A0A087XYH0_POEFO Loading...

CENP-T/Histone H4 histone fold domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XYH0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 684 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	43.3	Very low	42.2	Very low	255 Å²	255	136.2 Å²	136.2	100%	1.256	85%	0.854	S	S	*	*				0	146.7	0	-79.2	178.1	163.8	0	0	107.7
2	G	38.9	Very low	41.9	Very low	75 Å²	75	129.8 Å²	129.8	77%	0.773	82%	0.818	S	S	*	*			trans	104.3	92.6	-179.6	0	0	0	0	0	112.9
3	N	39.2	Very low	42.9	Very low	154 Å²	154	138 Å²	138	82%	0.824	82%	0.823	S	S	*	*			trans	-82.8	153.2	156.1	-61.8	-1.2	0	0	0	107.5
4	T	43.3	Very low	43.3	Very low	127 Å²	127	139 Å²	139	78%	0.779	81%	0.812	S	S	*	*				177.2	127.6	102.1	38.7	0	0	0	0	112.7
5	V	43.5	Very low	44.9	Very low	138 Å²	138	145.2 Å²	145.2	84%	0.836	82%	0.816	S	S	*	*			trans	64	127.7	136.6	-177.1	0	0	0	0	119.3
6	S	44.9	Very low	45.3	Very low	113 Å²	113	144.3 Å²	144.3	79%	0.79	82%	0.818	S	S	*	*			trans	-95	147.9	169.7	-177.2	0	0	0	0	111
7	A	36.5	Very low	45.8	Very low	96 Å²	96	149.9 Å²	149.9	79%	0.793	82%	0.823	S	S	*	*			trans	-152.5	90.2	172.5	0	0	0	0	0	111.2
8	A	40.6	Very low	46.5	Very low	103 Å²	103	152.1 Å²	152.1	85%	0.851	83%	0.827	S	S	*	*			trans	-83.8	136.2	166.3	0	0	0	0	0	109.5
9	K	49.3	Very low	47.2	Very low	200 Å²	200	149.9 Å²	149.9	87%	0.87	82%	0.824	S	S	*	*			trans	-125.6	100.6	-169	-161.3	169.2	-173.2	172.3	0	111.3
10	G	40.3	Very low	47.9	Very low	75 Å²	75	150.6 Å²	150.6	77%	0.773	83%	0.825	S	S	*	*			trans	-70.4	151.7	176.4	0	0	0	0	0	112.9
11	L	44.1	Very low	48.5	Very low	162 Å²	162	149 Å²	149	85%	0.848	82%	0.816	S	S	*	*			trans	-118.3	85.1	-178	-77.3	167.6	0	0	0	111
12	S	38.8	Very low	49.5	Very low	60 Å²	60	141.7 Å²	141.7	42%	0.42	79%	0.785	S	S	.	*			trans	-79.6	134.7	171.9	70.6	0	0	0	0	111.3	A497 A498	S12-A497 WeakPolarHBondContact CB-O 3.48Å; S12-A498 PolarHBondContact OG-O 2.77Å
13	R	54.9	Low	50.8	Low	236 Å²	236	142.4 Å²	142.4	89%	0.891	78%	0.775	S	S	*	*			trans	-117.9	83.6	178.4	-73.7	-171.9	175.4	-171.6	-0	110.7	R15	R13-R15 PolarHBondContact O-N 3.36Å
14	K	48.8	Very low	51.6	Low	152 Å²	152	138.2 Å²	138.2	66%	0.661	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-60.3	129.8	176.9	-62.8	172.6	-175.9	170.1	0	110.5	A499	K14-A499 PolarHBondContact NZ-O 3.03Å
15	R	66.4	Low	52.2	Low	232 Å²	232	139.5 Å²	139.5	88%	0.875	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-76.2	143.6	165.9	-61.5	-174.1	-171.4	-173.6	4.5	109.2	R13	R13-R15 PolarHBondContact O-N 3.36Å
16	P	52.5	Low	53.2	Low	130 Å²	130	138.5 Å²	138.5	84%	0.844	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-65.6	135.1	177	27.7	-34.2	0	0	0	110.8
17	R	53.5	Low	54.3	Low	241 Å²	241	139.9 Å²	139.9	91%	0.909	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-83.7	134.2	173.5	-57.7	-174.1	86.4	180	7	109.3	S19	R17-S19 PolarHBondContact O-N 3.49Å
18	Q	57.4	Low	55.4	Low	189 Å²	189	145.2 Å²	145.2	88%	0.883	73%	0.734	S	S	*	*			trans	-70.4	114.7	173.1	-173.5	174.5	7.4	0	0	109.2
19	S	60.2	Low	56.3	Low	111 Å²	111	146 Å²	146	78%	0.776	72%	0.723	S	S	*	*			trans	-70.1	128.9	178.3	46.2	0	0	0	0	111	R17	R17-S19 PolarHBondContact O-N 3.49Å
20	L	62.1	Low	56.5	Low	162 Å²	162	143.1 Å²	143.1	85%	0.848	71%	0.711	S	S	*	*			trans	-72.9	129.5	171.8	-73.2	169.6	0	0	0	109.2	V22	L20-V22 PolarHBondContact O-N 3.05Å; L20-V22 VanDerWaalsContact O-N 3.14Å
21	N	61	Low	57.1	Low	117 Å²	117	145.1 Å²	145.1	63%	0.626	70%	0.704	S	S	*	*			trans	-88	84.7	-171.7	-160.6	-31.6	0	0	0	110.4	T23 A24	N21-T23 VanDerWaalsContact C-N 3.29Å; N21-T23 PolarHBondContact O-N 3.32Å; N21-T23 PolarHBondContact OD1-OG1 2.82Å; N21-A24 WeakPolarHBondContact O-CB 3.46Å; N21-A24 PolarHBondContact O-N 3.41Å
22	V	62.6	Low	57.4	Low	102 Å²	102	141.3 Å²	141.3	62%	0.618	70%	0.696	S	S	*	*	H	α-helix	trans	-57.5	-37.5	-169.6	-176.9	0	0	0	0	112.8	L20 A24 F25 E26	L20-V22 PolarHBondContact O-N 3.05Å; L20-V22 VanDerWaalsContact O-N 3.14Å; V22-A24 PolarHBondContact O-N 2.62Å; V22-F25 WeakPolarHBondContact O-CA 3.3Å; V22-F25 WeakPolarHBondContact O-CB 3.43Å; V22-F25 PolarHBondContact O-N 3.45Å; V22-E26 PolarHBondContact O-N 3.08Å
23	T	66.3	Low	57.9	Low	90 Å²	90	146.5 Å²	146.5	55%	0.552	71%	0.713	S	S	*	*	H	α-helix	trans	-64.2	-21	178.9	41.9	0	0	0	0	113.7	N21 K27	N21-T23 VanDerWaalsContact C-N 3.29Å; N21-T23 PolarHBondContact O-N 3.32Å; N21-T23 PolarHBondContact OD1-OG1 2.82Å; T23-K27 WeakPolarHBondContact O-CB 3.32Å; T23-K27 PolarHBondContact O-N 2.82Å; T23-K27 VanDerWaalsContact O-N 3.14Å
24	A	57.4	Low	57.9	Low	66 Å²	66	143.4 Å²	143.4	55%	0.545	71%	0.709	S	S	.	*	H	α-helix	trans	-78.3	-21.3	171.6	0	0	0	0	0	113.3	N21 V22	N21-A24 WeakPolarHBondContact O-CB 3.46Å; N21-A24 PolarHBondContact O-N 3.41Å; V22-A24 PolarHBondContact O-N 2.62Å
25	F	56	Low	57.5	Low	155 Å²	155	145 Å²	145	68%	0.68	72%	0.719	S	S	*	*	H	α-helix	trans	-83.9	-44.6	171.6	-175.5	-94.5	0	0	0	110.7	V22 R28 L29	V22-F25 WeakPolarHBondContact O-CA 3.3Å; V22-F25 WeakPolarHBondContact O-CB 3.43Å; V22-F25 PolarHBondContact O-N 3.45Å; F25-R28 WeakPolarHBondContact O-CB 3.33Å; F25-R28 PolarHBondContact O-N 3.17Å; F25-R28 VanDerWaalsContact O-N 3.12Å; F25-L29 PolarHBondContact O-N 3.02Å
26	E	63.5	Low	56.5	Low	116 Å²	116	139.2 Å²	139.2	54%	0.542	71%	0.712	S	S	.	*	H	α-helix	trans	-63.8	-42.6	-179.9	-169.8	178.1	-174.1	0	0	112.6	V22 R28 L29 K30	V22-E26 PolarHBondContact O-N 3.08Å; E26-R28 VanDerWaalsContact C-N 3.26Å; E26-R28 PolarHBondContact O-N 2.61Å; E26-L29 WeakPolarHBondContact O-CB 3.47Å; E26-L29 PolarHBondContact O-N 3.47Å; E26-K30 PolarHBondContact O-N 3.17Å
27	K	67.9	Low	55.6	Low	143 Å²	143	141.9 Å²	141.9	62%	0.622	71%	0.713	S	S	*	*	H	α-helix	trans	-54.1	-44.7	170.3	-89.9	-156.4	166.5	-148.4	0	112.1	T23 L29 K30 D31	T23-K27 WeakPolarHBondContact O-CB 3.32Å; T23-K27 PolarHBondContact O-N 2.82Å; T23-K27 VanDerWaalsContact O-N 3.14Å; K27-L29 PolarHBondContact O-N 3.32Å; K27-L29 VanDerWaalsContact O-N 3.15Å; K27-K30 CarbonylContact O-C 3.07Å; K27-K30 WeakPolarHBondContact O-CA 3.15Å; K27-K30 WeakPolarHBondContact O-CB 3.43Å; K27-K30 PolarHBondContact O-N 3.01Å; K27-D31 WeakPolarHBondContact O-CB 3.49Å; K27-D31 PolarHBondContact O-N 3.47Å
28	R	59.7	Low	54.7	Low	207 Å²	207	138.5 Å²	138.5	78%	0.781	71%	0.713	S	S	*	*	H	α-helix	trans	-70.1	-10.2	-179.3	-154.5	173.3	-171.2	165.5	3.9	114.1	F25 E26	F25-R28 WeakPolarHBondContact O-CB 3.33Å; F25-R28 PolarHBondContact O-N 3.17Å; F25-R28 VanDerWaalsContact O-N 3.12Å; E26-R28 VanDerWaalsContact C-N 3.26Å; E26-R28 PolarHBondContact O-N 2.61Å
29	L	59	Low	53.6	Low	119 Å²	119	135.4 Å²	135.4	62%	0.623	71%	0.712	S	S	*	*	H	α-helix	trans	-88.7	-36.7	166.8	-149.9	81.9	0	0	0	111.2	F25 E26 K27	F25-L29 PolarHBondContact O-N 3.02Å; E26-L29 WeakPolarHBondContact O-CB 3.47Å; E26-L29 PolarHBondContact O-N 3.47Å; K27-L29 PolarHBondContact O-N 3.32Å; K27-L29 VanDerWaalsContact O-N 3.15Å
30	K	54.6	Low	52.8	Low	141 Å²	141	138.3 Å²	138.3	61%	0.613	72%	0.717	S	S	*	*	H	α-helix	trans	-68.7	-44.3	177.1	-145.2	75.6	176	178.3	0	112.6	E26 K27 A32 E33	E26-K30 PolarHBondContact O-N 3.17Å; K27-K30 CarbonylContact O-C 3.07Å; K27-K30 WeakPolarHBondContact O-CA 3.15Å; K27-K30 WeakPolarHBondContact O-CB 3.43Å; K27-K30 PolarHBondContact O-N 3.01Å; K30-A32 PolarHBondContact O-N 3.2Å; K30-E33 PolarHBondContact O-N 2.86Å; K30-E33 VanDerWaalsContact O-N 3.16Å
31	D	51.4	Low	51.4	Low	117 Å²	117	133.9 Å²	133.9	63%	0.626	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	8.7	178.2	-54.8	-26.6	0	0	0	113	K27	K27-D31 WeakPolarHBondContact O-CB 3.49Å; K27-D31 PolarHBondContact O-N 3.47Å
32	A	51.1	Low	50.5	Low	82 Å²	82	135.3 Å²	135.3	68%	0.678	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-6.2	176.8	0	0	0	0	0	113.8	K30	K30-A32 PolarHBondContact O-N 3.2Å
33	E	49.8	Very low	49.3	Very low	169 Å²	169	139.1 Å²	139.1	79%	0.79	73%	0.729	S	S	*	*	S	Bend	trans	-111.5	-1.5	-179	-63.4	-169.6	143.3	0	0	114	K30	K30-E33 PolarHBondContact O-N 2.86Å; K30-E33 VanDerWaalsContact O-N 3.16Å
34	E	55	Low	47.9	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.794	74%	0.738	S	S	*	*			trans	-127.6	88.7	-179.4	-68.8	-173.6	175.9	0	0	113.3
35	E	39.6	Very low	47	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.864	75%	0.752	S	S	*	*			trans	-143	133.3	156.3	-93	-69.2	149.1	0	0	108.5
36	P	44.9	Very low	45.8	Very low	112 Å²	112	143.3 Å²	143.3	73%	0.727	76%	0.763	S	S	*	*			trans	-87.6	146.3	-167.4	33.4	-35.8	0	0	0	114.7	N38	P36-N38 PolarHBondContact O-N 2.89Å
37	E	35.3	Very low	44.6	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	78%	0.778	S	S	*	*			trans	-65.5	127.3	168.2	-62.2	-171	149.6	0	0	111.5
38	N	34.1	Very low	42.9	Very low	170 Å²	170	144.8 Å²	144.8	91%	0.909	79%	0.79	S	S	*	*			trans	-174.2	83.1	150.4	-103.7	-58.1	0	0	0	112.8	P36	P36-N38 PolarHBondContact O-N 2.89Å
39	S	34.7	Very low	41.5	Very low	125 Å²	125	140.3 Å²	140.3	87%	0.874	79%	0.79	S	S	*	*			trans	-159.4	131.3	153.1	-169.3	0	0	0	0	111.6
40	I	43.3	Very low	40.2	Very low	171 Å²	171	140 Å²	140	88%	0.877	80%	0.798	S	S	*	*			trans	-78.5	135.2	-179.4	-68.8	163.4	0	0	0	110.5
41	G	32.6	Very low	39.4	Very low	70 Å²	70	138.3 Å²	138.3	72%	0.722	80%	0.804	S	S	*	*			trans	179.8	102	170.2	0	0	0	0	0	112.2
42	D	42.3	Very low	38.6	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	81%	0.814	S	S	*	*			trans	-59.7	134.7	176.6	-59.9	-74.6	0	0	0	112
43	H	36.5	Very low	38.2	Very low	182 Å²	182	139.4 Å²	139.4	84%	0.843	82%	0.816	S	S	*	*			trans	-179.6	121.5	131.1	-84.2	-24.3	0	0	0	112.9
44	S	37.4	Very low	37.9	Very low	106 Å²	106	139 Å²	139	74%	0.741	82%	0.818	S	S	*	*			trans	46.6	90.7	150.7	-59.2	0	0	0	0	120.6
45	S	37.5	Very low	37.2	Very low	119 Å²	119	134.8 Å²	134.8	83%	0.832	81%	0.808	S	S	*	*			trans	32.1	103.1	131.5	-49.5	0	0	0	0	119.7
46	L	31.2	Very low	37.5	Very low	174 Å²	174	134.2 Å²	134.2	91%	0.911	81%	0.81	S	S	*	*			trans	-131	98.5	155.5	-73.8	177.5	0	0	0	110.3
47	S	37.8	Very low	37.6	Very low	123 Å²	123	137.3 Å²	137.3	86%	0.86	81%	0.812	S	S	*	*			trans	-82.5	132.6	178.1	-57.2	0	0	0	0	112.2
48	L	32.1	Very low	38.5	Very low	167 Å²	167	133.3 Å²	133.3	87%	0.874	80%	0.8	S	S	*	*			trans	-72.3	129.8	166.7	-62.2	167.6	0	0	0	110.4
49	S	31.1	Very low	39.4	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	79%	0.794	S	S	*	*			trans	-179	115.4	144.9	-86.6	0	0	0	0	113.8
50	S	32.6	Very low	39.8	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	79%	0.793	S	S	*	*				43.1	148.6	122.5	-53.3	0	0	0	0	123.8
51	S	36.3	Very low	40	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	79%	0.789	S	S	*	*			trans	77.9	88.4	156.8	-61	0	0	0	0	118.7	S53	S51-S53 PolarHBondContact O-N 3.44Å
52	S	35.4	Very low	40.2	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	79%	0.793	S	S	*	*			trans	-60.1	99.2	159.2	178.1	0	0	0	0	111.2
53	S	42	Very low	40.7	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	79%	0.786	S	S	*	*			trans	-112.4	98.2	172	46.8	0	0	0	0	109.6	S51 S55	S51-S53 PolarHBondContact O-N 3.44Å; S53-S55 VanDerWaalsContact C-N 3.28Å; S53-S55 PolarHBondContact O-N 3.09Å
54	L	43.3	Very low	41.3	Very low	160 Å²	160	133.9 Å²	133.9	84%	0.838	79%	0.785	S	S	*	*			trans	-73.6	76.2	-178.4	-77.3	170.7	0	0	0	111.8	L56	L54-L56 PolarHBondContact O-N 3.27Å
55	S	41	Very low	41.9	Very low	82 Å²	82	135.3 Å²	135.3	57%	0.573	79%	0.789	S	S	*	*			trans	-70.5	111.9	167.5	80.8	0	0	0	0	109.3	S53 K57	S53-S55 VanDerWaalsContact C-N 3.28Å; S53-S55 PolarHBondContact O-N 3.09Å; S55-K57 VanDerWaalsContact C-N 3.25Å; S55-K57 PolarHBondContact O-N 3.43Å
56	L	46.3	Very low	42.3	Very low	174 Å²	174	137.3 Å²	137.3	91%	0.911	79%	0.785	S	S	*	*			trans	-69	81.7	173.5	-69.8	174.2	0	0	0	110.3	L54 T58	L54-L56 PolarHBondContact O-N 3.27Å; L56-T58 PolarHBondContact O-N 2.8Å
57	K	46.3	Very low	43.6	Very low	176 Å²	176	138.3 Å²	138.3	77%	0.765	78%	0.782	S	S	*	*			trans	-69.9	119.3	169.3	-120.4	71.1	174.2	-172.7	0	108.7	S55	S55-K57 VanDerWaalsContact C-N 3.25Å; S55-K57 PolarHBondContact O-N 3.43Å
58	T	55.6	Low	44.5	Very low	101 Å²	101	143.7 Å²	143.7	62%	0.62	78%	0.784	S	S	*	*			trans	-62.1	134.5	166.5	42.1	0	0	0	0	109.4	L56 F60	L56-T58 PolarHBondContact O-N 2.8Å; T58-F60 PolarHBondContact O-N 3.48Å
59	P	52.7	Low	45.5	Very low	120 Å²	120	138.8 Å²	138.8	78%	0.779	77%	0.773	S	S	*	*			trans	-72.6	97.5	175.1	28.9	-32.8	0	0	0	109	V61	P59-V61 PolarHBondContact O-N 3.44Å; P59-V61 VanDerWaalsContact O-N 3.17Å
60	F	42.3	Very low	46.6	Very low	195 Å²	195	141.5 Å²	141.5	86%	0.855	78%	0.778	S	S	*	*			trans	-59.7	116.8	160.5	-84.4	-93.3	0	0	0	107.8	T58 D62	T58-F60 PolarHBondContact O-N 3.48Å; F60-D62 PolarHBondContact O-N 3.03Å; F60-D62 VanDerWaalsContact O-N 3.1Å
61	V	47.7	Very low	47.5	Very low	131 Å²	131	143.5 Å²	143.5	79%	0.794	78%	0.775	S	S	*	*			trans	-75.4	100.9	-178.9	177.8	0	0	0	0	108.3	P59	P59-V61 PolarHBondContact O-N 3.44Å; P59-V61 VanDerWaalsContact O-N 3.17Å
62	D	37.3	Very low	48.4	Very low	151 Å²	151	149.5 Å²	149.5	81%	0.807	78%	0.781	S	S	*	*			trans	-67.8	148.7	170.1	-159.6	3.7	0	0	0	110.5	F60	F60-D62 PolarHBondContact O-N 3.03Å; F60-D62 VanDerWaalsContact O-N 3.1Å
63	V	52.9	Low	49.1	Very low	106 Å²	106	153.2 Å²	153.2	64%	0.642	78%	0.777	S	S	*	*	S	Bend	trans	-97.8	140.3	-166.9	-171.9	0	0	0	0	110.1
64	H	47.8	Very low	49.9	Very low	174 Å²	174	154.5 Å²	154.5	81%	0.806	78%	0.78	S	S	*	*			trans	88.4	73.4	178.1	-54	-80.2	0	0	0	118.6
65	T	50	Low	50.5	Low	135 Å²	135	151.5 Å²	151.5	83%	0.828	77%	0.773	S	S	*	*			trans	-131.3	95	135.8	61.2	0	0	0	0	111.3	K67	T65-K67 PolarHBondContact O-N 2.82Å
66	E	47.5	Very low	51.2	Low	162 Å²	162	155.2 Å²	155.2	76%	0.757	79%	0.786	S	S	*	*			trans	-80.7	102.2	176.3	-171.1	-167.8	149.1	0	0	111
67	K	58.3	Low	51.7	Low	195 Å²	195	158.1 Å²	158.1	85%	0.848	79%	0.785	S	S	*	*			trans	-90.1	114.5	163.1	-74.2	-175.7	178.1	176.7	0	109.6	T65 G69	T65-K67 PolarHBondContact O-N 2.82Å; K67-G69 PolarHBondContact O-N 2.84Å; K67-G69 VanDerWaalsContact O-N 3.11Å
68	R	56.9	Low	53.1	Low	236 Å²	236	159.7 Å²	159.7	89%	0.891	79%	0.786	S	S	*	*			trans	-63.9	108.3	174.3	-77.9	-176.7	170.3	-174.1	-2	111.1
69	G	52.8	Low	53.9	Low	63 Å²	63	164.3 Å²	164.3	65%	0.649	80%	0.797	S	S	*	*			trans	-162.1	113.5	174.1	0	0	0	0	0	113.1	K67 Q71	K67-G69 PolarHBondContact O-N 2.84Å; K67-G69 VanDerWaalsContact O-N 3.11Å; G69-Q71 PolarHBondContact O-N 2.69Å
70	L	52.9	Low	54.8	Low	170 Å²	170	164.4 Å²	164.4	89%	0.89	79%	0.79	S	S	*	*			trans	45.6	63.4	159.6	-150.7	72.5	0	0	0	118.5	R72	L70-R72 PolarHBondContact O-N 2.82Å; L70-R72 VanDerWaalsContact O-N 3.08Å
71	Q	51.3	Low	56.6	Low	155 Å²	155	158.7 Å²	158.7	72%	0.724	77%	0.771	S	S	*	*			trans	-70.3	99.1	170.5	-67.3	-171.2	11.1	0	0	113.1	G69 R73	G69-Q71 PolarHBondContact O-N 2.69Å; Q71-R73 HydrophobicContact CB-CG 4.04Å; Q71-R73 PolarHBondContact O-N 3.05Å
72	R	56.5	Low	58.1	Low	233 Å²	233	160.6 Å²	160.6	88%	0.879	77%	0.771	S	S	*	*			trans	-81.8	86.7	156.7	-68	-174.8	80.7	177.2	4.5	109.2	L70 V74	L70-R72 PolarHBondContact O-N 2.82Å; L70-R72 VanDerWaalsContact O-N 3.08Å; R72-V74 PolarHBondContact O-N 2.89Å
73	R	50.7	Low	60.2	Low	197 Å²	197	160.9 Å²	160.9	74%	0.743	77%	0.768	S	S	*	*			trans	-71.4	109	-178.5	-60.3	-172.5	74.5	-175.3	3.3	111.2	Q71 S75	Q71-R73 HydrophobicContact CB-CG 4.04Å; Q71-R73 PolarHBondContact O-N 3.05Å; R73-S75 VanDerWaalsContact C-N 3.27Å; R73-S75 PolarHBondContact O-N 3.27Å; R73-S75 VanDerWaalsContact O-N 3.07Å
74	V	58.7	Low	61.7	Low	129 Å²	129	160.4 Å²	160.4	78%	0.782	76%	0.759	S	S	*	*			trans	-82.9	74.9	168.3	-170.3	0	0	0	0	109.3	R72 N76	R72-V74 PolarHBondContact O-N 2.89Å; V74-N76 VanDerWaalsContact C-N 3.28Å; V74-N76 PolarHBondContact O-N 3.1Å
75	S	56	Low	63.3	Low	97 Å²	97	158 Å²	158	68%	0.678	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	72.8	-178.3	55.4	0	0	0	0	112.2	R73	R73-S75 VanDerWaalsContact C-N 3.27Å; R73-S75 PolarHBondContact O-N 3.27Å; R73-S75 VanDerWaalsContact O-N 3.07Å
76	N	55.6	Low	64.8	Low	159 Å²	159	154.5 Å²	154.5	85%	0.85	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.7	7.7	157.9	-100.5	-20.5	0	0	0	115.9	V74 R78	V74-N76 VanDerWaalsContact C-N 3.28Å; V74-N76 PolarHBondContact O-N 3.1Å; N76-R78 PolarHBondContact O-N 3.32Å
77	R	56.8	Low	66.3	Low	235 Å²	235	148.6 Å²	148.6	89%	0.887	71%	0.706	S	S	*	*			trans	-72.6	103.2	178.1	-149.5	177.1	-154.5	-111.4	4.8	110.5
78	R	75	Confident	67.1	Low	210 Å²	210	141.8 Å²	141.8	79%	0.792	69%	0.686	S	S	*	*			trans	-60.1	143.8	170	-67	-176.4	179.4	-179.4	0.2	109.6	N76	N76-R78 PolarHBondContact O-N 3.32Å
79	K	71.6	Confident	67.9	Low	197 Å²	197	134.8 Å²	134.8	86%	0.857	67%	0.666	S	S	*	*			trans	-83.3	111.7	167.2	-66.6	-174.4	179	-174.2	0	107.3	T81	K79-T81 PolarHBondContact O-N 3.35Å
80	I	71.8	Confident	68.7	Low	122 Å²	122	134.3 Å²	134.3	63%	0.626	65%	0.653	S	S	*	*			trans	-65.9	129.4	172.3	-58.8	171.8	0	0	0	107.3	E84 F85	I80-E84 WeakPolarHBondContact CA-OE2 3.32Å; I80-E84 HydrophobicContact CG2-CB 4.08Å; I80-E84 HydrophobicContact CG2-CG 4.26Å; I80-F85 HydrophobicContact CG2-CB 4.13Å
81	T	81.3	Confident	69.6	Low	75 Å²	75	133.2 Å²	133.2	46%	0.46	64%	0.641	S	S	.	*			trans	-87.3	159.5	172.9	59.5	0	0	0	0	110.7	K79 E83 E84 F85	K79-T81 PolarHBondContact O-N 3.35Å; T81-E83 PolarHBondContact O-N 2.9Å; T81-E84 PolarHBondContact O-N 3.32Å; T81-E84 PolarHBondContact OG1-N 3.07Å; T81-F85 PolarHBondContact O-N 2.78Å
82	E	77.8	Confident	70.2	Confident	172 Å²	172	131.9 Å²	131.9	80%	0.804	63%	0.634	S	S	*	*	H	α-helix	trans	-59.7	-32.9	176.7	-169.6	167.4	-171.4	0	0	112.2	S86	E82-S86 WeakPolarHBondContact O-CB 3.35Å; E82-S86 PolarHBondContact O-N 2.76Å; E82-S86 PolarHBondContact O-OG 2.87Å
83	E	81.3	Confident	70.2	Confident	156 Å²	156	127.8 Å²	127.8	73%	0.729	63%	0.625	S	S	*	*	H	α-helix	trans	-66.5	-41.5	170.4	-61.3	179.2	136.2	0	0	112.7	T81 F85 S86 A87	T81-E83 PolarHBondContact O-N 2.9Å; E83-F85 VanDerWaalsContact C-N 3.34Å; E83-S86 WeakPolarHBondContact CA-OG 3.24Å; E83-S86 PolarHBondContact O-OG 3.49Å; E83-A87 WeakPolarHBondContact O-CB 3.08Å; E83-A87 PolarHBondContact O-N 3.33Å
84	E	85.9	Confident	70.1	Confident	97 Å²	97	125.4 Å²	125.4	45%	0.453	62%	0.624	S	S	.	*	H	α-helix	trans	-67.9	-35.5	176.3	-172.7	174	-144.3	0	0	111.5	I80 T81 A88	I80-E84 WeakPolarHBondContact CA-OE2 3.32Å; I80-E84 HydrophobicContact CG2-CB 4.08Å; I80-E84 HydrophobicContact CG2-CG 4.26Å; T81-E84 PolarHBondContact O-N 3.32Å; T81-E84 PolarHBondContact OG1-N 3.07Å; E84-A88 PolarHBondContact O-N 3.45Å; E84-A88 VanDerWaalsContact O-N 3.11Å
85	F	81.6	Confident	69.7	Low	124 Å²	124	120.9 Å²	120.9	54%	0.544	60%	0.604	S	S	.	*	H	α-helix	trans	-70.1	-47.7	176.4	-177.2	-109.4	0	0	0	112.6	I80 T81 E83 A88 L89	I80-F85 HydrophobicContact CG2-CB 4.13Å; T81-F85 PolarHBondContact O-N 2.78Å; E83-F85 VanDerWaalsContact C-N 3.34Å; F85-A88 WeakPolarHBondContact O-CB 3.46Å; F85-A88 PolarHBondContact O-N 3.09Å; F85-L89 HydrophobicContact CD1-CD1 4.01Å; F85-L89 HydrophobicContact CE1-CD1 3.56Å; F85-L89 HydrophobicContact CE1-CG 4.44Å; F85-L89 HydrophobicContact CZ-CD1 3.94Å; F85-L89 HydrophobicContact CZ-CG 4.45Å; F85-L89 PolarHBondContact O-N 3.16Å
86	S	80.3	Confident	69.3	Low	61 Å²	61	119.3 Å²	119.3	43%	0.427	59%	0.588	S	S	.	*	H	α-helix	trans	-67.4	-33.7	175.5	52.9	0	0	0	0	112.6	E82 E83 A88 L89 S90	E82-S86 WeakPolarHBondContact O-CB 3.35Å; E82-S86 PolarHBondContact O-N 2.76Å; E82-S86 PolarHBondContact O-OG 2.87Å; E83-S86 WeakPolarHBondContact CA-OG 3.24Å; E83-S86 PolarHBondContact O-OG 3.49Å; S86-A88 PolarHBondContact O-N 3.01Å; S86-L89 PolarHBondContact O-N 3.49Å; S86-S90 WeakPolarHBondContact O-CB 2.92Å; S86-S90 PolarHBondContact O-N 2.83Å; S86-S90 PolarHBondContact O-OG 2.94Å
87	A	78.9	Confident	69	Low	37 Å²	37	116.5 Å²	116.5	31%	0.306	58%	0.576	S	S	.	*	H	α-helix	trans	-70.7	-12.4	169.5	0	0	0	0	0	114.2	E83 S90 K91	E83-A87 WeakPolarHBondContact O-CB 3.08Å; E83-A87 PolarHBondContact O-N 3.33Å; A87-S90 WeakPolarHBondContact CA-OG 3.28Å; A87-K91 WeakPolarHBondContact O-CD 3.41Å; A87-K91 VanDerWaalsContact O-CE 3.23Å; A87-K91 WeakPolarHBondContact O-CE 3.03Å; A87-K91 VanDerWaalsContact O-CG 3.29Å; A87-K91 WeakPolarHBondContact O-CG 3.5Å; A87-K91 PolarHBondContact O-NZ 3.12Å
88	A	75.3	Confident	68.5	Low	53 Å²	53	109 Å²	109	44%	0.438	56%	0.56	S	S	.	*	H	α-helix	trans	-88.7	-46.3	169.4	0	0	0	0	0	111.3	E84 F85 S86 S90 K91 Q92	E84-A88 PolarHBondContact O-N 3.45Å; E84-A88 VanDerWaalsContact O-N 3.11Å; F85-A88 WeakPolarHBondContact O-CB 3.46Å; F85-A88 PolarHBondContact O-N 3.09Å; S86-A88 PolarHBondContact O-N 3.01Å; A88-S90 PolarHBondContact O-N 2.79Å; A88-K91 WeakPolarHBondContact O-CB 3.42Å; A88-K91 PolarHBondContact O-N 2.79Å; A88-K91 VanDerWaalsContact O-N 3.14Å; A88-Q92 PolarHBondContact O-N 2.8Å
89	L	74	Confident	67.1	Low	88 Å²	88	107.6 Å²	107.6	46%	0.461	56%	0.555	S	S	.	*	H	α-helix	trans	-58	-46.5	176.9	-76.2	170.1	0	0	0	112.5	F85 S86 K91 Q92 Q93	F85-L89 HydrophobicContact CD1-CD1 4.01Å; F85-L89 HydrophobicContact CE1-CD1 3.56Å; F85-L89 HydrophobicContact CE1-CG 4.44Å; F85-L89 HydrophobicContact CZ-CD1 3.94Å; F85-L89 HydrophobicContact CZ-CG 4.45Å; F85-L89 PolarHBondContact O-N 3.16Å; S86-L89 PolarHBondContact O-N 3.49Å; L89-K91 VanDerWaalsContact C-N 3.27Å; L89-K91 PolarHBondContact O-N 2.98Å; L89-Q92 PolarHBondContact O-N 2.69Å; L89-Q92 VanDerWaalsContact O-N 3.14Å; L89-Q93 PolarHBondContact O-N 3.4Å
