	*	*			trans	-153.3	151.6	143.1	-120.8	171.2	-173.9	176.7	0	113.6
575	S	25.7	Very low	28.1	Very low	102 Å²	102	136.5 Å²	136.5	71%	0.713	77%	0.767	S	S	*	*			trans	-134.3	149.7	-165.8	155	0	0	0	0	111.4
576	R	30	Very low	27.9	Very low	216 Å²	216	138 Å²	138	82%	0.815	77%	0.774	S	S	*	*			trans	152	149.4	154.1	-91.6	172.9	178.4	-169.4	-0.3	108.9
577	R	29.4	Very low	27.5	Very low	198 Å²	198	138.1 Å²	138.1	75%	0.747	77%	0.77	S	S	*	*			cis	166.7	139.7	-12.3	-120.8	-169.7	-177.5	178.3	-2.3	103.5
578	T	27.4	Very low	27.2	Very low	125 Å²	125	138.7 Å²	138.7	77%	0.767	77%	0.774	S	S	*	*			trans	54	142.8	148.6	56.6	0	0	0	0	120.2
579	S	26.1	Very low	26.8	Very low	94 Å²	94	136.3 Å²	136.3	66%	0.657	78%	0.777	S	S	*	*			cis	-176	170.2	-1.8	45.9	0	0	0	0	110.5
580	T	28.1	Very low	26.5	Very low	113 Å²	113	132.8 Å²	132.8	69%	0.693	78%	0.775	S	S	*	*			trans	66.3	114.1	149.6	36.6	0	0	0	0	121.4
581	T	24.1	Very low	26.4	Very low	121 Å²	121	134.3 Å²	134.3	74%	0.742	78%	0.783	S	S	*	*				40.9	133	126	63.5	0	0	0	0	119.3
582	T	27.5	Very low	26.1	Very low	117 Å²	117	134.5 Å²	134.5	72%	0.718	78%	0.784	S	S	*	*			cis	-169.7	151.7	45.1	35.2	0	0	0	0	112.5
583	N	24.2	Very low	26	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	78%	0.779	S	S	*	*			trans	58.2	133.1	141.3	-65.7	9.4	0	0	0	125
584	C	23	Very low	26	Very low	110 Å²	110	132.6 Å²	132.6	74%	0.743	78%	0.778	S	S	*	*			trans	78.1	99.3	142.9	-63.9	0	0	0	0	122.5
585	S	22.1	Very low	25.6	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	77%	0.77	S	S	*	*				49	113.3	125.4	62.7	0	0	0	0	122
586	A	25.5	Very low	25.6	Very low	100 Å²	100	126.4 Å²	126.4	83%	0.826	77%	0.774	S	S	*	*				-179.5	150.8	113.8	0	0	0	0	0	113.9
587	T	23.3	Very low	25.2	Very low	143 Å²	143	125.9 Å²	125.9	88%	0.877	78%	0.778	S	S	*	*			trans	-35.1	160.8	166.1	-5.9	0	0	0	0	116.3
588	A	23.6	Very low	25	Very low	90 Å²	90	120.4 Å²	120.4	74%	0.744	77%	0.769	S	S	*	*			cis	-164.4	176.1	18.1	0	0	0	0	0	113.2
589	A	25.7	Very low	24.8	Very low	106 Å²	106	122.7 Å²	122.7	88%	0.876	77%	0.771	S	S	*	*			trans	136.1	129.7	139.5	0	0	0	0	0	117.7
590	A	23.2	Very low	24.6	Very low	84 Å²	84	123 Å²	123	69%	0.694	77%	0.773	S	S	*	*			trans	-53.2	156.2	-175	0	0	0	0	0	120.5
591	N	28.9	Very low	24.5	Very low	162 Å²	162	126.3 Å²	126.3	87%	0.866	78%	0.78	S	S	*	*				-175.2	165.8	104.2	-99.6	-37.9	0	0	0	116.3
592	V	22.4	Very low	24.4	Very low	124 Å²	124	124.2 Å²	124.2	75%	0.752	78%	0.782	S	S	*	*			trans	-74.4	153.4	-173.3	174.3	0	0	0	0	114.1
593	I	28.9	Very low	24.4	Very low	159 Å²	159	125.4 Å²	125.4	82%	0.815	79%	0.789	S	S	*	*			trans	176.6	117.6	133.6	-90.1	155.4	0	0	0	113.3
594	D	25.8	Very low	24.3	Very low	148 Å²	148	125.9 Å²	125.9	79%	0.791	79%	0.792	S	S	*	*			trans	58	175.7	138.8	-138.7	-11.5	0	0	0	123.1
595	S	23.5	Very low	24.5	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	80%	0.797	S	S	*	*			trans	-119.4	159.2	-145.3	56.3	0	0	0	0	115.1
596	G	24.7	Very low	24.6	Very low	77 Å²	77	127.8 Å²	127.8	79%	0.794	80%	0.796	S	S	*	*			trans	160.2	88.5	169	0	0	0	0	0	119.4
597	F	22.8	Very low	24.7	Very low	205 Å²	205	128.9 Å²	128.9	90%	0.899	79%	0.792	S	S	*	*			trans	42.9	145.3	136.2	-135.6	-110.6	0	0	0	125.4
598	C	24	Very low	24.9	Very low	84 Å²	84	126.8 Å²	126.8	57%	0.568	78%	0.776	S	S	*	*			trans	81.2	107.8	159.9	-95.5	0	0	0	0	123.6
599	E	22.6	Very low	25.3	Very low	173 Å²	173	126.3 Å²	126.3	81%	0.808	76%	0.76	S	S	*	*				40.8	122.8	123.8	-59.4	174.8	145.9	0	0	120
600	S	23.7	Very low	25.4	Very low	99 Å²	99	126.2 Å²	126.2	69%	0.692	75%	0.749	S	S	*	*				173.9	166.6	67.2	47.8	0	0	0	0	113
601	H	26.1	Very low	25.5	Very low	184 Å²	184	125.5 Å²	125.5	85%	0.852	74%	0.739	S	S	*	*			trans	59.6	99.4	162.1	-64.2	-62.8	0	0	0	121.9
602	G	22.1	Very low	25.5	Very low	76 Å²	76	126.8 Å²	126.8	78%	0.784	74%	0.737	S	S	*	*				57.4	118.5	117.6	0	0	0	0	0	121.9
603	V	25.6	Very low	25.9	Very low	143 Å²	143	125.8 Å²	125.8	87%	0.867	74%	0.741	S	S	*	*				-172.4	152.7	128.2	141.9	0	0	0	0	109.1
604	N	23.3	Very low	25.8	Very low	154 Å²	154	122.8 Å²	122.8	82%	0.824	74%	0.735	S	S	*	*			trans	-53.7	136.5	-179.2	-55.6	-39.9	0	0	0	114.5
605	T	27.7	Very low	26	Very low	141 Å²	141	121.7 Å²	121.7	87%	0.865	73%	0.733	S	S	*	*			trans	-147.8	131	143.4	15	0	0	0	0	112.2
606	T	23.7	Very low	26.3	Very low	121 Å²	121	119.6 Å²	119.6	74%	0.742	72%	0.722	S	S	*	*			trans	-68.2	173.8	160.6	43.1	0	0	0	0	111.5
607	T	27.9	Very low	26.5	Very low	123 Å²	123	120.2 Å²	120.2	76%	0.755	71%	0.707	S	S	*	*			trans	61.2	110.1	168.5	53.9	0	0	0	0	116.8
608	D	27.7	Very low	27.1	Very low	100 Å²	100	114.8 Å²	114.8	54%	0.535	69%	0.691	S	S	.	*				-164.9	109.5	125.1	-102.6	-12.3	0	0	0	110.9	S611	D608-S611 WeakPolarHBondContact CB-OG 3.38Å; D608-S611 WeakPolarHBondContact OD2-CB 3.44Å; D608-S611 PolarHBondContact OD2-OG 3.07Å
609	L	31.8	Very low	27.1	Very low	79 Å²	79	113.8 Å²	113.8	41%	0.414	70%	0.695	S	S	.	*	S	Bend	trans	-121.4	11.5	159.4	-84	173	0	0	0	110.7
610	T	27.7	Very low	27.3	Very low	105 Å²	105	108.5 Å²	108.5	64%	0.644	69%	0.687	S	S	*	*	S	Bend	trans	-129.4	25.9	-170.4	42.5	0	0	0	0	112
611	S	24.7	Very low	27.8	Very low	68 Å²	68	110.6 Å²	110.6	48%	0.476	69%	0.688	S	S	.	*	S	Bend	trans	-145.5	16.4	-176.7	71.1	0	0	0	0	115.5	D608	D608-S611 WeakPolarHBondContact CB-OG 3.38Å; D608-S611 WeakPolarHBondContact OD2-CB 3.44Å; D608-S611 PolarHBondContact OD2-OG 3.07Å
612	K	29.6	Very low	27.9	Very low	190 Å²	190	108.7 Å²	108.7	83%	0.826	69%	0.685	S	S	*	*			trans	-145.3	21.2	176	-115	158.3	-166.2	169.8	0	117.4	S614	K612-S614 PolarHBondContact O-N 3.33Å
613	A	30.5	Very low	28.3	Very low	102 Å²	102	115.2 Å²	115.2	84%	0.843	69%	0.686	S	S	*	*			trans	-75.1	62	145.3	0	0	0	0	0	108.8	V615	A613-V615 PolarHBondContact O-N 3.32Å
614	S	25.8	Very low	28.7	Very low	97 Å²	97	116.8 Å²	116.8	68%	0.678	69%	0.688	S	S	*	*			trans	-65.7	107.8	166.9	53.4	0	0	0	0	106.7	K612 A616	K612-S614 PolarHBondContact O-N 3.33Å; S614-A616 VanDerWaalsContact C-N 3.34Å; S614-A616 PolarHBondContact O-N 3.28Å
615	V	31.7	Very low	28.9	Very low	125 Å²	125	115.6 Å²	115.6	76%	0.758	68%	0.682	S	S	*	*			trans	-55.2	98.9	176.2	177.3	0	0	0	0	108.2	A613 D617	A613-V615 PolarHBondContact O-N 3.32Å; V615-D617 PolarHBondContact O-N 3.34Å
616	A	29.1	Very low	29.2	Very low	66 Å²	66	120.4 Å²	120.4	55%	0.545	68%	0.684	S	S	.	*			trans	-72.1	90.7	165.2	0	0	0	0	0	106.1	S614 V618	S614-A616 VanDerWaalsContact C-N 3.34Å; S614-A616 PolarHBondContact O-N 3.28Å; A616-V618 PolarHBondContact O-N 2.97Å
617	D	28	Very low	29.5	Very low	90 Å²	90	122.9 Å²	122.9	48%	0.481	69%	0.687	S	S	.	*			trans	4.5	80.3	176.6	-171.5	27.6	0	0	0	115.3	S384 V615 G619	S384-D617 WeakPolarHBondContact CB-OD2 3.47Å; S384-D617 PolarHBondContact OG-OD2 2.95Å; V615-D617 PolarHBondContact O-N 3.34Å; D617-G619 PolarHBondContact O-N 3.4Å; D617-G619 PolarHBondContact OD1-N 3.22Å
618	V	35	Very low	29.4	Very low	91 Å²	91	125.1 Å²	125.1	55%	0.552	69%	0.694	S	S	*	*			trans	-83.2	61.5	164.8	-164.4	0	0	0	0	108.2	A616 G620 I621	A616-V618 PolarHBondContact O-N 2.97Å; V618-G620 PolarHBondContact O-N 2.86Å; V618-I621 HydrophobicContact CG1-CD1 3.9Å; V618-I621 HydrophobicContact CG1-CG1 3.76Å; V618-I621 PolarHBondContact O-N 2.86Å
619	G	25.2	Very low	29.6	Very low	63 Å²	63	126.9 Å²	126.9	65%	0.649	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	81	162.4	0	0	0	0	0	109	D617	D617-G619 PolarHBondContact O-N 3.4Å; D617-G619 PolarHBondContact OD1-N 3.22Å
620	G	27.4	Very low	29.3	Very low	62 Å²	62	125.3 Å²	125.3	64%	0.639	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.7	-10.8	-164.3	0	0	0	0	0	115.7	V618	V618-G620 PolarHBondContact O-N 2.86Å
621	I	33.9	Very low	29.3	Very low	142 Å²	142	126.5 Å²	126.5	73%	0.728	72%	0.721	S	S	*	*			trans	-107.5	57.7	166.5	-47.8	172.1	0	0	0	109.2	V618	V618-I621 HydrophobicContact CG1-CD1 3.9Å; V618-I621 HydrophobicContact CG1-CG1 3.76Å; V618-I621 PolarHBondContact O-N 2.86Å
622	N	27.7	Very low	29.4	Very low	145 Å²	145	131.8 Å²	131.8	78%	0.775	74%	0.738	S	S	*	*			trans	-97.6	116.8	166.5	-95.2	-38.2	0	0	0	108.3
623	R	30.2	Very low	29.2	Very low	213 Å²	213	128.5 Å²	128.5	80%	0.804	74%	0.739	S	S	*	*			trans	65.7	129.1	-175.5	-64.3	178.2	169.7	147	-0.2	115	D625	R623-D625 PolarHBondContact O-N 3.44Å
624	L	35.1	Very low	29.1	Very low	176 Å²	176	126.4 Å²	126.4	92%	0.921	73%	0.727	S	S	*	*			trans	-59.3	92.6	137.6	-70.2	165.4	0	0	0	106.3	R626	L624-R626 PolarHBondContact O-N 3.24Å; L624-R626 VanDerWaalsContact O-N 3.12Å
625	D	27.5	Very low	29.6	Very low	128 Å²	128	131.6 Å²	131.6	68%	0.684	73%	0.732	S	S	*	*			trans	-60.3	118.9	167.8	-85.2	-28	0	0	0	107.2	R623 E627	R623-D625 PolarHBondContact O-N 3.44Å; D625-E627 PolarHBondContact O-N 2.97Å
626	R	33.8	Very low	29.8	Very low	243 Å²	243	134.7 Å²	134.7	92%	0.917	74%	0.738	S	S	*	*			trans	-68.1	84.7	171.4	-76	177	164.8	178.6	-5.9	107.5	L624 D628	L624-R626 PolarHBondContact O-N 3.24Å; L624-R626 VanDerWaalsContact O-N 3.12Å; R626-D628 PolarHBondContact O-N 2.63Å
627	E	30.3	Very low	30.7	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	73%	0.734	S	S	*	*			trans	-56.5	135.1	157	-67.2	-167.1	141	0	0	108	D625 V629	D625-E627 PolarHBondContact O-N 2.97Å; E627-V629 PolarHBondContact O-N 2.86Å
628	D	25.5	Very low	31.8	Very low	169 Å²	169	134.1 Å²	134.1	90%	0.904	72%	0.717	S	S	*	*			trans	-54.2	108.2	-168.9	-89.8	-51.9	0	0	0	112.2	R626 G630	R626-D628 PolarHBondContact O-N 2.63Å; D628-G630 VanDerWaalsContact C-N 3.33Å; D628-G630 PolarHBondContact O-N 3.03Å
