A0A077YYK6_TRITR Loading...

29kDa protein from Anisakis simplex

AlphaFold DB , UniProt , Accession A0A077YYK6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 476 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	43.4	Very low	52.5	Low	235 Å²	235	121.3 Å²	121.3	100%	1.158	61%	0.608	S	S	*	*				0	130.3	0	-78.2	-175.3	159.8	0	0	108
2	P	47.1	Very low	52.9	Low	93 Å²	93	120.1 Å²	120.1	60%	0.604	60%	0.603	S	S	*	*			trans	-63	149	174	27.7	-32.5	0	0	0	110	L4	P2-L4 PolarHBondContact O-N 3.24Å
3	P	56.4	Low	53	Low	90 Å²	90	118.3 Å²	118.3	58%	0.584	59%	0.591	S	S	*	*			trans	-58.7	138.4	-178.9	23.4	-32.2	0	0	0	110.4	S5 S6	P3-S5 PolarHBondContact O-N 2.8Å; P3-S6 PolarHBondContact O-N 2.84Å; P3-S6 PolarHBondContact O-OG 3.15Å
4	L	48.8	Very low	53.4	Low	131 Å²	131	115.1 Å²	115.1	69%	0.686	59%	0.586	S	S	*	*	H	α-helix	trans	-49.3	-27.4	-178.8	-87.6	147.2	0	0	0	113.5	P2 S6 R7 Y8	P2-L4 PolarHBondContact O-N 3.24Å; L4-S6 PolarHBondContact O-N 3.37Å; L4-R7 PolarHBondContact O-N 3.33Å; L4-Y8 HydrophobicContact CD2-CE2 4.43Å; L4-Y8 WeakPolarHBondContact O-CD2 3.34Å
5	S	54.4	Low	53.1	Low	73 Å²	73	120.9 Å²	120.9	51%	0.51	60%	0.597	S	S	.	*	H	α-helix	trans	-61.8	-38.1	176.6	64.2	0	0	0	0	113.4	P3 R7 Y8 E9	P3-S5 PolarHBondContact O-N 2.8Å; S5-R7 VanDerWaalsContact C-N 3.34Å; S5-R7 PolarHBondContact O-N 3.25Å; S5-Y8 PolarHBondContact O-N 3.48Å; S5-E9 PolarHBondContact O-N 3.31Å
6	S	55.8	Low	52.6	Low	36 Å²	36	118.8 Å²	118.8	25%	0.252	59%	0.593	S	S	.	*	H	α-helix	trans	-67.1	-33.6	-178.2	60.8	0	0	0	0	112.9	P3 L4 E10	P3-S6 PolarHBondContact O-N 2.84Å; P3-S6 PolarHBondContact O-OG 3.15Å; L4-S6 PolarHBondContact O-N 3.37Å; S6-E10 PolarHBondContact O-N 2.68Å; S6-E10 VanDerWaalsContact O-N 3.15Å
7	R	48.3	Very low	51.9	Low	175 Å²	175	123.8 Å²	123.8	66%	0.66	60%	0.604	S	S	*	*	H	α-helix	trans	-67.8	-35.5	177.5	-102.3	-174.5	174.9	-175.7	-1.2	113.1	L4 S5 Q11	L4-R7 PolarHBondContact O-N 3.33Å; S5-R7 VanDerWaalsContact C-N 3.34Å; S5-R7 PolarHBondContact O-N 3.25Å; R7-Q11 WeakPolarHBondContact O-CG 3.33Å; R7-Q11 PolarHBondContact O-N 2.69Å
8	Y	51.3	Low	51.3	Low	145 Å²	145	127.1 Å²	127.1	57%	0.569	61%	0.609	S	S	*	*	H	α-helix	trans	-77.8	-36.5	178.7	-72.1	-70.2	0	0	0	111.7	L4 S5 Q11 I12	L4-Y8 HydrophobicContact CD2-CE2 4.43Å; L4-Y8 WeakPolarHBondContact O-CD2 3.34Å; S5-Y8 PolarHBondContact O-N 3.48Å; Y8-Q11 PolarHBondContact O-N 3.31Å; Y8-I12 WeakPolarHBondContact O-CB 3.33Å; Y8-I12 WeakPolarHBondContact O-CD1 3.46Å; Y8-I12 WeakPolarHBondContact O-CG1 3.46Å; Y8-I12 PolarHBondContact O-N 3.41Å