90	S	68.9	Low	65.5	Low	54 Å²	54	106 Å²	106	38%	0.378	55%	0.55	S	S	.	*	H	α-helix	trans	-62.6	-30.3	176.8	48.8	0	0	0	0	113.5	S86 A87 A88 M94	S86-S90 WeakPolarHBondContact O-CB 2.92Å; S86-S90 PolarHBondContact O-N 2.83Å; S86-S90 PolarHBondContact O-OG 2.94Å; A87-S90 WeakPolarHBondContact CA-OG 3.28Å; A88-S90 PolarHBondContact O-N 2.79Å; S90-M94 PolarHBondContact O-N 2.96Å
91	K	71.6	Confident	64	Low	147 Å²	147	104 Å²	104	64%	0.639	55%	0.552	S	S	*	*	H	α-helix	trans	-73.4	-38.6	172.6	-71.6	171.5	-169.2	154.4	0	112.3	A87 A88 L89 Q93 M94 G95	A87-K91 WeakPolarHBondContact O-CD 3.41Å; A87-K91 VanDerWaalsContact O-CE 3.23Å; A87-K91 WeakPolarHBondContact O-CE 3.03Å; A87-K91 VanDerWaalsContact O-CG 3.29Å; A87-K91 WeakPolarHBondContact O-CG 3.5Å; A87-K91 PolarHBondContact O-NZ 3.12Å; A88-K91 WeakPolarHBondContact O-CB 3.42Å; A88-K91 PolarHBondContact O-N 2.79Å; A88-K91 VanDerWaalsContact O-N 3.14Å; L89-K91 VanDerWaalsContact C-N 3.27Å; L89-K91 PolarHBondContact O-N 2.98Å; K91-Q93 VanDerWaalsContact C-N 3.32Å; K91-M94 PolarHBondContact O-N 3.13Å; K91-G95 PolarHBondContact O-N 2.72Å
92	Q	63.8	Low	62.1	Low	126 Å²	126	107.8 Å²	107.8	59%	0.589	57%	0.569	S	S	*	*	H	α-helix	trans	-62	-42.9	174	-175.2	173.8	-11.8	0	0	110.8	A88 L89 M94 G95 D96	A88-Q92 PolarHBondContact O-N 2.8Å; L89-Q92 PolarHBondContact O-N 2.69Å; L89-Q92 VanDerWaalsContact O-N 3.14Å; Q92-M94 VanDerWaalsContact C-N 3.27Å; Q92-M94 PolarHBondContact O-N 3.37Å; Q92-G95 WeakPolarHBondContact O-CA 3.45Å; Q92-G95 PolarHBondContact O-N 2.9Å; Q92-D96 PolarHBondContact O-N 3.46Å
93	Q	57.7	Low	60.4	Low	148 Å²	148	108.5 Å²	108.5	69%	0.692	57%	0.572	S	S	*	*	H	α-helix	trans	-62.1	-30.4	177.4	-163.7	174.2	14.9	0	0	113.5	L89 K91 V97	L89-Q93 PolarHBondContact O-N 3.4Å; K91-Q93 VanDerWaalsContact C-N 3.32Å; Q93-V97 WeakPolarHBondContact O-CG2 3.38Å
94	M	48.3	Very low	58.4	Low	146 Å²	146	104.7 Å²	104.7	72%	0.719	58%	0.575	S	S	*	*	H	α-helix	trans	-80.8	-20.5	170.7	-68.3	-176.4	176.4	0	0	113.6	S90 K91 Q92 S98	S90-M94 PolarHBondContact O-N 2.96Å; K91-M94 PolarHBondContact O-N 3.13Å; Q92-M94 VanDerWaalsContact C-N 3.27Å; Q92-M94 PolarHBondContact O-N 3.37Å; M94-S98 PolarHBondContact O-OG 3.29Å
95	G	50.6	Low	55.8	Low	34 Å²	34	111.7 Å²	111.7	35%	0.351	60%	0.597	S	S	.	*	H	α-helix	trans	-71.2	-47.4	177.2	0	0	0	0	0	113	K91 Q92 S98	K91-G95 PolarHBondContact O-N 2.72Å; Q92-G95 WeakPolarHBondContact O-CA 3.45Å; Q92-G95 PolarHBondContact O-N 2.9Å; G95-S98 WeakPolarHBondContact O-CB 3.43Å; G95-S98 PolarHBondContact O-N 3.35Å; G95-S98 VanDerWaalsContact O-N 3.1Å
96	D	48.1	Very low	53.5	Low	65 Å²	65	114.8 Å²	114.8	35%	0.348	61%	0.613	S	S	.	*	H	α-helix	trans	-71.8	-30.6	-177.7	-70.7	-48	0	0	0	112.9	Q92 S98 R99 E100	Q92-D96 PolarHBondContact O-N 3.46Å; D96-S98 PolarHBondContact O-N 3.49Å; D96-S98 VanDerWaalsContact O-N 3.11Å; D96-R99 WeakPolarHBondContact O-CB 3.38Å; D96-R99 PolarHBondContact O-N 2.73Å; D96-R99 WeakPolarHBondContact OD1-CD 3.23Å; D96-R99 IonicContact OD1-CZ 3.8Å; D96-R99 IonicContact OD1-NE 3.9Å; D96-R99 IonicContact OD1-NH1 2.88Å; D96-R99 PolarHBondContact OD1-NH1 2.78Å; D96-E100 PolarHBondContact O-N 2.9Å
97	V	48.8	Very low	51.9	Low	99 Å²	99	119 Å²	119	60%	0.6	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-21	170	176.8	0	0	0	0	112.4	Q93	Q93-V97 WeakPolarHBondContact O-CG2 3.38Å
98	S	45.8	Very low	49.4	Very low	79 Å²	79	122.7 Å²	122.7	55%	0.552	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-10	173.9	-55.2	0	0	0	0	113.7	M94 G95 D96	M94-S98 PolarHBondContact O-OG 3.29Å; G95-S98 WeakPolarHBondContact O-CB 3.43Å; G95-S98 PolarHBondContact O-N 3.35Å; G95-S98 VanDerWaalsContact O-N 3.1Å; D96-S98 PolarHBondContact O-N 3.49Å; D96-S98 VanDerWaalsContact O-N 3.11Å
99	R	44.7	Very low	47.5	Very low	180 Å²	180	123.2 Å²	123.2	68%	0.679	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-36.6	179.5	-68.1	169.6	117.9	177.5	-1.2	112.4	D96 A101 L102	D96-R99 WeakPolarHBondContact O-CB 3.38Å; D96-R99 PolarHBondContact O-N 2.73Å; D96-R99 WeakPolarHBondContact OD1-CD 3.23Å; D96-R99 IonicContact OD1-CZ 3.8Å; D96-R99 IonicContact OD1-NE 3.9Å; D96-R99 IonicContact OD1-NH1 2.88Å; D96-R99 PolarHBondContact OD1-NH1 2.78Å; R99-A101 PolarHBondContact O-N 3.03Å; R99-L102 PolarHBondContact O-N 3.31Å
100	E	38.8	Very low	45.5	Very low	163 Å²	163	128.3 Å²	128.3	76%	0.762	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-69.5	-13.6	179.4	-62.5	179	131.2	0	0	113	D96	D96-E100 PolarHBondContact O-N 2.9Å
101	A	39.5	Very low	44.2	Very low	81 Å²	81	133.2 Å²	133.2	67%	0.669	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-86.3	-0.5	178.8	0	0	0	0	0	115.3	R99	R99-A101 PolarHBondContact O-N 3.03Å
102	L	43.1	Very low	42.6	Very low	153 Å²	153	132.1 Å²	132.1	80%	0.801	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-124.6	25.3	-173.4	-74.4	176.9	0	0	0	115.2	R99	R99-L102 PolarHBondContact O-N 3.31Å
103	Q	40.7	Very low	41.5	Very low	188 Å²	188	133 Å²	133	88%	0.879	73%	0.728	S	S	*	*			trans	-108.5	76.3	167.2	-70.9	-179.6	-13.8	0	0	109.9
104	G	39.8	Very low	40.7	Very low	76 Å²	76	134.2 Å²	134.2	78%	0.784	74%	0.738	S	S	*	*	S	Bend	trans	-170.2	16.7	-170.5	0	0	0	0	0	118.5
105	R	30.6	Very low	40.2	Very low	243 Å²	243	132.1 Å²	132.1	92%	0.917	74%	0.744	S	S	*	*			trans	-156.9	154.1	165.9	-151.1	156.7	-179	-90.4	-4.5	112.9
106	E	34.1	Very low	40	Very low	189 Å²	189	133.9 Å²	133.9	88%	0.883	76%	0.762	S	S	*	*			trans	-80.8	172.8	-170.5	-65.8	167.3	117.8	0	0	114.8
107	V	47	Very low	39.5	Very low	149 Å²	149	138.1 Å²	138.1	90%	0.903	78%	0.783	S	S	*	*			trans	-69.2	136.5	-164.9	-176.8	0	0	0	0	113.8
108	S	26.4	Very low	38.9	Very low	115 Å²	115	140.2 Å²	140.2	80%	0.804	80%	0.797	S	S	*	*			trans	-146.9	135.2	146.5	-168	0	0	0	0	108.2
109	G	34.2	Very low	38.7	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	81%	0.808	S	S	*	*			trans	-96	146.7	172.8	0	0	0	0	0	111.2
110	E	32.1	Very low	38.2	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	81%	0.811	S	S	*	*			trans	-163.8	139.8	158.1	-113.5	166.4	-170.2	0	0	108.4
111	D	41.8	Very low	38.2	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	82%	0.819	S	S	*	*			trans	-72.7	145.8	-174.4	-66.5	-70.5	0	0	0	112.8
112	T	38.9	Very low	37.9	Very low	124 Å²	124	140 Å²	140	76%	0.761	82%	0.819	S	S	*	*				-172.5	128.6	123.2	19.2	0	0	0	0	114.3
113	N	40.8	Very low	38.2	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	82%	0.824	S	S	*	*			trans	57.7	88.4	142.2	-57.6	-33.6	0	0	0	120.2
114	L	40.3	Very low	38.2	Very low	174 Å²	174	141 Å²	141	91%	0.911	82%	0.821	S	S	*	*			trans	-132	73.9	130.9	-167.4	66.3	0	0	0	111.3	G116	L114-G116 PolarHBondContact O-N 3.04Å
115	A	38.8	Very low	38.7	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	82%	0.82	S	S	*	*			trans	-66.6	118.5	168.1	0	0	0	0	0	109.5
116	G	45.2	Very low	39.5	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	82%	0.819	S	S	*	*			trans	-169.6	-17	-174.8	0	0	0	0	0	118.7	L114	L114-G116 PolarHBondContact O-N 3.04Å
117	I	38.5	Very low	40.5	Very low	154 Å²	154	135.7 Å²	135.7	79%	0.79	81%	0.806	S	S	*	*			trans	-134.7	85.7	177.6	-49.3	179.6	0	0	0	110.4	L119	I117-L119 HydrophobicContact CG2-CG 4.41Å; I117-L119 PolarHBondContact O-N 2.78Å
118	T	36	Very low	40.8	Very low	144 Å²	144	133.3 Å²	133.3	88%	0.883	79%	0.789	S	S	*	*			trans	-85.2	84.3	171	52.6	0	0	0	0	110.4
119	L	41.2	Very low	42.2	Very low	150 Å²	150	132 Å²	132	79%	0.785	78%	0.776	S	S	*	*			trans	-79.8	135.6	152.6	-70.5	175.4	0	0	0	108	I117 L121	I117-L119 HydrophobicContact CG2-CG 4.41Å; I117-L119 PolarHBondContact O-N 2.78Å; L119-L121 PolarHBondContact O-N 2.95Å
120	G	33.9	Very low	43.3	Very low	72 Å²	72	133.4 Å²	133.4	74%	0.742	77%	0.771	S	S	*	*			trans	-71.1	116.1	-167.8	0	0	0	0	0	112.7	S122	G120-S122 VanDerWaalsContact C-N 3.27Å; G120-S122 PolarHBondContact O-N 3.47Å
121	L	39	Very low	44.8	Very low	178 Å²	178	127.5 Å²	127.5	93%	0.932	75%	0.749	S	S	*	*			trans	-71.5	82	168.7	-66.7	175.6	0	0	0	110.3	L119 K123	L119-L121 PolarHBondContact O-N 2.95Å; L121-K123 PolarHBondContact O-N 3.42Å
122	S	33.9	Very low	45.1	Very low	97 Å²	97	123.6 Å²	123.6	68%	0.678	73%	0.728	S	S	*	*			trans	-64.9	122.9	158.2	50	0	0	0	0	108.5	G120 L124	G120-S122 VanDerWaalsContact C-N 3.27Å; G120-S122 PolarHBondContact O-N 3.47Å; S122-L124 PolarHBondContact O-N 2.71Å; S122-L124 VanDerWaalsContact O-N 3.08Å
123	K	49.3	Very low	46.3	Very low	206 Å²	206	123 Å²	123	90%	0.896	72%	0.719	S	S	*	*			trans	-60.8	112.5	178.9	-61.4	179.9	-177.8	-178	0	110.1	L121	L121-K123 PolarHBondContact O-N 3.42Å
124	L	40.5	Very low	47.4	Very low	156 Å²	156	121.7 Å²	121.7	82%	0.817	72%	0.716	S	S	*	*			trans	-115.7	145.8	158.4	-63.7	175.6	0	0	0	106.9	S122	S122-L124 PolarHBondContact O-N 2.71Å; S122-L124 VanDerWaalsContact O-N 3.08Å
125	S	49.5	Very low	48.5	Very low	109 Å²	109	117.8 Å²	117.8	76%	0.762	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-63	165.4	170.1	44.8	0	0	0	0	110.6	P127	S125-P127 VanDerWaalsContact O-CD 3.29Å; S125-P127 WeakPolarHBondContact O-CD 3.36Å; S125-P127 VanDerWaalsContact O-N 3.12Å
126	E	48.8	Very low	49.1	Very low	193 Å²	193	117.7 Å²	117.7	90%	0.902	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-50.2	117.4	174.3	-68.2	166.2	120.5	0	0	110.3
127	P	55.2	Low	49.5	Very low	95 Å²	95	120.6 Å²	120.6	62%	0.617	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-75	129.6	168.8	30.6	-30.6	0	0	0	107.9	S125 V129	S125-P127 VanDerWaalsContact O-CD 3.29Å; S125-P127 WeakPolarHBondContact O-CD 3.36Å; S125-P127 VanDerWaalsContact O-N 3.12Å; P127-V129 VanDerWaalsContact C-N 3.28Å; P127-V129 HydrophobicContact CG-CG2 4.42Å; P127-V129 WeakPolarHBondContact O-CG2 3.32Å; P127-V129 PolarHBondContact O-N 2.99Å
128	D	51.7	Low	50.3	Low	99 Å²	99	117.1 Å²	117.1	53%	0.529	67%	0.669	S	S	.	*			trans	-74.3	88.9	171.2	-170	-14.4	0	0	0	109.5	T130 V131	D128-T130 PolarHBondContact O-N 2.69Å; D128-T130 WeakPolarHBondContact OD1-CB 3.46Å; D128-T130 WeakPolarHBondContact OD1-CG2 3.5Å; D128-T130 PolarHBondContact OD1-N 3.48Å; D128-T130 PolarHBondContact OD1-OG1 3.06Å; D128-V131 HydrophobicContact CB-CG2 4.36Å; D128-V131 PolarHBondContact O-N 3.25Å; D128-V131 VanDerWaalsContact O-N 3.1Å
129	V	57.2	Low	51.1	Low	89 Å²	89	115.3 Å²	115.3	54%	0.539	67%	0.668	S	S	.	*	H	α-helix	trans	-57.9	-19.5	-178.9	-173.3	0	0	0	0	111.9	P127 I133	P127-V129 VanDerWaalsContact C-N 3.28Å; P127-V129 HydrophobicContact CG-CG2 4.42Å; P127-V129 WeakPolarHBondContact O-CG2 3.32Å; P127-V129 PolarHBondContact O-N 2.99Å; V129-I133 HydrophobicContact CG1-CD1 3.8Å; V129-I133 HydrophobicContact CG1-CG1 4.29Å; V129-I133 WeakPolarHBondContact O-CB 3.44Å; V129-I133 WeakPolarHBondContact O-CD1 3.29Å; V129-I133 VanDerWaalsContact O-CG1 3.25Å; V129-I133 WeakPolarHBondContact O-CG1 3.1Å; V129-I133 PolarHBondContact O-N 3.12Å
130	T	57	Low	51.4	Low	92 Å²	92	115.6 Å²	115.6	56%	0.564	67%	0.67	S	S	*	*	H	α-helix	trans	-68.6	-37.2	177.9	72.8	0	0	0	0	112	D128 V134	D128-T130 PolarHBondContact O-N 2.69Å; D128-T130 WeakPolarHBondContact OD1-CB 3.46Å; D128-T130 WeakPolarHBondContact OD1-CG2 3.5Å; D128-T130 PolarHBondContact OD1-N 3.48Å; D128-T130 PolarHBondContact OD1-OG1 3.06Å; T130-V134 VanDerWaalsContact O-CG2 3.32Å; T130-V134 WeakPolarHBondContact O-CG2 3.47Å; T130-V134 PolarHBondContact O-N 3.23Å; T130-V134 VanDerWaalsContact O-N 3.15Å
131	V	63.6	Low	51.8	Low	72 Å²	72	121.9 Å²	121.9	44%	0.436	67%	0.672	S	S	.	*	H	α-helix	trans	-74.2	-45.4	-178.1	-176.6	0	0	0	0	111.4	D128 I133 V134 N135	D128-V131 HydrophobicContact CB-CG2 4.36Å; D128-V131 PolarHBondContact O-N 3.25Å; D128-V131 VanDerWaalsContact O-N 3.1Å; V131-I133 PolarHBondContact O-N 2.79Å; V131-V134 PolarHBondContact O-N 3.4Å; V131-V134 VanDerWaalsContact O-N 3.16Å; V131-N135 PolarHBondContact O-N 3.15Å
132	D	48	Very low	52.3	Low	74 Å²	74	121.4 Å²	121.4	40%	0.396	67%	0.671	S	S	.	*	H	α-helix	trans	-62.3	-31.6	178.1	-83.8	-18.5	0	0	0	112.6	C136 Q137	D132-C136 WeakPolarHBondContact O-CA 3.39Å; D132-C136 PolarHBondContact O-N 2.65Å; D132-Q137 PolarHBondContact O-N 3.2Å; D132-Q137 VanDerWaalsContact O-N 3.1Å
133	I	64.4	Low	52.7	Low	113 Å²	113	125.7 Å²	125.7	58%	0.579	68%	0.68	S	S	*	*	H	α-helix	trans	-71.6	-45.1	173.8	-72.3	174.2	0	0	0	111	V129 V131 C136	V129-I133 HydrophobicContact CG1-CD1 3.8Å; V129-I133 HydrophobicContact CG1-CG1 4.29Å; V129-I133 WeakPolarHBondContact O-CB 3.44Å; V129-I133 WeakPolarHBondContact O-CD1 3.29Å; V129-I133 VanDerWaalsContact O-CG1 3.25Å; V129-I133 WeakPolarHBondContact O-CG1 3.1Å; V129-I133 PolarHBondContact O-N 3.12Å; V131-I133 PolarHBondContact O-N 2.79Å; I133-C136 PolarHBondContact O-N 3.49Å
134	V	63.9	Low	52.3	Low	117 Å²	117	125.1 Å²	125.1	71%	0.709	68%	0.681	S	S	*	*	H	α-helix	trans	-64.8	-42.8	179.7	168.8	0	0	0	0	111.4	T130 V131 C136	T130-V134 VanDerWaalsContact O-CG2 3.32Å; T130-V134 WeakPolarHBondContact O-CG2 3.47Å; T130-V134 PolarHBondContact O-N 3.23Å; T130-V134 VanDerWaalsContact O-N 3.15Å; V131-V134 PolarHBondContact O-N 3.4Å; V131-V134 VanDerWaalsContact O-N 3.16Å; V134-C136 VanDerWaalsContact C-N 3.33Å
135	N	62.4	Low	52	Low	91 Å²	91	125 Å²	125	49%	0.487	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	-4.2	178.7	-71.2	-1.9	0	0	0	114.1	V131 Q137	V131-N135 PolarHBondContact O-N 3.15Å; N135-Q137 HydrophobicContact CB-CG 3.95Å; N135-Q137 PolarHBondContact ND2-OE1 3.25Å; N135-Q137 VanDerWaalsContact ND2-OE1 3.11Å; N135-Q137 PolarHBondContact O-N 3.41Å
136	C	51.9	Low	51.8	Low	101 Å²	101	124 Å²	124	68%	0.682	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	56	27.4	-176.2	-63.8	0	0	0	0	114.9	D132 I133 V134 T138	D132-C136 WeakPolarHBondContact O-CA 3.39Å; D132-C136 PolarHBondContact O-N 2.65Å; I133-C136 PolarHBondContact O-N 3.49Å; V134-C136 VanDerWaalsContact C-N 3.33Å; C136-T138 PolarHBondContact O-N 2.69Å
137	Q	52.9	Low	51.1	Low	130 Å²	130	123.5 Å²	123.5	61%	0.607	68%	0.679	S	S	*	*			trans	-81.2	24.5	-172.8	-75.4	171.9	-58.3	0	0	114	D132 N135 A139	D132-Q137 PolarHBondContact O-N 3.2Å; D132-Q137 VanDerWaalsContact O-N 3.1Å; N135-Q137 HydrophobicContact CB-CG 3.95Å; N135-Q137 PolarHBondContact ND2-OE1 3.25Å; N135-Q137 VanDerWaalsContact ND2-OE1 3.11Å; N135-Q137 PolarHBondContact O-N 3.41Å; Q137-A139 PolarHBondContact O-N 2.79Å
138	T	55.8	Low	50.5	Low	82 Å²	82	125.1 Å²	125.1	50%	0.503	69%	0.687	S	S	.	*			trans	-72.3	119.6	174.1	60.9	0	0	0	0	111.2	C136 L140	C136-T138 PolarHBondContact O-N 2.69Å; T138-L140 PolarHBondContact O-N 2.83Å
139	A	53.3	Low	49.5	Very low	105 Å²	105	124.7 Å²	124.7	87%	0.868	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	49.7	-175.6	0	0	0	0	0	115	Q137	Q137-A139 PolarHBondContact O-N 2.79Å
140	L	48	Very low	49	Very low	156 Å²	156	128.1 Å²	128.1	82%	0.817	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	1	177.7	-75.2	173.7	0	0	0	114	T138	T138-L140 PolarHBondContact O-N 2.83Å
141	Y	42.3	Very low	47.8	Very low	204 Å²	204	132 Å²	132	80%	0.8	72%	0.717	S	S	*	*	S	Bend	trans	-121.3	113.7	169	-78.4	-87.4	0	0	0	109.8	Q143	Y141-Q143 PolarHBondContact O-N 3.13Å
142	D	48.7	Very low	46.8	Very low	168 Å²	168	134.4 Å²	134.4	90%	0.898	74%	0.737	S	S	*	*			trans	-63.2	120.6	163.7	-72.4	-48.6	0	0	0	108.4	H144	D142-H144 PolarHBondContact O-N 3.41Å
143	Q	41.8	Very low	46.4	Very low	188 Å²	188	138 Å²	138	88%	0.879	75%	0.754	S	S	*	*			trans	-66.2	129.6	175.7	-73.3	-173.3	-23.2	0	0	110	Y141 D145	Y141-Q143 PolarHBondContact O-N 3.13Å; Q143-D145 PolarHBondContact O-N 3.11Å
144	H	40.8	Very low	45.6	Very low	194 Å²	194	141.6 Å²	141.6	90%	0.898	77%	0.766	S	S	*	*			trans	-81	88.1	-177.2	-140.3	-60.7	0	0	0	110.2	D142	D142-H144 PolarHBondContact O-N 3.41Å
145	D	34.2	Very low	44.5	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	77%	0.768	S	S	*	*			trans	-57.6	136.8	-173.5	-144.3	-8.2	0	0	0	112.5	Q143 M147	Q143-D145 PolarHBondContact O-N 3.11Å; D145-M147 PolarHBondContact O-N 3.29Å
146	A	45.8	Very low	43.3	Very low	89 Å²	89	142.9 Å²	142.9	74%	0.736	78%	0.779	S	S	*	*			trans	-84.1	78.2	-162	0	0	0	0	0	113.4	T148	A146-T148 PolarHBondContact O-N 3.08Å
147	M	33.7	Very low	43.1	Very low	182 Å²	182	145 Å²	145	90%	0.897	78%	0.782	S	S	*	*			trans	-76.1	102	169.2	-84.4	-160.2	161.6	0	0	112.6	D145 S149	D145-M147 PolarHBondContact O-N 3.29Å; M147-S149 VanDerWaalsContact C-N 3.31Å; M147-S149 PolarHBondContact O-N 3.18Å
148	T	44	Very low	42.7	Very low	130 Å²	130	146.8 Å²	146.8	80%	0.798	79%	0.793	S	S	*	*			trans	-68.9	80	170.1	42.1	0	0	0	0	111.9	A146 N150	A146-T148 PolarHBondContact O-N 3.08Å; T148-N150 PolarHBondContact O-N 3.04Å
149	S	30.8	Very low	42.3	Very low	89 Å²	89	146.2 Å²	146.2	62%	0.622	80%	0.797	S	S	*	*			trans	-79.7	108.7	178.3	-168.2	0	0	0	0	111.7	M147 F151	M147-S149 VanDerWaalsContact C-N 3.31Å; M147-S149 PolarHBondContact O-N 3.18Å; S149-F151 PolarHBondContact O-N 3.39Å
150	N	45.3	Very low	42.5	Very low	161 Å²	161	145 Å²	145	86%	0.861	78%	0.779	S	S	*	*			trans	-70.8	85.1	-178.5	-75.1	-68.7	0	0	0	112.7	T148	T148-N150 PolarHBondContact O-N 3.04Å
151	F	32.1	Very low	42.8	Very low	175 Å²	175	142.7 Å²	142.7	77%	0.768	76%	0.764	S	S	*	*			trans	-96.1	110	166.4	-90.6	-85.7	0	0	0	111.6	S149 I153	S149-F151 PolarHBondContact O-N 3.39Å; F151-I153 PolarHBondContact O-N 2.91Å; F151-I153 VanDerWaalsContact O-N 3.12Å
152	S	43.1	Very low	43.6	Very low	122 Å²	122	138.8 Å²	138.8	85%	0.853	76%	0.756	S	S	*	*			trans	-69.1	107	177.4	-172.9	0	0	0	0	111
153	I	39.8	Very low	44.3	Very low	150 Å²	150	137.2 Å²	137.2	77%	0.769	74%	0.743	S	S	*	*			trans	-115	124.5	166.9	-58.7	179.6	0	0	0	107	F151	F151-I153 PolarHBondContact O-N 2.91Å; F151-I153 VanDerWaalsContact O-N 3.12Å
154	K	46.9	Very low	45.8	Very low	188 Å²	188	133.1 Å²	133.1	82%	0.817	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-68	127	-176.8	-61.6	174.7	-177.7	177.8	0	109.6
155	P	40	Very low	47.2	Very low	117 Å²	117	126.9 Å²	126.9	76%	0.76	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-71.1	134.1	177.3	28.5	-33.6	0	0	0	111.1
156	T	37.2	Very low	49.5	Very low	118 Å²	118	124.1 Å²	124.1	72%	0.724	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-68.7	130.6	169.2	-60.8	0	0	0	0	109.6	M158	T156-M158 PolarHBondContact O-N 3.26Å
157	I	47.7	Very low	51	Low	144 Å²	144	125.6 Å²	125.6	74%	0.738	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	69.4	-172.3	-47.5	174.1	0	0	0	111.1
158	M	46.1	Very low	53.1	Low	168 Å²	168	122 Å²	122	83%	0.828	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.3	-17.6	170.8	-77.7	-79.9	77.8	0	0	114.3	T156 T160	T156-M158 PolarHBondContact O-N 3.26Å; M158-T160 PolarHBondContact O-N 2.92Å
159	A	47	Very low	54.6	Low	71 Å²	71	120.7 Å²	120.7	59%	0.587	63%	0.634	S	S	*	*	S	Bend	trans	-90.6	9	-174.2	0	0	0	0	0	114.8
160	T	57.7	Low	57	Low	80 Å²	80	122.7 Å²	122.7	49%	0.491	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.1	-1.3	-160.3	50.3	0	0	0	0	116.4	M158 R164	M158-T160 PolarHBondContact O-N 2.92Å; T160-R164 PolarHBondContact O-NH2 2.99Å
161	Q	54.3	Low	58.6	Low	107 Å²	107	121 Å²	121	50%	0.5	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.5	-69.1	178.8	-163.6	60.1	39.6	0	0	111.1	Q163 R164 D165	Q161-Q163 PolarHBondContact O-N 2.8Å; Q161-R164 CarbonylContact O-C 3.58Å; Q161-R164 WeakPolarHBondContact O-CA 3.48Å; Q161-R164 WeakPolarHBondContact O-CB 3.39Å; Q161-R164 PolarHBondContact O-N 2.84Å; Q161-D165 PolarHBondContact NE2-OD1 3.39Å; Q161-D165 PolarHBondContact O-N 3.48Å
162	L	58.1	Low	60.8	Low	121 Å²	121	119.3 Å²	119.3	63%	0.634	61%	0.609	S	S	*	*	H	α-helix	trans	-54.4	-33.1	-178.2	-172.7	66.1	0	0	0	113.9	D165 I166	L162-D165 WeakPolarHBondContact CA-OD2 3.37Å; L162-I166 HydrophobicContact CD1-CD1 4.42Å; L162-I166 HydrophobicContact CG-CD1 4.05Å; L162-I166 WeakPolarHBondContact O-CB 3.42Å; L162-I166 WeakPolarHBondContact O-CD1 3.23Å; L162-I166 VanDerWaalsContact O-CG1 3.23Å; L162-I166 WeakPolarHBondContact O-CG1 3.36Å; L162-I166 PolarHBondContact O-N 3.34Å
163	Q	63.8	Low	62.5	Low	135 Å²	135	119.9 Å²	119.9	63%	0.631	59%	0.593	S	S	*	*	H	α-helix	trans	-74.4	-24.8	176	-172.4	166.1	3.9	0	0	113.4	Q161 Q167	Q161-Q163 PolarHBondContact O-N 2.8Å; Q163-Q167 WeakPolarHBondContact O-CB 3.46Å; Q163-Q167 PolarHBondContact O-N 3.07Å
164	R	72.8	Confident	64.3	Low	103 Å²	103	118.6 Å²	118.6	39%	0.389	58%	0.584	S	S	.	*	H	α-helix	trans	-77.8	-45.6	168.5	-163.2	-166.6	-51.4	98.9	-2.2	110.4	T160 Q161 I166 Q167 E168	T160-R164 PolarHBondContact O-NH2 2.99Å; Q161-R164 CarbonylContact O-C 3.58Å; Q161-R164 WeakPolarHBondContact O-CA 3.48Å; Q161-R164 WeakPolarHBondContact O-CB 3.39Å; Q161-R164 PolarHBondContact O-N 2.84Å; R164-I166 VanDerWaalsContact C-N 3.29Å; R164-I166 PolarHBondContact O-N 2.89Å; R164-Q167 CarbonylContact O-C 3.46Å; R164-Q167 WeakPolarHBondContact O-CA 3.4Å; R164-Q167 PolarHBondContact O-N 2.87Å; R164-E168 WeakPolarHBondContact CD-OE1 3.4Å; R164-E168 HydrophobicContact CG-CG 4.2Å; R164-E168 VanDerWaalsContact CG-OE1 3.24Å; R164-E168 WeakPolarHBondContact CG-OE1 3.45Å; R164-E168 PolarHBondContact O-N 3.25Å
165	D	71.8	Confident	65.6	Low	62 Å²	62	115.7 Å²	115.7	33%	0.332	57%	0.573	S	S	.	*	H	α-helix	trans	-55.8	-44.9	-179.9	-49.3	-23.1	0	0	0	110.9	Q161 L162 Q167 E169	Q161-D165 PolarHBondContact NE2-OD1 3.39Å; Q161-D165 PolarHBondContact O-N 3.48Å; L162-D165 WeakPolarHBondContact CA-OD2 3.37Å; D165-Q167 PolarHBondContact O-N 2.93Å; D165-E169 WeakPolarHBondContact O-CB 3.42Å; D165-E169 PolarHBondContact O-N 3.13Å