629	V	30.7	Very low	32.6	Very low	137 Å²	137	135 Å²	135	83%	0.83	72%	0.716	S	S	*	*			trans	-72.3	94.1	167.8	-179.9	0	0	0	0	107.5	E627	E627-V629 PolarHBondContact O-N 2.86Å
630	G	27.2	Very low	34.4	Very low	47 Å²	47	133 Å²	133	49%	0.485	69%	0.691	S	S	.	*			trans	-54.1	160.8	165.3	0	0	0	0	0	111.7	D628 E632	D628-G630 VanDerWaalsContact C-N 3.33Å; D628-G630 PolarHBondContact O-N 3.03Å; G630-E632 PolarHBondContact O-N 2.93Å
631	P	26.8	Very low	36.2	Very low	129 Å²	129	134.6 Å²	134.6	84%	0.838	69%	0.685	S	S	*	*	S	Bend	trans	-57.3	139.4	-169.6	25.7	-35.3	0	0	0	111.7	S633	P631-S633 PolarHBondContact O-N 2.66Å
632	E	26.2	Very low	38.2	Very low	180 Å²	180	133.5 Å²	133.5	84%	0.841	68%	0.677	S	S	*	*			trans	-49.8	90.5	-168.5	-64.4	-173	129.3	0	0	114.2	G630 G634	G630-E632 PolarHBondContact O-N 2.93Å; E632-G634 VanDerWaalsContact C-N 3.29Å; E632-G634 PolarHBondContact O-N 2.91Å
633	S	26	Very low	41.1	Very low	121 Å²	121	126.6 Å²	126.6	85%	0.846	64%	0.64	S	S	*	*			trans	-79.1	79.2	168.3	171.1	0	0	0	0	109.4	P631	P631-S633 PolarHBondContact O-N 2.66Å
634	G	27.4	Very low	43.8	Very low	57 Å²	57	116.4 Å²	116.4	59%	0.588	60%	0.602	S	S	*	*			trans	47.8	104.5	164	0	0	0	0	0	116.8	E632 Q636	E632-G634 VanDerWaalsContact C-N 3.29Å; E632-G634 PolarHBondContact O-N 2.91Å; G634-Q636 PolarHBondContact O-N 2.59Å
635	R	36.8	Very low	46.2	Very low	206 Å²	206	109.5 Å²	109.5	78%	0.777	57%	0.573	S	S	*	*			trans	-44.8	94.2	173.2	-81.6	-179.9	166.2	-158.2	-13.6	111.8	E259 R637	E259-R635 IonicContact OE1-NH1 2.63Å; E259-R635 IonicContact OE1-NH2 3.13Å; E259-R635 PolarHBondContact OE1-NH2 3.48Å; R635-R637 PolarHBondContact O-N 3.4Å
636	Q	37.1	Very low	49	Very low	190 Å²	190	105.3 Å²	105.3	89%	0.888	56%	0.56	S	S	*	*			trans	-80.8	89.4	-173.2	-157.9	161.9	9.8	0	0	108.3	G634 I638	G634-Q636 PolarHBondContact O-N 2.59Å; Q636-I638 PolarHBondContact O-N 3.24Å
637	R	47.3	Very low	51.8	Low	123 Å²	123	94.1 Å²	94.1	46%	0.464	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-51.8	131.3	-175.7	-77.6	-178.6	167.7	-165.2	-9.2	110.7	R635 M639 Q709	R635-R637 PolarHBondContact O-N 3.4Å; R637-M639 PolarHBondContact O-N 3.33Å; R637-Q709 VanDerWaalsContact NH1-CD 3.33Å; R637-Q709 VanDerWaalsContact NH1-NE2 3.16Å
638	I	51.6	Low	54.7	Low	22 Å²	22	86.3 Å²	86.3	11%	0.113	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-52.8	129.8	-176.6	-61.6	165.4	0	0	0	110.1	D253 E256 Q636 L643	D253-I638 WeakPolarHBondContact OD1-CD1 3.33Å; E256-I638 WeakPolarHBondContact OE2-CD1 3.41Å; Q636-I638 PolarHBondContact O-N 3.24Å; I638-L643 HydrophobicContact CB-CD1 4.43Å; I638-L643 HydrophobicContact CD1-CD1 3.89Å; I638-L643 HydrophobicContact CG2-CB 3.9Å; I638-L643 HydrophobicContact CG2-CD1 4.01Å
639	M	52.2	Low	58	Low	108 Å²	108	78.2 Å²	78.2	53%	0.532	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-67.6	134.6	170.1	-67.4	-158.6	171	0	0	109.7	R637 D641 Q642	R637-M639 PolarHBondContact O-N 3.33Å; M639-D641 WeakPolarHBondContact CB-OD1 3.43Å; M639-D641 PolarHBondContact O-N 3.49Å; M639-Q642 PolarHBondContact O-N 3.13Å; M639-Q642 VanDerWaalsContact O-N 3.08Å
640	T	62.1	Low	61.1	Low	22 Å²	22	71.8 Å²	71.8	14%	0.135	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.9	-170.4	43.1	0	0	0	0	115.1	P648 Y702	T640-P648 WeakPolarHBondContact O-CB 3.44Å; T640-P648 WeakPolarHBondContact O-CG 3.19Å; T640-Y702 HydrophobicContact CG2-CD1 3.75Å; T640-Y702 HydrophobicContact CG2-CE1 3.67Å
641	D	65.2	Low	64.4	Low	96 Å²	96	69.5 Å²	69.5	51%	0.513	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-31.1	178.4	63	-38.3	0	0	0	113.4	M639 G646	M639-D641 WeakPolarHBondContact CB-OD1 3.43Å; M639-D641 PolarHBondContact O-N 3.49Å; D641-G646 WeakPolarHBondContact O-CA 3.3Å
642	Q	76.7	Confident	67.7	Low	118 Å²	118	63.4 Å²	63.4	55%	0.551	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-22.7	-178.5	-60.8	-172.6	16.4	0	0	113.4	M639 G645 G646	M639-Q642 PolarHBondContact O-N 3.13Å; M639-Q642 VanDerWaalsContact O-N 3.08Å; Q642-G645 WeakPolarHBondContact O-CA 3.38Å; Q642-G645 PolarHBondContact O-N 2.95Å; Q642-G646 PolarHBondContact O-N 3.5Å
643	L	87.5	Confident	71.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-54.5	133.9	-178.4	-175.3	70.4	0	0	0	112.2	D253 L257 I638 G645 G646 N647 P648 F652 Y702	D253-L643 HydrophobicContact CB-CD1 3.85Å; L257-L643 HydrophobicContact CD1-CD1 4.03Å; L257-L643 HydrophobicContact CD1-CD2 4.1Å; L257-L643 HydrophobicContact CD1-CG 4.31Å; L257-L643 HydrophobicContact CD2-CD2 4.23Å; L257-L643 HydrophobicContact CG-CD1 4.19Å; I638-L643 HydrophobicContact CB-CD1 4.43Å; I638-L643 HydrophobicContact CD1-CD1 3.89Å; I638-L643 HydrophobicContact CG2-CB 3.9Å; I638-L643 HydrophobicContact CG2-CD1 4.01Å; L643-G645 PolarHBondContact O-N 3.03Å; L643-G646 PolarHBondContact O-N 3.02Å; L643-N647 CarbonylContact O-C 3.59Å; L643-N647 PolarHBondContact O-N 2.79Å; L643-P648 HydrophobicContact CB-CB 4.16Å; L643-P648 HydrophobicContact CD2-CB 4.07Å; L643-P648 HydrophobicContact CG-CB 4.39Å; L643-P648 WeakPolarHBondContact O-CA 3.28Å; L643-F652 HydrophobicContact CD2-CE2 3.66Å; L643-F652 HydrophobicContact CD2-CZ 3.95Å; L643-Y702 HydrophobicContact CD2-CE1 4.2Å
644	G	87.9	Confident	74.6	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	66.9	20.6	-176.9	0	0	0	0	0	113.2	K250 D253 N647 M651	K250-G644 WeakPolarHBondContact CG-O 3.47Å; K250-G644 PolarHBondContact NZ-O 2.82Å; D253-G644 WeakPolarHBondContact OD2-CA 3.49Å; D253-G644 PolarHBondContact OD2-N 3.33Å; G644-N647 PolarHBondContact O-N 3.04Å; G644-M651 VanDerWaalsContact CA-SD 3.51Å
645	G	85.2	Confident	77.9	Confident	31 Å²	31	46.3 Å²	46.3	32%	0.32	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	68.2	36.1	-177	0	0	0	0	0	113.8	Q642 L643	Q642-G645 WeakPolarHBondContact O-CA 3.38Å; Q642-G645 PolarHBondContact O-N 2.95Å; L643-G645 PolarHBondContact O-N 3.03Å
646	G	86.5	Confident	80.8	Confident	40 Å²	40	36.6 Å²	36.6	41%	0.412	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	6.9	-175.8	0	0	0	0	0	114.8	D641 Q642 L643	D641-G646 WeakPolarHBondContact O-CA 3.3Å; Q642-G646 PolarHBondContact O-N 3.5Å; L643-G646 PolarHBondContact O-N 3.02Å
647	N	91	Very high	83.6	Confident	8 Å²	8	27.6 Å²	27.6	4%	0.043	15%	0.15	C	C	.	.			trans	-125.2	85.9	163.8	-174	-12.8	0	0	0	109.8	E287 N304 L308 L643 G644 F649 L650	E287-N647 PolarHBondContact OE1-ND2 3.31Å; N304-N647 PolarHBondContact ND2-ND2 3.37Å; N304-N647 VanDerWaalsContact ND2-ND2 3.17Å; N304-N647 PolarHBondContact OD1-ND2 3.37Å; N304-N647 PolarHBondContact OD1-OD1 3.22Å; L308-N647 HydrophobicContact CD2-CB 4.12Å; L643-N647 CarbonylContact O-C 3.59Å; L643-N647 PolarHBondContact O-N 2.79Å; G644-N647 PolarHBondContact O-N 3.04Å; N647-F649 PolarHBondContact OD1-N 3.43Å; N647-L650 HydrophobicContact CB-CB 4.43Å; N647-L650 WeakPolarHBondContact ND2-CB 3.38Å; N647-L650 WeakPolarHBondContact OD1-CB 3.43Å; N647-L650 PolarHBondContact OD1-N 3.46Å; N647-L650 VanDerWaalsContact OD1-N 3.12Å
648	P	92.9	Very high	86	Confident	8 Å²	8	21.7 Å²	21.7	5%	0.052	13%	0.128	C	C	.	.	H	α-helix	trans	-68.7	-44.8	-178.8	26.3	-34.1	0	0	0	111.7	T640 L643 L650 M651 F652 Y699	T640-P648 WeakPolarHBondContact O-CB 3.44Å; T640-P648 WeakPolarHBondContact O-CG 3.19Å; L643-P648 HydrophobicContact CB-CB 4.16Å; L643-P648 HydrophobicContact CD2-CB 4.07Å; L643-P648 HydrophobicContact CG-CB 4.39Å; L643-P648 WeakPolarHBondContact O-CA 3.28Å; P648-L650 VanDerWaalsContact C-N 3.32Å; P648-L650 PolarHBondContact O-N 3.44Å; P648-M651 WeakPolarHBondContact O-CB 3.33Å; P648-M651 PolarHBondContact O-N 2.98Å; P648-F652 WeakPolarHBondContact O-CD2 3.35Å; P648-Y699 HydrophobicContact CB-CE2 4.05Å; P648-Y699 HydrophobicContact CG-CE2 4.2Å
649	F	94.6	Very high	88.1	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.6	-37.7	-171	-171.2	-112.2	0	0	0	112.5	Y94 V303 S307 N647 M651 F652 I653 L692 A695 R696 Y699	Y94-F649 HydrophobicContact CE2-CD1 4.01Å; Y94-F649 AromaticContact CE2-CD2 3.94Å; Y94-F649 HydrophobicContact CE2-CD2 3.94Å; Y94-F649 AromaticContact CE2-CE1 3.84Å; Y94-F649 HydrophobicContact CE2-CE1 3.84Å; Y94-F649 AromaticContact CE2-CE2 3.77Å; Y94-F649 HydrophobicContact CE2-CE2 3.77Å; Y94-F649 HydrophobicContact CE2-CG 4.06Å; Y94-F649 AromaticContact CE2-CZ 3.72Å; Y94-F649 HydrophobicContact CE2-CZ 3.72Å; Y94-F649 AromaticContact CZ-CE2 3.85Å; Y94-F649 WeakPolarHBondContact OH-CD2 3.39Å; Y94-F649 WeakPolarHBondContact OH-CE2 3.42Å; V303-F649 HydrophobicContact CG1-CE1 3.79Å; V303-F649 HydrophobicContact CG1-CZ 4.37Å; S307-F649 WeakPolarHBondContact OG-CB 3.49Å; N647-F649 PolarHBondContact OD1-N 3.43Å; F649-M651 PolarHBondContact O-N 2.97Å; F649-F652 WeakPolarHBondContact O-CA 3.49Å; F649-F652 PolarHBondContact O-N 3.32Å; F649-I653 HydrophobicContact CD1-CD1 3.82Å; F649-I653 HydrophobicContact CD1-CG1 4.05Å; F649-I653 HydrophobicContact CE1-CD1 3.72Å; F649-I653 HydrophobicContact CE1-CG1 3.79Å; F649-I653 HydrophobicContact CZ-CG1 4.27Å; F649-I653 WeakPolarHBondContact O-CG1 3.5Å; F649-I653 PolarHBondContact O-N 3.01Å; F649-L692 HydrophobicContact CE1-CD2 4.05Å; F649-L692 HydrophobicContact CZ-CD2 4.39Å; F649-A695 HydrophobicContact CE2-CB 3.98Å; F649-A695 HydrophobicContact CZ-CB 3.84Å; F649-R696 HydrophobicContact CE2-CG 4.23Å; F649-R696 HydrophobicContact CZ-CG 4.04Å; F649-Y699 AromaticContact CD2-CD1 3.88Å; F649-Y699 HydrophobicContact CD2-CD1 3.88Å; F649-Y699 AromaticContact CD2-CG 3.84Å; F649-Y699 HydrophobicContact CD2-CG 3.84Å; F649-Y699 HydrophobicContact CE2-CD1 4.46Å; F649-Y699 HydrophobicContact CE2-CG 4.46Å