9	E	58.5	Low	50.5	Low	122 Å²	122	127.9 Å²	127.9	57%	0.57	61%	0.605	S	S	*	*	H	α-helix	trans	-61.1	-45.3	173.9	-75.2	-179.9	173.8	0	0	111.8	S5 Q11 I12 E13	S5-E9 PolarHBondContact O-N 3.31Å; E9-Q11 VanDerWaalsContact C-N 3.34Å; E9-Q11 PolarHBondContact O-N 3.22Å; E9-I12 PolarHBondContact O-N 2.92Å; E9-E13 WeakPolarHBondContact O-CB 3.42Å; E9-E13 PolarHBondContact O-N 2.97Å
10	E	57.4	Low	50.1	Low	136 Å²	136	128.1 Å²	128.1	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-63.9	-36	174.9	-78.7	-177.6	158.6	0	0	112.9	S6 S14	S6-E10 PolarHBondContact O-N 2.68Å; S6-E10 VanDerWaalsContact O-N 3.15Å; E10-S14 VanDerWaalsContact O-CB 3.24Å; E10-S14 WeakPolarHBondContact O-CB 3.28Å; E10-S14 PolarHBondContact O-N 3.39Å; E10-S14 PolarHBondContact O-OG 2.71Å
11	Q	56	Low	49.7	Very low	98 Å²	98	127.7 Å²	127.7	46%	0.458	62%	0.623	S	S	.	*	H	α-helix	trans	-70.9	-33.6	175.9	-79.7	-176.5	-0.5	0	0	112.9	R7 Y8 E9 S14 R15	R7-Q11 WeakPolarHBondContact O-CG 3.33Å; R7-Q11 PolarHBondContact O-N 2.69Å; Y8-Q11 PolarHBondContact O-N 3.31Å; E9-Q11 VanDerWaalsContact C-N 3.34Å; E9-Q11 PolarHBondContact O-N 3.22Å; Q11-S14 WeakPolarHBondContact CA-OG 3.46Å; Q11-S14 PolarHBondContact O-OG 3.16Å; Q11-S14 VanDerWaalsContact O-OG 3.12Å; Q11-R15 VanDerWaalsContact O-CB 3.27Å; Q11-R15 WeakPolarHBondContact O-CB 3.25Å; Q11-R15 VanDerWaalsContact O-CG 3.28Å; Q11-R15 WeakPolarHBondContact O-CG 3.48Å; Q11-R15 PolarHBondContact O-N 2.99Å
12	I	57.3	Low	49.3	Very low	107 Å²	107	125 Å²	125	55%	0.549	60%	0.602	S	S	.	*	H	α-helix	trans	-73.7	-44.3	175.1	-66.9	163.6	0	0	0	110	Y8 E9 S14 R15 T16	Y8-I12 WeakPolarHBondContact O-CB 3.33Å; Y8-I12 WeakPolarHBondContact O-CD1 3.46Å; Y8-I12 WeakPolarHBondContact O-CG1 3.46Å; Y8-I12 PolarHBondContact O-N 3.41Å; E9-I12 PolarHBondContact O-N 2.92Å; I12-S14 PolarHBondContact O-N 3.46Å; I12-R15 PolarHBondContact O-N 3.3Å; I12-T16 HydrophobicContact CG2-CG2 4.34Å; I12-T16 WeakPolarHBondContact O-CB 3.44Å; I12-T16 VanDerWaalsContact O-CG2 3.29Å; I12-T16 WeakPolarHBondContact O-CG2 3.18Å; I12-T16 PolarHBondContact O-N 3.32Å; I12-T16 PolarHBondContact O-OG1 3.49Å
13	E	54.2	Low	48.7	Very low	97 Å²	97	123.1 Å²	123.1	45%	0.453	60%	0.599	S	S	.	*	H	α-helix	trans	-64.3	-37.7	176.3	-78.7	-173.2	167.4	0	0	112.1	E9 T16 R17 R30	E9-E13 WeakPolarHBondContact O-CB 3.42Å; E9-E13 PolarHBondContact O-N 2.97Å; E13-T16 PolarHBondContact O-OG1 3Å; E13-R17 WeakPolarHBondContact O-CB 3.35Å; E13-R17 WeakPolarHBondContact O-CG 3.41Å; E13-R17 PolarHBondContact O-N 3.06Å; E13-R30 IonicContact OE1-NH2 3.25Å; E13-R30 PolarHBondContact OE1-NH2 3.16Å