166	I	81.8	Confident	67.1	Low	94 Å²	94	114.6 Å²	114.6	48%	0.482	56%	0.558	S	S	.	*	H	α-helix	trans	-62.9	-39.9	174.4	-70.9	166.1	0	0	0	112	L162 R164 E169 E170	L162-I166 HydrophobicContact CD1-CD1 4.42Å; L162-I166 HydrophobicContact CG-CD1 4.05Å; L162-I166 WeakPolarHBondContact O-CB 3.42Å; L162-I166 WeakPolarHBondContact O-CD1 3.23Å; L162-I166 VanDerWaalsContact O-CG1 3.23Å; L162-I166 WeakPolarHBondContact O-CG1 3.36Å; L162-I166 PolarHBondContact O-N 3.34Å; R164-I166 VanDerWaalsContact C-N 3.29Å; R164-I166 PolarHBondContact O-N 2.89Å; I166-E169 PolarHBondContact O-N 3.4Å; I166-E170 WeakPolarHBondContact O-CB 3.32Å; I166-E170 PolarHBondContact O-N 2.89Å
167	Q	77.6	Confident	68.7	Low	120 Å²	120	118.3 Å²	118.3	56%	0.561	56%	0.558	S	S	*	*	H	α-helix	trans	-75.9	-35.1	-176	-166.7	163.7	4.3	0	0	111.9	Q163 R164 D165 E170 E171	Q163-Q167 WeakPolarHBondContact O-CB 3.46Å; Q163-Q167 PolarHBondContact O-N 3.07Å; R164-Q167 CarbonylContact O-C 3.46Å; R164-Q167 WeakPolarHBondContact O-CA 3.4Å; R164-Q167 PolarHBondContact O-N 2.87Å; D165-Q167 PolarHBondContact O-N 2.93Å; Q167-E170 PolarHBondContact O-N 2.76Å; Q167-E171 VanDerWaalsContact O-CB 3.28Å; Q167-E171 WeakPolarHBondContact O-CB 3.49Å; Q167-E171 PolarHBondContact O-N 2.81Å
168	E	77	Confident	69.7	Low	107 Å²	107	117.1 Å²	117.1	50%	0.5	55%	0.55	S	S	.	.	H	α-helix	trans	-67.6	-34.3	168.9	-71.1	173.4	-170.4	0	0	111.3	R164 R172	R164-E168 WeakPolarHBondContact CD-OE1 3.4Å; R164-E168 HydrophobicContact CG-CG 4.2Å; R164-E168 VanDerWaalsContact CG-OE1 3.24Å; R164-E168 WeakPolarHBondContact CG-OE1 3.45Å; R164-E168 PolarHBondContact O-N 3.25Å; E168-R172 WeakPolarHBondContact O-CB 3.46Å; E168-R172 PolarHBondContact O-N 2.88Å
169	E	76.6	Confident	70.8	Confident	102 Å²	102	114.8 Å²	114.8	48%	0.477	54%	0.535	S	S	.	.	H	α-helix	trans	-74.8	-23.6	174.6	-151.5	-159.5	135.5	0	0	113.5	D165 I166 R173	D165-E169 WeakPolarHBondContact O-CB 3.42Å; D165-E169 PolarHBondContact O-N 3.13Å; I166-E169 PolarHBondContact O-N 3.4Å; E169-R173 WeakPolarHBondContact O-CG 3.46Å; E169-R173 PolarHBondContact O-N 2.72Å; E169-R173 PolarHBondContact O-NH1 3.22Å; E169-R173 VanDerWaalsContact O-NH1 3.13Å; E169-R173 IonicContact OE1-CZ 2.69Å; E169-R173 IonicContact OE1-NH1 2.79Å; E169-R173 PolarHBondContact OE1-NH1 3.44Å; E169-R173 IonicContact OE1-NH2 2.82Å; E169-R173 PolarHBondContact OE1-NH2 3.16Å
170	E	79.9	Confident	71.4	Confident	131 Å²	131	114.7 Å²	114.7	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-80	-49.8	172.9	-170.2	163.6	-139.2	0	0	110.3	I166 Q167 R172 R173 E174	I166-E170 WeakPolarHBondContact O-CB 3.32Å; I166-E170 PolarHBondContact O-N 2.89Å; Q167-E170 PolarHBondContact O-N 2.76Å; E170-R172 PolarHBondContact O-N 3.33Å; E170-R173 PolarHBondContact O-N 2.7Å; E170-R173 VanDerWaalsContact O-N 3.12Å; E170-E174 PolarHBondContact O-N 3.01Å
171	E	78.9	Confident	71.7	Confident	125 Å²	125	113.5 Å²	113.5	58%	0.584	53%	0.528	S	S	*	.	H	α-helix	trans	-59	-44.9	175.7	-170	163.4	-139.9	0	0	111.4	Q167 R173 E174 E175	Q167-E171 VanDerWaalsContact O-CB 3.28Å; Q167-E171 WeakPolarHBondContact O-CB 3.49Å; Q167-E171 PolarHBondContact O-N 2.81Å; E171-R173 VanDerWaalsContact C-N 3.31Å; E171-R173 PolarHBondContact O-N 3.36Å; E171-E174 PolarHBondContact O-N 2.8Å; E171-E174 VanDerWaalsContact O-N 3.09Å; E171-E175 PolarHBondContact O-N 3.07Å
172	R	79.3	Confident	71.9	Confident	140 Å²	140	115 Å²	115	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-32.2	175.7	-171.2	-176.8	178.7	-63.8	-20.5	113.3	E168 E170 E176	E168-R172 WeakPolarHBondContact O-CB 3.46Å; E168-R172 PolarHBondContact O-N 2.88Å; E170-R172 PolarHBondContact O-N 3.33Å; R172-E176 IonicContact CZ-OE1 3.15Å; R172-E176 IonicContact CZ-OE2 2.61Å; R172-E176 IonicContact NH1-OE1 2.72Å; R172-E176 PolarHBondContact NH1-OE1 3.06Å; R172-E176 IonicContact NH1-OE2 3.12Å; R172-E176 PolarHBondContact NH1-OE2 3.4Å; R172-E176 IonicContact NH2-OE1 2.69Å; R172-E176 PolarHBondContact NH2-OE1 2.89Å; R172-E176 WeakPolarHBondContact O-CB 3.42Å; R172-E176 WeakPolarHBondContact O-CG 3.41Å; R172-E176 PolarHBondContact O-N 3.26Å
173	R	78.8	Confident	71.8	Confident	135 Å²	135	114.6 Å²	114.6	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-73.3	-33.8	173.1	-84.7	-168.6	-172.8	83.3	1.4	112.3	E169 E170 E171 R177	E169-R173 WeakPolarHBondContact O-CG 3.46Å; E169-R173 PolarHBondContact O-N 2.72Å; E169-R173 PolarHBondContact O-NH1 3.22Å; E169-R173 VanDerWaalsContact O-NH1 3.13Å; E169-R173 IonicContact OE1-CZ 2.69Å; E169-R173 IonicContact OE1-NH1 2.79Å; E169-R173 PolarHBondContact OE1-NH1 3.44Å; E169-R173 IonicContact OE1-NH2 2.82Å; E169-R173 PolarHBondContact OE1-NH2 3.16Å; E170-R173 PolarHBondContact O-N 2.7Å; E170-R173 VanDerWaalsContact O-N 3.12Å; E171-R173 VanDerWaalsContact C-N 3.31Å; E171-R173 PolarHBondContact O-N 3.36Å; R173-R177 VanDerWaalsContact O-CG 3.32Å; R173-R177 WeakPolarHBondContact O-CG 3.49Å; R173-R177 PolarHBondContact O-N 3.26Å
174	E	76.4	Confident	71.4	Confident	123 Å²	123	115.2 Å²	115.2	58%	0.575	53%	0.533	S	S	*	.	H	α-helix	trans	-72.4	-38.9	176.9	-168.5	149.6	-141.1	0	0	111	E170 E171 R177 Q178	E170-E174 PolarHBondContact O-N 3.01Å; E171-E174 PolarHBondContact O-N 2.8Å; E171-E174 VanDerWaalsContact O-N 3.09Å; E174-R177 PolarHBondContact O-N 3.19Å; E174-Q178 WeakPolarHBondContact O-CG 3.33Å; E174-Q178 PolarHBondContact O-N 2.91Å
175	E	75.4	Confident	70.4	Confident	126 Å²	126	117 Å²	117	59%	0.589	55%	0.546	S	S	*	.	H	α-helix	trans	-58.4	-48.1	167.7	-72.9	-170.1	151.9	0	0	112.4	E171 R177 Q178 K179	E171-E175 PolarHBondContact O-N 3.07Å; E175-R177 VanDerWaalsContact C-N 3.28Å; E175-R177 PolarHBondContact O-N 3.02Å; E175-Q178 PolarHBondContact O-N 3.43Å; E175-K179 VanDerWaalsContact O-CB 3.3Å; E175-K179 WeakPolarHBondContact O-CB 3.41Å; E175-K179 PolarHBondContact O-N 3.21Å
176	E	71.9	Confident	69.3	Low	94 Å²	94	119 Å²	119	44%	0.439	56%	0.56	S	S	.	*	H	α-helix	trans	-62.1	-34.8	178.4	-79.6	-179.8	153.9	0	0	112.2	R172 S180	R172-E176 IonicContact CZ-OE1 3.15Å; R172-E176 IonicContact CZ-OE2 2.61Å; R172-E176 IonicContact NH1-OE1 2.72Å; R172-E176 PolarHBondContact NH1-OE1 3.06Å; R172-E176 IonicContact NH1-OE2 3.12Å; R172-E176 PolarHBondContact NH1-OE2 3.4Å; R172-E176 IonicContact NH2-OE1 2.69Å; R172-E176 PolarHBondContact NH2-OE1 2.89Å; R172-E176 WeakPolarHBondContact O-CB 3.42Å; R172-E176 WeakPolarHBondContact O-CG 3.41Å; R172-E176 PolarHBondContact O-N 3.26Å; E176-S180 PolarHBondContact O-N 3.3Å; E176-S180 VanDerWaalsContact O-N 3.1Å; E176-S180 PolarHBondContact O-OG 3.2Å
177	R	70.6	Confident	67.6	Low	197 Å²	197	120 Å²	120	74%	0.743	57%	0.57	S	S	*	*	H	α-helix	trans	-73.7	-40	175.4	-72.8	-177.2	75.5	171.3	5.5	113.4	R173 E174 E175 S180 A181	R173-R177 VanDerWaalsContact O-CG 3.32Å; R173-R177 WeakPolarHBondContact O-CG 3.49Å; R173-R177 PolarHBondContact O-N 3.26Å; E174-R177 PolarHBondContact O-N 3.19Å; E175-R177 VanDerWaalsContact C-N 3.28Å; E175-R177 PolarHBondContact O-N 3.02Å; R177-S180 WeakPolarHBondContact CA-OG 3.48Å; R177-S180 PolarHBondContact O-N 3.07Å; R177-S180 PolarHBondContact O-OG 3.16Å; R177-A181 PolarHBondContact O-N 3.15Å
178	Q	67.2	Low	65.9	Low	119 Å²	119	119.2 Å²	119.2	56%	0.556	57%	0.574	S	S	*	*	H	α-helix	trans	-64	-43.8	174.7	-72.4	176	23.4	0	0	110.5	E174 E175 S180 A181 E182	E174-Q178 WeakPolarHBondContact O-CG 3.33Å; E174-Q178 PolarHBondContact O-N 2.91Å; E175-Q178 PolarHBondContact O-N 3.43Å; Q178-S180 PolarHBondContact O-N 2.92Å; Q178-A181 WeakPolarHBondContact O-CB 3.5Å; Q178-A181 PolarHBondContact O-N 3.29Å; Q178-A181 VanDerWaalsContact O-N 3.09Å; Q178-E182 PolarHBondContact O-N 3.36Å
179	K	70.9	Confident	64.1	Low	118 Å²	118	120.2 Å²	120.2	51%	0.513	58%	0.582	S	S	.	*	H	α-helix	trans	-64.2	-36.9	178	-169.7	168	-175.1	-75.2	0	113.2	E175 A181 E182 E183	E175-K179 VanDerWaalsContact O-CB 3.3Å; E175-K179 WeakPolarHBondContact O-CB 3.41Å; E175-K179 PolarHBondContact O-N 3.21Å; K179-A181 VanDerWaalsContact C-N 3.29Å; K179-A181 PolarHBondContact O-N 2.62Å; K179-E182 PolarHBondContact O-N 3.33Å; K179-E183 IonicContact NZ-OE1 3.89Å; K179-E183 PolarHBondContact NZ-OE1 3.03Å; K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 3.03Å
180	S	58.9	Low	62.5	Low	70 Å²	70	123.3 Å²	123.3	49%	0.49	60%	0.599	S	S	.	*	H	α-helix	trans	-64.8	-31.6	172.7	53.9	0	0	0	0	113.3	E176 R177 Q178 E184	E176-S180 PolarHBondContact O-N 3.3Å; E176-S180 VanDerWaalsContact O-N 3.1Å; E176-S180 PolarHBondContact O-OG 3.2Å; R177-S180 WeakPolarHBondContact CA-OG 3.48Å; R177-S180 PolarHBondContact O-N 3.07Å; R177-S180 PolarHBondContact O-OG 3.16Å; Q178-S180 PolarHBondContact O-N 2.92Å; S180-E184 PolarHBondContact O-N 3.05Å
181	A	64.7	Low	60.9	Low	54 Å²	54	126.2 Å²	126.2	45%	0.446	61%	0.613	S	S	.	*	H	α-helix	trans	-74.8	-38.8	176.5	0	0	0	0	0	112.2	R177 Q178 K179 E184 E185	R177-A181 PolarHBondContact O-N 3.15Å; Q178-A181 WeakPolarHBondContact O-CB 3.5Å; Q178-A181 PolarHBondContact O-N 3.29Å; Q178-A181 VanDerWaalsContact O-N 3.09Å; K179-A181 VanDerWaalsContact C-N 3.29Å; K179-A181 PolarHBondContact O-N 2.62Å; A181-E184 PolarHBondContact O-N 3.41Å; A181-E185 PolarHBondContact O-N 3.45Å
182	E	58.7	Low	59.1	Low	139 Å²	139	129.7 Å²	129.7	65%	0.65	63%	0.629	S	S	*	*	H	α-helix	trans	-65	-38.6	172.9	-68.6	-171.9	157.8	0	0	112.1	Q178 K179 E184 E185 V186	Q178-E182 PolarHBondContact O-N 3.36Å; K179-E182 PolarHBondContact O-N 3.33Å; E182-E184 VanDerWaalsContact C-N 3.31Å; E182-E184 PolarHBondContact O-N 2.9Å; E182-E185 PolarHBondContact O-N 3.21Å; E182-V186 WeakPolarHBondContact O-CG2 3.33Å; E182-V186 PolarHBondContact O-N 3.1Å; E182-V186 VanDerWaalsContact O-N 3.17Å
183	E	55.8	Low	57.1	Low	112 Å²	112	129.4 Å²	129.4	52%	0.523	64%	0.638	S	S	.	*	H	α-helix	trans	-68	-28.9	175.7	-74.6	177.9	-166.4	0	0	112.6	K179 V187	K179-E183 IonicContact NZ-OE1 3.89Å; K179-E183 PolarHBondContact NZ-OE1 3.03Å; K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 3.03Å; E183-V187 WeakPolarHBondContact O-CG2 3.44Å
184	E	54.7	Low	55.1	Low	148 Å²	148	132.5 Å²	132.5	69%	0.692	66%	0.658	S	S	*	*	H	α-helix	trans	-76	-40.3	174.1	-166.7	167.1	-130.5	0	0	112.4	S180 A181 E182 V186 V187	S180-E184 PolarHBondContact O-N 3.05Å; A181-E184 PolarHBondContact O-N 3.41Å; E182-E184 VanDerWaalsContact C-N 3.31Å; E182-E184 PolarHBondContact O-N 2.9Å; E184-V186 VanDerWaalsContact C-N 3.32Å; E184-V186 PolarHBondContact O-N 2.95Å; E184-V187 PolarHBondContact O-N 2.91Å
185	E	51.5	Low	52.9	Low	142 Å²	142	130.4 Å²	130.4	66%	0.664	67%	0.669	S	S	*	*	H	α-helix	trans	-69.8	-25	177.7	-162.8	177.6	-128.1	0	0	113.1	A181 E182 T188 N189	A181-E185 PolarHBondContact O-N 3.45Å; E182-E185 PolarHBondContact O-N 3.21Å; E185-T188 PolarHBondContact O-OG1 3.1Å; E185-T188 VanDerWaalsContact O-OG1 3.05Å; E185-N189 PolarHBondContact O-ND2 3.36Å
186	V	48.6	Very low	51	Low	102 Å²	102	133.5 Å²	133.5	62%	0.618	68%	0.681	S	S	*	*	H	α-helix	trans	-72.1	-31.7	175.4	168.4	0	0	0	0	112.7	E182 E184 N189	E182-V186 WeakPolarHBondContact O-CG2 3.33Å; E182-V186 PolarHBondContact O-N 3.1Å; E182-V186 VanDerWaalsContact O-N 3.17Å; E184-V186 VanDerWaalsContact C-N 3.32Å; E184-V186 PolarHBondContact O-N 2.95Å; V186-N189 PolarHBondContact O-N 3.42Å
187	V	45.5	Very low	49.2	Very low	116 Å²	116	136.9 Å²	136.9	70%	0.703	70%	0.697	S	S	*	*	H	α-helix	trans	-71.3	-32.5	-177.1	174	0	0	0	0	112.2	E183 E184 N189	E183-V187 WeakPolarHBondContact O-CG2 3.44Å; E184-V187 PolarHBondContact O-N 2.91Å; V187-N189 VanDerWaalsContact C-N 3.25Å; V187-N189 PolarHBondContact O-N 2.91Å
188	T	41.8	Very low	47.2	Very low	104 Å²	104	133.7 Å²	133.7	64%	0.638	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-73.3	-13.1	-179.1	57.6	0	0	0	0	114.1	E185	E185-T188 PolarHBondContact O-OG1 3.1Å; E185-T188 VanDerWaalsContact O-OG1 3.05Å
189	N	40.3	Very low	45.4	Very low	127 Å²	127	134.2 Å²	134.2	68%	0.679	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-97.4	17.5	-170.7	-83	-80	0	0	0	115	E185 V186 V187	E185-N189 PolarHBondContact O-ND2 3.36Å; V186-N189 PolarHBondContact O-N 3.42Å; V187-N189 VanDerWaalsContact C-N 3.25Å; V187-N189 PolarHBondContact O-N 2.91Å
190	M	43	Very low	43.6	Very low	168 Å²	168	135 Å²	135	83%	0.828	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-115.2	-3	-179.5	-64.8	-155	75.4	0	0	116.4
191	E	46.3	Very low	42.3	Very low	192 Å²	192	139.3 Å²	139.3	90%	0.897	73%	0.725	S	S	*	*	S	Bend	trans	-114.7	37.1	-176.4	-67.6	-157.7	119.5	0	0	115.3
192	E	40.8	Very low	40.7	Very low	198 Å²	198	141.3 Å²	141.3	93%	0.925	73%	0.732	S	S	*	*			trans	-147.3	52.4	176.6	-138.6	179.7	-111.2	0	0	117.6
193	D	36.8	Very low	39.4	Very low	134 Å²	134	142.8 Å²	142.8	72%	0.717	74%	0.739	S	S	*	*			trans	-151.4	90.5	157.1	-167.1	28.6	0	0	0	114.8
194	E	37	Very low	38.2	Very low	200 Å²	200	143.7 Å²	143.7	94%	0.935	75%	0.748	S	S	*	*			trans	-149.7	151.7	139.3	-83.5	-146.5	163	0	0	110.2
195	G	31.1	Very low	37.1	Very low	79 Å²	79	142.3 Å²	142.3	81%	0.814	75%	0.749	S	S	*	*			trans	105	47.1	154.7	0	0	0	0	0	120.2
196	K	35.9	Very low	36	Very low	190 Å²	190	140.1 Å²	140.1	83%	0.826	75%	0.749	S	S	*	*			trans	-84.9	109.7	166.1	-65.4	173.5	-178.3	101.3	0	112.4
197	E	32.2	Very low	35.1	Very low	165 Å²	165	142.2 Å²	142.2	77%	0.771	76%	0.756	S	S	*	*			trans	-153.8	101	164.6	-174.6	91.1	-102.5	0	0	114.2
198	N	29.9	Very low	34.6	Very low	131 Å²	131	145.7 Å²	145.7	70%	0.701	76%	0.762	S	S	*	*			trans	42.9	144.3	133.3	-68.1	-48.4	0	0	0	125.6
199	V	30.1	Very low	35.1	Very low	130 Å²	130	146.2 Å²	146.2	79%	0.788	77%	0.767	S	S	*	*			trans	85.8	96.9	139.7	164.2	0	0	0	0	119.9
200	D	31.3	Very low	34.6	Very low	134 Å²	134	149.5 Å²	149.5	72%	0.717	78%	0.778	S	S	*	*				54.8	137.3	119.9	-162.8	32.3	0	0	0	120.7
201	K	32.6	Very low	34.4	Very low	160 Å²	160	149 Å²	149	70%	0.696	77%	0.774	S	S	*	*				138.3	116.5	114.2	-153.3	162.2	-177.8	165.4	0	118.1
202	T	30	Very low	34.1	Very low	97 Å²	97	146.9 Å²	146.9	60%	0.595	76%	0.762	S	S	*	*			trans	64	127.1	147.4	55.5	0	0	0	0	123.8
203	Q	33.2	Very low	33.8	Very low	169 Å²	169	143.8 Å²	143.8	79%	0.79	75%	0.752	S	S	*	*				69.6	158	127.6	-68.7	-173.2	-82.1	0	0	120.3
204	D	28.9	Very low	33.6	Very low	132 Å²	132	144.8 Å²	144.8	71%	0.706	76%	0.757	S	S	*	*			cis	-176	178	-21.9	-176.8	15.8	0	0	0	107.4
205	V	31.5	Very low	33.4	Very low	118 Å²	118	139.2 Å²	139.2	72%	0.715	75%	0.745	S	S	*	*			trans	79.2	86.1	162	-162.4	0	0	0	0	118.4
206	S	29.2	Very low	33.5	Very low	96 Å²	96	142.8 Å²	142.8	67%	0.671	75%	0.751	S	S	*	*			trans	-28.5	174.1	144.4	-169.2	0	0	0	0	119.6
207	L	30.6	Very low	33.3	Very low	146 Å²	146	136.8 Å²	136.8	76%	0.764	74%	0.743	S	S	*	*			trans	87.8	148.2	165.8	-51.3	178.3	0	0	0	117.6
208	K	34	Very low	33.2	Very low	189 Å²	189	138.1 Å²	138.1	82%	0.822	75%	0.747	S	S	*	*			cis	-168.8	168.2	-37.3	-118.5	-161.1	176.4	-172.9	0	108.3
209	P	53.4	Low	33.4	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	75%	0.747	S	S	*	*			trans	-97.4	174.4	-176.8	39.5	-35.9	0	0	0	114.5
210	E	29.6	Very low	33.5	Very low	197 Å²	197	137.4 Å²	137.4	92%	0.921	74%	0.737	S	S	*	*			trans	-131.8	163	165.1	-73.2	-162.3	124.2	0	0	112.4
211	E	37.7	Very low	33.4	Very low	156 Å²	156	140.7 Å²	140.7	73%	0.729	75%	0.745	S	S	*	*			trans	-101.5	-163.1	177.7	-53.2	172.2	91.6	0	0	109.9
212	K	41	Very low	33.5	Very low	149 Å²	149	139 Å²	139	65%	0.648	74%	0.744	S	S	*	*			cis	-172.3	-168.8	18.3	-145.2	169.7	-172.6	84.8	0	111.9
213	D	33.9	Very low	33.7	Very low	133 Å²	133	142.6 Å²	142.6	71%	0.711	76%	0.759	S	S	*	*			trans	95.8	98.9	151.5	-57.3	-18.4	0	0	0	123.7
214	D	32.3	Very low	33.9	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	76%	0.758	S	S	*	*				51.2	112.1	122.9	-68.8	-16.2	0	0	0	127.6
215	A	33.4	Very low	34.1	Very low	84 Å²	84	143 Å²	143	69%	0.694	77%	0.766	S	S	*	*				74.9	155.9	112.9	0	0	0	0	0	126.5
216	V	33.3	Very low	34.1	Very low	153 Å²	153	140.4 Å²	140.4	93%	0.927	76%	0.763	S	S	*	*			trans	64.6	145.6	167.9	-54.4	0	0	0	0	120.8
217	G	31.6	Very low	34.4	Very low	65 Å²	65	142.1 Å²	142.1	67%	0.67	77%	0.769	S	S	*	*			cis	166.8	163.4	-10.4	0	0	0	0	0	115.3
218	F	29	Very low	34.6	Very low	193 Å²	193	143.4 Å²	143.4	85%	0.846	77%	0.771	S	S	*	*			trans	70.6	156.7	170.7	-72.5	-103.7	0	0	0	119.4
219	Q	35.6	Very low	34.5	Very low	152 Å²	152	138.3 Å²	138.3	71%	0.71	77%	0.765	S	S	*	*			cis	163	165.1	-34.1	-103	-169.6	-17.1	0	0	107.9
220	T	31.5	Very low	33.6	Very low	93 Å²	93	137.5 Å²	137.5	57%	0.571	77%	0.768	S	S	*	*			cis	-160.9	162.4	-1.4	1	0	0	0	0	108.6
221	F	28.7	Very low	33.7	Very low	203 Å²	203	132.9 Å²	132.9	89%	0.89	76%	0.763	S	S	*	*			trans	175.2	156.5	134.2	-103.2	-65.1	0	0	0	113.9
222	D	34.4	Very low	33.3	Very low	125 Å²	125	132.4 Å²	132.4	67%	0.668	77%	0.765	S	S	*	*			trans	-122.9	169.3	-159.3	-35.2	-100.8	0	0	0	114.5
223	L	35.6	Very low	33.1	Very low	173 Å²	173	129.2 Å²	129.2	91%	0.906	76%	0.762	S	S	*	*			trans	-179.6	169.2	132.9	-98.5	164.6	0	0	0	114.6
224	D	37.8	Very low	33	Very low	147 Å²	147	132 Å²	132	79%	0.786	77%	0.77	S	S	*	*			trans	-114.5	174.5	-154	-85.7	-68.3	0	0	0	118.1
225	D	31.7	Very low	32.9	Very low	163 Å²	163	129 Å²	129	87%	0.872	76%	0.762	S	S	*	*			trans	69.6	150.6	156.7	-110.4	16.2	0	0	0	120.4
226	G	32.4	Very low	33	Very low	63 Å²	63	133.4 Å²	133.4	65%	0.649	77%	0.768	S	S	*	*			cis	167	141.5	-10.2	0	0	0	0	0	116.3
227	V	33.9	Very low	32.8	Very low	132 Å²	132	132.8 Å²	132.8	80%	0.8	76%	0.76	S	S	*	*			trans	77	115.9	142	-175.8	0	0	0	0	124.1
228	E	35.7	Very low	33	Very low	172 Å²	172	134.8 Å²	134.8	80%	0.804	76%	0.758	S	S	*	*			trans	42.4	124.6	134.7	-58.4	-67.8	135.3	0	0	126.9
229	A	32.4	Very low	33.1	Very low	83 Å²	83	134.7 Å²	134.7	69%	0.686	76%	0.761	S	S	*	*				65.6	134.8	115.8	0	0	0	0	0	128.1
230	A	33.3	Very low	32.7	Very low	98 Å²	98	131 Å²	131	81%	0.81	76%	0.763	S	S	*	*			trans	78.6	146.9	130.3	0	0	0	0	0	124.9
231	A	32.9	Very low	32.4	Very low	99 Å²	99	130 Å²	130	82%	0.818	77%	0.772	S	S	*	*			trans	59.4	135.8	164.6	0	0	0	0	0	118.2
232	D	29.7	Very low	32.5	Very low	146 Å²	146	124.8 Å²	124.8	78%	0.781	76%	0.76	S	S	*	*			cis	108.8	147.1	25.1	-175.2	56.2	0	0	0	114
233	S	35	Very low	32.3	Very low	82 Å²	82	127 Å²	127	57%	0.573	77%	0.767	S	S	*	*			trans	82.7	126.4	163.9	-78.6	0	0	0	0	121.9
234	Q	33.3	Very low	32	Very low	191 Å²	191	126.5 Å²	126.5	89%	0.893	76%	0.76	S	S	*	*			trans	75.2	149.2	150	-65.7	173.7	-3	0	0	118.3
235	S	30.5	Very low	31.8	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	76%	0.76	S	S	*	*			cis	-153.1	152.1	10	52.7	0	0	0	0	112.7
236	E	33.9	Very low	31.8	Very low	178 Å²	178	127.2 Å²	127.2	83%	0.832	75%	0.753	S	S	*	*			trans	53.4	148.4	137.5	-63.2	166.8	170	0	0	119.8
237	D	30.8	Very low	31.7	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	75%	0.752	S	S	*	*			cis	-164.8	177.8	16.8	-147.5	-16.7	0	0	0	113.4
238	V	33.9	Very low	31.5	Very low	106 Å²	106	125.6 Å²	125.6	64%	0.642	75%	0.748	S	S	*	*			trans	75.2	123.1	152.4	170.1	0	0	0	0	122.1
239	E	31.1	Very low	31.4	Very low	192 Å²	192	124.6 Å²	124.6	90%	0.897	75%	0.753	S	S	*	*			trans	36.7	154.4	144.4	-58.5	-179.6	140.2	0	0	123
240	G	27.3	Very low	31.2	Very low	73 Å²	73	123.8 Å²	123.8	75%	0.753	75%	0.752	S	S	*	*			cis	153.5	141.7	-4	0	0	0	0	0	113.2
241	G	27	Very low	31.2	Very low	74 Å²	74	124.1 Å²	124.1	76%	0.763	75%	0.749	S	S	*	*			trans	74.9	163.1	178.7	0	0	0	0	0	115.3
242	S	29.8	Very low	31.2	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	75%	0.751	S	S	*	*			cis	140.6	127.7	-12.1	52.4	0	0	0	0	107.9
243	E	29.3	Very low	31.4	Very low	171 Å²	171	124.5 Å²	124.5	80%	0.799	74%	0.741	S	S	*	*			trans	64.6	155.2	164.6	-66.5	138.5	-134.2	0	0	115.8
244	E	30	Very low	31.5	Very low	162 Å²	162	129.1 Å²	129.1	76%	0.757	75%	0.754	S	S	*	*			cis	-156	-164.1	-18.7	-120.2	175.5	-175.4	0	0	109
245	E	32.9	Very low	31.9	Very low	170 Å²	170	128 Å²	128	79%	0.794	75%	0.748	S	S	*	*			trans	-3.2	155.2	152	-68.8	-164.1	163.4	0	0	120.7
246	E	32.9	Very low	32	Very low	155 Å²	155	132.6 Å²	132.6	72%	0.724	76%	0.76	S	S	*	*			cis	-167.3	169.4	17.3	-128.8	-82.5	87.2	0	0	110.7
247	A	29.5	Very low	31.7	Very low	77 Å²	77	127.1 Å²	127.1	64%	0.636	75%	0.751	S	S	*	*			trans	60.8	157.6	150.4	0	0	0	0	0	121.8
248	A	30.1	Very low	31.8	Very low	85 Å²	85	127.4 Å²	127.4	70%	0.702	76%	0.758	S	S	*	*			cis	-172	174.2	-26.2	0	0	0	0	0	110.1
249	V	33	Very low	31.8	Very low	150 Å²	150	129.8 Å²	129.8	91%	0.909	76%	0.762	S	S	*	*			trans	72.4	132.8	171.3	-167.2	0	0	0	0	114.7
250	G	28.6	Very low	31.9	Very low	66 Å²	66	128.8 Å²	128.8	68%	0.68	76%	0.757	S	S	*	*			cis	156.9	147.2	1	0	0	0	0	0	108.3
251	S	34.7	Very low	32.2	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	76%	0.757	S	S	*	*			cis	-162.3	155.2	23.5	-56.1	0	0	0	0	112.6
252	Q	32.5	Very low	33.2	Very low	184 Å²	184	131.6 Å²	131.6	86%	0.86	75%	0.751	S	S	*	*			trans	37.9	144.2	139.7	-69.3	-176.1	-79.4	0	0	122.6
253	A	32.9	Very low	33.1	Very low	69 Å²	69	133 Å²	133	57%	0.57	76%	0.756	S	S	*	*			cis	-168.1	161.9	-4	0	0	0	0	0	112.7
254	E	38.1	Very low	33.2	Very low	179 Å²	179	133.7 Å²	133.7	84%	0.836	76%	0.759	S	S	*	*			trans	51.8	137.5	150.8	-69.8	159.2	-131.1	0	0	120.9
255	E	40.3	Very low	33.4	Very low	168 Å²	168	134.1 Å²	134.1	79%	0.785	76%	0.761	S	S	*	*			cis	-147.3	-145.5	-27.2	-144.7	-160.2	100.5	0	0	107.5	G257	E255-G257 PolarHBondContact OE1-N 3.23Å
256	E	32.9	Very low	33.4	Very low	186 Å²	186	133.6 Å²	133.6	87%	0.869	76%	0.759	S	S	*	*			cis	-142.2	151.7	10.4	-67.7	175.8	64.3	0	0	110.8
257	G	29.2	Very low	33.1	Very low	64 Å²	64	132 Å²	132	66%	0.66	76%	0.76	S	S	*	*			trans	101.6	134.3	153.2	0	0	0	0	0	118.8	E255	E255-G257 PolarHBondContact OE1-N 3.23Å
258	V	31.8	Very low	32.9	Very low	145 Å²	145	133.3 Å²	133.3	88%	0.879	77%	0.771	S	S	*	*			trans	-138	148.3	-171	172.7	0	0	0	0	112.5