650	L	96.2	Very high	90.2	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-53	-37.5	172.8	179.1	64.7	0	0	0	112.6	E287 L288 N647 P648 F652 I653 C654	E287-L650 HydrophobicContact CB-CD1 4.38Å; E287-L650 HydrophobicContact CB-CD2 4.48Å; E287-L650 HydrophobicContact CG-CD2 4.06Å; L288-L650 HydrophobicContact CD1-CD1 3.94Å; L288-L650 HydrophobicContact CG-CD1 4.35Å; N647-L650 HydrophobicContact CB-CB 4.43Å; N647-L650 WeakPolarHBondContact ND2-CB 3.38Å; N647-L650 WeakPolarHBondContact OD1-CB 3.43Å; N647-L650 PolarHBondContact OD1-N 3.46Å; N647-L650 VanDerWaalsContact OD1-N 3.12Å; P648-L650 VanDerWaalsContact C-N 3.32Å; P648-L650 PolarHBondContact O-N 3.44Å; L650-F652 VanDerWaalsContact C-N 3.34Å; L650-F652 PolarHBondContact O-N 2.58Å; L650-I653 WeakPolarHBondContact O-CB 3.45Å; L650-I653 PolarHBondContact O-N 2.82Å; L650-C654 PolarHBondContact O-N 2.82Å; L650-C654 PolarHBondContact O-SG 3.16Å; L650-C654 VanDerWaalsContact O-SG 3.4Å
651	M	96.1	Very high	91.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.9	-39.2	177.8	-50.5	-60.8	87.9	0	0	111.1	K250 L257 L284 G644 P648 F649 I653 C654 V655	K250-M651 HydrophobicContact CB-SD 4.43Å; L257-M651 HydrophobicContact CD1-CB 3.41Å; L257-M651 VanDerWaalsContact CD1-CB 3.41Å; L257-M651 HydrophobicContact CD1-CG 4.21Å; L284-M651 HydrophobicContact CD2-CE 3.51Å; L284-M651 HydrophobicContact CD2-SD 4.15Å; G644-M651 VanDerWaalsContact CA-SD 3.51Å; P648-M651 WeakPolarHBondContact O-CB 3.33Å; P648-M651 PolarHBondContact O-N 2.98Å; F649-M651 PolarHBondContact O-N 2.97Å; M651-I653 VanDerWaalsContact C-N 3.33Å; M651-I653 PolarHBondContact O-N 3.45Å; M651-C654 WeakPolarHBondContact O-CB 3.29Å; M651-C654 PolarHBondContact O-N 3.02Å; M651-V655 WeakPolarHBondContact O-CG2 3.17Å; M651-V655 PolarHBondContact O-N 3.26Å
652	F	96.3	Very high	93.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-69	-28.7	175.5	-64.1	-86.3	0	0	0	112.8	L257 Y261 L643 P648 F649 L650 A656 A695 F698 Y699 Y702	L257-F652 HydrophobicContact CD1-CE2 4.5Å; L257-F652 HydrophobicContact CD1-CZ 4.42Å; L257-F652 HydrophobicContact CD2-CE1 3.95Å; L257-F652 HydrophobicContact CD2-CZ 3.77Å; Y261-F652 HydrophobicContact CE2-CD1 4.32Å; Y261-F652 AromaticContact CE2-CE1 3.82Å; Y261-F652 HydrophobicContact CE2-CE1 3.82Å; L643-F652 HydrophobicContact CD2-CE2 3.66Å; L643-F652 HydrophobicContact CD2-CZ 3.95Å; P648-F652 WeakPolarHBondContact O-CD2 3.35Å; F649-F652 WeakPolarHBondContact O-CA 3.49Å; F649-F652 PolarHBondContact O-N 3.32Å; L650-F652 VanDerWaalsContact C-N 3.34Å; L650-F652 PolarHBondContact O-N 2.58Å; F652-A656 VanDerWaalsContact O-CB 3.29Å; F652-A656 WeakPolarHBondContact O-CB 3.2Å; F652-A656 PolarHBondContact O-N 3.25Å; F652-A695 HydrophobicContact CB-CB 4.34Å; F652-F698 HydrophobicContact CD1-CB 3.74Å; F652-F698 HydrophobicContact CE1-CB 4.46Å; F652-Y699 AromaticContact CD2-CD2 3.54Å; F652-Y699 HydrophobicContact CD2-CD2 3.54Å; F652-Y699 HydrophobicContact CD2-CE2 4.38Å; F652-Y699 HydrophobicContact CD2-CG 4.24Å; F652-Y699 AromaticContact CE2-CD2 3.47Å; F652-Y699 HydrophobicContact CE2-CD2 3.47Å; F652-Y699 VanDerWaalsContact CE2-CD2 3.47Å; F652-Y699 HydrophobicContact CE2-CE2 4.09Å; F652-Y699 HydrophobicContact CE2-CG 4.5Å; F652-Y699 HydrophobicContact CG-CD2 4.26Å; F652-Y699 HydrophobicContact CZ-CD2 4.09Å; F652-Y702 HydrophobicContact CE1-CD2 4.27Å; F652-Y702 AromaticContact CE1-CG 3.99Å; F652-Y702 HydrophobicContact CE1-CG 3.99Å; F652-Y702 AromaticContact CZ-CD1 3.84Å; F652-Y702 HydrophobicContact CZ-CD1 3.84Å; F652-Y702 HydrophobicContact CZ-CD2 4.11Å; F652-Y702 HydrophobicContact CZ-CE1 4.47Å; F652-Y702 AromaticContact CZ-CG 3.63Å; F652-Y702 HydrophobicContact CZ-CG 3.63Å
653	I	97.5	Very high	94.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.4	-44.6	169	-55.1	173.2	0	0	0	110.1	L288 L300 F649 L650 M651 A656 L657 V691 L692 A695	L288-I653 HydrophobicContact CD1-CB 3.97Å; L288-I653 HydrophobicContact CD1-CG2 3.33Å; L300-I653 HydrophobicContact CD1-CD1 4.24Å; L300-I653 HydrophobicContact CD1-CG2 4.05Å; L300-I653 HydrophobicContact CG-CD1 4.31Å; F649-I653 HydrophobicContact CD1-CD1 3.82Å; F649-I653 HydrophobicContact CD1-CG1 4.05Å; F649-I653 HydrophobicContact CE1-CD1 3.72Å; F649-I653 HydrophobicContact CE1-CG1 3.79Å; F649-I653 HydrophobicContact CZ-CG1 4.27Å; F649-I653 WeakPolarHBondContact O-CG1 3.5Å; F649-I653 PolarHBondContact O-N 3.01Å; L650-I653 WeakPolarHBondContact O-CB 3.45Å; L650-I653 PolarHBondContact O-N 2.82Å; M651-I653 VanDerWaalsContact C-N 3.33Å; M651-I653 PolarHBondContact O-N 3.45Å; I653-A656 PolarHBondContact O-N 3.37Å; I653-L657 WeakPolarHBondContact O-CG 3.3Å; I653-L657 PolarHBondContact O-N 2.69Å; I653-V691 HydrophobicContact CG2-CG1 3.81Å; I653-L692 HydrophobicContact CD1-CD2 4.1Å; I653-L692 HydrophobicContact CG1-CD2 4.36Å; I653-A695 HydrophobicContact CB-CB 4.46Å; I653-A695 HydrophobicContact CG1-CB 3.98Å
654	C	97.9	Very high	94.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.6	-44.7	175.3	-64.5	0	0	0	0	112.3	L254 W283 L650 M651 A656 L657 F658	L254-C654 HydrophobicContact CD1-CB 3.63Å; L254-C654 HydrophobicContact CD2-CB 4.11Å; W283-C654 HydrophobicContact CE3-CB 4.34Å; L650-C654 PolarHBondContact O-N 2.82Å; L650-C654 PolarHBondContact O-SG 3.16Å; L650-C654 VanDerWaalsContact O-SG 3.4Å; M651-C654 WeakPolarHBondContact O-CB 3.29Å; M651-C654 PolarHBondContact O-N 3.02Å; C654-A656 VanDerWaalsContact C-N 3.34Å; C654-A656 PolarHBondContact O-N 3.06Å; C654-L657 WeakPolarHBondContact O-CB 3.43Å; C654-L657 PolarHBondContact O-N 2.78Å; C654-F658 VanDerWaalsContact O-CD2 3.23Å; C654-F658 WeakPolarHBondContact O-CD2 3.3Å; C654-F658 PolarHBondContact O-N 2.79Å
655	V	97	Very high	95.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-40.9	174.6	172.6	0	0	0	0	111.4	L254 L257 Y261 M651 L657 F658 L659 F698	L254-V655 HydrophobicContact CD1-CG2 3.82Å; L257-V655 HydrophobicContact CB-CG2 3.92Å; Y261-V655 HydrophobicContact CD2-CG1 4.32Å; Y261-V655 HydrophobicContact CG-CG1 4.36Å; M651-V655 WeakPolarHBondContact O-CG2 3.17Å; M651-V655 PolarHBondContact O-N 3.26Å; V655-L657 VanDerWaalsContact C-N 3.33Å; V655-L657 PolarHBondContact O-N 3.48Å; V655-F658 PolarHBondContact O-N 3.11Å; V655-L659 HydrophobicContact CG1-CD1 3.62Å; V655-L659 HydrophobicContact CG1-CG 4.11Å; V655-L659 WeakPolarHBondContact O-CG 3.36Å; V655-L659 PolarHBondContact O-N 3.34Å; V655-F698 HydrophobicContact CG1-CD2 4.2Å; V655-F698 HydrophobicContact CG1-CE2 4.2Å
656	A	97.3	Very high	95.8	Very high	2 Å²	2	21.8 Å²	21.8	2%	0.017	12%	0.117	C	C	.	.	H	α-helix	trans	-61	-39.4	175.1	0	0	0	0	0	112.8	F652 I653 C654 E660 V691 Q694 A695 F698	F652-A656 VanDerWaalsContact O-CB 3.29Å; F652-A656 WeakPolarHBondContact O-CB 3.2Å; F652-A656 PolarHBondContact O-N 3.25Å; I653-A656 PolarHBondContact O-N 3.37Å; C654-A656 VanDerWaalsContact C-N 3.34Å; C654-A656 PolarHBondContact O-N 3.06Å; A656-E660 WeakPolarHBondContact O-CB 3.28Å; A656-E660 PolarHBondContact O-N 2.84Å; A656-V691 HydrophobicContact CB-CG1 4.07Å; A656-Q694 HydrophobicContact CB-CB 4.02Å; A656-Q694 HydrophobicContact CB-CG 4.17Å; A656-A695 HydrophobicContact CB-CB 4.14Å; A656-F698 HydrophobicContact CB-CD2 4.49Å; A656-F698 HydrophobicContact CB-CE2 4.39Å
657	L	97.5	Very high	96.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.3	-43.1	173.7	-71.8	166.8	0	0	0	112.1	W283 L288 F292 I653 C654 V655 H661 H686 V691	W283-L657 HydrophobicContact CE3-CD1 4.1Å; W283-L657 HydrophobicContact CH2-CB 3.86Å; W283-L657 HydrophobicContact CH2-CD1 4.17Å; W283-L657 HydrophobicContact CZ3-CB 3.78Å; W283-L657 HydrophobicContact CZ3-CD1 3.9Å; L288-L657 HydrophobicContact CD1-CD1 3.98Å; L288-L657 HydrophobicContact CD2-CD1 3.51Å; L288-L657 HydrophobicContact CG-CD1 4.42Å; F292-L657 HydrophobicContact CZ-CD2 4.2Å; I653-L657 WeakPolarHBondContact O-CG 3.3Å; I653-L657 PolarHBondContact O-N 2.69Å; C654-L657 WeakPolarHBondContact O-CB 3.43Å; C654-L657 PolarHBondContact O-N 2.78Å; V655-L657 VanDerWaalsContact C-N 3.33Å; V655-L657 PolarHBondContact O-N 3.48Å; L657-H661 PolarHBondContact O-CD2 3.1Å; L657-H661 VanDerWaalsContact O-CD2 3.25Å; L657-H686 HydrophobicContact CD2-CB 4.15Å; L657-H686 VanDerWaalsContact CD2-ND1 3.33Å; L657-H686 WeakPolarHBondContact CD2-ND1 3.29Å; L657-V691 HydrophobicContact CD2-CG1 4.02Å; L657-V691 HydrophobicContact CD2-CG2 3.73Å; L657-V691 HydrophobicContact CG-CG1 3.93Å; L657-V691 HydrophobicContact CG-CG2 4.48Å