14	S	58.9	Low	48	Very low	73 Å²	73	124.1 Å²	124.1	51%	0.51	61%	0.608	S	S	.	*	H	α-helix	trans	-72.8	-36.1	175.6	57.1	0	0	0	0	113.3	E10 Q11 I12	E10-S14 VanDerWaalsContact O-CB 3.24Å; E10-S14 WeakPolarHBondContact O-CB 3.28Å; E10-S14 PolarHBondContact O-N 3.39Å; E10-S14 PolarHBondContact O-OG 2.71Å; Q11-S14 WeakPolarHBondContact CA-OG 3.46Å; Q11-S14 PolarHBondContact O-OG 3.16Å; Q11-S14 VanDerWaalsContact O-OG 3.12Å; I12-S14 PolarHBondContact O-N 3.46Å
15	R	48.3	Very low	47.3	Very low	202 Å²	202	128.5 Å²	128.5	76%	0.762	62%	0.617	S	S	*	*	H	α-helix	trans	-75.9	-28.4	176.5	-77.9	179.9	166	169.1	-2.7	113.9	Q11 I12 R17	Q11-R15 VanDerWaalsContact O-CB 3.27Å; Q11-R15 WeakPolarHBondContact O-CB 3.25Å; Q11-R15 VanDerWaalsContact O-CG 3.28Å; Q11-R15 WeakPolarHBondContact O-CG 3.48Å; Q11-R15 PolarHBondContact O-N 2.99Å; I12-R15 PolarHBondContact O-N 3.3Å; R15-R17 VanDerWaalsContact C-N 3.31Å
16	T	46	Very low	46.5	Very low	87 Å²	87	128.6 Å²	128.6	53%	0.534	63%	0.629	S	S	.	*	H	α-helix	trans	-84	-6	176.9	53.4	0	0	0	0	113.3	I12 E13 W18	I12-T16 HydrophobicContact CG2-CG2 4.34Å; I12-T16 WeakPolarHBondContact O-CB 3.44Å; I12-T16 VanDerWaalsContact O-CG2 3.29Å; I12-T16 WeakPolarHBondContact O-CG2 3.18Å; I12-T16 PolarHBondContact O-N 3.32Å; I12-T16 PolarHBondContact O-OG1 3.49Å; E13-T16 PolarHBondContact O-OG1 3Å; T16-W18 PolarHBondContact O-N 3.32Å
17	R	40.5	Very low	45.4	Very low	204 Å²	204	135.2 Å²	135.2	77%	0.77	65%	0.654	S	S	*	*			trans	-80.4	23.1	176.1	-103.8	-179.4	178.6	173	2.7	115.4	E13 R15 W19	E13-R17 WeakPolarHBondContact O-CB 3.35Å; E13-R17 WeakPolarHBondContact O-CG 3.41Å; E13-R17 PolarHBondContact O-N 3.06Å; R15-R17 VanDerWaalsContact C-N 3.31Å; R17-W19 PolarHBondContact O-N 3.02Å
18	W	41.4	Very low	45	Very low	184 Å²	184	132 Å²	132	70%	0.697	66%	0.658	S	S	*	*			trans	-65.3	12.1	-174.3	58	-74	0	0	0	116.2	T16	T16-W18 PolarHBondContact O-N 3.32Å
19	W	35.7	Very low	44.4	Very low	142 Å²	142	133 Å²	133	54%	0.538	67%	0.672	S	S	.	*			trans	-122.9	92.2	174	-61.1	81.2	0	0	0	110.2	R17 T21 Y22	R17-W19 PolarHBondContact O-N 3.02Å; W19-T21 PolarHBondContact O-N 3.03Å; W19-T21 VanDerWaalsContact O-N 3.09Å; W19-Y22 HydrophobicContact CB-CD2 4.42Å
20	P	41.4	Very low	43.5	Very low	131 Å²	131	137 Å²	137	85%	0.851	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-5.7	177.8	-16.9	30.5	0	0	0	114.3
21	T	42.5	Very low	42.9	Very low	121 Å²	121	133.2 Å²	133.2	74%	0.742	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	2.6	-169.8	36.7	0	0	0	0	114.8	W19 G23	W19-T21 PolarHBondContact O-N 3.03Å; W19-T21 VanDerWaalsContact O-N 3.09Å; T21-G23 PolarHBondContact O-N 3.48Å