259	E	33.7	Very low	33	Very low	156 Å²	156	134 Å²	134	73%	0.729	78%	0.777	S	S	*	*			trans	-107	-175.7	175.3	-57	-169	134.2	0	0	114.2
260	Q	33.2	Very low	32.6	Very low	171 Å²	171	132.9 Å²	132.9	80%	0.799	77%	0.766	S	S	*	*			trans	96.6	146.3	144.4	-74.5	160.6	40.6	0	0	121.6
261	S	33.2	Very low	32.9	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	78%	0.775	S	S	*	*			trans	-93.6	-164.7	168.9	60.5	0	0	0	0	108.9
262	P	48	Very low	32.6	Very low	99 Å²	99	142.7 Å²	142.7	64%	0.643	78%	0.779	S	S	*	*			cis	-148.9	-175	19.1	40	-15.9	0	0	0	118.2
263	T	28.3	Very low	32.5	Very low	124 Å²	124	138.6 Å²	138.6	76%	0.761	77%	0.771	S	S	*	*			trans	57.2	160.4	151.7	45.5	0	0	0	0	120.8
264	Q	32.6	Very low	32.7	Very low	184 Å²	184	144.8 Å²	144.8	86%	0.86	79%	0.788	S	S	*	*			cis	-144.3	-143.3	5.1	-141.7	168.7	12.3	0	0	112.9
265	E	32.2	Very low	32.4	Very low	171 Å²	171	143 Å²	143	80%	0.799	78%	0.784	S	S	*	*			trans	-117.4	144.9	-154.5	167.8	-178.9	-166.6	0	0	115.4
266	E	33	Very low	32	Very low	160 Å²	160	141 Å²	141	75%	0.748	78%	0.783	S	S	*	*				173.5	134.5	127.5	-102.1	-150.7	162.6	0	0	117.7
267	T	27.2	Very low	32	Very low	120 Å²	120	140.8 Å²	140.8	74%	0.736	78%	0.782	S	S	*	*			trans	71.4	161.7	143.4	68.5	0	0	0	0	124.7
268	A	26.5	Very low	31.9	Very low	105 Å²	105	140.8 Å²	140.8	87%	0.868	78%	0.782	S	S	*	*			trans	89.5	145.1	161	0	0	0	0	0	119.2
269	A	32.2	Very low	31.9	Very low	101 Å²	101	142.5 Å²	142.5	84%	0.835	79%	0.786	S	S	*	*			trans	-147	149.3	179.1	0	0	0	0	0	110
270	D	24.5	Very low	31.9	Very low	126 Å²	126	139.5 Å²	139.5	67%	0.674	78%	0.782	S	S	*	*			trans	-157	161.1	137.6	-159.8	15.3	0	0	0	109.6	Q272	D270-Q272 PolarHBondContact OD2-NE2 3.2Å
271	F	34.2	Very low	32.2	Very low	202 Å²	202	139.6 Å²	139.6	89%	0.886	78%	0.782	S	S	*	*			trans	-126	127.5	169.8	-95.7	-91	0	0	0	108.5
272	Q	28.9	Very low	32.2	Very low	176 Å²	176	143.6 Å²	143.6	82%	0.822	79%	0.789	S	S	*	*			trans	-128.6	159	172.8	-65.7	-168.2	6.2	0	0	111.6	D270	D270-Q272 PolarHBondContact OD2-NE2 3.2Å
273	S	30.5	Very low	31.6	Very low	98 Å²	98	148 Å²	148	69%	0.685	80%	0.801	S	S	*	*			trans	-109.2	161	-158.9	50.5	0	0	0	0	113.7
274	E	36.7	Very low	31.9	Very low	199 Å²	199	150.9 Å²	150.9	93%	0.93	81%	0.806	S	S	*	*			trans	-134.1	155.6	153.7	-65.7	-167	145.3	0	0	109.3
275	D	30.5	Very low	31.9	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	80%	0.795	S	S	*	*			trans	-114.5	-166.6	-157.7	-79.1	-72.2	0	0	0	114.4
276	V	33.1	Very low	31.9	Very low	126 Å²	126	142.4 Å²	142.4	76%	0.764	80%	0.797	S	S	*	*			trans	83.4	128.1	163.6	-178.8	0	0	0	0	115.2
277	E	32.3	Very low	32	Very low	181 Å²	181	139 Å²	139	85%	0.846	80%	0.796	S	S	*	*			cis	-158.6	172	-9.3	-113.3	171.2	-136.6	0	0	106.9
278	G	27.3	Very low	32.5	Very low	64 Å²	64	140.9 Å²	140.9	66%	0.66	80%	0.797	S	S	*	*			cis	148.8	117.4	-0.5	0	0	0	0	0	112
279	L	30.9	Very low	32.8	Very low	182 Å²	182	144 Å²	144	95%	0.953	79%	0.793	S	S	*	*			trans	-151.2	151.5	170.6	-93.2	179.9	0	0	0	111.4
280	S	35.2	Very low	32.8	Very low	92 Å²	92	145.7 Å²	145.7	64%	0.643	79%	0.788	S	S	*	*			trans	-102	179.2	-175.1	62.8	0	0	0	0	112.6
281	E	38.1	Very low	33.2	Very low	174 Å²	174	147.7 Å²	147.7	81%	0.813	79%	0.793	S	S	*	*			cis	-150.8	-170	1.5	-126.6	140.9	145	0	0	105.5
282	E	33.8	Very low	32.9	Very low	191 Å²	191	141 Å²	141	89%	0.893	78%	0.781	S	S	*	*			cis	-131.6	-132.5	11.4	-62.5	175.4	94.5	0	0	110
283	E	35.5	Very low	33	Very low	191 Å²	191	141 Å²	141	89%	0.893	78%	0.781	S	S	*	*			trans	-139.6	168.3	177.8	-69.4	-172.3	102	0	0	112.5
284	E	33.8	Very low	32.9	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	78%	0.783	S	S	*	*			trans	-167.9	156.9	132.3	-105.8	-68.2	155.7	0	0	112
285	A	32.6	Very low	32.7	Very low	78 Å²	78	141.2 Å²	141.2	65%	0.645	77%	0.771	S	S	*	*			trans	-44.1	140.3	-169.3	0	0	0	0	0	117.6
286	A	32.2	Very low	32.8	Very low	100 Å²	100	139.1 Å²	139.1	83%	0.826	77%	0.768	S	S	*	*				69.6	141.6	64.1	0	0	0	0	0	114.3
287	A	35	Very low	33	Very low	89 Å²	89	139.3 Å²	139.3	74%	0.736	77%	0.771	S	S	*	*			cis	-154.4	154	9.6	0	0	0	0	0	113.7
288	E	38	Very low	32.9	Very low	159 Å²	159	136.6 Å²	136.6	74%	0.743	77%	0.767	S	S	*	*			trans	36.1	136	142	-52.1	-63.4	-163.8	0	0	125.1
289	E	33.2	Very low	33.2	Very low	170 Å²	170	141.1 Å²	141.1	79%	0.794	77%	0.769	S	S	*	*			trans	66	149.1	136.5	-70.8	179.7	-175.3	0	0	121.7
290	D	31.9	Very low	33.2	Very low	136 Å²	136	138.9 Å²	138.9	73%	0.727	75%	0.754	S	S	*	*			cis	-163.1	-172.5	-27.3	-162.5	20.4	0	0	0	109.2
291	E	33	Very low	33.1	Very low	168 Å²	168	142.9 Å²	142.9	79%	0.785	76%	0.762	S	S	*	*			trans	-22.2	148.3	164.2	-59.2	-73.4	-176.6	0	0	116.4
292	G	28.6	Very low	32.7	Very low	61 Å²	61	141.8 Å²	141.8	63%	0.629	77%	0.768	S	S	*	*			cis	147.1	159	15.3	0	0	0	0	0	110
293	E	30.6	Very low	32.5	Very low	178 Å²	178	137.4 Å²	137.4	83%	0.832	76%	0.764	S	S	*	*			trans	27.4	118.6	164.3	-53	-171.5	139.1	0	0	121.2
294	E	29.2	Very low	32.3	Very low	153 Å²	153	133 Å²	133	72%	0.715	76%	0.76	S	S	*	*				176.4	155.9	107	-95.6	-72.2	72	0	0	116.1
295	Q	31.7	Very low	32	Very low	148 Å²	148	131.2 Å²	131.2	69%	0.692	76%	0.756	S	S	*	*			trans	-56.4	142.6	-170.3	-62.5	158.6	61.6	0	0	119.7
296	S	32.8	Very low	32.2	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	75%	0.752	S	S	*	*			trans	22.5	152.6	139.9	71	0	0	0	0	123.5
297	P	38.2	Very low	32.1	Very low	130 Å²	130	134.9 Å²	134.9	84%	0.844	75%	0.752	S	S	*	*			trans	-123.7	156	132.8	37.3	-30.7	0	0	0	114.2
298	T	29.4	Very low	32.1	Very low	124 Å²	124	135 Å²	135	76%	0.761	75%	0.747	S	S	*	*			trans	-106	151.4	175.6	51.4	0	0	0	0	111.7
299	K	34.1	Very low	31.8	Very low	160 Å²	160	136 Å²	136	70%	0.696	75%	0.752	S	S	*	*				171.9	151.1	128.1	-100.3	165	159.1	-77.8	0	115.9
300	E	29.7	Very low	31.9	Very low	135 Å²	135	137 Å²	137	63%	0.631	76%	0.757	S	S	*	*			trans	42.6	109.8	144.6	-72.7	145	-179.3	0	0	119.1
301	E	32.8	Very low	32.1	Very low	175 Å²	175	139.3 Å²	139.3	82%	0.818	76%	0.763	S	S	*	*				74.9	115.8	83.5	-78.8	-162.1	169.2	0	0	115.3
302	T	30.4	Very low	32.1	Very low	152 Å²	152	139.1 Å²	139.1	93%	0.933	76%	0.762	S	S	*	*				-172.3	174.5	125.4	16.7	0	0	0	0	110.5
303	A	30.5	Very low	32.1	Very low	98 Å²	98	140.5 Å²	140.5	81%	0.81	77%	0.768	S	S	*	*			trans	-126.5	-170.4	-170.5	0	0	0	0	0	113
304	A	31.6	Very low	32.2	Very low	99 Å²	99	136.1 Å²	136.1	82%	0.818	76%	0.762	S	S	*	*			trans	84.1	136.8	-168.4	0	0	0	0	0	113.9
305	D	27.6	Very low	32.4	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	77%	0.768	S	S	*	*			cis	123.8	145.8	1.5	-176.9	56.3	0	0	0	112.7
306	S	34.8	Very low	32.2	Very low	78 Å²	78	132.6 Å²	132.6	55%	0.545	78%	0.776	S	S	.	*			trans	69.9	122	164.8	-73.4	0	0	0	0	121.9
307	Q	31.8	Very low	32.2	Very low	178 Å²	178	133 Å²	133	83%	0.832	78%	0.779	S	S	*	*			trans	75.8	151.2	133.5	-68.9	178.4	-44.1	0	0	120.1
308	S	33.5	Very low	31.8	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	78%	0.781	S	S	*	*			cis	-166.9	151.8	-8.7	44.6	0	0	0	0	113.5
309	E	33.1	Very low	31.9	Very low	181 Å²	181	134 Å²	134	85%	0.846	78%	0.778	S	S	*	*			trans	44.3	135.2	136.1	-60.5	171.4	143.7	0	0	124.7
310	E	34.8	Very low	31.7	Very low	190 Å²	190	134.6 Å²	134.6	89%	0.888	78%	0.784	S	S	*	*			trans	151.2	117.8	149.1	-88.5	180	-174.8	0	0	106.7
311	E	35.6	Very low	31.8	Very low	184 Å²	184	134.5 Å²	134.5	86%	0.86	79%	0.788	S	S	*	*			cis	57.7	135.7	40.6	-76.1	-159.3	171.2	0	0	115.3
312	E	33.4	Very low	31.8	Very low	165 Å²	165	134.3 Å²	134.3	77%	0.771	78%	0.784	S	S	*	*			cis	-114.5	-140.9	-7.6	-146.1	-142.7	121.5	0	0	108.7	A314	E312-A314 PolarHBondContact OE1-N 2.89Å
313	A	29.2	Very low	31.7	Very low	90 Å²	90	135.1 Å²	135.1	74%	0.744	78%	0.783	S	S	*	*			cis	-144.7	156.6	0.9	0	0	0	0	0	113.2
314	A	32.5	Very low	31.7	Very low	85 Å²	85	135.8 Å²	135.8	70%	0.702	78%	0.776	S	S	*	*			trans	-122.9	165.5	-175.8	0	0	0	0	0	116.5	E312	E312-A314 PolarHBondContact OE1-N 2.89Å
315	A	32.8	Very low	31.7	Very low	103 Å²	103	138.8 Å²	138.8	85%	0.851	77%	0.773	S	S	*	*			trans	69.6	127	159.2	0	0	0	0	0	121.1
316	S	27	Very low	31.7	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	77%	0.771	S	S	*	*				-156.3	167.3	118.2	-163.3	0	0	0	0	110.3
317	S	33.4	Very low	31.4	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	78%	0.782	S	S	*	*			trans	-135.7	174	-167.1	58.3	0	0	0	0	113.8
318	Q	29.3	Very low	31.4	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	79%	0.785	S	S	*	*			trans	113.4	146	150.4	-157.7	164.1	-25.3	0	0	117.8
319	A	31.1	Very low	31.1	Very low	85 Å²	85	143 Å²	143	70%	0.702	79%	0.791	S	S	*	*			trans	-85.4	174.2	-163	0	0	0	0	0	115.7
320	E	31.3	Very low	31.1	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	79%	0.791	S	S	*	*				-168.1	166.6	116.6	-106.1	180	-149.1	0	0	112.7
321	D	31	Very low	31	Very low	132 Å²	132	143.1 Å²	143.1	71%	0.706	79%	0.791	S	S	*	*			trans	-89.1	159.3	-165.4	-36.9	-97.4	0	0	0	115.7
322	K	32.8	Very low	30.7	Very low	171 Å²	171	143 Å²	143	74%	0.743	79%	0.791	S	S	*	*				173.6	123.6	114.4	-91.6	151.1	-163	118.3	0	114.9
323	D	29.4	Very low	30.5	Very low	170 Å²	170	143 Å²	143	91%	0.909	80%	0.796	S	S	*	*			trans	-103.5	143.6	153.3	-85	-62.3	0	0	0	109.7
324	V	30.3	Very low	30.3	Very low	111 Å²	111	141.7 Å²	141.7	67%	0.673	79%	0.791	S	S	*	*			trans	-149.3	108.1	177	176.8	0	0	0	0	111.1
325	E	30.8	Very low	31.3	Very low	162 Å²	162	143 Å²	143	76%	0.757	79%	0.792	S	S	*	*			trans	62	163.1	152.1	-63.3	-175.3	169	0	0	118.3
326	Q	27	Very low	32.1	Very low	156 Å²	156	143.6 Å²	143.6	73%	0.729	79%	0.788	S	S	*	*			cis	-149.6	139.1	12.7	-146.2	161.1	73.1	0	0	112.9
327	S	30	Very low	32.5	Very low	110 Å²	110	145.4 Å²	145.4	77%	0.769	78%	0.782	S	S	*	*			trans	25	143.2	145.6	-48.7	0	0	0	0	124.4
328	Q	30.1	Very low	32.4	Very low	195 Å²	195	147.4 Å²	147.4	91%	0.911	79%	0.785	S	S	*	*			trans	-99.7	146.8	161.7	-64.7	172.5	-34	0	0	111.7
329	T	28.5	Very low	32.5	Very low	122 Å²	122	142.4 Å²	142.4	75%	0.748	78%	0.776	S	S	*	*			trans	-158.9	158.3	165.5	47.2	0	0	0	0	107.5
330	E	32	Very low	32.3	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	78%	0.782	S	S	*	*			cis	-155.6	-164.4	-11.3	-112.1	166.3	165.8	0	0	108.2
331	E	32.7	Very low	32.3	Very low	190 Å²	190	139.5 Å²	139.5	89%	0.888	78%	0.782	S	S	*	*			trans	-94.5	-161.8	-167.3	-52.5	-168.3	134.9	0	0	116.9
332	E	30.5	Very low	32.2	Very low	181 Å²	181	137.3 Å²	137.3	85%	0.846	78%	0.782	S	S	*	*			trans	93.5	98.5	166.1	-65	-160	139	0	0	121.9
333	D	29.3	Very low	32.2	Very low	165 Å²	165	134.7 Å²	134.7	88%	0.882	79%	0.785	S	S	*	*				65.5	152.2	110.9	-156	24.6	0	0	0	123.3
334	G	24.5	Very low	33.1	Very low	62 Å²	62	131.9 Å²	131.9	64%	0.639	78%	0.776	S	S	*	*			trans	138.3	125.5	166.4	0	0	0	0	0	118.2
335	P	54	Low	33.3	Very low	113 Å²	113	130.2 Å²	130.2	73%	0.734	77%	0.77	S	S	*	*			trans	-108.2	179.8	-178	44.5	-38.2	0	0	0	114
336	P	49.8	Very low	33.4	Very low	116 Å²	116	130.1 Å²	130.1	75%	0.753	77%	0.769	S	S	*	*				-149.2	140.8	83.8	38.5	-18.9	0	0	0	115.9
337	E	34.6	Very low	33.8	Very low	161 Å²	161	130.6 Å²	130.6	75%	0.752	77%	0.771	S	S	*	*				98.1	148.8	75.2	-71.5	-169.4	179.9	0	0	117.5
338	N	31.5	Very low	34.2	Very low	147 Å²	147	134 Å²	134	79%	0.786	78%	0.775	S	S	*	*			trans	93.3	138.2	164.7	-61.2	-82.3	0	0	0	119
339	A	31.5	Very low	34.5	Very low	84 Å²	84	133 Å²	133	69%	0.694	77%	0.771	S	S	*	*			cis	-167	162.8	-15.4	0	0	0	0	0	113.3
340	A	27.6	Very low	34.7	Very low	102 Å²	102	130.9 Å²	130.9	84%	0.843	77%	0.765	S	S	*	*			trans	72.1	152.9	164	0	0	0	0	0	120.1
341	A	29.8	Very low	34.7	Very low	96 Å²	96	126.9 Å²	126.9	79%	0.793	76%	0.763	S	S	*	*			cis	-173.9	142	-32.8	0	0	0	0	0	111
342	A	29.4	Very low	34.7	Very low	87 Å²	87	123.1 Å²	123.1	72%	0.719	77%	0.765	S	S	*	*			trans	19.3	132.5	157	0	0	0	0	0	121.8
343	S	32.3	Very low	34.5	Very low	115 Å²	115	117.8 Å²	117.8	80%	0.804	76%	0.759	S	S	*	*				68.3	152.3	58.7	-49.4	0	0	0	0	114.5
344	P	49.2	Very low	34.5	Very low	111 Å²	111	116.1 Å²	116.1	72%	0.721	76%	0.76	S	S	*	*			cis	-144.6	-179.1	14.3	44.8	-25	0	0	0	119
345	S	33.6	Very low	34.7	Very low	77 Å²	77	121.8 Å²	121.8	54%	0.538	77%	0.769	S	S	.	*			trans	48	164.3	140.8	58.7	0	0	0	0	126.7
346	E	34.3	Very low	34.9	Very low	159 Å²	159	120.4 Å²	120.4	74%	0.743	76%	0.76	S	S	*	*			trans	85.3	121.3	164.8	-64.2	136.2	-96.4	0	0	118.3
347	E	35	Very low	34.1	Very low	167 Å²	167	122.9 Å²	122.9	78%	0.78	76%	0.762	S	S	*	*			cis	92.8	130.8	15	-53.5	144	-116.3	0	0	114.7
348	E	37.3	Very low	33.7	Very low	181 Å²	181	122.9 Å²	122.9	85%	0.846	77%	0.767	S	S	*	*			cis	-161.7	-171.8	-5.7	-162.2	168.1	-142.4	0	0	110.8
349	E	37	Very low	33.9	Very low	175 Å²	175	124.9 Å²	124.9	82%	0.818	77%	0.772	S	S	*	*			trans	72.4	163.2	168.5	-66.5	-87	98.7	0	0	119.8
350	A	33	Very low	33.7	Very low	76 Å²	76	124.9 Å²	124.9	63%	0.628	78%	0.78	S	S	*	*			cis	-172.3	164.4	-34.8	0	0	0	0	0	115
351	A	32.4	Very low	33.6	Very low	99 Å²	99	123.8 Å²	123.8	82%	0.818	78%	0.778	S	S	*	*			trans	79.2	121.2	144.6	0	0	0	0	0	126.8
352	A	32.4	Very low	33.5	Very low	112 Å²	112	124.5 Å²	124.5	93%	0.926	78%	0.777	S	S	*	*				77.6	141.2	129.8	0	0	0	0	0	125
353	G	26.1	Very low	33.6	Very low	69 Å²	69	129.3 Å²	129.3	71%	0.711	79%	0.785	S	S	*	*			trans	163.7	77.9	161	0	0	0	0	0	122.1
354	S	29.4	Very low	33.5	Very low	130 Å²	130	132 Å²	132	91%	0.909	79%	0.785	S	S	*	*			trans	56.5	147.4	144	49.5	0	0	0	0	126
355	H	28.4	Very low	32.8	Very low	181 Å²	181	132.3 Å²	132.3	84%	0.838	78%	0.784	S	S	*	*			trans	-106.3	-168	165.6	-156.9	23.6	0	0	0	107.3
356	P	57.8	Low	32.6	Very low	83 Å²	83	138.8 Å²	138.8	54%	0.539	80%	0.799	S	S	.	*			cis	-146.9	-149.6	2.8	40.8	-14.1	0	0	0	116.5
357	E	33.5	Very low	32.6	Very low	169 Å²	169	138.2 Å²	138.2	79%	0.79	80%	0.796	S	S	*	*			trans	67	156.4	173.7	-34.1	-55.7	78.9	0	0	118.2
358	D	27.3	Very low	32.4	Very low	160 Å²	160	137 Å²	137	86%	0.856	79%	0.794	S	S	*	*			cis	-154.5	-178.7	35.7	-168.5	13.4	0	0	0	114
359	E	34.1	Very low	32	Very low	190 Å²	190	135.5 Å²	135.5	89%	0.888	79%	0.787	S	S	*	*			trans	-111.4	177	-159.9	-53.1	-169	139.2	0	0	119.8
360	G	26.8	Very low	32.1	Very low	84 Å²	84	136.9 Å²	136.9	87%	0.866	79%	0.785	S	S	*	*			trans	93.7	156.7	159.8	0	0	0	0	0	117.4
361	G	26	Very low	31.9	Very low	78 Å²	78	140.3 Å²	140.3	80%	0.804	79%	0.792	S	S	*	*			cis	151.9	152.2	-4.6	0	0	0	0	0	111.2
362	S	28.5	Very low	31.8	Very low	112 Å²	112	141.9 Å²	141.9	78%	0.783	79%	0.787	S	S	*	*			cis	-174.2	135.4	-11.9	52	0	0	0	0	112.9
363	E	31.5	Very low	31.9	Very low	188 Å²	188	145.2 Å²	145.2	88%	0.879	78%	0.784	S	S	*	*			trans	70.9	178.6	155.6	-59.7	-169.9	154.3	0	0	122.3
364	E	29.6	Very low	32.3	Very low	171 Å²	171	149 Å²	149	80%	0.799	78%	0.783	S	S	*	*			trans	67.3	124	-175.3	-56.2	-168.5	154.9	0	0	117.5
365	V	33.8	Very low	32.6	Very low	118 Å²	118	150.6 Å²	150.6	72%	0.715	77%	0.773	S	S	*	*			cis	88.6	92.3	9.7	-166.9	0	0	0	0	118.3
366	Y	31.3	Very low	32.7	Very low	213 Å²	213	146 Å²	146	84%	0.835	76%	0.761	S	S	*	*			trans	-162	161.8	140.6	-74.5	-62.4	0	0	0	108.3
367	Q	32.7	Very low	31.3	Very low	146 Å²	146	149.5 Å²	149.5	68%	0.682	78%	0.776	S	S	*	*			cis	135.7	117.8	-25	-80.6	-79.1	44.4	0	0	113.3
368	L	32.3	Very low	31.2	Very low	142 Å²	142	145 Å²	145	74%	0.743	77%	0.774	S	S	*	*			trans	63.2	163.6	162.9	-66.8	158	0	0	0	116.7
369	Q	28.9	Very low	31.4	Very low	150 Å²	150	141.8 Å²	141.8	70%	0.701	77%	0.77	S	S	*	*			cis	-145.4	175.1	7	-155.6	143.8	-55	0	0	112.9
370	R	38.6	Very low	31.2	Very low	204 Å²	204	139.8 Å²	139.8	77%	0.77	77%	0.766	S	S	*	*			trans	-79	173.6	158.2	-63.2	-175.4	177.6	91	-2	110.2
371	D	28.8	Very low	31.6	Very low	147 Å²	147	147.4 Å²	147.4	79%	0.786	77%	0.768	S	S	*	*			trans	-172.2	156.2	132.8	-85.7	-18.2	0	0	0	108.1
372	D	29.8	Very low	32	Very low	132 Å²	132	151.3 Å²	151.3	71%	0.706	77%	0.765	S	S	*	*			trans	-143.4	-178	-146.9	-69.2	-85.2	0	0	0	115.6
373	E	34.9	Very low	32.2	Very low	183 Å²	183	152.8 Å²	152.8	86%	0.855	77%	0.77	S	S	*	*			trans	82.2	160.4	167.2	-62.5	-156.7	123.8	0	0	122.7
374	E	34.5	Very low	32.3	Very low	149 Å²	149	149.4 Å²	149.4	70%	0.696	76%	0.758	S	S	*	*			trans	74	143.2	159.2	-63.1	-107.3	107.3	0	0	120.5
375	K	34.9	Very low	32.5	Very low	162 Å²	162	149.6 Å²	149.6	70%	0.704	76%	0.759	S	S	*	*			cis	-169.1	157.3	-23.2	-145.7	-162.1	-164.3	89.1	0	112.1
376	S	30.9	Very low	32.3	Very low	84 Å²	84	151.1 Å²	151.1	59%	0.587	76%	0.763	S	S	*	*			trans	69	149.5	146.1	86.9	0	0	0	0	125.3
377	D	29.3	Very low	32.3	Very low	157 Å²	157	148.9 Å²	148.9	84%	0.84	77%	0.766	S	S	*	*			trans	62.6	138.4	154.8	-41.9	-45.5	0	0	0	121.1
378	G	29.7	Very low	32.2	Very low	74 Å²	74	147.1 Å²	147.1	76%	0.763	77%	0.769	S	S	*	*			cis	165.5	168.5	-7.4	0	0	0	0	0	114.3
379	A	32.1	Very low	32	Very low	93 Å²	93	148 Å²	148	77%	0.769	78%	0.775	S	S	*	*			trans	79	119.4	164.8	0	0	0	0	0	122.5
380	D	30.3	Very low	32.2	Very low	149 Å²	149	150.2 Å²	150.2	80%	0.797	79%	0.785	S	S	*	*			trans	54.3	119.9	136	-51.4	-12.9	0	0	0	123.6
381	R	35.8	Very low	32	Very low	243 Å²	243	150 Å²	150	92%	0.917	79%	0.793	S	S	*	*				-164.8	140.7	95.8	-101.4	-179	-171.5	96.1	4.2	113.4
382	Q	34.3	Very low	32.2	Very low	160 Å²	160	154 Å²	154	75%	0.748	80%	0.797	S	S	*	*			trans	-85.2	147.8	164.3	-63.4	168	-101.7	0	0	111
383	T	31.9	Very low	32.2	Very low	143 Å²	143	155 Å²	155	88%	0.877	80%	0.802	S	S	*	*			trans	-154.4	107.9	141.1	44.2	0	0	0	0	108.9
384	D	34	Very low	32	Very low	118 Å²	118	155.6 Å²	155.6	63%	0.631	81%	0.805	S	S	*	*			trans	-72.8	169	159.9	-30.4	-82.5	0	0	0	107.9
385	E	33.1	Very low	31.9	Very low	175 Å²	175	157.6 Å²	157.6	82%	0.818	82%	0.815	S	S	*	*			cis	-158.9	-155.2	7.4	-147.5	156.2	-143.8	0	0	108.4
386	D	30.2	Very low	31.8	Very low	149 Å²	149	159.2 Å²	159.2	80%	0.797	83%	0.825	S	S	*	*			trans	68.8	95.3	170	-65	-23	0	0	0	119.5
387	D	30.5	Very low	32	Very low	167 Å²	167	164.5 Å²	164.5	89%	0.893	84%	0.84	S	S	*	*				-155.1	137.2	119.7	-117.2	-26.2	0	0	0	109.1
388	S	30.8	Very low	32.3	Very low	108 Å²	108	167.7 Å²	167.7	76%	0.755	84%	0.84	S	S	*	*			trans	-158.4	120.8	-177.7	-73.6	0	0	0	0	111.6
389	D	29.7	Very low	32.3	Very low	161 Å²	161	172.5 Å²	172.5	86%	0.861	84%	0.842	S	S	*	*			trans	167.8	92.9	152.4	-95.3	-20.8	0	0	0	109.9
390	E	32.3	Very low	32.5	Very low	196 Å²	196	176.6 Å²	176.6	92%	0.916	85%	0.85	S	S	*	*			trans	-159.8	26.7	165.8	-146.3	76.7	-94.6	0	0	115.5
391	E	34.3	Very low	32.5	Very low	200 Å²	200	174.9 Å²	174.9	94%	0.935	85%	0.849	S	S	*	*			trans	-113.5	80.4	171.5	-79.5	-145.8	136.6	0	0	113.1
392	R	32.1	Very low	32.4	Very low	230 Å²	230	175.3 Å²	175.3	87%	0.868	85%	0.851	S	S	*	*			trans	-156.5	103.2	159	-159.2	171.1	-172.3	162.5	4.2	113.2
393	N	30.3	Very low	32.2	Very low	154 Å²	154	178.5 Å²	178.5	82%	0.824	86%	0.856	S	S	*	*			trans	152.2	68.5	148.2	-76.8	-22.5	0	0	0	111.6
394	Q	31.8	Very low	32.3	Very low	196 Å²	196	175.8 Å²	175.8	92%	0.916	85%	0.848	S	S	*	*			trans	-136	43.8	171.2	-78.1	-159.5	72.4	0	0	113.1
395	E	31.8	Very low	32.2	Very low	191 Å²	191	179.3 Å²	179.3	89%	0.893	86%	0.858	S	S	*	*			trans	-156.8	73.5	172.8	-140.9	170.1	-138.7	0	0	114.5
396	E	33.6	Very low	32.2	Very low	196 Å²	196	182 Å²	182	92%	0.916	86%	0.861	S	S	*	*			trans	-164.5	58.4	160.3	-126	176.3	-134.4	0	0	115
397	E	35	Very low	32.1	Very low	195 Å²	195	179.3 Å²	179.3	91%	0.911	85%	0.854	S	S	*	*			trans	-153.1	78.2	161.9	-133.8	179.4	-129.4	0	0	115
398	R	33.9	Very low	32.2	Very low	224 Å²	224	180.7 Å²	180.7	85%	0.845	86%	0.855	S	S	*	*			trans	-138.1	146.1	162.5	-66.7	-171.9	-174.6	-102.8	-1.1	111.1
399	H	30.4	Very low	32.2	Very low	174 Å²	174	179.6 Å²	179.6	81%	0.806	86%	0.861	S	S	*	*			trans	73.9	107.1	173.8	-44.9	-77.3	0	0	0	118.2
400	I	35.6	Very low	32.1	Very low	179 Å²	179	175.2 Å²	175.2	92%	0.918	85%	0.854	S	S	*	*				-143.6	142.2	123.3	-97.4	144.8	0	0	0	107.8
401	S	31.8	Very low	31.8	Very low	113 Å²	113	174.3 Å²	174.3	79%	0.79	85%	0.854	S	S	*	*			trans	-105	155.9	-170.5	-87.2	0	0	0	0	114.7
402	R	32.5	Very low	31.7	Very low	253 Å²	253	170.8 Å²	170.8	96%	0.955	85%	0.846	S	S	*	*			trans	-55.2	141.2	175.9	-59.4	175.3	177.2	-175.7	-2.3	112.6
403	R	30.3	Very low	31.8	Very low	226 Å²	226	166.8 Å²	166.8	85%	0.853	84%	0.841	S	S	*	*			trans	-142.8	142.5	154.4	-172.1	168.7	-71.2	-152.8	-0.2	110.3	F405	R403-F405 HydrophobicContact CG-CE2 4.38Å
404	A	34.2	Very low	32.1	Very low	86 Å²	86	165.4 Å²	165.4	71%	0.711	84%	0.84	S	S	*	*			trans	-121.9	151.6	-179.3	0	0	0	0	0	111.3
405	F	32.9	Very low	31.9	Very low	192 Å²	192	161.6 Å²	161.6	84%	0.842	83%	0.83	S	S	*	*			trans	-143.3	174.5	167.2	-89.6	-69.5	0	0	0	111.1	R403	R403-F405 HydrophobicContact CG-CE2 4.38Å
406	R	31.5	Very low	32.1	Very low	232 Å²	232	159.4 Å²	159.4	88%	0.875	83%	0.83	S	S	*	*			trans	-131.2	163.9	-162.9	-78	177.4	149.1	-121	-0.4	113.6
407	S	28.5	Very low	31.9	Very low	93 Å²	93	155.7 Å²	155.7	65%	0.65	82%	0.82	S	S	*	*			trans	73.7	121.1	140.3	50.4	0	0	0	0	122.9
408	E	32.8	Very low	31.7	Very low	196 Å²	196	150.4 Å²	150.4	92%	0.916	81%	0.81	S	S	*	*			trans	78.6	145	130.8	-68.2	-175.1	105.5	0	0	123.4
409	G	30.3	Very low	31.5	Very low	85 Å²	85	146.6 Å²	146.6	88%	0.876	81%	0.812	S	S	*	*			trans	104.2	132.9	168.3	0	0	0	0	0	115.7
410	G	28.3	Very low	31.6	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	81%	0.813	S	S	*	*			cis	145	95.9	-18.2	0	0	0	0	0	116.1
411	L	26.8	Very low	31.3	Very low	177 Å²	177	142.9 Å²	142.9	93%	0.927	81%	0.808	S	S	*	*			trans	66.5	162.1	167.8	-55.2	163	0	0	0	114.6
412	V	31.1	Very low	31.1	Very low	126 Å²	126	145.8 Å²	145.8	76%	0.764	81%	0.809	S	S	*	*			cis	-150.3	165	-3.5	96.5	0	0	0	0	111.1