658	F	97.2	Very high	96.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.3	-51.9	175.8	-82.6	-63.4	0	0	0	112.5	L254 L258 F265 L277 F279 C280 W283 C654 V655 E660 H661 R662 F679	L254-F658 HydrophobicContact CD2-CE2 4.2Å; L258-F658 HydrophobicContact CD1-CB 3.98Å; L258-F658 HydrophobicContact CD1-CG 4.41Å; L258-F658 HydrophobicContact CD2-CD2 4.36Å; L258-F658 HydrophobicContact CD2-CG 4.31Å; F265-F658 HydrophobicContact CE1-CB 4.12Å; F265-F658 HydrophobicContact CE1-CD1 4.04Å; F265-F658 HydrophobicContact CE1-CG 4.43Å; F265-F658 HydrophobicContact CZ-CD1 4.43Å; L277-F658 HydrophobicContact CD1-CE2 4.25Å; L277-F658 HydrophobicContact CD1-CZ 4.39Å; L277-F658 HydrophobicContact CD2-CE1 4.24Å; L277-F658 HydrophobicContact CD2-CE2 4.43Å; L277-F658 HydrophobicContact CD2-CZ 3.84Å; L277-F658 HydrophobicContact CG-CZ 4.49Å; F279-F658 AromaticContact CE2-CE1 3.52Å; F279-F658 HydrophobicContact CE2-CE1 3.52Å; F279-F658 AromaticContact CE2-CZ 3.63Å; F279-F658 HydrophobicContact CE2-CZ 3.63Å; F279-F658 AromaticContact CZ-CE1 3.65Å; F279-F658 HydrophobicContact CZ-CE1 3.65Å; F279-F658 AromaticContact CZ-CZ 3.86Å; F279-F658 HydrophobicContact CZ-CZ 3.86Å; C280-F658 HydrophobicContact CB-CZ 4.37Å; W283-F658 HydrophobicContact CZ3-CD2 4.37Å; W283-F658 HydrophobicContact CZ3-CE2 4.04Å; W283-F658 HydrophobicContact CZ3-CZ 4.26Å; C654-F658 VanDerWaalsContact O-CD2 3.23Å; C654-F658 WeakPolarHBondContact O-CD2 3.3Å; C654-F658 PolarHBondContact O-N 2.79Å; V655-F658 PolarHBondContact O-N 3.11Å; F658-E660 VanDerWaalsContact C-N 3.3Å; F658-E660 PolarHBondContact O-N 2.88Å; F658-H661 PolarHBondContact O-N 3.4Å; F658-R662 PolarHBondContact O-N 3.49Å; F658-F679 HydrophobicContact CD1-CE2 4.12Å; F658-F679 HydrophobicContact CD1-CZ 4.01Å; F658-F679 AromaticContact CE1-CE2 3.94Å; F658-F679 HydrophobicContact CE1-CE2 3.94Å; F658-F679 HydrophobicContact CE1-CZ 4.23Å
659	L	96.2	Very high	96.8	Very high	29 Å²	29	42 Å²	42	15%	0.152	19%	0.19	C	C	.	.	H	α-helix	trans	-73.5	-20.3	-173.7	-61.1	179.9	0	0	0	113.2	L258 D262 F265 V655 H661 R662 F698	L258-L659 HydrophobicContact CD1-CD2 4.07Å; L258-L659 HydrophobicContact CD1-CG 4.45Å; D262-L659 HydrophobicContact CB-CD2 3.64Å; F265-L659 HydrophobicContact CD1-CD2 4.36Å; V655-L659 HydrophobicContact CG1-CD1 3.62Å; V655-L659 HydrophobicContact CG1-CG 4.11Å; V655-L659 WeakPolarHBondContact O-CG 3.36Å; V655-L659 PolarHBondContact O-N 3.34Å; L659-H661 VanDerWaalsContact C-N 3.26Å; L659-H661 PolarHBondContact O-N 2.91Å; L659-R662 WeakPolarHBondContact O-CG 3.36Å; L659-F698 HydrophobicContact CD1-CE1 4.49Å; L659-F698 HydrophobicContact CD1-CE2 3.74Å; L659-F698 HydrophobicContact CD1-CZ 3.59Å
660	E	96.1	Very high	96.9	Very high	52 Å²	52	42.6 Å²	42.6	24%	0.243	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-33	167.8	-179.8	166.2	-153.7	0	0	112.2	A656 F658 K690	A656-E660 WeakPolarHBondContact O-CB 3.28Å; A656-E660 PolarHBondContact O-N 2.84Å; F658-E660 VanDerWaalsContact C-N 3.3Å; F658-E660 PolarHBondContact O-N 2.88Å; E660-K690 WeakPolarHBondContact OE1-CD 3.31Å; E660-K690 VanDerWaalsContact OE1-CE 3.29Å; E660-K690 WeakPolarHBondContact OE1-CE 3.26Å; E660-K690 IonicContact OE1-NZ 3.43Å; E660-K690 PolarHBondContact OE1-NZ 3.34Å
661	H	96.2	Very high	96.9	Very high	37 Å²	37	45.9 Å²	45.9	17%	0.171	21%	0.21	C	C	.	.	H	α-helix	trans	-109.9	-9.7	-172.5	-63.4	-60.5	0	0	0	115.2	L657 F658 L659 N663 L664 I665 Y678 F679 H686	L657-H661 PolarHBondContact O-CD2 3.1Å; L657-H661 VanDerWaalsContact O-CD2 3.25Å; F658-H661 PolarHBondContact O-N 3.4Å; L659-H661 VanDerWaalsContact C-N 3.26Å; L659-H661 PolarHBondContact O-N 2.91Å; H661-N663 VanDerWaalsContact C-N 3.26Å; H661-N663 PolarHBondContact O-N 3.37Å; H661-L664 PolarHBondContact O-N 2.86Å; H661-I665 HydrophobicContact CB-CD1 4.15Å; H661-I665 PolarHBondContact O-N 3.25Å; H661-Y678 HydrophobicContact CB-CE1 3.87Å; H661-Y678 AromaticContact CG-CE1 3.89Å; H661-Y678 AromaticContact ND1-CZ 4Å; H661-Y678 PolarHBondContact ND1-OH 2.96Å; H661-F679 HydrophobicContact CB-CE1 4.46Å; H661-F679 HydrophobicContact CB-CZ 4.41Å; H661-F679 AromaticContact CD2-CE1 3.81Å; H661-H686 AromaticContact NE2-CE1 2.94Å; H661-H686 PolarHBondContact NE2-CE1 3.35Å; H661-H686 AromaticContact NE2-ND1 2.69Å; H661-H686 PolarHBondContact NE2-ND1 3.01Å
662	R	96.5	Very high	96.9	Very high	71 Å²	71	48.6 Å²	48.6	27%	0.268	22%	0.222	S	C	.	.	H	α-helix	trans	-42.2	-46.1	-178.5	68.7	-174	-105.4	-67	-6.7	114.8	D262 F265 F658 L659 L664 I665 M666	D262-R662 WeakPolarHBondContact OD2-CD 3.41Å; D262-R662 IonicContact OD2-CZ 3.23Å; D262-R662 IonicContact OD2-NE 3.43Å; D262-R662 PolarHBondContact OD2-NE 3.33Å; D262-R662 IonicContact OD2-NH2 3.38Å; F265-R662 HydrophobicContact CB-CB 4.43Å; F265-R662 HydrophobicContact CD1-CB 4.12Å; F265-R662 HydrophobicContact CD2-CB 3.7Å; F265-R662 HydrophobicContact CE1-CB 4.32Å; F265-R662 HydrophobicContact CE2-CB 3.92Å; F265-R662 HydrophobicContact CG-CB 3.81Å; F265-R662 HydrophobicContact CZ-CB 4.22Å; F658-R662 PolarHBondContact O-N 3.49Å; L659-R662 WeakPolarHBondContact O-CG 3.36Å; R662-L664 PolarHBondContact O-N 2.84Å; R662-I665 PolarHBondContact O-N 3.32Å; R662-M666 WeakPolarHBondContact O-CG 3.39Å; R662-M666 PolarHBondContact O-N 3.33Å
663	N	96.9	Very high	97	Very high	101 Å²	101	53.1 Å²	53.1	54%	0.54	25%	0.247	S	C	.	.	H	α-helix	trans	-62.7	-44.1	-175.4	-73.1	-31.4	0	0	0	110.9	H661 E667	H661-N663 VanDerWaalsContact C-N 3.26Å; H661-N663 PolarHBondContact O-N 3.37Å; N663-E667 WeakPolarHBondContact O-CB 3.42Å; N663-E667 PolarHBondContact O-N 3.32Å
664	L	96.9	Very high	96.9	Very high	47 Å²	47	57.1 Å²	57.1	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-72.4	-35.9	-177	-166.6	72.6	0	0	0	111.5	H661 R662 R668 M670 Y678	H661-L664 PolarHBondContact O-N 2.86Å; R662-L664 PolarHBondContact O-N 2.84Å; L664-R668 WeakPolarHBondContact O-CB 3.37Å; L664-R668 WeakPolarHBondContact O-CG 3.4Å; L664-R668 PolarHBondContact O-N 3.4Å; L664-R668 VanDerWaalsContact O-N 3.13Å; L664-M670 HydrophobicContact CG-CE 4.35Å; L664-Y678 HydrophobicContact CD2-CE2 3.68Å; L664-Y678 WeakPolarHBondContact CD2-OH 3.47Å
665	I	97.6	Very high	96.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-52.3	175.1	-68.5	168.7	0	0	0	109.8	F265 Y268 H661 R662 K669 M670 I675 Y678 F679	F265-I665 HydrophobicContact CE2-CB 4.12Å; F265-I665 HydrophobicContact CE2-CD1 4.29Å; F265-I665 HydrophobicContact CE2-CG2 3.82Å; F265-I665 HydrophobicContact CZ-CD1 3.95Å; F265-I665 HydrophobicContact CZ-CG2 4.35Å; Y268-I665 HydrophobicContact CD1-CG2 4.41Å; Y268-I665 HydrophobicContact CE1-CG2 3.72Å; H661-I665 HydrophobicContact CB-CD1 4.15Å; H661-I665 PolarHBondContact O-N 3.25Å; R662-I665 PolarHBondContact O-N 3.32Å; I665-K669 PolarHBondContact O-N 3.3Å; I665-K669 VanDerWaalsContact O-N 3.09Å; I665-M670 HydrophobicContact CB-SD 4.37Å; I665-M670 HydrophobicContact CG1-SD 3.94Å; I665-M670 HydrophobicContact CG2-CB 4.29Å; I665-M670 PolarHBondContact O-N 3.3Å; I665-I675 HydrophobicContact CG2-CD1 3.83Å; I665-I675 HydrophobicContact CG2-CG1 3.82Å; I665-Y678 HydrophobicContact CG1-CD1 4.45Å; I665-F679 HydrophobicContact CD1-CE2 4.01Å; I665-F679 HydrophobicContact CD1-CZ 4.09Å
666	M	97.4	Very high	96.9	Very high	61 Å²	61	58.2 Å²	58.2	30%	0.3	28%	0.277	S	S	.	.	H	α-helix	trans	-69.1	-41.6	-179.9	-64.7	178.3	79.1	0	0	113.1	F265 Y268 R662 R668 K669	F265-M666 HydrophobicContact CB-SD 4.35Å; F265-M666 HydrophobicContact CD2-CG 3.87Å; F265-M666 HydrophobicContact CD2-SD 3.85Å; F265-M666 HydrophobicContact CE2-CG 4.31Å; Y268-M666 HydrophobicContact CD1-CG 4.02Å; Y268-M666 HydrophobicContact CD2-CE 4.34Å; Y268-M666 HydrophobicContact CD2-CG 4.03Å; Y268-M666 HydrophobicContact CE1-CG 4.45Å; Y268-M666 HydrophobicContact CE2-CG 4.41Å; Y268-M666 HydrophobicContact CG-CE 4.27Å; Y268-M666 HydrophobicContact CG-CG 3.83Å; R662-M666 WeakPolarHBondContact O-CG 3.39Å; R662-M666 PolarHBondContact O-N 3.33Å; M666-R668 VanDerWaalsContact C-N 3.31Å; M666-R668 PolarHBondContact O-N 2.91Å; M666-K669 PolarHBondContact O-N 3.07Å
667	E	97.3	Very high	96.8	Very high	151 Å²	151	64.7 Å²	64.7	71%	0.706	31%	0.309	S	S	*	.	H	α-helix	trans	-60.6	-41.3	178.7	-179.3	-177.9	-164.1	0	0	111.7	N663	N663-E667 WeakPolarHBondContact O-CB 3.42Å; N663-E667 PolarHBondContact O-N 3.32Å
668	R	97.1	Very high	96.8	Very high	164 Å²	164	66.2 Å²	66.2	62%	0.619	31%	0.314	S	S	*	.	H	α-helix	trans	-84.5	-8.3	179.2	-66.5	-178.3	178.8	-174.2	2.3	114.1	L664 M666 M670	L664-R668 WeakPolarHBondContact O-CB 3.37Å; L664-R668 WeakPolarHBondContact O-CG 3.4Å; L664-R668 PolarHBondContact O-N 3.4Å; L664-R668 VanDerWaalsContact O-N 3.13Å; M666-R668 VanDerWaalsContact C-N 3.31Å; M666-R668 PolarHBondContact O-N 2.91Å; R668-M670 VanDerWaalsContact C-N 3.32Å; R668-M670 HydrophobicContact CB-CE 4.12Å; R668-M670 HydrophobicContact CB-CG 4.05Å; R668-M670 HydrophobicContact CG-CE 4.4Å; R668-M670 PolarHBondContact O-N 3.32Å
669	K	96.8	Very high	96.8	Very high	167 Å²	167	66.4 Å²	66.4	73%	0.726	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	44.9	-176.5	-54.7	-175.1	179.1	-171.9	0	113	Y268 I665 M666	Y268-K669 VanDerWaalsContact OH-CA 3.22Å; Y268-K669 WeakPolarHBondContact OH-CA 3.26Å; I665-K669 PolarHBondContact O-N 3.3Å; I665-K669 VanDerWaalsContact O-N 3.09Å; M666-K669 PolarHBondContact O-N 3.07Å
670	M	97.5	Very high	96.8	Very high	11 Å²	11	68 Å²	68	5%	0.054	32%	0.324	C	S	.	.			trans	-63.5	130.1	178.5	-61.5	-174.3	-168.2	0	0	111.7	Y268 L664 I665 R668 D674 I675 Y678	Y268-M670 PolarHBondContact OH-N 3.04Å; Y268-M670 PolarHBondContact OH-O 3.25Å; L664-M670 HydrophobicContact CG-CE 4.35Å; I665-M670 HydrophobicContact CB-SD 4.37Å; I665-M670 HydrophobicContact CG1-SD 3.94Å; I665-M670 HydrophobicContact CG2-CB 4.29Å; I665-M670 PolarHBondContact O-N 3.3Å; R668-M670 VanDerWaalsContact C-N 3.32Å; R668-M670 HydrophobicContact CB-CE 4.12Å; R668-M670 HydrophobicContact CB-CG 4.05Å; R668-M670 HydrophobicContact CG-CE 4.4Å; R668-M670 PolarHBondContact O-N 3.32Å; M670-D674 HydrophobicContact CB-CB 3.52Å; M670-D674 HydrophobicContact CG-CB 3.94Å; M670-I675 HydrophobicContact CB-CG1 3.72Å; M670-Y678 HydrophobicContact CE-CD2 3.92Å; M670-Y678 HydrophobicContact CE-CE2 4.34Å; M670-Y678 HydrophobicContact CE-CG 4Å; M670-Y678 HydrophobicContact SD-CD1 4.39Å; M670-Y678 HydrophobicContact SD-CD2 4.5Å; M670-Y678 HydrophobicContact SD-CG 4.01Å