22	Y	34.7	Very low	42.5	Very low	179 Å²	179	131.7 Å²	131.7	70%	0.702	67%	0.672	S	S	*	*	S	Bend	trans	-79.9	112	176.2	-113	-91.8	0	0	0	111	W19 S24 F27	W19-Y22 HydrophobicContact CB-CD2 4.42Å; Y22-S24 PolarHBondContact O-N 3.48Å; Y22-F27 HydrophobicContact CD1-CE2 4.43Å
23	G	35.4	Very low	41.9	Very low	52 Å²	52	131.3 Å²	131.3	54%	0.536	68%	0.677	S	S	.	*			trans	-56.6	128	-179.1	0	0	0	0	0	112.7	T21 Y25	T21-G23 PolarHBondContact O-N 3.48Å; G23-Y25 PolarHBondContact O-N 2.98Å; G23-Y25 VanDerWaalsContact O-N 3.09Å
24	S	41.8	Very low	41.8	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	69%	0.694	S	S	*	*			trans	-70.3	7	-178.8	44.1	0	0	0	0	115.1	Y22	Y22-S24 PolarHBondContact O-N 3.48Å
25	Y	34.4	Very low	41.7	Very low	223 Å²	223	138.3 Å²	138.3	88%	0.875	70%	0.695	S	S	*	*	S	Bend	trans	-95.5	106.2	-178.2	-83	-90.5	0	0	0	111.1	G23	G23-Y25 PolarHBondContact O-N 2.98Å; G23-Y25 VanDerWaalsContact O-N 3.09Å
26	G	36.1	Very low	41.9	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	68%	0.679	S	S	*	*	S	Bend	trans	115	1.2	159.1	0	0	0	0	0	118	S28	G26-S28 PolarHBondContact O-N 3.31Å
27	F	33	Very low	42.4	Very low	174 Å²	174	135.5 Å²	135.5	76%	0.763	68%	0.684	S	S	*	*			trans	-81	99	172.7	-78.8	-84.1	0	0	0	110.7	Y22	Y22-F27 HydrophobicContact CD1-CE2 4.43Å
28	S	39.8	Very low	43.2	Very low	108 Å²	108	127.1 Å²	127.1	76%	0.755	66%	0.661	S	S	*	*			trans	-55.9	137.1	168.7	57	0	0	0	0	110.8	G26	G26-S28 PolarHBondContact O-N 3.31Å
29	L	38.3	Very low	43.9	Very low	165 Å²	165	121.1 Å²	121.1	86%	0.864	65%	0.647	S	S	*	*	S	Bend	trans	-19.9	130.1	168.4	-92	89.3	0	0	0	114.7	A31	L29-A31 PolarHBondContact O-N 3.07Å
30	R	40.5	Very low	44.8	Very low	206 Å²	206	120.7 Å²	120.7	78%	0.777	65%	0.647	S	S	*	*			trans	-0.2	88.2	158.2	-70.8	-179.7	169.5	178.5	-6.2	113.4	E13 T32	E13-R30 IonicContact OE1-NH2 3.25Å; E13-R30 PolarHBondContact OE1-NH2 3.16Å; R30-T32 PolarHBondContact O-N 3.24Å
31	A	43.6	Very low	45.5	Very low	58 Å²	58	116.7 Å²	116.7	48%	0.479	62%	0.62	S	S	.	*			trans	-66.5	111.8	166.5	0	0	0	0	0	106.9	L29 T36	L29-A31 PolarHBondContact O-N 3.07Å; A31-T36 HydrophobicContact CB-CG2 3.49Å; A31-T36 VanDerWaalsContact CB-CG2 3.49Å
32	T	48.9	Very low	46	Very low	66 Å²	66	119.6 Å²	119.6	41%	0.405	62%	0.617	S	S	.	*			trans	-55.3	143.6	171.8	68.2	0	0	0	0	107.8	R30 R34 D35 T36	R30-T32 PolarHBondContact O-N 3.24Å; T32-R34 PolarHBondContact O-N 3.3Å; T32-D35 WeakPolarHBondContact O-CA 3.4Å; T32-D35 PolarHBondContact O-N 2.9Å; T32-D35 WeakPolarHBondContact OG1-CB 3.47Å; T32-D35 PolarHBondContact OG1-N 3.15Å; T32-D35 VanDerWaalsContact OG1-N 3.12Å; T32-D35 PolarHBondContact OG1-OD2 3.45Å; T32-T36 PolarHBondContact O-N 3.35Å; T32-T36 PolarHBondContact O-OG1 2.97Å