413	L	35.5	Very low	31.1	Very low	146 Å²	146	137.9 Å²	137.9	76%	0.764	79%	0.792	S	S	*	*			trans	-80	160.5	175.5	-75.7	166.2	0	0	0	114.2
414	P	35.7	Very low	30.9	Very low	124 Å²	124	135.7 Å²	135.7	81%	0.805	79%	0.789	S	S	*	*			trans	-121.1	152.7	137.6	36.2	-29.4	0	0	0	113.2
415	V	27.7	Very low	30.6	Very low	116 Å²	116	139.7 Å²	139.7	70%	0.703	80%	0.795	S	S	*	*			trans	-118.8	139.4	177.6	171.6	0	0	0	0	109.5	T417	V415-T417 HydrophobicContact CG1-CG2 4.24Å
416	V	35.2	Very low	30.5	Very low	146 Å²	146	139.2 Å²	139.2	89%	0.885	79%	0.793	S	S	*	*			trans	-135	153.7	165.6	-173.3	0	0	0	0	108.7
417	T	30.2	Very low	30.7	Very low	117 Å²	117	133.4 Å²	133.4	72%	0.718	79%	0.788	S	S	*	*			trans	-129	173.9	-160.5	54	0	0	0	0	113.8	V415	V415-T417 HydrophobicContact CG1-CG2 4.24Å
418	A	30.8	Very low	30.7	Very low	85 Å²	85	137 Å²	137	70%	0.702	79%	0.791	S	S	*	*			trans	79.2	149.4	162.3	0	0	0	0	0	116.4
419	T	30.6	Very low	30.6	Very low	144 Å²	144	131 Å²	131	88%	0.883	77%	0.772	S	S	*	*			cis	-153.4	172.1	-5.8	-3	0	0	0	0	112.6
420	E	31.7	Very low	30.6	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	77%	0.768	S	S	*	*			trans	-79.1	148.1	-176.8	170.8	-178	-146.9	0	0	115.6
421	A	28.3	Very low	30.6	Very low	98 Å²	98	139 Å²	139	81%	0.81	77%	0.773	S	S	*	*			trans	-159.3	134.6	157.1	0	0	0	0	0	114
422	H	29.2	Very low	30.7	Very low	175 Å²	175	134 Å²	134	81%	0.81	76%	0.758	S	S	*	*			trans	-93.4	170	169.3	-109.4	-120.3	0	0	0	109.3
423	S	31	Very low	30.9	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	77%	0.767	S	S	*	*			cis	-174.1	-175.2	9.9	46.6	0	0	0	0	111.6
424	F	26.3	Very low	30.4	Very low	179 Å²	179	132.9 Å²	132.9	79%	0.785	76%	0.763	S	S	*	*			trans	68.1	114.4	148.1	-99	-73.8	0	0	0	121.1
425	M	27.8	Very low	30.3	Very low	170 Å²	170	134.7 Å²	134.7	84%	0.837	77%	0.765	S	S	*	*				-174.2	-177.3	105.4	-105.3	-61.2	158.1	0	0	113.7
426	K	31.5	Very low	30.4	Very low	183 Å²	183	135 Å²	135	80%	0.796	76%	0.763	S	S	*	*			trans	-146.8	152.7	-160.4	175.9	-179.5	-179.5	177.2	0	112.1
427	S	34.9	Very low	30.1	Very low	110 Å²	110	135 Å²	135	77%	0.769	76%	0.763	S	S	*	*			trans	111.5	162.8	163.6	-54.4	0	0	0	0	115.8
428	K	29.8	Very low	29.9	Very low	167 Å²	167	134.6 Å²	134.6	73%	0.726	77%	0.765	S	S	*	*			cis	-178.9	115.3	-35.1	175.1	168.9	177.3	-177.4	0	109.1
429	S	30.6	Very low	29.8	Very low	72 Å²	72	137 Å²	137	50%	0.503	77%	0.765	S	S	.	*			trans	32.7	140.8	157.3	64.7	0	0	0	0	122.5
430	Y	29.8	Very low	29.8	Very low	201 Å²	201	136.3 Å²	136.3	79%	0.788	75%	0.752	S	S	*	*				161.7	140.1	110	-83.4	-57.4	0	0	0	114.1
431	S	28.6	Very low	29.6	Very low	119 Å²	119	136.4 Å²	136.4	83%	0.832	75%	0.745	S	S	*	*			trans	63.3	160.9	141.6	-162.7	0	0	0	0	120.4
432	A	29.1	Very low	29.6	Very low	73 Å²	73	138.4 Å²	138.4	60%	0.603	74%	0.741	S	S	*	*			cis	-170.9	159.5	-48.2	0	0	0	0	0	108.3
433	L	33.8	Very low	29.7	Very low	183 Å²	183	137 Å²	137	96%	0.958	73%	0.734	S	S	*	*			trans	66.6	156.6	175.4	-41.8	176.9	0	0	0	114.2
434	G	26.7	Very low	29.6	Very low	66 Å²	66	138.6 Å²	138.6	68%	0.68	74%	0.736	S	S	*	*			cis	165.3	167.6	-9.7	0	0	0	0	0	112.7
435	L	32.8	Very low	29.8	Very low	162 Å²	162	139 Å²	139	85%	0.848	74%	0.74	S	S	*	*			trans	75	118.2	166.3	-53.6	-179.6	0	0	0	120.7
436	N	29.8	Very low	29.6	Very low	123 Å²	123	137.4 Å²	137.4	66%	0.658	74%	0.741	S	S	*	*			trans	-30.2	149.2	147.7	45.8	-94.6	0	0	0	119.2
437	T	28.9	Very low	29.4	Very low	144 Å²	144	132.2 Å²	132.2	88%	0.883	74%	0.739	S	S	*	*				-167.8	166.9	113.1	14.3	0	0	0	0	113
438	S	25.6	Very low	29	Very low	109 Å²	109	136.8 Å²	136.8	76%	0.762	75%	0.745	S	S	*	*			trans	-90.1	169.5	177.8	-175.4	0	0	0	0	112
439	L	30.2	Very low	30	Very low	135 Å²	135	134 Å²	134	71%	0.707	74%	0.744	S	S	*	*				142.7	123.3	122.4	-167.2	67.3	0	0	0	114.7
440	E	29.3	Very low	29.7	Very low	130 Å²	130	136.5 Å²	136.5	61%	0.607	75%	0.752	S	S	*	*			trans	65.5	164.7	152.5	-77.5	-170.2	159.4	0	0	120.2
441	R	27.1	Very low	29.6	Very low	179 Å²	179	137.6 Å²	137.6	68%	0.675	76%	0.755	S	S	*	*			cis	-173.1	172.6	-21.9	-172.4	-158.7	-70.7	174.4	-4.2	106.1
442	I	28.5	Very low	29.4	Very low	139 Å²	139	137.8 Å²	137.8	71%	0.713	75%	0.751	S	S	*	*			trans	76.9	148.3	162.8	-57.3	174.2	0	0	0	115.7
443	Q	32	Very low	29.7	Very low	146 Å²	146	143.6 Å²	143.6	68%	0.682	76%	0.763	S	S	*	*			cis	-176.6	152.1	-40.4	-135.6	-175	-53.4	0	0	110.8
444	N	28.9	Very low	29.9	Very low	121 Å²	121	140.5 Å²	140.5	65%	0.647	75%	0.753	S	S	*	*			trans	72.5	148.6	153	-52.5	-35.1	0	0	0	122.5
445	Q	29.7	Very low	30.1	Very low	186 Å²	186	141.8 Å²	141.8	87%	0.869	75%	0.752	S	S	*	*			trans	94	141.7	155.9	-55.3	-174.7	96.6	0	0	118.3
446	T	24.8	Very low	29.7	Very low	138 Å²	138	141.5 Å²	141.5	85%	0.847	75%	0.75	S	S	*	*			cis	159.1	126.4	-19.8	-84.8	0	0	0	0	105.1
447	G	26.7	Very low	29.8	Very low	74 Å²	74	142.8 Å²	142.8	76%	0.763	75%	0.752	S	S	*	*			trans	159.1	140.3	167.9	0	0	0	0	0	119.2
448	K	27.1	Very low	29.7	Very low	206 Å²	206	143 Å²	143	90%	0.896	74%	0.743	S	S	*	*			trans	-153.4	176.2	169.9	-78.3	-168.4	178.3	-174.1	0	107.5
449	P	49.2	Very low	30	Very low	109 Å²	109	144.6 Å²	144.6	71%	0.708	74%	0.743	S	S	*	*			cis	-124.8	-136.2	-26.8	28.9	-2.5	0	0	0	110
450	D	24.6	Very low	29.9	Very low	124 Å²	124	143.7 Å²	143.7	66%	0.663	74%	0.738	S	S	*	*			cis	-165.8	169	-4.2	-136	-31.6	0	0	0	114.9
451	W	28.1	Very low	30	Very low	224 Å²	224	146.3 Å²	146.3	85%	0.848	75%	0.751	S	S	*	*			trans	57.1	-178.8	160.5	-78.4	19.2	0	0	0	118.5
452	T	25.5	Very low	30.1	Very low	122 Å²	122	143.9 Å²	143.9	75%	0.748	75%	0.751	S	S	*	*			cis	-150	-160.2	17.1	-31.4	0	0	0	0	113.3
453	K	34.1	Very low	29.9	Very low	196 Å²	196	144.5 Å²	144.5	85%	0.852	75%	0.749	S	S	*	*			trans	-149.8	-165.9	-175.3	-53.4	-174.1	-178.7	-178.6	0	109.5
454	P	37.5	Very low	29.7	Very low	117 Å²	117	147.6 Å²	147.6	76%	0.76	75%	0.754	S	S	*	*			cis	-145.4	170.7	-5.1	45.1	-25.9	0	0	0	119.5
455	S	31.4	Very low	29.6	Very low	94 Å²	94	148.1 Å²	148.1	66%	0.657	76%	0.757	S	S	*	*			trans	63.7	136.1	135.5	-160.9	0	0	0	0	127.4
456	L	25.2	Very low	29.6	Very low	155 Å²	155	146.5 Å²	146.5	81%	0.812	75%	0.749	S	S	*	*			trans	-171.1	158.1	138.9	-112.7	96.6	0	0	0	107.4
457	Q	32	Very low	29.8	Very low	150 Å²	150	146.5 Å²	146.5	70%	0.701	74%	0.744	S	S	*	*			cis	91.6	136	14.5	-62.8	172.3	-94.2	0	0	116.4
458	H	27.2	Very low	30.1	Very low	149 Å²	149	149.8 Å²	149.8	69%	0.69	75%	0.745	S	S	*	*			cis	-165.3	-178	-7.8	-160.4	-91.1	0	0	0	111.5	D460	H458-D460 IonicContact CE1-OD2 2.65Å; H458-D460 IonicContact ND1-OD2 2.69Å
459	L	30.8	Very low	31.1	Very low	143 Å²	143	145 Å²	145	75%	0.749	73%	0.734	S	S	*	*			trans	81.9	158.4	168.1	-65.4	113.8	0	0	0	119.5
460	D	29.3	Very low	30.2	Very low	115 Å²	115	144.2 Å²	144.2	62%	0.615	74%	0.737	S	S	*	*			cis	178.1	179.3	-38.9	-90.8	-47	0	0	0	108.9	H458	H458-D460 IonicContact CE1-OD2 2.65Å; H458-D460 IonicContact ND1-OD2 2.69Å
461	E	30.2	Very low	30.7	Very low	186 Å²	186	143 Å²	143	87%	0.869	73%	0.731	S	S	*	*			trans	67.5	153.7	163.9	-65	173.6	-166.5	0	0	120.6
462	D	29.3	Very low	30.9	Very low	128 Å²	128	142.2 Å²	142.2	68%	0.684	73%	0.728	S	S	*	*			cis	-165.5	114.2	-32.6	-167.3	57	0	0	0	114.5
463	F	24.9	Very low	31.3	Very low	152 Å²	152	142.6 Å²	142.6	67%	0.667	72%	0.719	S	S	*	*			trans	58.7	167	135.2	-139.9	-90.7	0	0	0	125.3
464	W	27.6	Very low	31.2	Very low	211 Å²	211	140.2 Å²	140.2	80%	0.799	72%	0.715	S	S	*	*			trans	82.2	159.7	171.2	-50.2	95.7	0	0	0	120.2
465	D	27.3	Very low	31	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	72%	0.719	S	S	*	*				-174.1	166.2	-76.1	-169.6	11.1	0	0	0	110.4
466	E	28.2	Very low	30.9	Very low	152 Å²	152	138.8 Å²	138.8	71%	0.71	71%	0.714	S	S	*	*			trans	76.6	133.3	150.2	-142.5	-172.2	-148.9	0	0	123.5
467	N	30.1	Very low	31.1	Very low	138 Å²	138	139.6 Å²	139.6	74%	0.738	71%	0.711	S	S	*	*			trans	117.9	117.8	147.8	-65.9	-80	0	0	0	121.6
468	D	32.4	Very low	31	Very low	144 Å²	144	140.3 Å²	140.3	77%	0.77	71%	0.714	S	S	*	*			trans	-88.9	-167.8	153.2	-156.4	34.6	0	0	0	108.1
469	P	49.3	Very low	31.1	Very low	105 Å²	105	140.2 Å²	140.2	68%	0.682	72%	0.718	S	S	*	*			cis	-144.2	166.8	1.9	46.2	-26.8	0	0	0	120.4
470	A	28.9	Very low	31.2	Very low	92 Å²	92	141.1 Å²	141.1	76%	0.76	72%	0.723	S	S	*	*			trans	69.5	156.6	135.9	0	0	0	0	0	126.3
471	D	35.3	Very low	31	Very low	99 Å²	99	142.7 Å²	142.7	53%	0.529	73%	0.726	S	S	.	*			trans	76.7	111.4	155	-158.7	31.2	0	0	0	120.3	K473	D471-K473 IonicContact OD1-NZ 2.62Å; D471-K473 PolarHBondContact OD1-NZ 3.45Å; D471-K473 IonicContact OD2-NZ 2.82Å; D471-K473 PolarHBondContact OD2-NZ 3.43Å
472	R	32.7	Very low	30.9	Very low	208 Å²	208	140 Å²	140	79%	0.785	72%	0.722	S	S	*	*				168.9	110.9	105.5	-86.1	-169.7	-177.6	-160.7	-0	119.5
473	K	34.6	Very low	31.1	Very low	130 Å²	130	137.9 Å²	137.9	57%	0.565	72%	0.718	S	S	*	*				61.8	111.5	115.6	-64.1	175.6	178.9	69.2	0	123.8	D471	D471-K473 IonicContact OD1-NZ 2.62Å; D471-K473 PolarHBondContact OD1-NZ 3.45Å; D471-K473 IonicContact OD2-NZ 2.82Å; D471-K473 PolarHBondContact OD2-NZ 3.43Å
474	N	31.6	Very low	31.4	Very low	146 Å²	146	140 Å²	140	78%	0.781	73%	0.729	S	S	*	*				89.2	134.7	117	-62.1	6.3	0	0	0	124.4
475	A	31.9	Very low	31.2	Very low	100 Å²	100	137.1 Å²	137.1	83%	0.826	73%	0.729	S	S	*	*			trans	80.1	151.5	140.8	0	0	0	0	0	121.1
476	S	30.7	Very low	31.4	Very low	80 Å²	80	135.3 Å²	135.3	56%	0.559	73%	0.732	S	S	*	*			cis	-176.5	164.5	-24.3	-171.6	0	0	0	0	110.6
477	F	28.6	Very low	31.5	Very low	172 Å²	172	136.5 Å²	136.5	75%	0.754	74%	0.738	S	S	*	*			trans	72.5	153	160.7	-56.7	-57.6	0	0	0	118.6
478	H	30.1	Very low	31.3	Very low	166 Å²	166	135.3 Å²	135.3	77%	0.769	74%	0.736	S	S	*	*			cis	-149.5	148.8	-2.9	-132.2	-62	0	0	0	112.1
479	L	30.4	Very low	31.1	Very low	146 Å²	146	132.7 Å²	132.7	76%	0.764	73%	0.729	S	S	*	*			trans	-79	148.6	169.9	176.2	68.5	0	0	0	112.5
480	L	31.1	Very low	30	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	73%	0.734	S	S	*	*			trans	-148	142.5	153.6	-118.5	176	0	0	0	111.6
481	H	26.7	Very low	29.9	Very low	148 Å²	148	139.9 Å²	139.9	69%	0.685	73%	0.728	S	S	*	*			trans	-132.5	132.3	-174.2	173.1	-88.1	0	0	0	109.2
482	V	26.7	Very low	29.7	Very low	129 Å²	129	141.9 Å²	141.9	78%	0.782	73%	0.734	S	S	*	*			trans	-138.8	124.2	176.3	-179.3	0	0	0	0	109
483	S	34.2	Very low	29.6	Very low	85 Å²	85	139.2 Å²	139.2	59%	0.594	73%	0.731	S	S	*	*			trans	-110.4	155.4	-179.5	50.4	0	0	0	0	111.5
484	H	30.5	Very low	29.3	Very low	196 Å²	196	140.1 Å²	140.1	91%	0.907	74%	0.742	S	S	*	*			trans	-149.3	147.5	155.6	-92.5	-65.6	0	0	0	110
485	D	24.1	Very low	29.3	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	74%	0.739	S	S	*	*			trans	-136.4	144.9	-173.3	173.6	23.5	0	0	0	108.8
486	A	30.8	Very low	29.3	Very low	93 Å²	93	142.6 Å²	142.6	77%	0.769	74%	0.739	S	S	*	*			trans	-170.7	73.4	177.1	0	0	0	0	0	113.9
487	E	29.9	Very low	29.2	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	74%	0.738	S	S	*	*				49.8	148.3	129.3	-95.5	-165	-164.2	0	0	125.3
488	V	26.6	Very low	29.2	Very low	114 Å²	114	137.5 Å²	137.5	69%	0.691	73%	0.734	S	S	*	*			trans	94.4	90.8	143.7	166.6	0	0	0	0	121.3
489	S	28.3	Very low	29.4	Very low	89 Å²	89	132.4 Å²	132.4	62%	0.622	72%	0.721	S	S	*	*				78.5	126.5	121	-68.9	0	0	0	0	124.7
490	R	25.9	Very low	29.6	Very low	212 Å²	212	133.3 Å²	133.3	80%	0.8	72%	0.721	S	S	*	*			trans	73.2	147	140.3	-65.1	170.6	-176.7	-136.7	3.1	117.4
491	Q	28.3	Very low	29.5	Very low	135 Å²	135	133.7 Å²	133.7	63%	0.631	72%	0.718	S	S	*	*			cis	-160.6	139.9	-0.4	-122.8	165.1	-57.4	0	0	110.3
492	Q	29.3	Very low	29.6	Very low	141 Å²	141	131.1 Å²	131.1	66%	0.659	72%	0.723	S	S	*	*			trans	48.7	128.1	145.1	-64.9	-165.9	-86.9	0	0	120.4
493	E	30.9	Very low	29.6	Very low	153 Å²	153	128.3 Å²	128.3	72%	0.715	72%	0.72	S	S	*	*				60.5	137.9	76.1	-57.4	158.9	-176.3	0	0	112.4
494	D	29	Very low	29.4	Very low	149 Å²	149	133.4 Å²	133.4	80%	0.797	74%	0.735	S	S	*	*			cis	-157.4	-165.9	11.2	-137.8	-13.6	0	0	0	114.2
495	V	32.4	Very low	29.3	Very low	119 Å²	119	131.6 Å²	131.6	72%	0.721	73%	0.726	S	S	*	*			trans	-91.1	159.3	-163.9	-143.9	0	0	0	0	117.7
496	E	30	Very low	29.6	Very low	178 Å²	178	132.1 Å²	132.1	83%	0.832	72%	0.724	S	S	*	*			trans	82.9	160.3	136.2	-114.8	-178	176.5	0	0	126.7
497	A	29.7	Very low	29.7	Very low	65 Å²	65	137.5 Å²	137.5	54%	0.537	73%	0.733	S	S	.	*			trans	76.7	105.5	145.3	0	0	0	0	0	124.4	S12	S12-A497 WeakPolarHBondContact CB-O 3.48Å
498	A	28.2	Very low	29.8	Very low	80 Å²	80	137.5 Å²	137.5	66%	0.661	73%	0.733	S	S	*	*				77.7	165.2	115.2	0	0	0	0	0	124.7	S12	S12-A498 PolarHBondContact OG-O 2.77Å
499	A	33.8	Very low	29.9	Very low	59 Å²	59	137.6 Å²	137.6	49%	0.488	74%	0.739	S	S	.	*			trans	79.7	121.1	167.9	0	0	0	0	0	118.5	K14	K14-A499 PolarHBondContact NZ-O 3.03Å
500	E	34.2	Very low	29.9	Very low	165 Å²	165	139.2 Å²	139.2	77%	0.771	74%	0.741	S	S	*	*				68.7	143.2	89.3	-59.3	-39.4	133.7	0	0	115
501	E	29.3	Very low	30.4	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	74%	0.741	S	S	*	*			cis	-157.2	172	-9.7	-152.8	-158.1	144.2	0	0	110
502	A	30.4	Very low	30.8	Very low	94 Å²	94	140 Å²	140	78%	0.777	75%	0.754	S	S	*	*			trans	58.5	132.9	160.2	0	0	0	0	0	120
503	G	26.6	Very low	31.1	Very low	71 Å²	71	142.2 Å²	142.2	73%	0.732	76%	0.764	S	S	*	*			cis	-153	-133.4	-5.4	0	0	0	0	0	109.9
504	E	30.2	Very low	31.3	Very low	192 Å²	192	142.2 Å²	142.2	90%	0.897	77%	0.768	S	S	*	*			cis	-158.2	169.7	-0.9	-64.6	-177.1	95.8	0	0	109.4
505	H	27.1	Very low	31.7	Very low	158 Å²	158	141.9 Å²	141.9	73%	0.731	77%	0.767	S	S	*	*			trans	65.2	106.8	167.1	-115	-73.8	0	0	0	121.9
506	E	31.8	Very low	31.9	Very low	160 Å²	160	143.3 Å²	143.3	75%	0.748	77%	0.771	S	S	*	*			trans	18.9	133.4	133.2	-54.4	164.2	-170.4	0	0	121.7
507	E	32.7	Very low	32.3	Very low	206 Å²	206	143.9 Å²	143.9	96%	0.963	77%	0.773	S	S	*	*				-148.5	170.2	104.5	-118.9	-176.8	-148.4	0	0	110.5
508	E	30.6	Very low	32.6	Very low	178 Å²	178	147.8 Å²	147.8	83%	0.832	79%	0.785	S	S	*	*			trans	-118.1	138.6	-154.3	174.3	179.7	-143	0	0	112.6
509	S	29.2	Very low	32.8	Very low	116 Å²	116	154.2 Å²	154.2	81%	0.811	80%	0.798	S	S	*	*			trans	-167.1	117.3	154	-152.8	0	0	0	0	112.9
510	D	29.1	Very low	32.8	Very low	123 Å²	123	159.4 Å²	159.4	66%	0.658	82%	0.817	S	S	*	*			trans	-20.5	164.4	152.4	-49.9	-19.5	0	0	0	118
511	E	35.5	Very low	32.7	Very low	174 Å²	174	154.3 Å²	154.3	81%	0.813	81%	0.809	S	S	*	*			cis	-172.7	143.1	-21.6	-100.7	-174.4	161	0	0	103.2
512	E	37.1	Very low	33.2	Very low	190 Å²	190	155.9 Å²	155.9	89%	0.888	81%	0.813	S	S	*	*			trans	177.1	90.5	154	-89.7	-46.4	167.5	0	0	106.8
513	E	35.3	Very low	33.9	Very low	186 Å²	186	158 Å²	158	87%	0.869	82%	0.817	S	S	*	*			trans	-93.1	136.3	171.8	-64.2	-175.7	137.9	0	0	110.3
514	D	35.3	Very low	34.9	Very low	153 Å²	153	160.7 Å²	160.7	82%	0.818	82%	0.821	S	S	*	*			trans	-145.9	128.7	153.3	-164.5	10.7	0	0	0	110.4
515	D	38.3	Very low	35	Very low	143 Å²	143	155.6 Å²	155.6	77%	0.765	81%	0.811	S	S	*	*			trans	-80.8	129	-160.5	-78.8	-53.5	0	0	0	113.6
516	N	35.2	Very low	36	Very low	149 Å²	149	158.2 Å²	158.2	80%	0.797	82%	0.821	S	S	*	*			trans	-149.7	73.3	165.8	-87.3	-86.2	0	0	0	113.6
517	E	39.7	Very low	36.4	Very low	189 Å²	189	157 Å²	157	88%	0.883	82%	0.824	S	S	*	*			trans	-161.3	173.6	147.5	-116.4	158.8	-145.4	0	0	113.4
518	D	34.3	Very low	37.1	Very low	147 Å²	147	158.3 Å²	158.3	79%	0.786	82%	0.82	S	S	*	*			trans	58.9	83.7	172.3	-82.2	-6.7	0	0	0	121
519	F	32.7	Very low	37.5	Very low	216 Å²	216	157.7 Å²	157.7	95%	0.947	82%	0.817	S	S	*	*			trans	-129.8	84.9	145.1	-107.4	-83.8	0	0	0	112.7
520	L	34.3	Very low	38.2	Very low	167 Å²	167	161 Å²	161	87%	0.874	82%	0.817	S	S	*	*			trans	-125.4	96.3	167.1	-150.9	83.7	0	0	0	113
521	G	33	Very low	38.7	Very low	58 Å²	58	160.9 Å²	160.9	60%	0.598	82%	0.815	S	S	*	*			trans	76.8	111.2	152.4	0	0	0	0	0	118.9
522	K	38.5	Very low	38.6	Very low	204 Å²	204	161.3 Å²	161.3	89%	0.887	81%	0.814	S	S	*	*			trans	-150.3	146.1	130.3	-82.9	106.8	-153.9	153	0	109.3
523	T	45.8	Very low	38.4	Very low	139 Å²	139	159.6 Å²	159.6	85%	0.853	81%	0.805	S	S	*	*			trans	-92.6	137.9	-179	40	0	0	0	0	112.5
524	P	47.5	Very low	38.3	Very low	127 Å²	127	159.7 Å²	159.7	83%	0.825	80%	0.802	S	S	*	*			trans	-99.5	118.9	165.4	33.7	-27.2	0	0	0	111
525	A	32.3	Very low	38	Very low	84 Å²	84	158 Å²	158	69%	0.694	80%	0.798	S	S	*	*			trans	-120.5	88.3	179.8	0	0	0	0	0	111.8
526	F	48.8	Very low	37.6	Very low	213 Å²	213	157.5 Å²	157.5	93%	0.934	81%	0.805	S	S	*	*			trans	-139.9	151.3	169.6	-76.2	-67.3	0	0	0	112.9
527	V	39.8	Very low	37.4	Very low	134 Å²	134	155.7 Å²	155.7	81%	0.812	81%	0.805	S	S	*	*			trans	-102.4	136.2	-161.9	174.6	0	0	0	0	112.8
528	R	45.9	Very low	37.6	Very low	234 Å²	234	152.1 Å²	152.1	88%	0.883	80%	0.797	S	S	*	*			trans	-176.9	94.6	152.4	-103	153.9	168	-146.4	-7.5	108.5
529	E	39.4	Very low	37.8	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	80%	0.8	S	S	*	*				67.1	120.1	76.6	-164	-167.1	165.5	0	0	114.4
530	K	44.5	Very low	37.7	Very low	186 Å²	186	145.5 Å²	145.5	81%	0.809	79%	0.792	S	S	*	*			trans	123.2	79.5	155.5	-158.8	169.2	-171.9	174.5	0	113.9
531	I	39	Very low	37.8	Very low	120 Å²	120	145.5 Å²	145.5	62%	0.615	79%	0.792	S	S	*	*				59.1	108.4	84.9	-53.2	159.1	0	0	0	110.1	F533	I531-F533 HydrophobicContact CG2-CE2 4.43Å
532	K	34.8	Very low	38.3	Very low	183 Å²	183	148.6 Å²	148.6	80%	0.796	80%	0.802	S	S	*	*				-160.4	155.7	74.5	-76.9	-177.5	-177.6	-178.7	0	115.5
533	F	31.1	Very low	38	Very low	155 Å²	155	143.9 Å²	143.9	68%	0.68	79%	0.794	S	S	*	*			trans	-13.1	153.5	154.8	-39.6	-80	0	0	0	118.5	I531	I531-F533 HydrophobicContact CG2-CE2 4.43Å
534	F	34.5	Very low	37.4	Very low	188 Å²	188	143.9 Å²	143.9	83%	0.825	79%	0.794	S	S	*	*			cis	-141.2	156.4	29.1	-63.9	-99.5	0	0	0	109.5
535	T	29.3	Very low	36.8	Very low	118 Å²	118	142.4 Å²	142.4	72%	0.724	79%	0.786	S	S	*	*			cis	67.4	88.8	39.2	69.6	0	0	0	0	117.2
536	S	29.8	Very low	37.1	Very low	131 Å²	131	147 Å²	147	92%	0.916	79%	0.791	S	S	*	*				176.6	178	116.4	-154.9	0	0	0	0	112.9
537	S	30.3	Very low	36.4	Very low	112 Å²	112	144.4 Å²	144.4	78%	0.783	79%	0.787	S	S	*	*			trans	-107.8	-173.1	-171.3	-128.1	0	0	0	0	113.2
538	P	44.7	Very low	36.2	Very low	113 Å²	113	146 Å²	146	73%	0.734	79%	0.79	S	S	*	*			trans	-92.3	170.7	-156.8	38.6	-40.3	0	0	0	116.3
539	P	38.1	Very low	36.2	Very low	131 Å²	131	140.3 Å²	140.3	85%	0.851	78%	0.783	S	S	*	*			trans	-118.8	166	162.9	39.8	-29	0	0	0	113.9
540	A	31.1	Very low	35.7	Very low	93 Å²	93	137 Å²	137	77%	0.769	78%	0.784	S	S	*	*			trans	-142.9	148.4	178.2	0	0	0	0	0	114.2
541	L	34.9	Very low	35	Very low	168 Å²	168	133.6 Å²	133.6	88%	0.88	78%	0.784	S	S	*	*			trans	62	152.4	165.4	-61.4	174.1	0	0	0	119.3
542	P	45.1	Very low	34.8	Very low	123 Å²	123	132.7 Å²	132.7	80%	0.799	79%	0.788	S	S	*	*				-145.4	129.5	112.1	36.1	-20.4	0	0	0	117.2
543	S	30.8	Very low	34.8	Very low	104 Å²	104	128.3 Å²	128.3	73%	0.727	79%	0.786	S	S	*	*			trans	35.3	130.8	133.8	-70.1	0	0	0	0	125.6
544	V	34.3	Very low	35.1	Very low	139 Å²	139	126.2 Å²	126.2	84%	0.842	79%	0.79	S	S	*	*				77.6	144.7	129.7	173.1	0	0	0	0	117.2
545	S	34.4	Very low	35.1	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	79%	0.792	S	S	*	*			cis	-148.9	146.8	13.6	48.8	0	0	0	0	116.1
546	K	38.5	Very low	35.3	Very low	181 Å²	181	125 Å²	125	79%	0.787	79%	0.791	S	S	*	*			trans	20	129	136.3	-50.3	178.3	-179.4	-178.5	0	121
547	N	34.4	Very low	35.9	Very low	158 Å²	158	126.4 Å²	126.4	85%	0.845	79%	0.787	S	S	*	*				164.2	154.7	108.7	-83.4	-47	0	0	0	115.1
548	L	35.6	Very low	36.7	Very low	168 Å²	168	127.3 Å²	127.3	88%	0.88	79%	0.79	S	S	*	*			trans	-107.8	-176.6	169.5	-71	167.1	0	0	0	109.4
549	P	46.3	Very low	36.7	Very low	115 Å²	115	126.5 Å²	126.5	75%	0.747	79%	0.793	S	S	*	*			cis	-138.1	175	-2.1	42.2	-24.8	0	0	0	117.5
550	A	28.5	Very low	36.8	Very low	94 Å²	94	124.8 Å²	124.8	78%	0.777	79%	0.79	S	S	*	*			trans	73.1	149.4	139.8	0	0	0	0	0	124.5
551	S	30.4	Very low	38	Very low	116 Å²	116	130 Å²	130	81%	0.811	80%	0.795	S	S	*	*			trans	75.6	136.1	156.1	-157.9	0	0	0	0	117.9
552	S	33	Very low	38.5	Very low	101 Å²	101	127.9 Å²	127.9	71%	0.706	79%	0.792	S	S	*	*			cis	-163.5	178.3	-15.1	49.8	0	0	0	0	110.8
553	A	35.4	Very low	38.7	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	80%	0.796	S	S	*	*			trans	19.4	133.7	149.2	0	0	0	0	0	120
554	S	36.8	Very low	39.6	Very low	112 Å²	112	136 Å²	136	78%	0.783	80%	0.804	S	S	*	*			cis	-179.3	-179.1	12.7	50.9	0	0	0	0	112.4
555	K	36.2	Very low	40.1	Very low	195 Å²	195	133.8 Å²	133.8	85%	0.848	80%	0.801	S	S	*	*			trans	102.9	100.2	140.8	-157.7	173.9	-176.6	179.5	0	119.9
556	A	32.3	Very low	40.8	Very low	85 Å²	85	140.6 Å²	140.6	70%	0.702	81%	0.812	S	S	*	*			trans	66.1	102	140.9	0	0	0	0	0	121.6
557	L	42.6	Very low	41.3	Very low	160 Å²	160	142.9 Å²	142.9	84%	0.838	82%	0.816	S	S	*	*				21.1	143.1	112.4	-68.6	-178.5	0	0	0	119.1
558	P	48.2	Very low	42	Very low	132 Å²	132	146.5 Å²	146.5	86%	0.857	82%	0.817	S	S	*	*			cis	-125.9	-178.9	44.8	40.9	-28.7	0	0	0	116.6
559	A	43.6	Very low	42.6	Very low	95 Å²	95	149.7 Å²	149.7	79%	0.785	82%	0.818	S	S	*	*			trans	-102.6	151	-164.6	0	0	0	0	0	114.9
560	A	41	Very low	42.6	Very low	96 Å²	96	151 Å²	151	79%	0.793	82%	0.823	S	S	*	*			trans	-113.1	154.8	157.5	0	0	0	0	0	109.6
561	K	55.3	Low	43.1	Very low	201 Å²	201	148.9 Å²	148.9	87%	0.874	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.7	136.4	-168.1	-58.8	171.4	-175.3	172.4	0	111.7	K563	K561-K563 PolarHBondContact O-N 3.5Å