671	D	95.8	Very high	96.8	Very high	70 Å²	70	68.2 Å²	68.2	37%	0.374	33%	0.331	S	S	.	.			trans	-79.2	-176.9	168.4	81.4	6.2	0	0	0	112.4	N673 D674 I675	D671-N673 VanDerWaalsContact C-N 3.28Å; D671-N673 PolarHBondContact O-N 3.45Å; D671-N673 WeakPolarHBondContact OD1-CA 3.33Å; D671-N673 WeakPolarHBondContact OD1-CB 3.33Å; D671-N673 PolarHBondContact OD1-N 3.08Å; D671-D674 PolarHBondContact N-OD2 3.33Å; D671-D674 PolarHBondContact O-N 3.48Å; D671-D674 PolarHBondContact OD1-N 3.44Å; D671-I675 WeakPolarHBondContact O-CB 3.42Å; D671-I675 WeakPolarHBondContact O-CG1 3.5Å; D671-I675 PolarHBondContact O-N 2.87Å
672	F	96.6	Very high	96.9	Very high	57 Å²	57	67.6 Å²	67.6	25%	0.25	33%	0.329	C	S	.	.	H	α-helix	trans	-49.1	-45.2	175.1	178.5	-82.9	0	0	0	113.7	A274 F279 A676	A274-F672 HydrophobicContact CB-CB 4.12Å; A274-F672 HydrophobicContact CB-CD2 4.02Å; F279-F672 HydrophobicContact CB-CZ 4.28Å; F279-F672 HydrophobicContact CD1-CD2 4Å; F279-F672 AromaticContact CD1-CE2 3.74Å; F279-F672 HydrophobicContact CD1-CE2 3.74Å; F279-F672 HydrophobicContact CD1-CZ 4.26Å; F672-A676 WeakPolarHBondContact O-CB 3.11Å; F672-A676 PolarHBondContact O-N 3.42Å
673	N	96.6	Very high	96.8	Very high	96 Å²	96	66.3 Å²	66.3	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-73.2	-42.7	-176	-56.5	-73.2	0	0	0	110.7	D671 I675 A676 M677	D671-N673 VanDerWaalsContact C-N 3.28Å; D671-N673 PolarHBondContact O-N 3.45Å; D671-N673 WeakPolarHBondContact OD1-CA 3.33Å; D671-N673 WeakPolarHBondContact OD1-CB 3.33Å; D671-N673 PolarHBondContact OD1-N 3.08Å; N673-I675 VanDerWaalsContact C-N 3.33Å; N673-I675 PolarHBondContact O-N 3.08Å; N673-A676 PolarHBondContact O-N 3.43Å; N673-M677 WeakPolarHBondContact O-CB 3.48Å; N673-M677 WeakPolarHBondContact O-CG 3.17Å; N673-M677 PolarHBondContact O-N 2.98Å
674	D	97.4	Very high	96.8	Very high	83 Å²	83	66.5 Å²	66.5	44%	0.444	33%	0.325	S	S	.	.	H	α-helix	trans	-60	-43.4	174.5	-73.5	-36.5	0	0	0	111.1	M670 D671 Y678	M670-D674 HydrophobicContact CB-CB 3.52Å; M670-D674 HydrophobicContact CG-CB 3.94Å; D671-D674 PolarHBondContact N-OD2 3.33Å; D671-D674 PolarHBondContact O-N 3.48Å; D671-D674 PolarHBondContact OD1-N 3.44Å; D674-Y678 WeakPolarHBondContact O-CB 3.32Å; D674-Y678 PolarHBondContact O-N 3.43Å
675	I	97.1	Very high	96.8	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-46.7	176.6	-68.8	166.3	0	0	0	110.7	L269 A274 F279 I665 M670 D671 N673 Y678 F679	L269-I675 HydrophobicContact CD2-CD1 3.63Å; A274-I675 HydrophobicContact CB-CD1 4.23Å; F279-I675 HydrophobicContact CD1-CG2 4.41Å; F279-I675 HydrophobicContact CD2-CG2 4.16Å; F279-I675 HydrophobicContact CE1-CG2 4.04Å; F279-I675 HydrophobicContact CE2-CG2 3.76Å; F279-I675 HydrophobicContact CG-CG2 4.48Å; F279-I675 HydrophobicContact CZ-CG2 3.71Å; I665-I675 HydrophobicContact CG2-CD1 3.83Å; I665-I675 HydrophobicContact CG2-CG1 3.82Å; M670-I675 HydrophobicContact CB-CG1 3.72Å; D671-I675 WeakPolarHBondContact O-CB 3.42Å; D671-I675 WeakPolarHBondContact O-CG1 3.5Å; D671-I675 PolarHBondContact O-N 2.87Å; N673-I675 VanDerWaalsContact C-N 3.33Å; N673-I675 PolarHBondContact O-N 3.08Å; I675-Y678 PolarHBondContact O-N 3.4Å; I675-F679 HydrophobicContact CG2-CD2 3.74Å; I675-F679 HydrophobicContact CG2-CE2 3.77Å; I675-F679 WeakPolarHBondContact O-CD2 3.45Å; I675-F679 PolarHBondContact O-N 2.97Å
676	A	96.2	Very high	96.7	Very high	23 Å²	23	73.6 Å²	73.6	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-50.4	178.2	0	0	0	0	0	111.6	F279 F672 N673 Y678 F679 D680	F279-A676 HydrophobicContact CB-CB 3.68Å; F279-A676 HydrophobicContact CG-CB 4.44Å; F672-A676 WeakPolarHBondContact O-CB 3.11Å; F672-A676 PolarHBondContact O-N 3.42Å; N673-A676 PolarHBondContact O-N 3.43Å; A676-Y678 VanDerWaalsContact C-N 3.29Å; A676-Y678 PolarHBondContact O-N 2.9Å; A676-F679 PolarHBondContact O-N 3.08Å; A676-D680 PolarHBondContact O-N 2.92Å
677	M	97	Very high	96.6	Very high	139 Å²	139	75 Å²	75	69%	0.685	36%	0.357	S	S	*	.	H	α-helix	trans	-61.7	-37.2	176	-73.2	-177.5	61.9	0	0	112.2	N673 S681	N673-M677 WeakPolarHBondContact O-CB 3.48Å; N673-M677 WeakPolarHBondContact O-CG 3.17Å; N673-M677 PolarHBondContact O-N 2.98Å; M677-S681 WeakPolarHBondContact O-CB 3.41Å; M677-S681 PolarHBondContact O-N 2.86Å
678	Y	97.4	Very high	96.5	Very high	31 Å²	31	67.9 Å²	67.9	12%	0.122	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-50.1	177.2	175.2	-103.9	0	0	0	111.4	H661 L664 I665 M670 D674 I675 A676 S681 L682	H661-Y678 HydrophobicContact CB-CE1 3.87Å; H661-Y678 AromaticContact CG-CE1 3.89Å; H661-Y678 AromaticContact ND1-CZ 4Å; H661-Y678 PolarHBondContact ND1-OH 2.96Å; L664-Y678 HydrophobicContact CD2-CE2 3.68Å; L664-Y678 WeakPolarHBondContact CD2-OH 3.47Å; I665-Y678 HydrophobicContact CG1-CD1 4.45Å; M670-Y678 HydrophobicContact CE-CD2 3.92Å; M670-Y678 HydrophobicContact CE-CE2 4.34Å; M670-Y678 HydrophobicContact CE-CG 4Å; M670-Y678 HydrophobicContact SD-CD1 4.39Å; M670-Y678 HydrophobicContact SD-CD2 4.5Å; M670-Y678 HydrophobicContact SD-CG 4.01Å; D674-Y678 WeakPolarHBondContact O-CB 3.32Å; D674-Y678 PolarHBondContact O-N 3.43Å; I675-Y678 PolarHBondContact O-N 3.4Å; A676-Y678 VanDerWaalsContact C-N 3.29Å; A676-Y678 PolarHBondContact O-N 2.9Å; Y678-S681 WeakPolarHBondContact O-CB 3.43Å; Y678-S681 PolarHBondContact O-N 3.46Å; Y678-S681 VanDerWaalsContact O-N 3.13Å; Y678-S681 PolarHBondContact O-OG 2.93Å; Y678-L682 HydrophobicContact CD1-CD1 4.22Å; Y678-L682 HydrophobicContact CE1-CD1 3.54Å; Y678-L682 HydrophobicContact CE1-CG 4.44Å; Y678-L682 HydrophobicContact CE2-CD1 4.36Å; Y678-L682 PolarHBondContact O-N 3.39Å
679	F	97.1	Very high	96.3	Very high	5 Å²	5	68.4 Å²	68.4	2%	0.022	33%	0.326	C	S	.	.	H	α-helix	trans	-65.7	-39	176.9	-80.3	-63.2	0	0	0	112.7	F279 W283 F658 H661 I665 I675 A676 S681 L682 V683	F279-F679 HydrophobicContact CD2-CD2 4.3Å; F279-F679 HydrophobicContact CE2-CD2 4.09Å; F279-F679 HydrophobicContact CE2-CE2 4.18Å; W283-F679 AromaticContact CH2-CD1 3.69Å; W283-F679 HydrophobicContact CH2-CD1 3.69Å; W283-F679 HydrophobicContact CH2-CD2 4.47Å; W283-F679 AromaticContact CH2-CE1 3.64Å; W283-F679 HydrophobicContact CH2-CE1 3.64Å; W283-F679 HydrophobicContact CH2-CE2 4.42Å; W283-F679 HydrophobicContact CH2-CG 4.13Å; W283-F679 HydrophobicContact CH2-CZ 4.03Å; W283-F679 HydrophobicContact CZ2-CB 4.13Å; W283-F679 AromaticContact CZ2-CD1 3.56Å; W283-F679 HydrophobicContact CZ2-CD1 3.56Å; W283-F679 HydrophobicContact CZ2-CD2 4.45Å; W283-F679 HydrophobicContact CZ2-CE1 4.03Å; W283-F679 AromaticContact CZ2-CG 3.81Å; W283-F679 HydrophobicContact CZ2-CG 3.81Å; F658-F679 HydrophobicContact CD1-CE2 4.12Å; F658-F679 HydrophobicContact CD1-CZ 4.01Å; F658-F679 AromaticContact CE1-CE2 3.94Å; F658-F679 HydrophobicContact CE1-CE2 3.94Å; F658-F679 HydrophobicContact CE1-CZ 4.23Å; H661-F679 HydrophobicContact CB-CE1 4.46Å; H661-F679 HydrophobicContact CB-CZ 4.41Å; H661-F679 AromaticContact CD2-CE1 3.81Å; I665-F679 HydrophobicContact CD1-CE2 4.01Å; I665-F679 HydrophobicContact CD1-CZ 4.09Å; I675-F679 HydrophobicContact CG2-CD2 3.74Å; I675-F679 HydrophobicContact CG2-CE2 3.77Å; I675-F679 WeakPolarHBondContact O-CD2 3.45Å; I675-F679 PolarHBondContact O-N 2.97Å; A676-F679 PolarHBondContact O-N 3.08Å; F679-S681 PolarHBondContact O-N 2.71Å; F679-L682 HydrophobicContact CD1-CD1 4.32Å; F679-L682 WeakPolarHBondContact O-CA 3.44Å; F679-L682 WeakPolarHBondContact O-CB 3.48Å; F679-L682 PolarHBondContact O-N 3.09Å; F679-V683 PolarHBondContact O-N 3.34Å
680	D	95.7	Very high	96.2	Very high	63 Å²	63	65.3 Å²	65.3	34%	0.337	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-31.7	172.2	-92.8	-17.6	0	0	0	112.5	R282 A676 L682 V683	R282-D680 IonicContact CZ-OD1 3.7Å; R282-D680 IonicContact NH1-OD1 3.89Å; R282-D680 PolarHBondContact NH1-OD1 2.95Å; R282-D680 IonicContact NH1-OD2 3.24Å; R282-D680 IonicContact NH2-OD1 2.72Å; R282-D680 PolarHBondContact NH2-OD1 3.27Å; A676-D680 PolarHBondContact O-N 2.92Å; D680-L682 PolarHBondContact O-N 3.19Å; D680-V683 WeakPolarHBondContact O-CB 3.29Å; D680-V683 WeakPolarHBondContact O-CG2 3.43Å; D680-V683 PolarHBondContact O-N 2.93Å
681	S	96.8	Very high	96.2	Very high	55 Å²	55	64.9 Å²	64.9	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-71.1	-15.2	172.4	87.9	0	0	0	0	114.1	M677 Y678 F679 R685	M677-S681 WeakPolarHBondContact O-CB 3.41Å; M677-S681 PolarHBondContact O-N 2.86Å; Y678-S681 WeakPolarHBondContact O-CB 3.43Å; Y678-S681 PolarHBondContact O-N 3.46Å; Y678-S681 VanDerWaalsContact O-N 3.13Å; Y678-S681 PolarHBondContact O-OG 2.93Å; F679-S681 PolarHBondContact O-N 2.71Å; S681-R685 WeakPolarHBondContact O-CD 3.48Å; S681-R685 PolarHBondContact O-NH1 3.24Å