33	P	45.1	Very low	47	Very low	98 Å²	98	114.1 Å²	114.1	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-51.4	-29.7	179.8	-28.1	34.1	0	0	0	112.8	T36 Y37	P33-T36 VanDerWaalsContact CA-OG1 3.28Å; P33-T36 WeakPolarHBondContact CA-OG1 3.34Å; P33-T36 PolarHBondContact O-OG1 3.31Å; P33-Y37 WeakPolarHBondContact O-CB 3.48Å; P33-Y37 PolarHBondContact O-N 3.35Å
34	R	51.9	Low	47.7	Very low	215 Å²	215	113.3 Å²	113.3	81%	0.811	58%	0.584	S	S	*	*	H	α-helix	trans	-70.5	-43.5	175.5	-163.9	174.1	-170.1	169.1	2.3	112.6	T32 G38	T32-R34 PolarHBondContact O-N 3.3Å; R34-G38 PolarHBondContact O-N 3.47Å
35	D	55.5	Low	47.9	Very low	103 Å²	103	114.2 Å²	114.2	55%	0.551	57%	0.574	S	S	*	*	H	α-helix	trans	-73	-35.5	177.1	-63.3	-32.3	0	0	0	111.9	T32 S39	T32-D35 WeakPolarHBondContact O-CA 3.4Å; T32-D35 PolarHBondContact O-N 2.9Å; T32-D35 WeakPolarHBondContact OG1-CB 3.47Å; T32-D35 PolarHBondContact OG1-N 3.15Å; T32-D35 VanDerWaalsContact OG1-N 3.12Å; T32-D35 PolarHBondContact OG1-OD2 3.45Å; D35-S39 WeakPolarHBondContact O-CB 3.31Å; D35-S39 PolarHBondContact O-N 3.15Å
36	T	53.5	Low	48.6	Very low	67 Å²	67	107.9 Å²	107.9	41%	0.411	56%	0.559	S	S	.	*	H	α-helix	trans	-67.2	-44.1	172.9	12.5	0	0	0	0	111.3	A31 T32 P33 S39 Y40	A31-T36 HydrophobicContact CB-CG2 3.49Å; A31-T36 VanDerWaalsContact CB-CG2 3.49Å; T32-T36 PolarHBondContact O-N 3.35Å; T32-T36 PolarHBondContact O-OG1 2.97Å; P33-T36 VanDerWaalsContact CA-OG1 3.28Å; P33-T36 WeakPolarHBondContact CA-OG1 3.34Å; P33-T36 PolarHBondContact O-OG1 3.31Å; T36-S39 PolarHBondContact O-N 3.27Å; T36-Y40 WeakPolarHBondContact O-CB 3.42Å; T36-Y40 PolarHBondContact O-N 3.49Å
37	Y	55.8	Low	49.2	Very low	162 Å²	162	110.4 Å²	110.4	64%	0.635	55%	0.545	S	S	*	.	H	α-helix	trans	-65	-44.4	174.7	-178.2	-101	0	0	0	111.6	P33 S39 Y40 V41	P33-Y37 WeakPolarHBondContact O-CB 3.48Å; P33-Y37 PolarHBondContact O-N 3.35Å; Y37-S39 PolarHBondContact O-N 3.41Å; Y37-Y40 PolarHBondContact O-N 3.17Å; Y37-V41 HydrophobicContact CD1-CG2 4.1Å; Y37-V41 HydrophobicContact CD2-CG2 4.2Å; Y37-V41 HydrophobicContact CE1-CG2 3.72Å; Y37-V41 HydrophobicContact CE2-CG2 3.83Å; Y37-V41 HydrophobicContact CG-CG2 4.33Å; Y37-V41 WeakPolarHBondContact O-CB 3.45Å; Y37-V41 VanDerWaalsContact O-CG2 3.27Å; Y37-V41 WeakPolarHBondContact O-CG2 3.36Å; Y37-V41 PolarHBondContact O-N 2.84Å