562	P	44.7	Very low	43.9	Very low	124 Å²	124	151.2 Å²	151.2	81%	0.805	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-68.2	127.9	174.1	28.3	-33.4	0	0	0	110.4	Q564	P562-Q564 PolarHBondContact O-N 3.28Å
563	K	50.5	Low	44.3	Very low	204 Å²	204	151 Å²	151	89%	0.887	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.4	168.9	-72.9	-178.2	176.7	-178.6	0	108.5	K561 A565	K561-K563 PolarHBondContact O-N 3.5Å; K563-A565 PolarHBondContact O-N 3.47Å
564	Q	50.1	Low	45.1	Very low	193 Å²	193	157.4 Å²	157.4	90%	0.902	82%	0.817	S	S	*	*			trans	-62.8	111.5	174.8	-72.7	-172.7	-2.3	0	0	109.1	P562 R566	P562-Q564 PolarHBondContact O-N 3.28Å; Q564-R566 PolarHBondContact O-N 2.82Å
565	A	43.8	Very low	45.9	Very low	94 Å²	94	163.2 Å²	163.2	78%	0.777	82%	0.822	S	S	*	*			trans	-60.1	108.8	168.4	0	0	0	0	0	107.7	K563 R567	K563-A565 PolarHBondContact O-N 3.47Å; A565-R567 PolarHBondContact O-N 3.39Å
566	R	48.6	Very low	47.2	Very low	238 Å²	238	161.5 Å²	161.5	90%	0.898	81%	0.814	S	S	*	*			trans	-61.7	86	177.4	178.5	179.1	171	-177.5	-2.4	108.3	Q564 R568	Q564-R566 PolarHBondContact O-N 2.82Å; R566-R568 PolarHBondContact O-N 3.5Å
567	R	49.5	Very low	48.5	Very low	230 Å²	230	160.8 Å²	160.8	87%	0.868	80%	0.802	S	S	*	*			trans	-47.8	113.5	168.7	-87.8	-168.9	170.5	-151.6	-2.4	105.9	A565 R569	A565-R567 PolarHBondContact O-N 3.39Å; R567-R569 PolarHBondContact O-N 2.89Å
568	R	49.3	Very low	49.8	Very low	234 Å²	234	156.8 Å²	156.8	88%	0.883	78%	0.783	S	S	*	*			trans	-60.3	99.1	165	-72.7	-171.8	178.9	-161.3	1	104.8	R566 T570	R566-R568 PolarHBondContact O-N 3.5Å; R568-T570 VanDerWaalsContact C-N 3.28Å; R568-T570 PolarHBondContact O-N 3.12Å
569	R	47.6	Very low	51.6	Low	235 Å²	235	152.9 Å²	152.9	89%	0.887	76%	0.755	S	S	*	*			trans	-60.9	105.1	164.6	-64.4	178.7	90.7	161	4.7	103.3	R567 G571	R567-R569 PolarHBondContact O-N 2.89Å; R569-G571 PolarHBondContact O-N 3.39Å
570	T	46.7	Very low	53.9	Low	141 Å²	141	152 Å²	152	87%	0.865	74%	0.741	S	S	*	*			trans	-66.3	66.8	154.1	-50.2	0	0	0	0	105.9	R568 L572	R568-T570 VanDerWaalsContact C-N 3.28Å; R568-T570 PolarHBondContact O-N 3.12Å; T570-L572 PolarHBondContact O-N 2.93Å
571	G	39.1	Very low	56.3	Low	50 Å²	50	152.6 Å²	152.6	52%	0.515	73%	0.726	S	S	.	*			trans	-58.1	130.4	164.9	0	0	0	0	0	104.9	R569 S573	R569-G571 PolarHBondContact O-N 3.39Å; G571-S573 PolarHBondContact O-N 3.31Å
572	L	47.8	Very low	58.1	Low	165 Å²	165	148.4 Å²	148.4	86%	0.864	72%	0.717	S	S	*	*			trans	-64.7	75.4	160.6	-172.5	66.2	0	0	0	106.4	T570 R574	T570-L572 PolarHBondContact O-N 2.93Å; L572-R574 VanDerWaalsContact C-N 3.26Å; L572-R574 PolarHBondContact O-N 2.89Å
573	S	41.1	Very low	60.3	Low	98 Å²	98	149 Å²	149	69%	0.685	71%	0.705	S	S	*	*			trans	-56.8	102	166.5	177.7	0	0	0	0	103.7	G571 R575	G571-S573 PolarHBondContact O-N 3.31Å; S573-R575 VanDerWaalsContact C-N 3.26Å; S573-R575 PolarHBondContact O-N 2.99Å
574	R	51.2	Low	62.4	Low	223 Å²	223	139.7 Å²	139.7	84%	0.842	67%	0.665	S	S	*	*			trans	-54.7	100.7	177.7	-78.2	-174.1	-94.5	-159.9	-5.5	105.2	L572 K576	L572-R574 VanDerWaalsContact C-N 3.26Å; L572-R574 PolarHBondContact O-N 2.89Å; R574-K576 PolarHBondContact O-N 2.99Å
575	R	54	Low	64.5	Low	235 Å²	235	132 Å²	132	89%	0.887	63%	0.629	S	S	*	*			trans	-66.3	91.7	173.2	-71.4	-167.9	-179.5	-151.7	3.1	103.7	S573 T577	S573-R575 VanDerWaalsContact C-N 3.26Å; S573-R575 PolarHBondContact O-N 2.99Å; R575-T577 PolarHBondContact O-N 3.4Å
576	K	64.7	Low	66.8	Low	158 Å²	158	131.2 Å²	131.2	69%	0.687	62%	0.617	S	S	*	*			trans	-44.8	135.4	175.2	-69.7	-171.4	175.5	-167.3	0	106.8	R574 V578	R574-K576 PolarHBondContact O-N 2.99Å; K576-V578 HydrophobicContact CB-CG2 3.64Å; K576-V578 PolarHBondContact O-N 3.02Å
577	T	58.6	Low	69	Low	71 Å²	71	122.2 Å²	122.2	44%	0.436	59%	0.589	S	S	.	*			trans	-77.5	46.4	-171.3	20.9	0	0	0	0	110.9	R575 L579 D609	R575-T577 PolarHBondContact O-N 3.4Å; T577-L579 PolarHBondContact O-N 3.38Å; T577-D609 PolarHBondContact N-OD1 3.3Å; T577-D609 PolarHBondContact OG1-OD1 3.03Å; T577-D609 VanDerWaalsContact OG1-OD1 3.12Å
578	V	71.3	Confident	71.1	Confident	75 Å²	75	115 Å²	115	46%	0.455	56%	0.564	S	S	.	*			trans	-67.2	91.3	-174.9	-177.8	0	0	0	0	109.2	K576 F601	K576-V578 HydrophobicContact CB-CG2 3.64Å; K576-V578 PolarHBondContact O-N 3.02Å; V578-F601 HydrophobicContact CG1-CZ 4.43Å
579	L	84.9	Confident	73.3	Confident	50 Å²	50	109.7 Å²	109.7	26%	0.262	55%	0.547	S	S	.	.			trans	-49.3	138.8	152.5	-65.2	178.1	0	0	0	108.5	T577 K581 L584 F612	T577-L579 PolarHBondContact O-N 3.38Å; L579-K581 PolarHBondContact O-N 2.91Å; L579-L584 HydrophobicContact CB-CB 4.33Å; L579-L584 HydrophobicContact CD1-CD1 4.46Å; L579-F612 HydrophobicContact CD1-CE2 3.81Å; L579-F612 HydrophobicContact CD1-CZ 4.02Å; L579-F612 HydrophobicContact CG-CE2 4.12Å
580	P	91.8	Very high	75.4	Confident	77 Å²	77	105 Å²	105	50%	0.5	54%	0.535	S	S	.	.			trans	-51.1	130.4	-178.3	-28.8	35.2	0	0	0	112	T582 Y583 L584	P580-T582 PolarHBondContact O-N 3.02Å; P580-T582 VanDerWaalsContact O-N 3.1Å; P580-Y583 WeakPolarHBondContact O-CA 3.2Å; P580-Y583 WeakPolarHBondContact O-CB 3.28Å; P580-Y583 PolarHBondContact O-N 3.06Å; P580-L584 PolarHBondContact O-N 3.1Å
581	K	91.2	Very high	77.6	Confident	109 Å²	109	104.4 Å²	104.4	47%	0.474	52%	0.521	S	S	.	.	H	α-helix	trans	-51.1	-39.3	-176.6	175.9	171.8	-177	-177.3	0	112.6	L579 M585 F601	L579-K581 PolarHBondContact O-N 2.91Å; K581-M585 WeakPolarHBondContact O-CB 3.38Å; K581-M585 PolarHBondContact O-N 3.08Å; K581-F601 HydrophobicContact CB-CD2 4.19Å; K581-F601 HydrophobicContact CB-CE1 4.18Å; K581-F601 HydrophobicContact CB-CE2 3.72Å; K581-F601 HydrophobicContact CB-CZ 3.72Å; K581-F601 HydrophobicContact CD-CD1 3.72Å; K581-F601 HydrophobicContact CD-CD2 4.32Å; K581-F601 HydrophobicContact CD-CE1 3.91Å; K581-F601 HydrophobicContact CD-CE2 4.49Å; K581-F601 HydrophobicContact CD-CG 3.93Å; K581-F601 HydrophobicContact CD-CZ 4.31Å; K581-F601 HydrophobicContact CG-CD1 4.01Å; K581-F601 HydrophobicContact CG-CD2 3.69Å; K581-F601 HydrophobicContact CG-CE1 4.07Å; K581-F601 HydrophobicContact CG-CE2 3.77Å; K581-F601 HydrophobicContact CG-CG 3.82Å; K581-F601 HydrophobicContact CG-CZ 3.96Å
582	T	92.8	Very high	80.2	Confident	112 Å²	112	103.7 Å²	103.7	69%	0.687	51%	0.51	S	S	*	.	H	α-helix	trans	-61.5	-50.2	175.2	46.8	0	0	0	0	112	P580 S586	P580-T582 PolarHBondContact O-N 3.02Å; P580-T582 VanDerWaalsContact O-N 3.1Å; T582-S586 WeakPolarHBondContact O-CB 3.47Å; T582-S586 PolarHBondContact O-N 3.49Å
583	Y	92.8	Very high	82.4	Confident	138 Å²	138	104.9 Å²	104.9	54%	0.541	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-54.1	177.9	177.7	-102.6	0	0	0	111.7	P580 M585 S586 V587	P580-Y583 WeakPolarHBondContact O-CA 3.2Å; P580-Y583 WeakPolarHBondContact O-CB 3.28Å; P580-Y583 PolarHBondContact O-N 3.06Å; Y583-M585 PolarHBondContact O-N 3.14Å; Y583-S586 PolarHBondContact O-N 3.05Å; Y583-V587 HydrophobicContact CD1-CG2 4.45Å; Y583-V587 HydrophobicContact CD2-CG2 4.12Å; Y583-V587 HydrophobicContact CE1-CG2 4.12Å; Y583-V587 HydrophobicContact CE2-CG2 3.75Å; Y583-V587 HydrophobicContact CG-CG2 4.46Å; Y583-V587 WeakPolarHBondContact O-CG2 3.32Å; Y583-V587 PolarHBondContact O-N 2.85Å
584	L	93	Very high	84.9	Confident	8 Å²	8	104.5 Å²	104.5	4%	0.042	50%	0.502	C	S	.	.	H	α-helix	trans	-62.3	-42.2	-175.7	179.7	53.5	0	0	0	112	L579 P580 F588 F601 L604 M608	L579-L584 HydrophobicContact CB-CB 4.33Å; L579-L584 HydrophobicContact CD1-CD1 4.46Å; P580-L584 PolarHBondContact O-N 3.1Å; L584-F588 WeakPolarHBondContact O-CB 3.4Å; L584-F588 PolarHBondContact O-N 3.4Å; L584-F601 HydrophobicContact CD2-CE2 4.16Å; L584-L604 HydrophobicContact CD1-CD1 4.43Å; L584-L604 HydrophobicContact CD1-CD2 3.95Å; L584-L604 HydrophobicContact CD1-CG 3.95Å; L584-L604 HydrophobicContact CD2-CD2 4.39Å; L584-L604 HydrophobicContact CD2-CG 4.06Å; L584-L604 HydrophobicContact CG-CD2 3.76Å; L584-L604 HydrophobicContact CG-CG 3.91Å; L584-M608 HydrophobicContact CD1-CE 4.16Å; L584-M608 HydrophobicContact CD1-CG 3.7Å; L584-M608 HydrophobicContact CD1-SD 4.26Å; L584-M608 HydrophobicContact CD2-CB 4.45Å; L584-M608 HydrophobicContact CD2-CG 3.95Å
585	M	93.9	Very high	86.8	Confident	32 Å²	32	103.9 Å²	103.9	16%	0.158	51%	0.505	C	S	.	.	H	α-helix	trans	-71.9	-34.3	176.8	-168.9	57.6	68.1	0	0	112.6	K581 Y583 K589 V596 V600 F601	K581-M585 WeakPolarHBondContact O-CB 3.38Å; K581-M585 PolarHBondContact O-N 3.08Å; Y583-M585 PolarHBondContact O-N 3.14Å; M585-K589 WeakPolarHBondContact O-CB 3.48Å; M585-K589 PolarHBondContact O-N 2.97Å; M585-V596 HydrophobicContact CE-CG1 4.47Å; M585-V596 HydrophobicContact SD-CB 4.19Å; M585-V596 HydrophobicContact SD-CG1 3.69Å; M585-V600 HydrophobicContact CE-CB 4.34Å; M585-F601 HydrophobicContact CE-CB 3.73Å
586	S	93.8	Very high	88.6	Confident	76 Å²	76	94.6 Å²	94.6	53%	0.531	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-49.9	175.4	-176.4	0	0	0	0	111.7	T582 Y583 F588 K589 H590	T582-S586 WeakPolarHBondContact O-CB 3.47Å; T582-S586 PolarHBondContact O-N 3.49Å; Y583-S586 PolarHBondContact O-N 3.05Å; S586-F588 PolarHBondContact O-N 3.3Å; S586-K589 PolarHBondContact O-N 2.75Å; S586-H590 WeakPolarHBondContact O-CB 3.46Å; S586-H590 PolarHBondContact O-N 2.92Å
587	V	93.8	Very high	89.9	Confident	49 Å²	49	89.8 Å²	89.8	30%	0.297	46%	0.461	S	S	.	.	H	α-helix	trans	-59.4	-46.8	176.9	172.3	0	0	0	0	110.8	Y583 H590 F591	Y583-V587 HydrophobicContact CD1-CG2 4.45Å; Y583-V587 HydrophobicContact CD2-CG2 4.12Å; Y583-V587 HydrophobicContact CE1-CG2 4.12Å; Y583-V587 HydrophobicContact CE2-CG2 3.75Å; Y583-V587 HydrophobicContact CG-CG2 4.46Å; Y583-V587 WeakPolarHBondContact O-CG2 3.32Å; Y583-V587 PolarHBondContact O-N 2.85Å; V587-H590 PolarHBondContact O-N 2.86Å; V587-F591 HydrophobicContact CG1-CD2 3.86Å; V587-F591 HydrophobicContact CG1-CE2 3.79Å; V587-F591 VanDerWaalsContact O-CD2 3.29Å; V587-F591 WeakPolarHBondContact O-CD2 3.25Å; V587-F591 PolarHBondContact O-N 3.39Å; V587-F591 VanDerWaalsContact O-N 3.13Å
588	F	94.4	Very high	91.4	Very high	78 Å²	78	89.3 Å²	89.3	34%	0.342	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-44.7	177.9	-177	-99.3	0	0	0	112.2	L584 S586 H590 F591 A592 V596 V600 L604	L584-F588 WeakPolarHBondContact O-CB 3.4Å; L584-F588 PolarHBondContact O-N 3.4Å; S586-F588 PolarHBondContact O-N 3.3Å; F588-H590 VanDerWaalsContact C-N 3.33Å; F588-H590 PolarHBondContact O-N 2.79Å; F588-F591 PolarHBondContact O-N 3.42Å; F588-A592 HydrophobicContact CD1-CB 4.47Å; F588-A592 HydrophobicContact CE1-CB 4.21Å; F588-A592 HydrophobicContact CZ-CB 4.4Å; F588-A592 WeakPolarHBondContact O-CB 3.41Å; F588-A592 PolarHBondContact O-N 2.91Å; F588-V596 HydrophobicContact CD1-CB 4.49Å; F588-V596 HydrophobicContact CD1-CG1 3.93Å; F588-V596 HydrophobicContact CD1-CG2 3.91Å; F588-V596 HydrophobicContact CE1-CB 4.47Å; F588-V596 HydrophobicContact CE1-CG1 3.78Å; F588-V596 HydrophobicContact CE1-CG2 3.8Å; F588-V600 HydrophobicContact CE1-CG1 4.26Å; F588-L604 HydrophobicContact CB-CD2 3.62Å; F588-L604 HydrophobicContact CD1-CD2 4.23Å; F588-L604 HydrophobicContact CD2-CD1 3.97Å; F588-L604 HydrophobicContact CD2-CD2 4.09Å; F588-L604 HydrophobicContact CE2-CD1 4.4Å; F588-L604 HydrophobicContact CG-CD1 4.45Å; F588-L604 HydrophobicContact CG-CD2 3.72Å
589	K	94.6	Very high	92.4	Very high	123 Å²	123	91.4 Å²	91.4	54%	0.535	47%	0.472	S	S	.	.	H	α-helix	trans	-61.5	-38.3	176.4	-175.3	-177	176.7	-172.3	0	112.4	M585 S586 K593	M585-K589 WeakPolarHBondContact O-CB 3.48Å; M585-K589 PolarHBondContact O-N 2.97Å; S586-K589 PolarHBondContact O-N 2.75Å; K589-K593 PolarHBondContact O-N 3.21Å; K589-K593 VanDerWaalsContact O-N 3.08Å
590	H	92.9	Very high	92.8	Very high	138 Å²	138	91.3 Å²	91.3	64%	0.639	47%	0.474	S	S	*	.	H	α-helix	trans	-61.6	-49.6	176.2	178.7	85.4	0	0	0	111.7	S586 V587 F588 K593	S586-H590 WeakPolarHBondContact O-CB 3.46Å; S586-H590 PolarHBondContact O-N 2.92Å; V587-H590 PolarHBondContact O-N 2.86Å; F588-H590 VanDerWaalsContact C-N 3.33Å; F588-H590 PolarHBondContact O-N 2.79Å; H590-K593 WeakPolarHBondContact O-CG 3.29Å
591	F	92.9	Very high	92.8	Very high	128 Å²	128	89.2 Å²	89.2	56%	0.561	46%	0.457	S	S	*	.	H	α-helix	trans	-73.2	-36.3	179	-72.7	-62.2	0	0	0	113.5	V587 F588 K593 Y659	V587-F591 HydrophobicContact CG1-CD2 3.86Å; V587-F591 HydrophobicContact CG1-CE2 3.79Å; V587-F591 VanDerWaalsContact O-CD2 3.29Å; V587-F591 WeakPolarHBondContact O-CD2 3.25Å; V587-F591 PolarHBondContact O-N 3.39Å; V587-F591 VanDerWaalsContact O-N 3.13Å; F588-F591 PolarHBondContact O-N 3.42Å; F591-K593 VanDerWaalsContact C-N 3.29Å; F591-K593 PolarHBondContact O-N 2.92Å; F591-Y659 HydrophobicContact CE1-CD1 4.32Å; F591-Y659 HydrophobicContact CE1-CE1 4.15Å; F591-Y659 HydrophobicContact CZ-CD1 4.23Å; F591-Y659 HydrophobicContact CZ-CE1 4.47Å
592	A	93.1	Very high	92.9	Very high	35 Å²	35	87.9 Å²	87.9	29%	0.289	46%	0.459	S	S	.	.	H	α-helix	trans	-74.1	-15.9	179.4	0	0	0	0	0	113.8	F588 T594 V596	F588-A592 HydrophobicContact CD1-CB 4.47Å; F588-A592 HydrophobicContact CE1-CB 4.21Å; F588-A592 HydrophobicContact CZ-CB 4.4Å; F588-A592 WeakPolarHBondContact O-CB 3.41Å; F588-A592 PolarHBondContact O-N 2.91Å; A592-T594 WeakPolarHBondContact O-CB 3.34Å; A592-T594 WeakPolarHBondContact O-CG2 3.44Å; A592-T594 PolarHBondContact O-N 3.18Å; A592-T594 PolarHBondContact O-OG1 3.27Å; A592-V596 HydrophobicContact CB-CG2 4.43Å
593	K	93.4	Very high	92.9	Very high	190 Å²	190	86.6 Å²	86.6	83%	0.826	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	25.2	177.7	-60.3	-177.4	179.9	-178.4	0	114.9	K589 H590 F591	K589-K593 PolarHBondContact O-N 3.21Å; K589-K593 VanDerWaalsContact O-N 3.08Å; H590-K593 WeakPolarHBondContact O-CG 3.29Å; F591-K593 VanDerWaalsContact C-N 3.29Å; F591-K593 PolarHBondContact O-N 2.92Å
594	T	93	Very high	93	Very high	89 Å²	89	80.5 Å²	80.5	55%	0.546	43%	0.428	S	S	.	.	S	Bend	trans	-137.9	168.1	-169.5	42.9	0	0	0	0	111.3	A592 V596	A592-T594 WeakPolarHBondContact O-CB 3.34Å; A592-T594 WeakPolarHBondContact O-CG2 3.44Å; A592-T594 PolarHBondContact O-N 3.18Å; A592-T594 PolarHBondContact O-OG1 3.27Å; T594-V596 PolarHBondContact O-N 3.14Å
595	K	91.9	Very high	92.9	Very high	211 Å²	211	80.7 Å²	80.7	92%	0.917	43%	0.429	S	S	*	.			trans	-79	113.3	173.2	-66	-175.7	-179.6	-178.2	0	108.9
596	V	92.6	Very high	92.9	Very high	39 Å²	39	84 Å²	84	24%	0.236	44%	0.444	C	S	.	.			trans	-104.1	135	179.8	-172.8	0	0	0	0	109.1	M585 F588 A592 T594 V600	M585-V596 HydrophobicContact CE-CG1 4.47Å; M585-V596 HydrophobicContact SD-CB 4.19Å; M585-V596 HydrophobicContact SD-CG1 3.69Å; F588-V596 HydrophobicContact CD1-CB 4.49Å; F588-V596 HydrophobicContact CD1-CG1 3.93Å; F588-V596 HydrophobicContact CD1-CG2 3.91Å; F588-V596 HydrophobicContact CE1-CB 4.47Å; F588-V596 HydrophobicContact CE1-CG1 3.78Å; F588-V596 HydrophobicContact CE1-CG2 3.8Å; A592-V596 HydrophobicContact CB-CG2 4.43Å; T594-V596 PolarHBondContact O-N 3.14Å; V596-V600 HydrophobicContact CG1-CB 3.87Å; V596-V600 HydrophobicContact CG1-CG1 4.15Å; V596-V600 HydrophobicContact CG1-CG2 3.8Å
597	S	92.3	Very high	92.9	Very high	58 Å²	58	84.7 Å²	84.7	41%	0.406	44%	0.441	S	S	.	.			trans	-81.1	159.1	176.1	79.8	0	0	0	0	112.1	D599 V600	S597-D599 VanDerWaalsContact CB-OD2 3.26Å; S597-D599 WeakPolarHBondContact CB-OD2 3.32Å; S597-D599 PolarHBondContact O-N 2.99Å; S597-D599 PolarHBondContact OG-OD2 2.92Å; S597-V600 PolarHBondContact O-N 3.19Å
598	A	89.6	Confident	92.9	Very high	60 Å²	60	84.8 Å²	84.8	50%	0.496	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.6	179.9	0	0	0	0	0	113.1	V600 F601	A598-V600 VanDerWaalsContact C-N 3.26Å; A598-V600 PolarHBondContact O-N 3.39Å; A598-F601 VanDerWaalsContact O-CB 3.23Å; A598-F601 WeakPolarHBondContact O-CB 3.42Å; A598-F601 PolarHBondContact O-N 3.33Å; A598-F601 VanDerWaalsContact O-N 3.16Å
599	D	92.1	Very high	92.8	Very high	119 Å²	119	82.2 Å²	82.2	64%	0.636	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-16.6	-175.5	-32.7	-68.8	0	0	0	112.9	S597 F601 P602	S597-D599 VanDerWaalsContact CB-OD2 3.26Å; S597-D599 WeakPolarHBondContact CB-OD2 3.32Å; S597-D599 PolarHBondContact O-N 2.99Å; S597-D599 PolarHBondContact OG-OD2 2.92Å; D599-F601 PolarHBondContact O-N 3.08Å; D599-P602 VanDerWaalsContact O-CD 3.27Å; D599-P602 WeakPolarHBondContact O-CD 3.34Å; D599-P602 WeakPolarHBondContact O-CG 3.16Å
600	V	93.3	Very high	92.8	Very high	48 Å²	48	81.1 Å²	81.1	29%	0.291	42%	0.424	S	S	.	.	H	α-helix	trans	-69.6	-23	171.7	-178.2	0	0	0	0	111.2	M585 F588 V596 S597 A598 V603 L604	M585-V600 HydrophobicContact CE-CB 4.34Å; F588-V600 HydrophobicContact CE1-CG1 4.26Å; V596-V600 HydrophobicContact CG1-CB 3.87Å; V596-V600 HydrophobicContact CG1-CG1 4.15Å; V596-V600 HydrophobicContact CG1-CG2 3.8Å; S597-V600 PolarHBondContact O-N 3.19Å; A598-V600 VanDerWaalsContact C-N 3.26Å; A598-V600 PolarHBondContact O-N 3.39Å; V600-V603 PolarHBondContact O-N 2.9Å; V600-L604 HydrophobicContact CG1-CB 4.47Å; V600-L604 VanDerWaalsContact O-CB 3.31Å; V600-L604 WeakPolarHBondContact O-CB 3.48Å; V600-L604 PolarHBondContact O-N 3.41Å
601	F	92.3	Very high	92.8	Very high	34 Å²	34	78.4 Å²	78.4	15%	0.149	41%	0.41	C	S	.	.	H	α-helix	trans	-54.9	-52.4	-176.8	176.6	-110.6	0	0	0	115.3	V578 K581 L584 M585 A598 D599 V603 L604 N605	V578-F601 HydrophobicContact CG1-CZ 4.43Å; K581-F601 HydrophobicContact CB-CD2 4.19Å; K581-F601 HydrophobicContact CB-CE1 4.18Å; K581-F601 HydrophobicContact CB-CE2 3.72Å; K581-F601 HydrophobicContact CB-CZ 3.72Å; K581-F601 HydrophobicContact CD-CD1 3.72Å; K581-F601 HydrophobicContact CD-CD2 4.32Å; K581-F601 HydrophobicContact CD-CE1 3.91Å; K581-F601 HydrophobicContact CD-CE2 4.49Å; K581-F601 HydrophobicContact CD-CG 3.93Å; K581-F601 HydrophobicContact CD-CZ 4.31Å; K581-F601 HydrophobicContact CG-CD1 4.01Å; K581-F601 HydrophobicContact CG-CD2 3.69Å; K581-F601 HydrophobicContact CG-CE1 4.07Å; K581-F601 HydrophobicContact CG-CE2 3.77Å; K581-F601 HydrophobicContact CG-CG 3.82Å; K581-F601 HydrophobicContact CG-CZ 3.96Å; L584-F601 HydrophobicContact CD2-CE2 4.16Å; M585-F601 HydrophobicContact CE-CB 3.73Å; A598-F601 VanDerWaalsContact O-CB 3.23Å; A598-F601 WeakPolarHBondContact O-CB 3.42Å; A598-F601 PolarHBondContact O-N 3.33Å; A598-F601 VanDerWaalsContact O-N 3.16Å; D599-F601 PolarHBondContact O-N 3.08Å; F601-V603 VanDerWaalsContact C-N 3.33Å; F601-V603 PolarHBondContact O-N 2.92Å; F601-L604 PolarHBondContact O-N 3.46Å; F601-N605 HydrophobicContact CE2-CB 4.28Å; F601-N605 HydrophobicContact CZ-CB 4.25Å; F601-N605 WeakPolarHBondContact O-CB 3.4Å; F601-N605 PolarHBondContact O-N 2.97Å
602	P	92.8	Very high	92.9	Very high	80 Å²	80	76 Å²	76	52%	0.519	40%	0.4	S	S	.	.	H	α-helix	trans	-57.8	-42.2	179.3	20.2	-34.1	0	0	0	113.2	D599 N605 E606	D599-P602 VanDerWaalsContact O-CD 3.27Å; D599-P602 WeakPolarHBondContact O-CD 3.34Å; D599-P602 WeakPolarHBondContact O-CG 3.16Å; P602-N605 PolarHBondContact O-N 3.42Å; P602-E606 PolarHBondContact O-N 3.3Å
603	V	93.4	Very high	93	Very high	85 Å²	85	79.2 Å²	79.2	52%	0.515	41%	0.412	S	S	.	.	H	α-helix	trans	-65.8	-44.5	177.7	-178	0	0	0	0	110.6	V600 F601 N605 E606 I607	V600-V603 PolarHBondContact O-N 2.9Å; F601-V603 VanDerWaalsContact C-N 3.33Å; F601-V603 PolarHBondContact O-N 2.92Å; V603-N605 PolarHBondContact O-N 2.79Å; V603-E606 PolarHBondContact O-N 2.91Å; V603-I607 HydrophobicContact CG1-CD1 3.94Å; V603-I607 VanDerWaalsContact O-CG1 3.29Å; V603-I607 WeakPolarHBondContact O-CG1 3.45Å; V603-I607 PolarHBondContact O-N 3.36Å
604	L	93.1	Very high	93.1	Very high	10 Å²	10	76.9 Å²	76.9	5%	0.052	40%	0.398	C	S	.	.	H	α-helix	trans	-64.9	-38.3	177.9	-176.5	60.8	0	0	0	112	L584 F588 V600 F601 I607 M608	L584-L604 HydrophobicContact CD1-CD1 4.43Å; L584-L604 HydrophobicContact CD1-CD2 3.95Å; L584-L604 HydrophobicContact CD1-CG 3.95Å; L584-L604 HydrophobicContact CD2-CD2 4.39Å; L584-L604 HydrophobicContact CD2-CG 4.06Å; L584-L604 HydrophobicContact CG-CD2 3.76Å; L584-L604 HydrophobicContact CG-CG 3.91Å; F588-L604 HydrophobicContact CB-CD2 3.62Å; F588-L604 HydrophobicContact CD1-CD2 4.23Å; F588-L604 HydrophobicContact CD2-CD1 3.97Å; F588-L604 HydrophobicContact CD2-CD2 4.09Å; F588-L604 HydrophobicContact CE2-CD1 4.4Å; F588-L604 HydrophobicContact CG-CD1 4.45Å; F588-L604 HydrophobicContact CG-CD2 3.72Å; V600-L604 HydrophobicContact CG1-CB 4.47Å; V600-L604 VanDerWaalsContact O-CB 3.31Å; V600-L604 WeakPolarHBondContact O-CB 3.48Å; V600-L604 PolarHBondContact O-N 3.41Å; F601-L604 PolarHBondContact O-N 3.46Å; L604-I607 PolarHBondContact O-N 3.06Å; L604-M608 HydrophobicContact CD1-CE 3.91Å; L604-M608 VanDerWaalsContact O-CG 3.24Å; L604-M608 WeakPolarHBondContact O-CG 3.1Å; L604-M608 PolarHBondContact O-N 3.13Å
605	N	92.3	Very high	93.2	Very high	12 Å²	12	73.8 Å²	73.8	6%	0.064	38%	0.379	C	S	.	.	H	α-helix	trans	-65	-45.1	174.2	-162.3	108.3	0	0	0	111	F601 P602 V603 I607 M608 D609	F601-N605 HydrophobicContact CE2-CB 4.28Å; F601-N605 HydrophobicContact CZ-CB 4.25Å; F601-N605 WeakPolarHBondContact O-CB 3.4Å; F601-N605 PolarHBondContact O-N 2.97Å; P602-N605 PolarHBondContact O-N 3.42Å; V603-N605 PolarHBondContact O-N 2.79Å; N605-I607 VanDerWaalsContact C-N 3.29Å; N605-I607 PolarHBondContact O-N 2.83Å; N605-M608 PolarHBondContact O-N 3.5Å; N605-M608 VanDerWaalsContact O-N 3.13Å; N605-D609 PolarHBondContact ND2-OD1 3.35Å; N605-D609 PolarHBondContact ND2-OD2 3.25Å; N605-D609 PolarHBondContact O-N 3.47Å