682	L	96.4	Very high	96.2	Very high	24 Å²	24	61.7 Å²	61.7	13%	0.126	29%	0.294	C	S	.	.	H	α-helix	trans	-97.6	-3.4	177.7	-66.8	-179.7	0	0	0	113.9	Y678 F679 D680 K684 R685 H686	Y678-L682 HydrophobicContact CD1-CD1 4.22Å; Y678-L682 HydrophobicContact CE1-CD1 3.54Å; Y678-L682 HydrophobicContact CE1-CG 4.44Å; Y678-L682 HydrophobicContact CE2-CD1 4.36Å; Y678-L682 PolarHBondContact O-N 3.39Å; F679-L682 HydrophobicContact CD1-CD1 4.32Å; F679-L682 WeakPolarHBondContact O-CA 3.44Å; F679-L682 WeakPolarHBondContact O-CB 3.48Å; F679-L682 PolarHBondContact O-N 3.09Å; D680-L682 PolarHBondContact O-N 3.19Å; L682-K684 PolarHBondContact O-N 2.97Å; L682-K684 VanDerWaalsContact O-N 3.17Å; L682-R685 WeakPolarHBondContact O-CA 3.05Å; L682-R685 VanDerWaalsContact O-CB 3.31Å; L682-R685 WeakPolarHBondContact O-CB 3.27Å; L682-R685 PolarHBondContact O-N 3.5Å; L682-H686 WeakPolarHBondContact CB-NE2 3.36Å; L682-H686 PolarHBondContact O-CD2 2.94Å
683	V	96	Very high	96.1	Very high	45 Å²	45	62.9 Å²	62.9	27%	0.273	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	121.5	173.8	163.4	0	0	0	0	111	F679 D680 R685	F679-V683 PolarHBondContact O-N 3.34Å; D680-V683 WeakPolarHBondContact O-CB 3.29Å; D680-V683 WeakPolarHBondContact O-CG2 3.43Å; D680-V683 PolarHBondContact O-N 2.93Å; V683-R685 VanDerWaalsContact C-N 3.29Å; V683-R685 PolarHBondContact O-N 3.03Å
684	K	95.8	Very high	96	Very high	105 Å²	105	61.7 Å²	61.7	46%	0.457	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	16.7	-176.5	-48.7	-176.9	176.9	-178.8	0	115.6	E291 F292 T293 L682	E291-K684 VanDerWaalsContact O-CA 3.32Å; E291-K684 WeakPolarHBondContact O-CA 3.34Å; E291-K684 PolarHBondContact O-N 3.3Å; F292-K684 WeakPolarHBondContact O-CG 3.19Å; T293-K684 HydrophobicContact CG2-CB 4.31Å; T293-K684 WeakPolarHBondContact CG2-O 3.4Å; L682-K684 PolarHBondContact O-N 2.97Å; L682-K684 VanDerWaalsContact O-N 3.17Å
685	R	96.5	Very high	96	Very high	187 Å²	187	57.8 Å²	57.8	71%	0.706	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-7	179.9	-58.1	175.4	175.3	170.5	-7.5	114	S681 L682 V683	S681-R685 WeakPolarHBondContact O-CD 3.48Å; S681-R685 PolarHBondContact O-NH1 3.24Å; L682-R685 WeakPolarHBondContact O-CA 3.05Å; L682-R685 VanDerWaalsContact O-CB 3.31Å; L682-R685 WeakPolarHBondContact O-CB 3.27Å; L682-R685 PolarHBondContact O-N 3.5Å; V683-R685 VanDerWaalsContact C-N 3.29Å; V683-R685 PolarHBondContact O-N 3.03Å
686	H	95.2	Very high	95.8	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.037	27%	0.272	C	S	.	.	S	Bend	trans	-68.7	139.4	176.1	-66	-78.5	0	0	0	112.3	F292 L657 H661 L682 V688	F292-H686 HydrophobicContact CD1-CB 4.06Å; F292-H686 HydrophobicContact CE1-CB 3.52Å; F292-H686 HydrophobicContact CZ-CB 4.11Å; L657-H686 HydrophobicContact CD2-CB 4.15Å; L657-H686 VanDerWaalsContact CD2-ND1 3.33Å; L657-H686 WeakPolarHBondContact CD2-ND1 3.29Å; H661-H686 AromaticContact NE2-CE1 2.94Å; H661-H686 PolarHBondContact NE2-CE1 3.35Å; H661-H686 AromaticContact NE2-ND1 2.69Å; H661-H686 PolarHBondContact NE2-ND1 3.01Å; L682-H686 WeakPolarHBondContact CB-NE2 3.36Å; L682-H686 PolarHBondContact O-CD2 2.94Å; H686-V688 PolarHBondContact O-N 3.24Å
687	N	95.5	Very high	95.7	Very high	90 Å²	90	59.7 Å²	59.7	48%	0.481	28%	0.277	S	S	.	.			trans	-82.1	97.7	175.9	-177	-38.6	0	0	0	110.2	R689 K690 V691	N687-R689 PolarHBondContact O-N 3.27Å; N687-R689 VanDerWaalsContact O-N 3.16Å; N687-R689 PolarHBondContact OD1-N 3.17Å; N687-K690 HydrophobicContact CB-CB 4.07Å; N687-K690 PolarHBondContact O-N 3.47Å; N687-K690 VanDerWaalsContact O-N 3.13Å; N687-K690 PolarHBondContact OD1-N 3.24Å; N687-K690 VanDerWaalsContact OD1-N 3.08Å; N687-V691 WeakPolarHBondContact O-CG2 3.47Å; N687-V691 PolarHBondContact O-N 3.2Å
688	V	95.8	Very high	95.5	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-55	-36.5	-175.5	73	0	0	0	0	113.6	F292 D296 L299 L300 H686 L692	F292-V688 HydrophobicContact CD1-CB 3.76Å; F292-V688 HydrophobicContact CD1-CG2 4.01Å; F292-V688 HydrophobicContact CE1-CB 3.8Å; F292-V688 HydrophobicContact CE1-CG2 3.99Å; D296-V688 HydrophobicContact CB-CB 3.92Å; D296-V688 HydrophobicContact CB-CG1 3.8Å; D296-V688 HydrophobicContact CB-CG2 4.31Å; D296-V688 WeakPolarHBondContact OD1-CG1 3.44Å; L299-V688 HydrophobicContact CD2-CG1 3.99Å; L300-V688 HydrophobicContact CB-CG2 4.34Å; L300-V688 HydrophobicContact CD1-CG2 3.78Å; H686-V688 PolarHBondContact O-N 3.24Å; V688-L692 HydrophobicContact CG2-CD1 3.9Å; V688-L692 HydrophobicContact CG2-CG 4.21Å; V688-L692 VanDerWaalsContact O-CB 3.26Å; V688-L692 WeakPolarHBondContact O-CB 3.27Å; V688-L692 VanDerWaalsContact O-CG 3.27Å; V688-L692 WeakPolarHBondContact O-CG 3.25Å; V688-L692 PolarHBondContact O-N 3.1Å
689	R	94.3	Very high	95.2	Very high	174 Å²	174	53.9 Å²	53.9	66%	0.657	25%	0.248	S	C	*	.	H	α-helix	trans	-68.8	-43.1	-179.1	-66.9	-173.2	-177.2	166.5	2.8	111.4	N687 Q693	N687-R689 PolarHBondContact O-N 3.27Å; N687-R689 VanDerWaalsContact O-N 3.16Å; N687-R689 PolarHBondContact OD1-N 3.17Å; R689-Q693 VanDerWaalsContact O-CB 3.29Å; R689-Q693 WeakPolarHBondContact O-CB 3.25Å; R689-Q693 PolarHBondContact O-N 2.88Å
690	K	94.6	Very high	94.8	Very high	103 Å²	103	55.6 Å²	55.6	45%	0.448	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-47.7	176.2	-176.5	-175.3	168.5	-164.6	0	111.1	E660 N687 Q693 Q694	E660-K690 WeakPolarHBondContact OE1-CD 3.31Å; E660-K690 VanDerWaalsContact OE1-CE 3.29Å; E660-K690 WeakPolarHBondContact OE1-CE 3.26Å; E660-K690 IonicContact OE1-NZ 3.43Å; E660-K690 PolarHBondContact OE1-NZ 3.34Å; N687-K690 HydrophobicContact CB-CB 4.07Å; N687-K690 PolarHBondContact O-N 3.47Å; N687-K690 VanDerWaalsContact O-N 3.13Å; N687-K690 PolarHBondContact OD1-N 3.24Å; N687-K690 VanDerWaalsContact OD1-N 3.08Å; K690-Q693 PolarHBondContact O-N 2.68Å; K690-Q694 WeakPolarHBondContact O-CB 3.49Å; K690-Q694 PolarHBondContact O-N 3.41Å
691	V	96.6	Very high	94.5	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-48.5	178.5	176.4	0	0	0	0	110.8	F292 I653 A656 L657 N687 Q693 Q694 A695	F292-V691 HydrophobicContact CZ-CB 4.42Å; F292-V691 HydrophobicContact CZ-CG1 4.27Å; F292-V691 HydrophobicContact CZ-CG2 4.45Å; I653-V691 HydrophobicContact CG2-CG1 3.81Å; A656-V691 HydrophobicContact CB-CG1 4.07Å; L657-V691 HydrophobicContact CD2-CG1 4.02Å; L657-V691 HydrophobicContact CD2-CG2 3.73Å; L657-V691 HydrophobicContact CG-CG1 3.93Å; L657-V691 HydrophobicContact CG-CG2 4.48Å; N687-V691 WeakPolarHBondContact O-CG2 3.47Å; N687-V691 PolarHBondContact O-N 3.2Å; V691-Q693 PolarHBondContact O-N 3.43Å; V691-Q694 PolarHBondContact O-N 3.12Å; V691-A695 WeakPolarHBondContact O-CB 3.35Å; V691-A695 PolarHBondContact O-N 2.72Å
692	L	95.9	Very high	94	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-39	177.1	-74.8	176.1	0	0	0	112.5	L299 L300 V303 F649 I653 V688 A695 R696	L299-L692 HydrophobicContact CD2-CD1 4.33Å; L299-L692 HydrophobicContact CG-CD1 4.05Å; L300-L692 HydrophobicContact CD1-CD1 4.41Å; L300-L692 HydrophobicContact CD1-CD2 3.73Å; L300-L692 HydrophobicContact CD1-CG 3.99Å; V303-L692 HydrophobicContact CB-CD1 4.37Å; V303-L692 HydrophobicContact CB-CD2 4.31Å; V303-L692 HydrophobicContact CG1-CD2 3.99Å; V303-L692 HydrophobicContact CG2-CD1 4.19Å; F649-L692 HydrophobicContact CE1-CD2 4.05Å; F649-L692 HydrophobicContact CZ-CD2 4.39Å; I653-L692 HydrophobicContact CD1-CD2 4.1Å; I653-L692 HydrophobicContact CG1-CD2 4.36Å; V688-L692 HydrophobicContact CG2-CD1 3.9Å; V688-L692 HydrophobicContact CG2-CG 4.21Å; V688-L692 VanDerWaalsContact O-CB 3.26Å; V688-L692 WeakPolarHBondContact O-CB 3.27Å; V688-L692 VanDerWaalsContact O-CG 3.27Å; V688-L692 WeakPolarHBondContact O-CG 3.25Å; V688-L692 PolarHBondContact O-N 3.1Å; L692-A695 PolarHBondContact O-N 3.41Å; L692-R696 VanDerWaalsContact O-CG 3.27Å; L692-R696 WeakPolarHBondContact O-CG 3.46Å; L692-R696 PolarHBondContact O-N 3.42Å
693	Q	94.4	Very high	93.3	Very high	82 Å²	82	56.4 Å²	56.4	38%	0.383	25%	0.252	S	S	.	.	H	α-helix	trans	-61.9	-45.7	175.1	-177.4	175.4	5.2	0	0	111.3	R689 K690 V691 R696 I697	R689-Q693 VanDerWaalsContact O-CB 3.29Å; R689-Q693 WeakPolarHBondContact O-CB 3.25Å; R689-Q693 PolarHBondContact O-N 2.88Å; K690-Q693 PolarHBondContact O-N 2.68Å; V691-Q693 PolarHBondContact O-N 3.43Å; Q693-R696 PolarHBondContact O-N 2.92Å; Q693-I697 HydrophobicContact CG-CD1 4.41Å; Q693-I697 WeakPolarHBondContact O-CG1 3.5Å; Q693-I697 PolarHBondContact O-N 2.81Å; Q693-I697 VanDerWaalsContact O-N 3.15Å
694	Q	94.8	Very high	92.6	Very high	72 Å²	72	57.8 Å²	57.8	34%	0.336	26%	0.264	S	S	.	.	H	α-helix	trans	-65.8	-41	178.7	-166.4	63.2	50.9	0	0	111.9	A656 K690 V691 R696 I697 F698	A656-Q694 HydrophobicContact CB-CB 4.02Å; A656-Q694 HydrophobicContact CB-CG 4.17Å; K690-Q694 WeakPolarHBondContact O-CB 3.49Å; K690-Q694 PolarHBondContact O-N 3.41Å; V691-Q694 PolarHBondContact O-N 3.12Å; Q694-R696 PolarHBondContact O-N 3.46Å; Q694-I697 PolarHBondContact O-N 3.22Å; Q694-F698 HydrophobicContact CG-CD2 4.16Å; Q694-F698 HydrophobicContact CG-CE2 3.54Å; Q694-F698 HydrophobicContact CG-CZ 3.75Å; Q694-F698 WeakPolarHBondContact O-CD2 3.36Å; Q694-F698 WeakPolarHBondContact O-CG 3.27Å; Q694-F698 PolarHBondContact O-N 3.09Å; Q694-F698 VanDerWaalsContact O-N 3.07Å