38	G	56.7	Low	49.7	Very low	29 Å²	29	106.9 Å²	106.9	30%	0.299	54%	0.54	S	S	.	.	H	α-helix	trans	-60.3	-43.4	175.8	0	0	0	0	0	112.4	R34 R42	R34-G38 PolarHBondContact O-N 3.47Å; G38-R42 WeakPolarHBondContact O-CB 3.21Å; G38-R42 PolarHBondContact O-N 3.37Å
39	S	56.9	Low	49.8	Very low	58 Å²	58	111.4 Å²	111.4	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-63.3	-46.8	172.3	155.6	0	0	0	0	111.6	D35 T36 Y37 R42 D43	D35-S39 WeakPolarHBondContact O-CB 3.31Å; D35-S39 PolarHBondContact O-N 3.15Å; T36-S39 PolarHBondContact O-N 3.27Å; Y37-S39 PolarHBondContact O-N 3.41Å; S39-R42 PolarHBondContact O-N 3.26Å; S39-D43 VanDerWaalsContact O-CB 3.24Å; S39-D43 WeakPolarHBondContact O-CB 3.49Å; S39-D43 PolarHBondContact O-N 3.03Å; S39-D43 PolarHBondContact OG-OD2 3.33Å
40	Y	54.1	Low	50.1	Low	133 Å²	133	108.9 Å²	108.9	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-63.4	-50.1	-177.6	-169.8	-95.9	0	0	0	111.3	T36 Y37 R42 D43 V44	T36-Y40 WeakPolarHBondContact O-CB 3.42Å; T36-Y40 PolarHBondContact O-N 3.49Å; Y37-Y40 PolarHBondContact O-N 3.17Å; Y40-R42 PolarHBondContact O-N 3.21Å; Y40-D43 PolarHBondContact O-N 3.08Å; Y40-V44 HydrophobicContact CD1-CG2 3.89Å; Y40-V44 HydrophobicContact CE1-CG2 3.78Å; Y40-V44 HydrophobicContact CG-CG2 4.48Å; Y40-V44 VanDerWaalsContact O-CB 3.32Å; Y40-V44 WeakPolarHBondContact O-CB 3.33Å; Y40-V44 WeakPolarHBondContact O-CG2 3.49Å; Y40-V44 PolarHBondContact O-N 3.09Å
41	V	57.2	Low	50.2	Low	47 Å²	47	102 Å²	102	29%	0.285	50%	0.501	S	S	.	.	H	α-helix	trans	-58.8	-48.1	174.4	170.3	0	0	0	0	110.1	Y37 D43 V44 F45	Y37-V41 HydrophobicContact CD1-CG2 4.1Å; Y37-V41 HydrophobicContact CD2-CG2 4.2Å; Y37-V41 HydrophobicContact CE1-CG2 3.72Å; Y37-V41 HydrophobicContact CE2-CG2 3.83Å; Y37-V41 HydrophobicContact CG-CG2 4.33Å; Y37-V41 WeakPolarHBondContact O-CB 3.45Å; Y37-V41 VanDerWaalsContact O-CG2 3.27Å; Y37-V41 WeakPolarHBondContact O-CG2 3.36Å; Y37-V41 PolarHBondContact O-N 2.84Å; V41-D43 PolarHBondContact O-N 3.48Å; V41-V44 PolarHBondContact O-N 3.23Å; V41-F45 HydrophobicContact CG1-CD2 3.82Å; V41-F45 HydrophobicContact CG1-CE2 3.82Å; V41-F45 WeakPolarHBondContact O-CD2 3.14Å; V41-F45 PolarHBondContact O-N 3.5Å
42	R	52.9	Low	50.2	Low	182 Å²	182	102.7 Å²	102.7	69%	0.687	49%	0.491	S	S	*	.	H	α-helix	trans	-65.6	-37.2	-179.3	-163.1	-178.1	-76.3	165.2	-6.3	111.8	G38 S39 Y40 F45 T46	G38-R42 WeakPolarHBondContact O-CB 3.21Å; G38-R42 PolarHBondContact O-N 3.37Å; S39-R42 PolarHBondContact O-N 3.26Å; Y40-R42 PolarHBondContact O-N 3.21Å; R42-F45 PolarHBondContact O-N 3.28Å; R42-T46 HydrophobicContact CG-CG2 4.12Å; R42-T46 VanDerWaalsContact O-CB 3.24Å; R42-T46 WeakPolarHBondContact O-CB 3.34Å; R42-T46 WeakPolarHBondContact O-CG2 3.33Å; R42-T46 PolarHBondContact O-N 3.47Å; R42-T46 PolarHBondContact O-OG1 2.97Å