606	E	93.2	Very high	93.4	Very high	103 Å²	103	66.4 Å²	66.4	48%	0.481	36%	0.357	S	S	.	.	H	α-helix	trans	-62.3	-36.3	177.2	-172.3	-175.7	158.6	0	0	112.2	P602 V603 K610	P602-E606 PolarHBondContact O-N 3.3Å; V603-E606 PolarHBondContact O-N 2.91Å; E606-K610 HydrophobicContact CG-CD 4.36Å; E606-K610 WeakPolarHBondContact O-CB 3.35Å; E606-K610 VanDerWaalsContact O-CG 3.24Å; E606-K610 WeakPolarHBondContact O-CG 3.45Å; E606-K610 PolarHBondContact O-N 3Å; E606-K610 VanDerWaalsContact O-N 3.12Å; E606-K610 VanDerWaalsContact OE1-CE 3.3Å; E606-K610 WeakPolarHBondContact OE1-CE 3.49Å; E606-K610 IonicContact OE1-NZ 3.68Å; E606-K610 PolarHBondContact OE1-NZ 2.93Å
607	I	93.5	Very high	93.5	Very high	90 Å²	90	70.7 Å²	70.7	46%	0.462	38%	0.375	S	S	.	.	H	α-helix	trans	-66.9	-39.5	173.6	-69.9	166.5	0	0	0	111.2	V603 L604 N605 F611	V603-I607 HydrophobicContact CG1-CD1 3.94Å; V603-I607 VanDerWaalsContact O-CG1 3.29Å; V603-I607 WeakPolarHBondContact O-CG1 3.45Å; V603-I607 PolarHBondContact O-N 3.36Å; L604-I607 PolarHBondContact O-N 3.06Å; N605-I607 VanDerWaalsContact C-N 3.29Å; N605-I607 PolarHBondContact O-N 2.83Å; I607-F611 WeakPolarHBondContact O-CB 3.49Å; I607-F611 PolarHBondContact O-N 2.79Å
608	M	94	Very high	93.7	Very high	50 Å²	50	70.1 Å²	70.1	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-71.4	-43.2	178.1	-70	-65.1	154.2	0	0	112.4	L584 L604 N605 K610 F611 F612	L584-M608 HydrophobicContact CD1-CE 4.16Å; L584-M608 HydrophobicContact CD1-CG 3.7Å; L584-M608 HydrophobicContact CD1-SD 4.26Å; L584-M608 HydrophobicContact CD2-CB 4.45Å; L584-M608 HydrophobicContact CD2-CG 3.95Å; L604-M608 HydrophobicContact CD1-CE 3.91Å; L604-M608 VanDerWaalsContact O-CG 3.24Å; L604-M608 WeakPolarHBondContact O-CG 3.1Å; L604-M608 PolarHBondContact O-N 3.13Å; N605-M608 PolarHBondContact O-N 3.5Å; N605-M608 VanDerWaalsContact O-N 3.13Å; M608-K610 VanDerWaalsContact C-N 3.33Å; M608-K610 PolarHBondContact O-N 3.4Å; M608-F611 WeakPolarHBondContact O-CA 3.4Å; M608-F611 WeakPolarHBondContact O-CB 3.48Å; M608-F611 PolarHBondContact O-N 2.87Å; M608-F612 HydrophobicContact CB-CE2 4.34Å; M608-F612 WeakPolarHBondContact O-CD2 3.29Å; M608-F612 PolarHBondContact O-N 3.39Å
609	D	92.2	Very high	94.1	Very high	24 Å²	24	68.3 Å²	68.3	13%	0.128	35%	0.349	C	S	.	.	H	α-helix	trans	-53.1	-53.8	172.6	-63.1	-24.2	0	0	0	108.9	T577 N605 F611 F612 D613	T577-D609 PolarHBondContact N-OD1 3.3Å; T577-D609 PolarHBondContact OG1-OD1 3.03Å; T577-D609 VanDerWaalsContact OG1-OD1 3.12Å; N605-D609 PolarHBondContact ND2-OD1 3.35Å; N605-D609 PolarHBondContact ND2-OD2 3.25Å; N605-D609 PolarHBondContact O-N 3.47Å; D609-F611 PolarHBondContact O-N 3.15Å; D609-F612 PolarHBondContact O-N 2.93Å; D609-D613 VanDerWaalsContact O-CG 3.32Å; D609-D613 PolarHBondContact O-N 3.06Å
610	K	94.2	Very high	94.3	Very high	101 Å²	101	69.4 Å²	69.4	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-14.7	175.8	-69.6	174.4	-172.8	172	0	114.9	E606 M608 R614	E606-K610 HydrophobicContact CG-CD 4.36Å; E606-K610 WeakPolarHBondContact O-CB 3.35Å; E606-K610 VanDerWaalsContact O-CG 3.24Å; E606-K610 WeakPolarHBondContact O-CG 3.45Å; E606-K610 PolarHBondContact O-N 3Å; E606-K610 VanDerWaalsContact O-N 3.12Å; E606-K610 VanDerWaalsContact OE1-CE 3.3Å; E606-K610 WeakPolarHBondContact OE1-CE 3.49Å; E606-K610 IonicContact OE1-NZ 3.68Å; E606-K610 PolarHBondContact OE1-NZ 2.93Å; M608-K610 VanDerWaalsContact C-N 3.33Å; M608-K610 PolarHBondContact O-N 3.4Å; K610-R614 VanDerWaalsContact O-CZ 3.3Å; K610-R614 PolarHBondContact O-NE 3.37Å; K610-R614 PolarHBondContact O-NH2 3.26Å
611	F	94.6	Very high	94.4	Very high	81 Å²	81	70.5 Å²	70.5	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-84.5	-46.1	174.5	170.9	-99.4	0	0	0	109.7	I607 M608 D609 D613 R614 V615	I607-F611 WeakPolarHBondContact O-CB 3.49Å; I607-F611 PolarHBondContact O-N 2.79Å; M608-F611 WeakPolarHBondContact O-CA 3.4Å; M608-F611 WeakPolarHBondContact O-CB 3.48Å; M608-F611 PolarHBondContact O-N 2.87Å; D609-F611 PolarHBondContact O-N 3.15Å; F611-D613 PolarHBondContact O-N 3.02Å; F611-R614 PolarHBondContact O-N 3.03Å; F611-V615 HydrophobicContact CD1-CG2 4.34Å; F611-V615 HydrophobicContact CD2-CG2 4.18Å; F611-V615 HydrophobicContact CE1-CG2 3.97Å; F611-V615 HydrophobicContact CE2-CG2 3.79Å; F611-V615 HydrophobicContact CG-CG2 4.45Å; F611-V615 HydrophobicContact CZ-CG2 3.68Å; F611-V615 WeakPolarHBondContact O-CB 3.37Å; F611-V615 WeakPolarHBondContact O-CG2 3.13Å; F611-V615 PolarHBondContact O-N 3.32Å
612	F	94.8	Very high	94.6	Very high	78 Å²	78	69.9 Å²	69.9	34%	0.342	35%	0.354	S	S	.	.	H	α-helix	trans	-64.3	-38.4	175.7	-68.9	-60.8	0	0	0	112.6	L579 M608 D609 R614 V615 A616	L579-F612 HydrophobicContact CD1-CE2 3.81Å; L579-F612 HydrophobicContact CD1-CZ 4.02Å; L579-F612 HydrophobicContact CG-CE2 4.12Å; M608-F612 HydrophobicContact CB-CE2 4.34Å; M608-F612 WeakPolarHBondContact O-CD2 3.29Å; M608-F612 PolarHBondContact O-N 3.39Å; D609-F612 PolarHBondContact O-N 2.93Å; F612-R614 PolarHBondContact O-N 3.1Å; F612-V615 PolarHBondContact O-N 3.25Å; F612-A616 VanDerWaalsContact O-CB 3.3Å; F612-A616 WeakPolarHBondContact O-CB 3.43Å; F612-A616 PolarHBondContact O-N 3.21Å
613	D	94.8	Very high	94.8	Very high	102 Å²	102	66.3 Å²	66.3	55%	0.545	33%	0.331	S	S	.	.	H	α-helix	trans	-56.3	-50.3	174.5	-69.2	-23	0	0	0	111.4	D609 F611 A616 E617	D609-D613 VanDerWaalsContact O-CG 3.32Å; D609-D613 PolarHBondContact O-N 3.06Å; F611-D613 PolarHBondContact O-N 3.02Å; D613-A616 PolarHBondContact O-N 3.12Å; D613-E617 PolarHBondContact O-N 2.93Å
614	R	95	Very high	95	Very high	141 Å²	141	65.1 Å²	65.1	53%	0.532	33%	0.33	S	S	.	.	H	α-helix	trans	-69.3	-37.7	179	-80.6	176	-70.1	152.2	3.8	113.5	K610 F611 F612 A616 E617 D618	K610-R614 VanDerWaalsContact O-CZ 3.3Å; K610-R614 PolarHBondContact O-NE 3.37Å; K610-R614 PolarHBondContact O-NH2 3.26Å; F611-R614 PolarHBondContact O-N 3.03Å; F612-R614 PolarHBondContact O-N 3.1Å; R614-A616 VanDerWaalsContact C-N 3.32Å; R614-E617 PolarHBondContact O-N 3.41Å; R614-D618 WeakPolarHBondContact O-CB 3.34Å; R614-D618 PolarHBondContact O-N 2.87Å
615	V	95.5	Very high	95.1	Very high	24 Å²	24	72.7 Å²	72.7	15%	0.145	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-35.4	176.1	165.8	0	0	0	0	111.1	F611 F612 L619 L639	F611-V615 HydrophobicContact CD1-CG2 4.34Å; F611-V615 HydrophobicContact CD2-CG2 4.18Å; F611-V615 HydrophobicContact CE1-CG2 3.97Å; F611-V615 HydrophobicContact CE2-CG2 3.79Å; F611-V615 HydrophobicContact CG-CG2 4.45Å; F611-V615 HydrophobicContact CZ-CG2 3.68Å; F611-V615 WeakPolarHBondContact O-CB 3.37Å; F611-V615 WeakPolarHBondContact O-CG2 3.13Å; F611-V615 PolarHBondContact O-N 3.32Å; F612-V615 PolarHBondContact O-N 3.25Å; V615-L619 HydrophobicContact CG1-CD1 3.78Å; V615-L619 HydrophobicContact CG1-CG 4.42Å; V615-L619 WeakPolarHBondContact O-CB 3.46Å; V615-L619 WeakPolarHBondContact O-CD1 3.42Å; V615-L619 WeakPolarHBondContact O-CG 3.34Å; V615-L619 PolarHBondContact O-N 2.95Å; V615-L639 HydrophobicContact CG1-CD2 3.84Å; V615-L639 HydrophobicContact CG2-CD2 4.3Å
616	A	95.3	Very high	95.3	Very high	55 Å²	55	74.3 Å²	74.3	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-66.1	-45.4	172.7	0	0	0	0	0	111.3	F612 D613 R614 L619 E620	F612-A616 VanDerWaalsContact O-CB 3.3Å; F612-A616 WeakPolarHBondContact O-CB 3.43Å; F612-A616 PolarHBondContact O-N 3.21Å; D613-A616 PolarHBondContact O-N 3.12Å; R614-A616 VanDerWaalsContact C-N 3.32Å; A616-L619 PolarHBondContact O-N 3.42Å; A616-E620 WeakPolarHBondContact O-CB 3.12Å; A616-E620 PolarHBondContact O-N 2.97Å
617	E	96.3	Very high	95.4	Very high	130 Å²	130	76.9 Å²	76.9	61%	0.607	40%	0.397	S	S	*	.	H	α-helix	trans	-60.3	-51	176	-172.6	173.6	-155.6	0	0	112	D613 R614 L619 E620 T621	D613-E617 PolarHBondContact O-N 2.93Å; R614-E617 PolarHBondContact O-N 3.41Å; E617-L619 PolarHBondContact O-N 3.32Å; E617-E620 PolarHBondContact O-N 3.12Å; E617-T621 WeakPolarHBondContact O-CG2 3.34Å; E617-T621 PolarHBondContact O-N 2.99Å
618	D	96.4	Very high	95.5	Very high	46 Å²	46	75.3 Å²	75.3	25%	0.246	39%	0.385	C	S	.	.	H	α-helix	trans	-55.2	-49.4	174.7	-90.4	-45.5	0	0	0	111.3	R614 E620 T621 Y622 L639 R642	R614-D618 WeakPolarHBondContact O-CB 3.34Å; R614-D618 PolarHBondContact O-N 2.87Å; D618-E620 PolarHBondContact O-N 2.81Å; D618-T621 PolarHBondContact O-N 3.43Å; D618-T621 PolarHBondContact O-OG1 2.94Å; D618-Y622 HydrophobicContact CB-CE2 3.99Å; D618-Y622 WeakPolarHBondContact O-CD2 3.2Å; D618-Y622 WeakPolarHBondContact O-CE2 3.48Å; D618-Y622 PolarHBondContact O-N 3.13Å; D618-Y622 PolarHBondContact OD1-OH 3.18Å; D618-L639 HydrophobicContact CB-CD1 3.78Å; D618-R642 IonicContact OD1-NH1 2.6Å; D618-R642 PolarHBondContact OD1-NH1 2.75Å
619	L	96.6	Very high	95.5	Very high	21 Å²	21	83.2 Å²	83.2	11%	0.11	42%	0.418	C	S	.	.	H	α-helix	trans	-68.1	-34.2	-178.4	-68.9	170.7	0	0	0	113.2	V615 A616 E617 Y622 A623 I631 D635 V636 L639	V615-L619 HydrophobicContact CG1-CD1 3.78Å; V615-L619 HydrophobicContact CG1-CG 4.42Å; V615-L619 WeakPolarHBondContact O-CB 3.46Å; V615-L619 WeakPolarHBondContact O-CD1 3.42Å; V615-L619 WeakPolarHBondContact O-CG 3.34Å; V615-L619 PolarHBondContact O-N 2.95Å; A616-L619 PolarHBondContact O-N 3.42Å; E617-L619 PolarHBondContact O-N 3.32Å; L619-Y622 HydrophobicContact CD2-CD2 4.11Å; L619-Y622 HydrophobicContact CD2-CE2 4.32Å; L619-A623 WeakPolarHBondContact O-CB 3.3Å; L619-A623 PolarHBondContact O-N 3.42Å; L619-A623 VanDerWaalsContact O-N 3.1Å; L619-I631 HydrophobicContact CB-CD1 3.83Å; L619-I631 HydrophobicContact CB-CG1 4.18Å; L619-I631 HydrophobicContact CB-CG2 4.28Å; L619-I631 HydrophobicContact CD1-CD1 4.44Å; L619-I631 HydrophobicContact CD1-CG2 4.4Å; L619-I631 HydrophobicContact CD2-CG2 4.08Å; L619-I631 HydrophobicContact CG-CG2 4.49Å; L619-D635 HydrophobicContact CD2-CB 4.08Å; L619-V636 HydrophobicContact CD2-CG2 3.9Å; L619-L639 HydrophobicContact CD1-CD2 4.41Å; L619-L639 HydrophobicContact CD2-CB 4.3Å; L619-L639 HydrophobicContact CD2-CD2 4.07Å; L619-L639 HydrophobicContact CG-CD2 4.12Å
620	E	96.3	Very high	95.7	Very high	143 Å²	143	87 Å²	87	67%	0.668	44%	0.442	S	S	*	.	H	α-helix	trans	-64.1	-43.5	170.9	-177.9	167.2	-163.6	0	0	110.5	A616 E617 D618 Y622 A623 A624	A616-E620 WeakPolarHBondContact O-CB 3.12Å; A616-E620 PolarHBondContact O-N 2.97Å; E617-E620 PolarHBondContact O-N 3.12Å; D618-E620 PolarHBondContact O-N 2.81Å; E620-Y622 PolarHBondContact O-N 2.95Å; E620-A623 PolarHBondContact O-N 2.78Å; E620-A624 VanDerWaalsContact O-CB 3.28Å; E620-A624 WeakPolarHBondContact O-CB 3.31Å; E620-A624 PolarHBondContact O-N 3.12Å
621	T	96.7	Very high	95.8	Very high	71 Å²	71	86.3 Å²	86.3	44%	0.436	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-43.1	176.8	65	0	0	0	0	112.7	E617 D618 A624 H625	E617-T621 WeakPolarHBondContact O-CG2 3.34Å; E617-T621 PolarHBondContact O-N 2.99Å; D618-T621 PolarHBondContact O-N 3.43Å; D618-T621 PolarHBondContact O-OG1 2.94Å; T621-A624 PolarHBondContact O-N 3.24Å; T621-H625 WeakPolarHBondContact O-CB 3.44Å; T621-H625 PolarHBondContact O-N 3.16Å
622	Y	96.4	Very high	95.8	Very high	21 Å²	21	86.7 Å²	86.7	8%	0.082	44%	0.444	C	S	.	.	H	α-helix	trans	-65.6	-42.2	177.4	-49.4	-46	0	0	0	112.3	D618 L619 E620 A624 H625 A626 D635 L638 L639 R642	D618-Y622 HydrophobicContact CB-CE2 3.99Å; D618-Y622 WeakPolarHBondContact O-CD2 3.2Å; D618-Y622 WeakPolarHBondContact O-CE2 3.48Å; D618-Y622 PolarHBondContact O-N 3.13Å; D618-Y622 PolarHBondContact OD1-OH 3.18Å; L619-Y622 HydrophobicContact CD2-CD2 4.11Å; L619-Y622 HydrophobicContact CD2-CE2 4.32Å; E620-Y622 PolarHBondContact O-N 2.95Å; Y622-A624 VanDerWaalsContact C-N 3.35Å; Y622-A624 PolarHBondContact O-N 2.88Å; Y622-H625 PolarHBondContact O-N 3.21Å; Y622-A626 PolarHBondContact O-N 3.16Å; Y622-D635 HydrophobicContact CD2-CB 4.18Å; Y622-L638 HydrophobicContact CD1-CD2 3.72Å; Y622-L638 HydrophobicContact CD1-CG 4.41Å; Y622-L638 HydrophobicContact CE1-CD2 4.08Å; Y622-L638 HydrophobicContact CE1-CG 4.34Å; Y622-L638 HydrophobicContact CG-CD2 4.01Å; Y622-L639 HydrophobicContact CE2-CB 3.86Å; Y622-L639 HydrophobicContact CE2-CD1 4.02Å; Y622-L639 HydrophobicContact CE2-CG 4.5Å; Y622-L639 WeakPolarHBondContact OH-CD1 3.18Å; Y622-R642 WeakPolarHBondContact OH-CD 3.34Å; Y622-R642 PolarHBondContact OH-NH1 2.96Å
623	A	96.9	Very high	95.7	Very high	4 Å²	4	87.8 Å²	87.8	3%	0.033	46%	0.457	C	S	.	.	H	α-helix	trans	-60.4	-47.3	176.6	0	0	0	0	0	110.3	L619 E620 H625 A626 N627 R628 I631	L619-A623 WeakPolarHBondContact O-CB 3.3Å; L619-A623 PolarHBondContact O-N 3.42Å; L619-A623 VanDerWaalsContact O-N 3.1Å; E620-A623 PolarHBondContact O-N 2.78Å; A623-H625 PolarHBondContact O-N 3.37Å; A623-A626 CarbonylContact O-C 3.56Å; A623-A626 PolarHBondContact O-N 3.44Å; A623-N627 PolarHBondContact O-N 2.96Å; A623-R628 CarbonylContact C-O 3.6Å; A623-R628 WeakPolarHBondContact O-CA 3.43Å; A623-R628 PolarHBondContact O-N 2.75Å; A623-R628 VanDerWaalsContact O-O 3.05Å; A623-I631 HydrophobicContact CB-CG1 4.49Å
624	A	96.4	Very high	95.6	Very high	60 Å²	60	88.2 Å²	88.2	50%	0.496	46%	0.455	S	S	.	.	H	α-helix	trans	-61.6	-40.6	175.5	0	0	0	0	0	112.8	E620 T621 Y622 A626 N627	E620-A624 VanDerWaalsContact O-CB 3.28Å; E620-A624 WeakPolarHBondContact O-CB 3.31Å; E620-A624 PolarHBondContact O-N 3.12Å; T621-A624 PolarHBondContact O-N 3.24Å; Y622-A624 VanDerWaalsContact C-N 3.35Å; Y622-A624 PolarHBondContact O-N 2.88Å; A624-A626 PolarHBondContact O-N 2.88Å; A624-N627 WeakPolarHBondContact O-CA 3.24Å; A624-N627 PolarHBondContact O-N 2.78Å
625	H	96.3	Very high	95.6	Very high	170 Å²	170	81.8 Å²	81.8	79%	0.787	43%	0.431	S	S	*	.	H	α-helix	trans	-63.6	-29	177.3	-140.3	-62.7	0	0	0	112.6	T621 Y622 A623 N627	T621-H625 WeakPolarHBondContact O-CB 3.44Å; T621-H625 PolarHBondContact O-N 3.16Å; Y622-H625 PolarHBondContact O-N 3.21Å; A623-H625 PolarHBondContact O-N 3.37Å; H625-N627 VanDerWaalsContact C-N 3.33Å
626	A	95.1	Very high	95.6	Very high	45 Å²	45	83.3 Å²	83.3	37%	0.372	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	11.9	171.7	0	0	0	0	0	113.5	Y622 A623 A624 R628	Y622-A626 PolarHBondContact O-N 3.16Å; A623-A626 CarbonylContact O-C 3.56Å; A623-A626 PolarHBondContact O-N 3.44Å; A624-A626 PolarHBondContact O-N 2.88Å; A626-R628 VanDerWaalsContact CB-NH2 3.3Å; A626-R628 PolarHBondContact O-N 2.86Å
627	N	95.3	Very high	95.5	Very high	157 Å²	157	84.5 Å²	84.5	84%	0.84	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	25.6	-175.5	-63.6	-78	0	0	0	114.7	A623 A624 H625	A623-N627 PolarHBondContact O-N 2.96Å; A624-N627 WeakPolarHBondContact O-CA 3.24Å; A624-N627 PolarHBondContact O-N 2.78Å; H625-N627 VanDerWaalsContact C-N 3.33Å
628	R	95.8	Very high	95.4	Very high	57 Å²	57	82 Å²	82	22%	0.215	43%	0.426	C	S	.	.			trans	-103.5	147.4	179.6	-72	-177.1	-79.1	104.5	-6.5	111.5	A623 A626 T630 D635	A623-R628 CarbonylContact C-O 3.6Å; A623-R628 WeakPolarHBondContact O-CA 3.43Å; A623-R628 PolarHBondContact O-N 2.75Å; A623-R628 VanDerWaalsContact O-O 3.05Å; A626-R628 VanDerWaalsContact CB-NH2 3.3Å; A626-R628 PolarHBondContact O-N 2.86Å; R628-T630 PolarHBondContact NH1-O 2.91Å; R628-D635 IonicContact CZ-OD1 3.36Å; R628-D635 IonicContact CZ-OD2 2.72Å; R628-D635 IonicContact NH1-OD1 2.97Å; R628-D635 PolarHBondContact NH1-OD1 2.97Å; R628-D635 IonicContact NH1-OD2 2.7Å; R628-D635 PolarHBondContact NH1-OD2 3.31Å; R628-D635 IonicContact NH2-OD1 3.49Å; R628-D635 PolarHBondContact NH2-OD1 2.6Å; R628-D635 IonicContact NH2-OD2 3.62Å
629	K	95.4	Very high	95.3	Very high	217 Å²	217	80.3 Å²	80.3	94%	0.943	42%	0.417	S	S	*	.	S	Bend	trans	-99.6	8.7	169	-61.4	-178.1	-179	178.8	0	113
630	T	95.7	Very high	95.2	Very high	103 Å²	103	81.3 Å²	81.3	63%	0.632	42%	0.422	S	S	*	.	S	Bend	trans	-132.1	123.4	-174.5	-50.4	0	0	0	0	108.8	R628	R628-T630 PolarHBondContact NH1-O 2.91Å
631	I	96.5	Very high	95.1	Very high	87 Å²	87	81.3 Å²	81.3	45%	0.446	42%	0.416	S	S	.	.			trans	-69.4	128.1	174.6	-58.3	164.8	0	0	0	108.4	L619 A623 D635 V636	L619-I631 HydrophobicContact CB-CD1 3.83Å; L619-I631 HydrophobicContact CB-CG1 4.18Å; L619-I631 HydrophobicContact CB-CG2 4.28Å; L619-I631 HydrophobicContact CD1-CD1 4.44Å; L619-I631 HydrophobicContact CD1-CG2 4.4Å; L619-I631 HydrophobicContact CD2-CG2 4.08Å; L619-I631 HydrophobicContact CG-CG2 4.49Å; A623-I631 HydrophobicContact CB-CG1 4.49Å; I631-D635 WeakPolarHBondContact CA-OD2 3.5Å; I631-D635 HydrophobicContact CG2-CB 4.18Å; I631-V636 HydrophobicContact CG2-CG2 4.27Å
632	K	94.9	Very high	95	Very high	89 Å²	89	85.6 Å²	85.6	39%	0.387	42%	0.424	S	S	.	.			trans	-103.1	166.8	175.8	-80.6	-170.3	172.8	-170.3	0	111.3	E634 D635 V636	K632-E634 HydrophobicContact CB-CB 4.15Å; K632-E634 HydrophobicContact CD-CB 4.47Å; K632-E634 HydrophobicContact CD-CG 4.36Å; K632-E634 VanDerWaalsContact CD-OE1 3.29Å; K632-E634 WeakPolarHBondContact CD-OE1 3.29Å; K632-E634 WeakPolarHBondContact CD-OE2 3.37Å; K632-E634 IonicContact NZ-OE1 3.6Å; K632-E634 PolarHBondContact NZ-OE1 3.25Å; K632-E634 IonicContact NZ-OE2 3.41Å; K632-E634 PolarHBondContact NZ-OE2 3.38Å; K632-E634 PolarHBondContact O-N 2.82Å; K632-D635 PolarHBondContact N-OD2 3.33Å; K632-D635 PolarHBondContact O-N 3.01Å; K632-D635 VanDerWaalsContact O-N 3.16Å; K632-V636 PolarHBondContact O-N 2.91Å
633	V	92.7	Very high	94.9	Very high	101 Å²	101	87.8 Å²	87.8	61%	0.612	44%	0.435	S	S	*	.	H	α-helix	trans	-57.5	-35.5	167.5	-175.6	0	0	0	0	111.6	D635 V636 K637	V633-D635 VanDerWaalsContact C-N 3.34Å; V633-D635 PolarHBondContact O-N 3.43Å; V633-V636 PolarHBondContact O-N 2.74Å; V633-K637 HydrophobicContact CG1-CG 4.36Å; V633-K637 WeakPolarHBondContact O-CG 3.23Å; V633-K637 PolarHBondContact O-N 3.3Å
634	E	92.7	Very high	94.6	Very high	110 Å²	110	89.6 Å²	89.6	51%	0.514	45%	0.454	S	S	.	.	H	α-helix	trans	-51	-48.8	172.6	-71.1	151.7	-138.1	0	0	112.2	K632 V636 K637 L638	K632-E634 HydrophobicContact CB-CB 4.15Å; K632-E634 HydrophobicContact CD-CB 4.47Å; K632-E634 HydrophobicContact CD-CG 4.36Å; K632-E634 VanDerWaalsContact CD-OE1 3.29Å; K632-E634 WeakPolarHBondContact CD-OE1 3.29Å; K632-E634 WeakPolarHBondContact CD-OE2 3.37Å; K632-E634 IonicContact NZ-OE1 3.6Å; K632-E634 PolarHBondContact NZ-OE1 3.25Å; K632-E634 IonicContact NZ-OE2 3.41Å; K632-E634 PolarHBondContact NZ-OE2 3.38Å; K632-E634 PolarHBondContact O-N 2.82Å; E634-V636 VanDerWaalsContact C-N 3.31Å; E634-V636 PolarHBondContact O-N 2.73Å; E634-K637 PolarHBondContact O-N 3.4Å; E634-L638 PolarHBondContact O-N 3.5Å
635	D	95.3	Very high	94.4	Very high	6 Å²	6	93.4 Å²	93.4	3%	0.032	46%	0.457	C	S	.	.	H	α-helix	trans	-66.4	-34.8	-177.6	-50.4	-34.6	0	0	0	111.5	L619 Y622 R628 I631 K632 V633 L638 L639	L619-D635 HydrophobicContact CD2-CB 4.08Å; Y622-D635 HydrophobicContact CD2-CB 4.18Å; R628-D635 IonicContact CZ-OD1 3.36Å; R628-D635 IonicContact CZ-OD2 2.72Å; R628-D635 IonicContact NH1-OD1 2.97Å; R628-D635 PolarHBondContact NH1-OD1 2.97Å; R628-D635 IonicContact NH1-OD2 2.7Å; R628-D635 PolarHBondContact NH1-OD2 3.31Å; R628-D635 IonicContact NH2-OD1 3.49Å; R628-D635 PolarHBondContact NH2-OD1 2.6Å; R628-D635 IonicContact NH2-OD2 3.62Å; I631-D635 WeakPolarHBondContact CA-OD2 3.5Å; I631-D635 HydrophobicContact CG2-CB 4.18Å; K632-D635 PolarHBondContact N-OD2 3.33Å; K632-D635 PolarHBondContact O-N 3.01Å; K632-D635 VanDerWaalsContact O-N 3.16Å; V633-D635 VanDerWaalsContact C-N 3.34Å; V633-D635 PolarHBondContact O-N 3.43Å; D635-L638 PolarHBondContact O-N 3.33Å; D635-L639 WeakPolarHBondContact O-CB 3.45Å; D635-L639 PolarHBondContact O-N 3.38Å
636	V	94.1	Very high	94.2	Very high	56 Å²	56	85.7 Å²	85.7	34%	0.339	42%	0.421	S	S	.	.	H	α-helix	trans	-74.7	-37.5	176.3	-176.4	0	0	0	0	111.4	L619 I631 K632 V633 E634 L638 L639 L640	L619-V636 HydrophobicContact CD2-CG2 3.9Å; I631-V636 HydrophobicContact CG2-CG2 4.27Å; K632-V636 PolarHBondContact O-N 2.91Å; V633-V636 PolarHBondContact O-N 2.74Å; E634-V636 VanDerWaalsContact C-N 3.31Å; E634-V636 PolarHBondContact O-N 2.73Å; V636-L638 VanDerWaalsContact C-N 3.31Å; V636-L639 PolarHBondContact O-N 3.38Å; V636-L640 HydrophobicContact CG1-CD1 4.22Å; V636-L640 WeakPolarHBondContact O-CB 3.24Å; V636-L640 WeakPolarHBondContact O-CG 3.26Å; V636-L640 PolarHBondContact O-N 2.69Å
637	K	93.1	Very high	94.1	Very high	81 Å²	81	87.4 Å²	87.4	35%	0.352	42%	0.424	S	S	.	.	H	α-helix	trans	-63.6	-38.1	170.6	-67	-160.7	-169.9	-155.3	0	110.6	V633 E634 R641 I646 V652 E653	V633-K637 HydrophobicContact CG1-CG 4.36Å; V633-K637 WeakPolarHBondContact O-CG 3.23Å; V633-K637 PolarHBondContact O-N 3.3Å; E634-K637 PolarHBondContact O-N 3.4Å; K637-R641 WeakPolarHBondContact O-CG 3.27Å; K637-R641 PolarHBondContact O-N 3.08Å; K637-I646 HydrophobicContact CB-CD1 4.31Å; K637-I646 WeakPolarHBondContact O-CD1 3.1Å; K637-V652 HydrophobicContact CD-CG1 3.73Å; K637-V652 VanDerWaalsContact CE-CG1 3.47Å; K637-V652 HydrophobicContact CG-CG1 4.1Å; K637-E653 IonicContact NZ-OE1 2.69Å; K637-E653 PolarHBondContact NZ-OE1 2.72Å
638	L	94.4	Very high	93.7	Very high	78 Å²	78	86.9 Å²	86.9	41%	0.408	42%	0.421	S	S	.	.	H	α-helix	trans	-65.8	-44.5	174.4	-179.9	59.8	0	0	0	112.3	Y622 E634 D635 V636 L640 R641 R642	Y622-L638 HydrophobicContact CD1-CD2 3.72Å; Y622-L638 HydrophobicContact CD1-CG 4.41Å; Y622-L638 HydrophobicContact CE1-CD2 4.08Å; Y622-L638 HydrophobicContact CE1-CG 4.34Å; Y622-L638 HydrophobicContact CG-CD2 4.01Å; E634-L638 PolarHBondContact O-N 3.5Å; D635-L638 PolarHBondContact O-N 3.33Å; V636-L638 VanDerWaalsContact C-N 3.31Å; L638-L640 PolarHBondContact O-N 3.23Å; L638-R641 PolarHBondContact O-N 2.79Å; L638-R642 HydrophobicContact CD1-CG 4.47Å; L638-R642 PolarHBondContact O-N 2.85Å