695	A	96.3	Very high	91.8	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-39.2	175.1	0	0	0	0	0	112.6	F649 F652 I653 A656 V691 L692 Y699	F649-A695 HydrophobicContact CE2-CB 3.98Å; F649-A695 HydrophobicContact CZ-CB 3.84Å; F652-A695 HydrophobicContact CB-CB 4.34Å; I653-A695 HydrophobicContact CB-CB 4.46Å; I653-A695 HydrophobicContact CG1-CB 3.98Å; A656-A695 HydrophobicContact CB-CB 4.14Å; V691-A695 WeakPolarHBondContact O-CB 3.35Å; V691-A695 PolarHBondContact O-N 2.72Å; L692-A695 PolarHBondContact O-N 3.41Å; A695-Y699 VanDerWaalsContact O-CB 3.26Å; A695-Y699 WeakPolarHBondContact O-CB 3.48Å; A695-Y699 PolarHBondContact O-N 2.95Å
696	R	94.4	Very high	90.7	Very high	8 Å²	8	48.4 Å²	48.4	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-43.4	173.9	-73.4	-176.5	-167.1	103.1	-4.9	111.9	Y94 F649 L692 Q693 Q694 Y699 S700	Y94-R696 HydrophobicContact CE1-CG 4.03Å; Y94-R696 VanDerWaalsContact O-CZ 3.3Å; Y94-R696 PolarHBondContact O-NE 2.88Å; Y94-R696 PolarHBondContact O-NH2 2.92Å; F649-R696 HydrophobicContact CE2-CG 4.23Å; F649-R696 HydrophobicContact CZ-CG 4.04Å; L692-R696 VanDerWaalsContact O-CG 3.27Å; L692-R696 WeakPolarHBondContact O-CG 3.46Å; L692-R696 PolarHBondContact O-N 3.42Å; Q693-R696 PolarHBondContact O-N 2.92Å; Q694-R696 PolarHBondContact O-N 3.46Å; R696-Y699 PolarHBondContact O-N 3.45Å; R696-S700 WeakPolarHBondContact O-CB 3.49Å; R696-S700 PolarHBondContact O-N 3.38Å; R696-S700 PolarHBondContact O-OG 2.84Å
697	I	93.2	Very high	89.4	Confident	56 Å²	56	50.4 Å²	50.4	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-58.7	-58.8	176.9	-67.6	165.1	0	0	0	109.5	Q693 Q694 Y699 S700 E701	Q693-I697 HydrophobicContact CG-CD1 4.41Å; Q693-I697 WeakPolarHBondContact O-CG1 3.5Å; Q693-I697 PolarHBondContact O-N 2.81Å; Q693-I697 VanDerWaalsContact O-N 3.15Å; Q694-I697 PolarHBondContact O-N 3.22Å; I697-Y699 VanDerWaalsContact C-N 3.33Å; I697-Y699 PolarHBondContact O-N 2.96Å; I697-S700 PolarHBondContact O-N 3.45Å; I697-S700 VanDerWaalsContact O-N 3.09Å; I697-S700 PolarHBondContact O-OG 3.14Å; I697-E701 HydrophobicContact CG2-CG 4.39Å; I697-E701 WeakPolarHBondContact CG2-OE1 3.35Å; I697-E701 WeakPolarHBondContact O-CG 3.25Å; I697-E701 PolarHBondContact O-N 3.23Å
698	F	93	Very high	88	Confident	21 Å²	21	48.6 Å²	48.6	9%	0.092	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-43.6	179.9	-61.3	-34.3	0	0	0	112.5	Y261 F652 V655 A656 L659 Q694 S700 E701 Y702	Y261-F698 AromaticContact CD1-CD1 3.77Å; Y261-F698 HydrophobicContact CD1-CD1 3.77Å; Y261-F698 HydrophobicContact CD1-CE1 4.03Å; Y261-F698 HydrophobicContact CD1-CG 4.23Å; Y261-F698 HydrophobicContact CE1-CB 3.93Å; Y261-F698 AromaticContact CE1-CD1 3.52Å; Y261-F698 HydrophobicContact CE1-CD1 3.52Å; Y261-F698 HydrophobicContact CE1-CE1 4.21Å; Y261-F698 AromaticContact CE1-CG 3.92Å; Y261-F698 HydrophobicContact CE1-CG 3.92Å; Y261-F698 HydrophobicContact CE2-CB 4.47Å; Y261-F698 PolarHBondContact OH-O 3.36Å; F652-F698 HydrophobicContact CD1-CB 3.74Å; F652-F698 HydrophobicContact CE1-CB 4.46Å; V655-F698 HydrophobicContact CG1-CD2 4.2Å; V655-F698 HydrophobicContact CG1-CE2 4.2Å; A656-F698 HydrophobicContact CB-CD2 4.49Å; A656-F698 HydrophobicContact CB-CE2 4.39Å; L659-F698 HydrophobicContact CD1-CE1 4.49Å; L659-F698 HydrophobicContact CD1-CE2 3.74Å; L659-F698 HydrophobicContact CD1-CZ 3.59Å; Q694-F698 HydrophobicContact CG-CD2 4.16Å; Q694-F698 HydrophobicContact CG-CE2 3.54Å; Q694-F698 HydrophobicContact CG-CZ 3.75Å; Q694-F698 WeakPolarHBondContact O-CD2 3.36Å; Q694-F698 WeakPolarHBondContact O-CG 3.27Å; Q694-F698 PolarHBondContact O-N 3.09Å; Q694-F698 VanDerWaalsContact O-N 3.07Å; F698-S700 VanDerWaalsContact C-N 3.33Å; F698-S700 PolarHBondContact O-N 3.34Å; F698-E701 PolarHBondContact O-N 3.32Å; F698-Y702 WeakPolarHBondContact O-CB 3.3Å; F698-Y702 PolarHBondContact O-N 3.38Å
699	Y	91.7	Very high	86.2	Confident	26 Å²	26	52.1 Å²	52.1	10%	0.102	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-40.3	178.3	-175	-123.5	0	0	0	112.6	Y94 P648 F649 F652 A695 R696 I697 R703	Y94-Y699 WeakPolarHBondContact OH-CD1 3.43Å; P648-Y699 HydrophobicContact CB-CE2 4.05Å; P648-Y699 HydrophobicContact CG-CE2 4.2Å; F649-Y699 AromaticContact CD2-CD1 3.88Å; F649-Y699 HydrophobicContact CD2-CD1 3.88Å; F649-Y699 AromaticContact CD2-CG 3.84Å; F649-Y699 HydrophobicContact CD2-CG 3.84Å; F649-Y699 HydrophobicContact CE2-CD1 4.46Å; F649-Y699 HydrophobicContact CE2-CG 4.46Å; F652-Y699 AromaticContact CD2-CD2 3.54Å; F652-Y699 HydrophobicContact CD2-CD2 3.54Å; F652-Y699 HydrophobicContact CD2-CE2 4.38Å; F652-Y699 HydrophobicContact CD2-CG 4.24Å; F652-Y699 AromaticContact CE2-CD2 3.47Å; F652-Y699 HydrophobicContact CE2-CD2 3.47Å; F652-Y699 VanDerWaalsContact CE2-CD2 3.47Å; F652-Y699 HydrophobicContact CE2-CE2 4.09Å; F652-Y699 HydrophobicContact CE2-CG 4.5Å; F652-Y699 HydrophobicContact CG-CD2 4.26Å; F652-Y699 HydrophobicContact CZ-CD2 4.09Å; A695-Y699 VanDerWaalsContact O-CB 3.26Å; A695-Y699 WeakPolarHBondContact O-CB 3.48Å; A695-Y699 PolarHBondContact O-N 2.95Å; R696-Y699 PolarHBondContact O-N 3.45Å; I697-Y699 VanDerWaalsContact C-N 3.33Å; I697-Y699 PolarHBondContact O-N 2.96Å; Y699-R703 WeakPolarHBondContact O-CB 3.45Å; Y699-R703 PolarHBondContact O-N 3.07Å
700	S	87.8	Confident	84.5	Confident	41 Å²	41	48.1 Å²	48.1	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-68.1	-39.9	177.2	72.7	0	0	0	0	113	R696 I697 F698 S704	R696-S700 WeakPolarHBondContact O-CB 3.49Å; R696-S700 PolarHBondContact O-N 3.38Å; R696-S700 PolarHBondContact O-OG 2.84Å; I697-S700 PolarHBondContact O-N 3.45Å; I697-S700 VanDerWaalsContact O-N 3.09Å; I697-S700 PolarHBondContact O-OG 3.14Å; F698-S700 VanDerWaalsContact C-N 3.33Å; F698-S700 PolarHBondContact O-N 3.34Å; S700-S704 WeakPolarHBondContact O-CB 3.36Å; S700-S704 PolarHBondContact O-N 2.93Å; S700-S704 PolarHBondContact O-OG 3.5Å
701	E	88.9	Confident	82.7	Confident	85 Å²	85	47.2 Å²	47.2	40%	0.397	25%	0.247	S	C	.	.	H	α-helix	trans	-64.1	-46.9	175.4	-70.9	171.8	165	0	0	110.9	I697 F698 S704 N705	I697-E701 HydrophobicContact CG2-CG 4.39Å; I697-E701 WeakPolarHBondContact CG2-OE1 3.35Å; I697-E701 WeakPolarHBondContact O-CG 3.25Å; I697-E701 PolarHBondContact O-N 3.23Å; F698-E701 PolarHBondContact O-N 3.32Å; E701-S704 PolarHBondContact O-N 2.95Å; E701-N705 WeakPolarHBondContact O-CB 3.31Å; E701-N705 VanDerWaalsContact O-CG 3.25Å; E701-N705 PolarHBondContact O-N 2.97Å; E701-N705 PolarHBondContact O-ND2 3.34Å
702	Y	87	Confident	80.7	Confident	16 Å²	16	50.5 Å²	50.5	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-58.3	-51.1	177.1	-167.3	-96.1	0	0	0	111.7	L257 H260 Y261 T640 L643 F652 F698 S704 N705 C706	L257-Y702 HydrophobicContact CD2-CD2 4.13Å; L257-Y702 HydrophobicContact CD2-CE2 3.78Å; H260-Y702 AromaticContact CD2-CD2 3.92Å; H260-Y702 AromaticContact CD2-CE2 3.93Å; Y261-Y702 HydrophobicContact CE2-CD2 4.39Å; Y261-Y702 WeakPolarHBondContact OH-CB 3.2Å; T640-Y702 HydrophobicContact CG2-CD1 3.75Å; T640-Y702 HydrophobicContact CG2-CE1 3.67Å; L643-Y702 HydrophobicContact CD2-CE1 4.2Å; F652-Y702 HydrophobicContact CE1-CD2 4.27Å; F652-Y702 AromaticContact CE1-CG 3.99Å; F652-Y702 HydrophobicContact CE1-CG 3.99Å; F652-Y702 AromaticContact CZ-CD1 3.84Å; F652-Y702 HydrophobicContact CZ-CD1 3.84Å; F652-Y702 HydrophobicContact CZ-CD2 4.11Å; F652-Y702 HydrophobicContact CZ-CE1 4.47Å; F652-Y702 AromaticContact CZ-CG 3.63Å; F652-Y702 HydrophobicContact CZ-CG 3.63Å; F698-Y702 WeakPolarHBondContact O-CB 3.3Å; F698-Y702 PolarHBondContact O-N 3.38Å; Y702-S704 VanDerWaalsContact C-N 3.34Å; Y702-S704 PolarHBondContact O-N 2.79Å; Y702-N705 PolarHBondContact O-N 2.79Å; Y702-C706 PolarHBondContact O-N 3.3Å; Y702-C706 PolarHBondContact O-SG 3.32Å; Y702-C706 VanDerWaalsContact O-SG 3.36Å
703	R	81.2	Confident	78.7	Confident	59 Å²	59	54.6 Å²	54.6	22%	0.223	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-41.3	179.2	-175.6	175.9	175.2	141.2	2.1	112	H45 Y699 C706 N707	H45-R703 VanDerWaalsContact CE1-CZ 3.41Å; H45-R703 PolarHBondContact CE1-NH1 3.48Å; H45-R703 PolarHBondContact CE1-NH2 3.01Å; H45-R703 PolarHBondContact NE2-NH1 3.26Å; H45-R703 PolarHBondContact NE2-NH2 3.26Å; Y699-R703 WeakPolarHBondContact O-CB 3.45Å; Y699-R703 PolarHBondContact O-N 3.07Å; R703-C706 PolarHBondContact O-N 3.34Å; R703-N707 WeakPolarHBondContact O-CB 3.09Å; R703-N707 PolarHBondContact O-N 2.79Å
704	S	81.8	Confident	76.9	Confident	74 Å²	74	55.8 Å²	55.8	52%	0.517	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-44.6	177.2	-58.4	0	0	0	0	111.6	S700 E701 Y702 N707 A708	S700-S704 WeakPolarHBondContact O-CB 3.36Å; S700-S704 PolarHBondContact O-N 2.93Å; S700-S704 PolarHBondContact O-OG 3.5Å; E701-S704 PolarHBondContact O-N 2.95Å; Y702-S704 VanDerWaalsContact C-N 3.34Å; Y702-S704 PolarHBondContact O-N 2.79Å; S704-N707 PolarHBondContact O-N 3.09Å; S704-A708 WeakPolarHBondContact O-CB 3.45Å; S704-A708 PolarHBondContact O-N 3.34Å
705	N	79.5	Confident	75.1	Confident	77 Å²	77	57.2 Å²	57.2	41%	0.412	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.1	-71.6	-27.9	0	0	0	112.3	E701 Y702 N707 A708 Q709	E701-N705 WeakPolarHBondContact O-CB 3.31Å; E701-N705 VanDerWaalsContact O-CG 3.25Å; E701-N705 PolarHBondContact O-N 2.97Å; E701-N705 PolarHBondContact O-ND2 3.34Å; Y702-N705 PolarHBondContact O-N 2.79Å; N705-N707 PolarHBondContact O-N 3.25Å; N705-A708 PolarHBondContact O-N 3.06Å; N705-Q709 WeakPolarHBondContact O-CG 3.35Å; N705-Q709 PolarHBondContact O-N 2.98Å; N705-Q709 VanDerWaalsContact O-N 3.12Å