43	D	55	Low	49.8	Very low	64 Å²	64	110.7 Å²	110.7	34%	0.342	51%	0.514	S	S	.	.	H	α-helix	trans	-73.8	-38.3	177.7	-82.5	-36.7	0	0	0	112.5	S39 Y40 V41 F45 R47	S39-D43 VanDerWaalsContact O-CB 3.24Å; S39-D43 WeakPolarHBondContact O-CB 3.49Å; S39-D43 PolarHBondContact O-N 3.03Å; S39-D43 PolarHBondContact OG-OD2 3.33Å; Y40-D43 PolarHBondContact O-N 3.08Å; V41-D43 PolarHBondContact O-N 3.48Å; D43-F45 PolarHBondContact O-N 3.04Å; D43-R47 CarbonylContact O-C 3.45Å; D43-R47 PolarHBondContact O-N 2.92Å
44	V	49.7	Very low	49.6	Very low	35 Å²	35	110.4 Å²	110.4	21%	0.212	52%	0.515	C	S	.	.	H	α-helix	trans	-54.9	-40.8	172.5	165.2	0	0	0	0	110.5	Y40 V41 L51	Y40-V44 HydrophobicContact CD1-CG2 3.89Å; Y40-V44 HydrophobicContact CE1-CG2 3.78Å; Y40-V44 HydrophobicContact CG-CG2 4.48Å; Y40-V44 VanDerWaalsContact O-CB 3.32Å; Y40-V44 WeakPolarHBondContact O-CB 3.33Å; Y40-V44 WeakPolarHBondContact O-CG2 3.49Å; Y40-V44 PolarHBondContact O-N 3.09Å; V41-V44 PolarHBondContact O-N 3.23Å; V44-L51 HydrophobicContact CB-CD1 4.17Å; V44-L51 HydrophobicContact CB-CD2 4.32Å; V44-L51 HydrophobicContact CG1-CD1 4.01Å; V44-L51 HydrophobicContact CG2-CD1 4.17Å; V44-L51 HydrophobicContact CG2-CD2 3.45Å; V44-L51 VanDerWaalsContact CG2-CD2 3.45Å; V44-L51 HydrophobicContact CG2-CG 4.21Å
45	F	46	Very low	49.1	Very low	130 Å²	130	102.3 Å²	102.3	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-97.7	-24.6	-172.5	-64.7	-58.3	0	0	0	114.9	V41 R42 D43 L179	V41-F45 HydrophobicContact CG1-CD2 3.82Å; V41-F45 HydrophobicContact CG1-CE2 3.82Å; V41-F45 WeakPolarHBondContact O-CD2 3.14Å; V41-F45 PolarHBondContact O-N 3.5Å; R42-F45 PolarHBondContact O-N 3.28Å; D43-F45 PolarHBondContact O-N 3.04Å; F45-L179 HydrophobicContact CE1-CD2 3.92Å; F45-L179 HydrophobicContact CZ-CD2 4.27Å
46	T	50.7	Low	48.6	Very low	91 Å²	91	100.4 Å²	100.4	56%	0.558	48%	0.484	S	S	*	.	H	α-helix	trans	-94.8	-21.3	177.9	60.5	0	0	0	0	113.3	R42	R42-T46 HydrophobicContact CG-CG2 4.12Å; R42-T46 VanDerWaalsContact O-CB 3.24Å; R42-T46 WeakPolarHBondContact O-CB 3.34Å; R42-T46 WeakPolarHBondContact O-CG2 3.33Å; R42-T46 PolarHBondContact O-N 3.47Å; R42-T46 PolarHBondContact O-OG1 2.97Å