639	L	95.4	Very high	93.3	Very high	9 Å²	9	93.9 Å²	93.9	5%	0.047	45%	0.453	C	S	.	.	H	α-helix	trans	-55.6	-50.4	174.9	-178	61.7	0	0	0	111.7	V615 D618 L619 Y622 D635 V636 R641 R642 Q643	V615-L639 HydrophobicContact CG1-CD2 3.84Å; V615-L639 HydrophobicContact CG2-CD2 4.3Å; D618-L639 HydrophobicContact CB-CD1 3.78Å; L619-L639 HydrophobicContact CD1-CD2 4.41Å; L619-L639 HydrophobicContact CD2-CB 4.3Å; L619-L639 HydrophobicContact CD2-CD2 4.07Å; L619-L639 HydrophobicContact CG-CD2 4.12Å; Y622-L639 HydrophobicContact CE2-CB 3.86Å; Y622-L639 HydrophobicContact CE2-CD1 4.02Å; Y622-L639 HydrophobicContact CE2-CG 4.5Å; Y622-L639 WeakPolarHBondContact OH-CD1 3.18Å; D635-L639 WeakPolarHBondContact O-CB 3.45Å; D635-L639 PolarHBondContact O-N 3.38Å; V636-L639 PolarHBondContact O-N 3.38Å; L639-R641 VanDerWaalsContact C-N 3.3Å; L639-R641 PolarHBondContact O-N 3.44Å; L639-R642 PolarHBondContact O-N 3.22Å; L639-Q643 HydrophobicContact CD1-CG 4.43Å; L639-Q643 WeakPolarHBondContact O-CB 3.35Å; L639-Q643 WeakPolarHBondContact O-CG 3.3Å; L639-Q643 PolarHBondContact O-N 2.88Å
640	L	94.1	Very high	93.1	Very high	43 Å²	43	86 Å²	86	23%	0.225	42%	0.424	C	S	.	.	H	α-helix	trans	-70.3	-25.4	-177.9	-70.9	172.2	0	0	0	112.8	V636 L638 G644 Y645 I646 V652	V636-L640 HydrophobicContact CG1-CD1 4.22Å; V636-L640 WeakPolarHBondContact O-CB 3.24Å; V636-L640 WeakPolarHBondContact O-CG 3.26Å; V636-L640 PolarHBondContact O-N 2.69Å; L638-L640 PolarHBondContact O-N 3.23Å; L640-G644 PolarHBondContact O-N 3.46Å; L640-Y645 HydrophobicContact CD2-CD2 3.82Å; L640-Y645 HydrophobicContact CD2-CG 4.47Å; L640-Y645 PolarHBondContact O-N 3.11Å; L640-I646 HydrophobicContact CB-CD1 3.39Å; L640-I646 HydrophobicContact CB-CG1 3.81Å; L640-I646 HydrophobicContact CD1-CD1 4.2Å; L640-I646 HydrophobicContact CG-CD1 4.46Å; L640-I646 PolarHBondContact O-N 3.46Å; L640-V652 HydrophobicContact CD1-CG2 4.21Å
641	R	94.1	Very high	92.9	Very high	143 Å²	143	83.8 Å²	83.8	54%	0.54	41%	0.411	S	S	.	.	H	α-helix	trans	-68.2	-50	165.4	-81	-178.8	159.6	178	-10.7	111.6	K637 L638 L639 Q643 G644 I646 D648	K637-R641 WeakPolarHBondContact O-CG 3.27Å; K637-R641 PolarHBondContact O-N 3.08Å; L638-R641 PolarHBondContact O-N 2.79Å; L639-R641 VanDerWaalsContact C-N 3.3Å; L639-R641 PolarHBondContact O-N 3.44Å; R641-Q643 PolarHBondContact O-N 3.2Å; R641-G644 PolarHBondContact O-N 2.89Å; R641-I646 HydrophobicContact CG-CB 3.7Å; R641-I646 HydrophobicContact CG-CD1 4.45Å; R641-I646 HydrophobicContact CG-CG2 3.68Å; R641-D648 IonicContact NH2-OD1 2.89Å; R641-D648 PolarHBondContact NH2-OD1 3.01Å
642	R	94.4	Very high	92.6	Very high	160 Å²	160	80.2 Å²	80.2	60%	0.604	39%	0.393	S	S	*	.	H	α-helix	trans	-61.4	-27.4	176.7	-74.6	-175.4	71.2	-138.9	4.4	113.3	D618 Y622 L638 L639 G644	D618-R642 IonicContact OD1-NH1 2.6Å; D618-R642 PolarHBondContact OD1-NH1 2.75Å; Y622-R642 WeakPolarHBondContact OH-CD 3.34Å; Y622-R642 PolarHBondContact OH-NH1 2.96Å; L638-R642 HydrophobicContact CD1-CG 4.47Å; L638-R642 PolarHBondContact O-N 2.85Å; L639-R642 PolarHBondContact O-N 3.22Å; R642-G644 VanDerWaalsContact C-N 3.33Å
643	Q	93.8	Very high	92.4	Very high	68 Å²	68	79.5 Å²	79.5	32%	0.318	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.6	173.3	-68.7	177	1.1	0	0	114	L639 R641 Y645	L639-Q643 HydrophobicContact CD1-CG 4.43Å; L639-Q643 WeakPolarHBondContact O-CB 3.35Å; L639-Q643 WeakPolarHBondContact O-CG 3.3Å; L639-Q643 PolarHBondContact O-N 2.88Å; R641-Q643 PolarHBondContact O-N 3.2Å; Q643-Y645 VanDerWaalsContact C-N 3.28Å; Q643-Y645 HydrophobicContact CB-CD2 3.6Å; Q643-Y645 HydrophobicContact CB-CE2 3.82Å; Q643-Y645 PolarHBondContact O-N 3.11Å
644	G	92.2	Very high	92.3	Very high	42 Å²	42	78 Å²	78	43%	0.433	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	8.4	178.8	0	0	0	0	0	115.5	L640 R641 R642 N647	L640-G644 PolarHBondContact O-N 3.46Å; R641-G644 PolarHBondContact O-N 2.89Å; R642-G644 VanDerWaalsContact C-N 3.33Å; G644-N647 PolarHBondContact O-ND2 3.25Å
645	Y	91	Very high	92.3	Very high	139 Å²	139	74.1 Å²	74.1	55%	0.545	37%	0.365	S	S	.	.	S	Bend	trans	-78.4	-39.4	177.8	-67.6	-61.1	0	0	0	112.4	L640 Q643	L640-Y645 HydrophobicContact CD2-CD2 3.82Å; L640-Y645 HydrophobicContact CD2-CG 4.47Å; L640-Y645 PolarHBondContact O-N 3.11Å; Q643-Y645 VanDerWaalsContact C-N 3.28Å; Q643-Y645 HydrophobicContact CB-CD2 3.6Å; Q643-Y645 HydrophobicContact CB-CE2 3.82Å; Q643-Y645 PolarHBondContact O-N 3.11Å
646	I	92.8	Very high	92.1	Very high	9 Å²	9	74.9 Å²	74.9	5%	0.046	37%	0.368	C	S	.	.			trans	-96.6	126.6	171.2	-60.4	164	0	0	0	108.2	K637 L640 R641 V650 V652 L655	K637-I646 HydrophobicContact CB-CD1 4.31Å; K637-I646 WeakPolarHBondContact O-CD1 3.1Å; L640-I646 HydrophobicContact CB-CD1 3.39Å; L640-I646 HydrophobicContact CB-CG1 3.81Å; L640-I646 HydrophobicContact CD1-CD1 4.2Å; L640-I646 HydrophobicContact CG-CD1 4.46Å; L640-I646 PolarHBondContact O-N 3.46Å; R641-I646 HydrophobicContact CG-CB 3.7Å; R641-I646 HydrophobicContact CG-CD1 4.45Å; R641-I646 HydrophobicContact CG-CG2 3.68Å; I646-V650 WeakPolarHBondContact CA-O 3.38Å; I646-V652 HydrophobicContact CD1-CB 3.57Å; I646-V652 HydrophobicContact CD1-CG2 3.76Å; I646-V652 HydrophobicContact CG1-CB 3.86Å; I646-V652 HydrophobicContact CG1-CG2 4.2Å; I646-L655 HydrophobicContact CG1-CD1 3.72Å
647	N	91.9	Very high	91.9	Very high	80 Å²	80	77.9 Å²	77.9	43%	0.428	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-135.7	170.8	168.3	-59.2	-82.8	0	0	0	107.4	G644 K649 V650	G644-N647 PolarHBondContact O-ND2 3.25Å; N647-K649 PolarHBondContact O-N 3.21Å; N647-K649 VanDerWaalsContact O-N 3.13Å; N647-V650 PolarHBondContact N-O 3.04Å; N647-V650 CarbonylContact O-C 3.17Å; N647-V650 WeakPolarHBondContact O-CA 3.42Å; N647-V650 PolarHBondContact O-N 3.07Å
648	D	86.8	Confident	91.8	Very high	146 Å²	146	80.7 Å²	80.7	78%	0.781	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.2	-179.1	-46.8	-54.7	0	0	0	112.3	R641	R641-D648 IonicContact NH2-OD1 2.89Å; R641-D648 PolarHBondContact NH2-OD1 3.01Å
649	K	88.8	Confident	91.7	Very high	204 Å²	204	83.2 Å²	83.2	89%	0.887	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.9	168.6	-57.5	-165.8	178.3	-159.7	0	114.8	N647	N647-K649 PolarHBondContact O-N 3.21Å; N647-K649 VanDerWaalsContact O-N 3.13Å
650	V	90.7	Very high	91.6	Very high	53 Å²	53	85.3 Å²	85.3	32%	0.321	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-143.2	84.2	-176.3	-174.2	0	0	0	0	109.2	I646 N647 L655	I646-V650 WeakPolarHBondContact CA-O 3.38Å; N647-V650 PolarHBondContact N-O 3.04Å; N647-V650 CarbonylContact O-C 3.17Å; N647-V650 WeakPolarHBondContact O-CA 3.42Å; N647-V650 PolarHBondContact O-N 3.07Å; V650-L655 HydrophobicContact CG1-CD2 4.06Å; V650-L655 HydrophobicContact CG1-CG 4.36Å
651	P	90.9	Very high	91.5	Very high	55 Å²	55	91.9 Å²	91.9	36%	0.357	43%	0.429	S	S	.	.			trans	-68.6	159.3	178	29.1	-34.8	0	0	0	111.6	E653 V654	P651-E653 PolarHBondContact O-N 2.92Å; P651-V654 HydrophobicContact CG-CG2 3.94Å; P651-V654 PolarHBondContact O-N 2.83Å; P651-V654 VanDerWaalsContact O-N 3.15Å
652	V	90.2	Very high	91.2	Very high	13 Å²	13	89.6 Å²	89.6	8%	0.079	43%	0.426	C	S	.	.	H	α-helix	trans	-67.3	-25.4	-174.3	68.6	0	0	0	0	112.8	K637 L640 I646 V654 L655 I656	K637-V652 HydrophobicContact CD-CG1 3.73Å; K637-V652 VanDerWaalsContact CE-CG1 3.47Å; K637-V652 HydrophobicContact CG-CG1 4.1Å; L640-V652 HydrophobicContact CD1-CG2 4.21Å; I646-V652 HydrophobicContact CD1-CB 3.57Å; I646-V652 HydrophobicContact CD1-CG2 3.76Å; I646-V652 HydrophobicContact CG1-CB 3.86Å; I646-V652 HydrophobicContact CG1-CG2 4.2Å; V652-V654 VanDerWaalsContact C-N 3.27Å; V652-V654 PolarHBondContact O-N 3.37Å; V652-L655 HydrophobicContact CG2-CD1 4.5Å; V652-L655 WeakPolarHBondContact O-CB 3.42Å; V652-L655 PolarHBondContact O-N 2.97Å; V652-I656 HydrophobicContact CG2-CD1 4.25Å; V652-I656 WeakPolarHBondContact O-CG1 3.48Å; V652-I656 PolarHBondContact O-N 2.96Å
653	E	90.5	Very high	91	Very high	74 Å²	74	86.6 Å²	86.6	35%	0.346	42%	0.421	S	S	.	.	H	α-helix	trans	-61.1	-37.4	176.5	-66.6	66.5	-149.3	0	0	110.6	K637 P651 I656 E657 I669	K637-E653 IonicContact NZ-OE1 2.69Å; K637-E653 PolarHBondContact NZ-OE1 2.72Å; P651-E653 PolarHBondContact O-N 2.92Å; E653-I656 PolarHBondContact O-N 2.96Å; E653-E657 PolarHBondContact O-N 3.14Å; E653-I669 HydrophobicContact CB-CD1 4.04Å; E653-I669 HydrophobicContact CG-CD1 4.35Å; E653-I669 HydrophobicContact CG-CG1 4.45Å
654	V	91.2	Very high	90.8	Very high	70 Å²	70	87 Å²	87	42%	0.424	42%	0.423	S	S	.	.	H	α-helix	trans	-71	-33.5	173.1	172.4	0	0	0	0	111.9	P651 V652 E657 K658	P651-V654 HydrophobicContact CG-CG2 3.94Å; P651-V654 PolarHBondContact O-N 2.83Å; P651-V654 VanDerWaalsContact O-N 3.15Å; V652-V654 VanDerWaalsContact C-N 3.27Å; V652-V654 PolarHBondContact O-N 3.37Å; V654-E657 PolarHBondContact O-N 3.3Å; V654-K658 VanDerWaalsContact O-CB 3.23Å; V654-K658 WeakPolarHBondContact O-CB 3.39Å; V654-K658 PolarHBondContact O-N 3.29Å
655	L	91.9	Very high	90.7	Very high	28 Å²	28	87.6 Å²	87.6	15%	0.147	41%	0.413	C	S	.	.	H	α-helix	trans	-68.1	-40.4	173.2	-60.4	174.5	0	0	0	111.5	I646 V650 V652 K658 Y659	I646-L655 HydrophobicContact CG1-CD1 3.72Å; V650-L655 HydrophobicContact CG1-CD2 4.06Å; V650-L655 HydrophobicContact CG1-CG 4.36Å; V652-L655 HydrophobicContact CG2-CD1 4.5Å; V652-L655 WeakPolarHBondContact O-CB 3.42Å; V652-L655 PolarHBondContact O-N 2.97Å; L655-K658 PolarHBondContact O-N 3.3Å; L655-Y659 HydrophobicContact CB-CD2 4.5Å; L655-Y659 HydrophobicContact CD2-CD2 4.42Å; L655-Y659 HydrophobicContact CD2-CE2 3.97Å; L655-Y659 WeakPolarHBondContact O-CD2 3.41Å; L655-Y659 PolarHBondContact O-N 3.1Å
656	I	91.6	Very high	90.6	Very high	21 Å²	21	86.9 Å²	86.9	11%	0.108	41%	0.412	C	S	.	.	H	α-helix	trans	-61.1	-46	174.1	-73.2	160.7	0	0	0	110	V652 E653 L660 R665 L668 I669	V652-I656 HydrophobicContact CG2-CD1 4.25Å; V652-I656 WeakPolarHBondContact O-CG1 3.48Å; V652-I656 PolarHBondContact O-N 2.96Å; E653-I656 PolarHBondContact O-N 2.96Å; I656-L660 HydrophobicContact CB-CD1 4.41Å; I656-L660 HydrophobicContact CG1-CD1 4.16Å; I656-L660 HydrophobicContact CG2-CD1 4.22Å; I656-L660 WeakPolarHBondContact O-CB 3.23Å; I656-L660 PolarHBondContact O-N 3.32Å; I656-L660 VanDerWaalsContact O-N 3.13Å; I656-R665 HydrophobicContact CG2-CB 4.27Å; I656-R665 HydrophobicContact CG2-CG 3.96Å; I656-L668 HydrophobicContact CD1-CB 4.07Å; I656-L668 HydrophobicContact CD1-CD1 4.31Å; I656-L668 HydrophobicContact CG1-CD1 4.2Å; I656-L668 HydrophobicContact CG2-CB 4.38Å; I656-I669 HydrophobicContact CB-CD1 4.18Å; I656-I669 HydrophobicContact CD1-CG1 4.45Å; I656-I669 HydrophobicContact CG2-CD1 3.68Å; I656-I669 HydrophobicContact CG2-CG1 4.02Å
657	E	90.9	Very high	90.4	Very high	120 Å²	120	92.8 Å²	92.8	56%	0.561	44%	0.443	S	S	*	.	H	α-helix	trans	-66.8	-35.9	176.6	-162.9	179.9	-173.6	0	0	112.8	E653 V654 R665	E653-E657 PolarHBondContact O-N 3.14Å; V654-E657 PolarHBondContact O-N 3.3Å; E657-R665 VanDerWaalsContact CG-NH1 3.3Å; E657-R665 PolarHBondContact O-NE 3.29Å; E657-R665 PolarHBondContact O-NH1 3.04Å; E657-R665 PolarHBondContact O-NH2 3.02Å
658	K	91.3	Very high	90	Very high	140 Å²	140	93.4 Å²	93.4	61%	0.609	45%	0.445	S	S	*	.	H	α-helix	trans	-76.1	-37.5	-178.1	-170.1	173.5	178.2	-171.1	0	114	V654 L655	V654-K658 VanDerWaalsContact O-CB 3.23Å; V654-K658 WeakPolarHBondContact O-CB 3.39Å; V654-K658 PolarHBondContact O-N 3.29Å; L655-K658 PolarHBondContact O-N 3.3Å
659	Y	91.9	Very high	89.8	Confident	130 Å²	130	88.7 Å²	88.7	51%	0.51	42%	0.419	S	S	.	.	H	α-helix	trans	-117.2	-11.4	-166.3	-58.7	-61.4	0	0	0	115.8	F591 L655	F591-Y659 HydrophobicContact CE1-CD1 4.32Å; F591-Y659 HydrophobicContact CE1-CE1 4.15Å; F591-Y659 HydrophobicContact CZ-CD1 4.23Å; F591-Y659 HydrophobicContact CZ-CE1 4.47Å; L655-Y659 HydrophobicContact CB-CD2 4.5Å; L655-Y659 HydrophobicContact CD2-CD2 4.42Å; L655-Y659 HydrophobicContact CD2-CE2 3.97Å; L655-Y659 WeakPolarHBondContact O-CD2 3.41Å; L655-Y659 PolarHBondContact O-N 3.1Å
660	L	92.6	Very high	89.1	Confident	54 Å²	54	84.2 Å²	84.2	28%	0.283	41%	0.411	S	S	.	.	S	Bend	trans	-106.4	154	178.4	-57.4	-179.5	0	0	0	112.2	I656 Q664 R665 L668	I656-L660 HydrophobicContact CB-CD1 4.41Å; I656-L660 HydrophobicContact CG1-CD1 4.16Å; I656-L660 HydrophobicContact CG2-CD1 4.22Å; I656-L660 WeakPolarHBondContact O-CB 3.23Å; I656-L660 PolarHBondContact O-N 3.32Å; I656-L660 VanDerWaalsContact O-N 3.13Å; L660-Q664 HydrophobicContact CB-CB 4.03Å; L660-Q664 HydrophobicContact CD1-CB 4.48Å; L660-R665 HydrophobicContact CB-CG 4.45Å; L660-R665 PolarHBondContact O-NE 2.9Å; L660-R665 PolarHBondContact O-NH2 3.32Å; L660-L668 HydrophobicContact CD1-CD1 3.44Å; L660-L668 VanDerWaalsContact CD1-CD1 3.44Å
661	R	92.3	Very high	88	Confident	181 Å²	181	86.9 Å²	86.9	68%	0.683	42%	0.423	S	S	*	.			trans	-75	155.7	175.6	-65.3	-174.2	-68.1	161.6	-1.5	110.8	D663 Q664 R665	R661-D663 PolarHBondContact O-N 3.47Å; R661-D663 VanDerWaalsContact O-N 3.08Å; R661-Q664 WeakPolarHBondContact O-CA 3.17Å; R661-Q664 WeakPolarHBondContact O-CB 3.29Å; R661-Q664 PolarHBondContact O-N 3Å; R661-R665 PolarHBondContact O-N 3.05Å
662	M	88.2	Confident	85.9	Confident	95 Å²	95	88.4 Å²	88.4	47%	0.468	44%	0.44	S	S	.	.	H	α-helix	trans	-50.9	-39.6	-174.6	-71.8	-56.5	-63	0	0	113.8	Q664 R665 K666	M662-Q664 VanDerWaalsContact C-N 3.29Å; M662-Q664 PolarHBondContact O-N 2.92Å; M662-R665 WeakPolarHBondContact O-CB 3.45Å; M662-R665 PolarHBondContact O-N 3.14Å; M662-R665 PolarHBondContact SD-NH1 3.17Å; M662-K666 VanDerWaalsContact O-CG 3.32Å; M662-K666 WeakPolarHBondContact O-CG 3.38Å; M662-K666 PolarHBondContact O-N 3.1Å
663	D	89.8	Confident	84.1	Confident	96 Å²	96	94.3 Å²	94.3	51%	0.513	48%	0.476	S	S	.	.	H	α-helix	trans	-71	-25.4	-178.6	-48	-62.3	0	0	0	113.4	R661 K666 I667	R661-D663 PolarHBondContact O-N 3.47Å; R661-D663 VanDerWaalsContact O-N 3.08Å; D663-K666 IonicContact OD1-NZ 3.86Å; D663-K666 PolarHBondContact OD1-NZ 2.92Å; D663-I667 WeakPolarHBondContact O-CD1 3.42Å; D663-I667 WeakPolarHBondContact O-CG1 3.47Å
664	Q	89.6	Confident	81.8	Confident	78 Å²	78	95.6 Å²	95.6	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-78.3	-37.5	170.8	-61.8	168.2	-59	0	0	110.7	L660 R661 M662 I667 L668	L660-Q664 HydrophobicContact CB-CB 4.03Å; L660-Q664 HydrophobicContact CD1-CB 4.48Å; R661-Q664 WeakPolarHBondContact O-CA 3.17Å; R661-Q664 WeakPolarHBondContact O-CB 3.29Å; R661-Q664 PolarHBondContact O-N 3Å; M662-Q664 VanDerWaalsContact C-N 3.29Å; M662-Q664 PolarHBondContact O-N 2.92Å; Q664-I667 PolarHBondContact O-N 2.75Å; Q664-L668 PolarHBondContact O-N 3.01Å
665	R	90.6	Very high	79.9	Confident	54 Å²	54	95.3 Å²	95.3	20%	0.204	51%	0.505	C	S	.	.	H	α-helix	trans	-60.1	-46.4	174.7	-59.2	178.8	-157.5	-178.6	5.6	111.3	I656 E657 L660 R661 M662 I667 L668 I669	I656-R665 HydrophobicContact CG2-CB 4.27Å; I656-R665 HydrophobicContact CG2-CG 3.96Å; E657-R665 VanDerWaalsContact CG-NH1 3.3Å; E657-R665 PolarHBondContact O-NE 3.29Å; E657-R665 PolarHBondContact O-NH1 3.04Å; E657-R665 PolarHBondContact O-NH2 3.02Å; L660-R665 HydrophobicContact CB-CG 4.45Å; L660-R665 PolarHBondContact O-NE 2.9Å; L660-R665 PolarHBondContact O-NH2 3.32Å; R661-R665 PolarHBondContact O-N 3.05Å; M662-R665 WeakPolarHBondContact O-CB 3.45Å; M662-R665 PolarHBondContact O-N 3.14Å; M662-R665 PolarHBondContact SD-NH1 3.17Å; R665-I667 PolarHBondContact O-N 3.37Å; R665-L668 PolarHBondContact O-N 3.45Å; R665-L668 VanDerWaalsContact O-N 3.12Å; R665-I669 WeakPolarHBondContact O-CA 3.48Å; R665-I669 PolarHBondContact O-N 3.25Å
666	K	87.9	Confident	78	Confident	123 Å²	123	100.7 Å²	100.7	54%	0.535	53%	0.534	S	S	.	.	H	α-helix	trans	-54.5	-25.9	177.7	-68.6	167.6	-161	166.1	0	114.1	M662 D663	M662-K666 VanDerWaalsContact O-CG 3.32Å; M662-K666 WeakPolarHBondContact O-CG 3.38Å; M662-K666 PolarHBondContact O-N 3.1Å; D663-K666 IonicContact OD1-NZ 3.86Å; D663-K666 PolarHBondContact OD1-NZ 2.92Å
667	I	88.3	Confident	76.4	Confident	134 Å²	134	105.3 Å²	105.3	69%	0.687	56%	0.562	S	S	*	*	H	α-helix	trans	-88.2	-38.5	-179.6	-61.6	166.4	0	0	0	111.2	D663 Q664 R665	D663-I667 WeakPolarHBondContact O-CD1 3.42Å; D663-I667 WeakPolarHBondContact O-CG1 3.47Å; Q664-I667 PolarHBondContact O-N 2.75Å; R665-I667 PolarHBondContact O-N 3.37Å
668	L	85.2	Confident	75.1	Confident	93 Å²	93	105.4 Å²	105.4	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-90.9	-29.9	-174.6	-64.2	174.2	0	0	0	113.7	I656 L660 Q664 R665	I656-L668 HydrophobicContact CD1-CB 4.07Å; I656-L668 HydrophobicContact CD1-CD1 4.31Å; I656-L668 HydrophobicContact CG1-CD1 4.2Å; I656-L668 HydrophobicContact CG2-CB 4.38Å; L660-L668 HydrophobicContact CD1-CD1 3.44Å; L660-L668 VanDerWaalsContact CD1-CD1 3.44Å; Q664-L668 PolarHBondContact O-N 3.01Å; R665-L668 PolarHBondContact O-N 3.45Å; R665-L668 VanDerWaalsContact O-N 3.12Å
669	I	82.6	Confident	74.1	Confident	46 Å²	46	105.2 Å²	105.2	24%	0.236	58%	0.575	C	S	.	*	S	Bend	trans	-116.3	98.1	170.2	-57.2	173.2	0	0	0	105.5	E653 I656 R665 I671	E653-I669 HydrophobicContact CB-CD1 4.04Å; E653-I669 HydrophobicContact CG-CD1 4.35Å; E653-I669 HydrophobicContact CG-CG1 4.45Å; I656-I669 HydrophobicContact CB-CD1 4.18Å; I656-I669 HydrophobicContact CD1-CG1 4.45Å; I656-I669 HydrophobicContact CG2-CD1 3.68Å; I656-I669 HydrophobicContact CG2-CG1 4.02Å; R665-I669 WeakPolarHBondContact O-CA 3.48Å; R665-I669 PolarHBondContact O-N 3.25Å; I669-I671 HydrophobicContact CG2-CG1 3.93Å; I669-I671 PolarHBondContact O-N 3.06Å
670	P	73.8	Confident	73.1	Confident	110 Å²	110	103.7 Å²	103.7	71%	0.714	58%	0.581	S	S	*	*			trans	-67	80.5	166.2	-16.4	31.7	0	0	0	108.5	A672	P670-A672 PolarHBondContact O-N 3.11Å; P670-A672 VanDerWaalsContact O-N 3.16Å
671	I	65.9	Low	72	Confident	109 Å²	109	111 Å²	111	56%	0.559	61%	0.611	S	S	*	*			trans	-54.6	124.7	169.1	-58	174.7	0	0	0	105.6	I669 T673	I669-I671 HydrophobicContact CG2-CG1 3.93Å; I669-I671 PolarHBondContact O-N 3.06Å; I671-T673 VanDerWaalsContact C-N 3.3Å; I671-T673 PolarHBondContact O-N 3.44Å; I671-T673 PolarHBondContact O-OG1 2.91Å
672	A	48.3	Very low	71.1	Confident	88 Å²	88	109.5 Å²	109.5	73%	0.727	62%	0.615	S	S	*	*			trans	-61.1	98	173	0	0	0	0	0	107.8	P670 S674	P670-A672 PolarHBondContact O-N 3.11Å; P670-A672 VanDerWaalsContact O-N 3.16Å; A672-S674 VanDerWaalsContact C-N 3.32Å; A672-S674 PolarHBondContact O-N 2.76Å
673	T	51.3	Low	69.9	Low	137 Å²	137	116.6 Å²	116.6	84%	0.84	64%	0.636	S	S	*	*			trans	-61.8	96.5	-179.6	-45.3	0	0	0	0	107.3	I671 G675	I671-T673 VanDerWaalsContact C-N 3.3Å; I671-T673 PolarHBondContact O-N 3.44Å; I671-T673 PolarHBondContact O-OG1 2.91Å; T673-G675 PolarHBondContact O-N 3.05Å
674	S	43.4	Very low	68.7	Low	101 Å²	101	125 Å²	125	71%	0.706	67%	0.669	S	S	*	*			trans	-67.4	99.3	-163	42.6	0	0	0	0	109.6	A672 N676	A672-S674 VanDerWaalsContact C-N 3.32Å; A672-S674 PolarHBondContact O-N 2.76Å; S674-N676 PolarHBondContact O-N 3.49Å
675	G	50	Low	67.7	Low	64 Å²	64	127.4 Å²	127.4	66%	0.66	68%	0.684	S	S	*	*			trans	-68.7	31.3	-176.8	0	0	0	0	0	114.4	T673 V677	T673-G675 PolarHBondContact O-N 3.05Å; G675-V677 PolarHBondContact O-N 2.93Å
676	N	53.4	Low	66.5	Low	141 Å²	141	131.3 Å²	131.3	75%	0.754	71%	0.709	S	S	*	*			trans	-69.9	67.1	168.3	-78.5	9.8	0	0	0	109.3	S674 V678	S674-N676 PolarHBondContact O-N 3.49Å; N676-V678 PolarHBondContact O-N 3.02Å
677	V	57.7	Low	65.3	Low	117 Å²	117	131.7 Å²	131.7	71%	0.709	72%	0.719	S	S	*	*			trans	-67.7	84.6	162.8	-173.8	0	0	0	0	106.2	G675 I679	G675-V677 PolarHBondContact O-N 2.93Å; V677-I679 HydrophobicContact CG1-CG1 3.87Å; V677-I679 PolarHBondContact O-N 3.23Å
678	V	62.2	Low	64	Low	122 Å²	122	131.6 Å²	131.6	74%	0.739	72%	0.721	S	S	*	*			trans	-67.9	86.7	174.3	-178.9	0	0	0	0	107.5	N676 P680	N676-V678 PolarHBondContact O-N 3.02Å; V678-P680 WeakPolarHBondContact O-CD 3.06Å
679	I	70.5	Confident	62.6	Low	136 Å²	136	134 Å²	134	70%	0.697	74%	0.735	S	S	*	*			trans	-72.5	109.2	172	-56.9	178.2	0	0	0	106.8	V677 K681	V677-I679 HydrophobicContact CG1-CG1 3.87Å; V677-I679 PolarHBondContact O-N 3.23Å; I679-K681 PolarHBondContact O-N 3.4Å
680	P	71.4	Confident	61.3	Low	99 Å²	99	139.9 Å²	139.9	64%	0.643	77%	0.769	S	S	*	*			trans	-64.3	124	178.7	27.2	-33.8	0	0	0	109.1	V678 I682	V678-P680 WeakPolarHBondContact O-CD 3.06Å; P680-I682 PolarHBondContact O-N 3.23Å
681	K	70.3	Confident	60.4	Low	206 Å²	206	142 Å²	142	90%	0.896	77%	0.772	S	S	*	*			trans	-65.6	94.7	176	-73.1	-178.7	179	174.8	0	109.5	I679 R683	I679-K681 PolarHBondContact O-N 3.4Å; K681-R683 PolarHBondContact O-N 3.29Å; K681-R683 VanDerWaalsContact O-N 3.08Å
682	I	72.2	Confident	60	Low	151 Å²	151	144.5 Å²	144.5	77%	0.774	79%	0.789	S	S	*	*			trans	-57.8	113.8	172.2	-56.4	175.9	0	0	0	107.7	P680 K684	P680-I682 PolarHBondContact O-N 3.23Å; I682-K684 PolarHBondContact O-N 3.19Å
683	R	64.5	Low	61	Low	243 Å²	243	149.3 Å²	149.3	92%	0.917	79%	0.794	S	S	*	*			trans	-66	129.1	172.4	-63.4	-178.1	-179.8	-177.5	-0.9	108.1	K681	K681-R683 PolarHBondContact O-N 3.29Å; K681-R683 VanDerWaalsContact O-N 3.08Å
684	K	64.6	Low	61.8	Low	274 Å²	274	150.4 Å²	150.4	100%	1.191	79%	0.79	S	S	*	*			trans	-98.4	0	175.5	-72	-174.5	176	-179.5	0	110.4	I682	I682-K684 PolarHBondContact O-N 3.19Å

Retrieved 684 of 684 residues in 402.7 ms (Link to these results)

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