706	C	73.2	Confident	72.9	Confident	18 Å²	18	62.5 Å²	62.5	12%	0.122	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-41.5	175	-71	0	0	0	0	112.3	Y702 R703 Q709 R710	Y702-C706 PolarHBondContact O-N 3.3Å; Y702-C706 PolarHBondContact O-SG 3.32Å; Y702-C706 VanDerWaalsContact O-SG 3.36Å; R703-C706 PolarHBondContact O-N 3.34Å; C706-Q709 PolarHBondContact O-N 2.97Å; C706-R710 PolarHBondContact O-N 2.96Å
707	N	68	Low	70.6	Confident	50 Å²	50	67.6 Å²	67.6	27%	0.267	36%	0.359	S	S	.	.	H	α-helix	trans	-67.6	-43.5	178.4	-79.5	1.6	0	0	0	112.2	R703 S704 N705 Q709 R710 T711	R703-N707 WeakPolarHBondContact O-CB 3.09Å; R703-N707 PolarHBondContact O-N 2.79Å; S704-N707 PolarHBondContact O-N 3.09Å; N705-N707 PolarHBondContact O-N 3.25Å; N707-Q709 PolarHBondContact O-N 3.33Å; N707-R710 PolarHBondContact O-N 3.07Å; N707-T711 PolarHBondContact O-N 3.39Å; N707-T711 PolarHBondContact O-OG1 3.27Å
708	A	65.3	Low	68.4	Low	52 Å²	52	66.4 Å²	66.4	43%	0.43	36%	0.361	S	S	.	.	H	α-helix	trans	-60.4	-33.1	175.5	0	0	0	0	0	112.7	S704 N705 T711 S712	S704-A708 WeakPolarHBondContact O-CB 3.45Å; S704-A708 PolarHBondContact O-N 3.34Å; N705-A708 PolarHBondContact O-N 3.06Å; A708-T711 WeakPolarHBondContact CA-OG1 3.37Å; A708-T711 PolarHBondContact O-OG1 2.86Å; A708-S712 PolarHBondContact O-N 3.43Å; A708-S712 PolarHBondContact O-OG 3.27Å
709	Q	58.3	Low	66.4	Low	77 Å²	77	71.1 Å²	71.1	36%	0.36	38%	0.383	S	S	.	.	H	α-helix	trans	-73.7	-47.1	175.4	-71.9	178.2	-42.8	0	0	111.8	R637 N705 C706 N707 T711 S712 D713	R637-Q709 VanDerWaalsContact NH1-CD 3.33Å; R637-Q709 VanDerWaalsContact NH1-NE2 3.16Å; N705-Q709 WeakPolarHBondContact O-CG 3.35Å; N705-Q709 PolarHBondContact O-N 2.98Å; N705-Q709 VanDerWaalsContact O-N 3.12Å; C706-Q709 PolarHBondContact O-N 2.97Å; N707-Q709 PolarHBondContact O-N 3.33Å; Q709-T711 VanDerWaalsContact C-N 3.28Å; Q709-T711 PolarHBondContact O-N 3.3Å; Q709-S712 WeakPolarHBondContact O-CB 3.24Å; Q709-S712 PolarHBondContact O-N 3.35Å; Q709-D713 PolarHBondContact O-N 3.04Å
710	R	58.6	Low	64.6	Low	89 Å²	89	74.7 Å²	74.7	34%	0.336	40%	0.401	S	S	.	.	H	α-helix	trans	-53.2	-44.2	172.9	-76.3	-177.7	177.8	-173.4	0.1	112.3	D46 C706 N707 S712 D713 V714	D46-R710 IonicContact OD1-NH1 3.11Å; D46-R710 PolarHBondContact OD1-NH1 3.42Å; D46-R710 IonicContact OD2-NH1 3.7Å; D46-R710 PolarHBondContact OD2-NH1 3.33Å; C706-R710 PolarHBondContact O-N 2.96Å; N707-R710 PolarHBondContact O-N 3.07Å; R710-S712 VanDerWaalsContact C-N 3.34Å; R710-D713 PolarHBondContact O-N 3.33Å; R710-V714 VanDerWaalsContact O-CG2 3.28Å; R710-V714 WeakPolarHBondContact O-CG2 3.4Å; R710-V714 PolarHBondContact O-N 3.11Å
711	T	57.3	Low	62.8	Low	84 Å²	84	82.3 Å²	82.3	52%	0.515	42%	0.424	S	S	.	.	H	α-helix	trans	-65.7	-37.1	177.6	47.4	0	0	0	0	112.5	N707 A708 Q709 I715	N707-T711 PolarHBondContact O-N 3.39Å; N707-T711 PolarHBondContact O-OG1 3.27Å; A708-T711 WeakPolarHBondContact CA-OG1 3.37Å; A708-T711 PolarHBondContact O-OG1 2.86Å; Q709-T711 VanDerWaalsContact C-N 3.28Å; Q709-T711 PolarHBondContact O-N 3.3Å; T711-I715 WeakPolarHBondContact O-CD1 3.31Å; T711-I715 VanDerWaalsContact O-CG1 3.26Å; T711-I715 WeakPolarHBondContact O-CG1 3.33Å; T711-I715 PolarHBondContact O-N 3.07Å; T711-I715 VanDerWaalsContact O-N 3.17Å
712	S	54.8	Low	60.9	Low	71 Å²	71	88.9 Å²	88.9	50%	0.497	45%	0.445	S	S	.	.	H	α-helix	trans	-67	-44.1	176.9	-57.9	0	0	0	0	111.8	A708 Q709 R710 I715 F716	A708-S712 PolarHBondContact O-N 3.43Å; A708-S712 PolarHBondContact O-OG 3.27Å; Q709-S712 WeakPolarHBondContact O-CB 3.24Å; Q709-S712 PolarHBondContact O-N 3.35Å; R710-S712 VanDerWaalsContact C-N 3.34Å; S712-I715 PolarHBondContact O-N 3.18Å; S712-F716 WeakPolarHBondContact O-CB 3.45Å; S712-F716 PolarHBondContact O-N 3.31Å
713	D	53	Low	59.4	Low	88 Å²	88	92.5 Å²	92.5	47%	0.471	48%	0.478	S	S	.	.	H	α-helix	trans	-64.1	-43.6	178.6	-66.3	-27.3	0	0	0	111.6	Q709 R710 I715 F716 F717	Q709-D713 PolarHBondContact O-N 3.04Å; R710-D713 PolarHBondContact O-N 3.33Å; D713-I715 VanDerWaalsContact C-N 3.32Å; D713-I715 PolarHBondContact O-N 3.08Å; D713-F716 PolarHBondContact O-N 3.04Å; D713-F717 HydrophobicContact CB-CD2 4.41Å; D713-F717 HydrophobicContact CB-CE2 4.42Å; D713-F717 WeakPolarHBondContact O-CD2 3.43Å; D713-F717 PolarHBondContact O-N 2.62Å
714	V	57.5	Low	57.8	Low	108 Å²	108	96.4 Å²	96.4	66%	0.655	51%	0.514	S	S	*	.	H	α-helix	trans	-62.2	-38.9	177.2	169.9	0	0	0	0	111.6	R710 G718	R710-V714 VanDerWaalsContact O-CG2 3.28Å; R710-V714 WeakPolarHBondContact O-CG2 3.4Å; R710-V714 PolarHBondContact O-N 3.11Å; V714-G718 PolarHBondContact O-N 3.35Å
715	I	55.9	Low	56.6	Low	102 Å²	102	97.6 Å²	97.6	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-49.8	174.1	-68.4	165	0	0	0	110	T711 S712 D713 F717 G718 E719	T711-I715 WeakPolarHBondContact O-CD1 3.31Å; T711-I715 VanDerWaalsContact O-CG1 3.26Å; T711-I715 WeakPolarHBondContact O-CG1 3.33Å; T711-I715 PolarHBondContact O-N 3.07Å; T711-I715 VanDerWaalsContact O-N 3.17Å; S712-I715 PolarHBondContact O-N 3.18Å; D713-I715 VanDerWaalsContact C-N 3.32Å; D713-I715 PolarHBondContact O-N 3.08Å; I715-F717 PolarHBondContact O-N 3.07Å; I715-G718 CarbonylContact O-C 3.57Å; I715-G718 WeakPolarHBondContact O-CA 3.45Å; I715-G718 PolarHBondContact O-N 3.1Å; I715-G718 VanDerWaalsContact O-N 3.11Å; I715-E719 HydrophobicContact CG2-CG 4.48Å; I715-E719 WeakPolarHBondContact O-CG 3.36Å; I715-E719 PolarHBondContact O-N 3.12Å
716	F	50	Low	55.4	Low	111 Å²	111	98.6 Å²	98.6	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-59.8	-47.4	-178.5	-176.8	-99.2	0	0	0	113	S712 D713 G718 E719 Q720	S712-F716 WeakPolarHBondContact O-CB 3.45Å; S712-F716 PolarHBondContact O-N 3.31Å; D713-F716 PolarHBondContact O-N 3.04Å; F716-G718 VanDerWaalsContact C-N 3.32Å; F716-G718 PolarHBondContact O-N 3.44Å; F716-E719 PolarHBondContact O-N 3.48Å; F716-Q720 HydrophobicContact CE1-CG 4.42Å; F716-Q720 PolarHBondContact O-N 3.11Å
717	F	47.8	Very low	54.4	Low	114 Å²	114	103.1 Å²	103.1	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-70.1	-28.6	175.3	-71.4	-62.2	0	0	0	112.8	D713 I715 R721	D713-F717 HydrophobicContact CB-CD2 4.41Å; D713-F717 HydrophobicContact CB-CE2 4.42Å; D713-F717 WeakPolarHBondContact O-CD2 3.43Å; D713-F717 PolarHBondContact O-N 2.62Å; I715-F717 PolarHBondContact O-N 3.07Å; F717-R721 WeakPolarHBondContact O-CG 3.09Å; F717-R721 PolarHBondContact O-N 3.26Å; F717-R721 VanDerWaalsContact O-N 3.09Å
718	G	46.7	Very low	53.6	Low	32 Å²	32	106.2 Å²	106.2	33%	0.33	56%	0.558	S	S	.	*	H	α-helix	trans	-67.5	-38.5	172.2	0	0	0	0	0	112.9	V714 I715 F716 R722	V714-G718 PolarHBondContact O-N 3.35Å; I715-G718 CarbonylContact O-C 3.57Å; I715-G718 WeakPolarHBondContact O-CA 3.45Å; I715-G718 PolarHBondContact O-N 3.1Å; I715-G718 VanDerWaalsContact O-N 3.11Å; F716-G718 VanDerWaalsContact C-N 3.32Å; F716-G718 PolarHBondContact O-N 3.44Å; G718-R722 WeakPolarHBondContact O-CG 3.3Å; G718-R722 PolarHBondContact O-N 3.06Å
719	E	50.6	Low	52.8	Low	120 Å²	120	109.6 Å²	109.6	56%	0.561	57%	0.566	S	S	*	*	H	α-helix	trans	-71.4	-41.6	174.6	-71.9	-175	159.7	0	0	111.8	I715 F716 R721 R722 A723	I715-E719 HydrophobicContact CG2-CG 4.48Å; I715-E719 WeakPolarHBondContact O-CG 3.36Å; I715-E719 PolarHBondContact O-N 3.12Å; F716-E719 PolarHBondContact O-N 3.48Å; E719-R721 VanDerWaalsContact C-N 3.31Å; E719-R721 PolarHBondContact O-N 2.93Å; E719-R722 CarbonylContact O-C 3.59Å; E719-R722 PolarHBondContact O-N 3.2Å; E719-A723 PolarHBondContact O-N 3.34Å
720	Q	53.6	Low	52.5	Low	101 Å²	101	111.8 Å²	111.8	47%	0.472	58%	0.58	S	S	.	*	H	α-helix	trans	-58.3	-41.3	172.1	-79.4	-172.5	-21.3	0	0	112.4	F716 R722 A723 S724	F716-Q720 HydrophobicContact CE1-CG 4.42Å; F716-Q720 PolarHBondContact O-N 3.11Å; Q720-R722 PolarHBondContact O-N 3.11Å; Q720-A723 PolarHBondContact O-N 3.05Å; Q720-S724 PolarHBondContact O-N 3.27Å; Q720-S724 VanDerWaalsContact O-N 3.08Å; Q720-S724 PolarHBondContact O-OG 3.21Å
721	R	49.6	Very low	52	Low	201 Å²	201	113.4 Å²	113.4	76%	0.758	60%	0.597	S	S	*	*	H	α-helix	trans	-70.9	-12.3	174.3	-71.8	-172.6	-156.7	-175.1	8.2	114.9	F717 E719 S724	F717-R721 WeakPolarHBondContact O-CG 3.09Å; F717-R721 PolarHBondContact O-N 3.26Å; F717-R721 VanDerWaalsContact O-N 3.09Å; E719-R721 VanDerWaalsContact C-N 3.31Å; E719-R721 PolarHBondContact O-N 2.93Å; R721-S724 WeakPolarHBondContact CA-OG 3.28Å; R721-S724 PolarHBondContact O-OG 2.71Å
722	R	50.2	Low	51.6	Low	222 Å²	222	115.7 Å²	115.7	84%	0.838	60%	0.603	S	S	*	*	H	α-helix	trans	-94.4	-18.9	170.8	-75.1	178.3	178	172.5	1.5	112.6	G718 E719 Q720	G718-R722 WeakPolarHBondContact O-CG 3.3Å; G718-R722 PolarHBondContact O-N 3.06Å; E719-R722 CarbonylContact O-C 3.59Å; E719-R722 PolarHBondContact O-N 3.2Å; Q720-R722 PolarHBondContact O-N 3.11Å
723	A	54.5	Low	51.4	Low	93 Å²	93	119.4 Å²	119.4	77%	0.769	61%	0.612	S	S	*	*	H	α-helix	trans	-89.4	-19.6	176.1	0	0	0	0	0	113.1	E719 Q720	E719-A723 PolarHBondContact O-N 3.34Å; Q720-A723 PolarHBondContact O-N 3.05Å
724	S	47	Very low	51.2	Low	141 Å²	141	122.3 Å²	122.3	99%	0.986	63%	0.625	S	S	*	*			trans	-87.9	0	169.6	65.4	0	0	0	0	112.7	Q720 R721	Q720-S724 PolarHBondContact O-N 3.27Å; Q720-S724 VanDerWaalsContact O-N 3.08Å; Q720-S724 PolarHBondContact O-OG 3.21Å; R721-S724 WeakPolarHBondContact CA-OG 3.28Å; R721-S724 PolarHBondContact O-OG 2.71Å

Retrieved 724 of 724 residues in 490.1 ms (Link to these results)

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