47	R	47.6	Very low	48.1	Very low	127 Å²	127	102.6 Å²	102.6	48%	0.479	50%	0.497	S	S	.	.			trans	-138.7	75.5	-177.7	-67	-178.6	174.8	163.4	-3.4	110.5	D43 R49 K50	D43-R47 CarbonylContact O-C 3.45Å; D43-R47 PolarHBondContact O-N 2.92Å; R47-R49 PolarHBondContact O-N 3.41Å; R47-K50 HydrophobicContact CB-CB 4.36Å; R47-K50 HydrophobicContact CB-CG 4.39Å; R47-K50 PolarHBondContact O-N 2.95Å
48	P	43.6	Very low	47.5	Very low	100 Å²	100	97.8 Å²	97.8	65%	0.649	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-55.2	-19.8	177.9	21.7	-32.8	0	0	0	113.2
49	R	42.1	Very low	47.1	Very low	203 Å²	203	98.3 Å²	98.3	77%	0.766	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-79.6	-10	178.4	-68.5	-175.1	167.7	-170.2	-5.5	115.9	R47 Y52	R47-R49 PolarHBondContact O-N 3.41Å; R49-Y52 WeakPolarHBondContact O-CD2 3.44Å
50	K	44.7	Very low	46.6	Very low	112 Å²	112	96.4 Å²	96.4	49%	0.487	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-103.2	3.4	-176.7	-73.7	-166.8	179.4	-178.4	0	115	R47 Y52	R47-K50 HydrophobicContact CB-CB 4.36Å; R47-K50 HydrophobicContact CB-CG 4.39Å; R47-K50 PolarHBondContact O-N 2.95Å; K50-Y52 PolarHBondContact O-N 3.41Å
51	L	43	Very low	46.1	Very low	62 Å²	62	94.2 Å²	94.2	33%	0.325	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-76.5	3.2	-178.3	-84.5	163.2	0	0	0	115.7	V44 R53	V44-L51 HydrophobicContact CB-CD1 4.17Å; V44-L51 HydrophobicContact CB-CD2 4.32Å; V44-L51 HydrophobicContact CG1-CD1 4.01Å; V44-L51 HydrophobicContact CG2-CD1 4.17Å; V44-L51 HydrophobicContact CG2-CD2 3.45Å; V44-L51 VanDerWaalsContact CG2-CD2 3.45Å; V44-L51 HydrophobicContact CG2-CG 4.21Å; L51-R53 PolarHBondContact O-N 3.48Å; L51-R53 VanDerWaalsContact O-N 3.14Å
52	Y	43	Very low	45.5	Very low	72 Å²	72	96.8 Å²	96.8	28%	0.282	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-70	-3.2	176.1	-67.5	-75.4	0	0	0	114.4	R49 K50 S54 V55 L60 Y63 V69	R49-Y52 WeakPolarHBondContact O-CD2 3.44Å; K50-Y52 PolarHBondContact O-N 3.41Å; Y52-S54 VanDerWaalsContact C-N 3.31Å; Y52-S54 PolarHBondContact O-N 3.32Å; Y52-V55 PolarHBondContact O-N 3.5Å; Y52-L60 HydrophobicContact CD1-CD2 3.46Å; Y52-L60 VanDerWaalsContact CD1-CD2 3.46Å; Y52-L60 HydrophobicContact CE1-CD2 4.38Å; Y52-L60 HydrophobicContact CG-CD2 3.99Å; Y52-Y63 HydrophobicContact CE1-CD1 4.48Å; Y52-Y63 HydrophobicContact CE1-CD2 4.14Å; Y52-Y63 HydrophobicContact CE1-CE2 4.28Å; Y52-Y63 HydrophobicContact CE1-CG 4.24Å; Y52-V69 HydrophobicContact CD2-CG1 3.85Å; Y52-V69 HydrophobicContact CE2-CG1 4.43Å; Y52-V69 HydrophobicContact CE2-CG2 4.49Å
53	R	40.5	Very low	45.3	Very low	234 Å²	234	94.1 Å²	94.1	88%	0.883	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-71.5	-16.4	-176.8	-72.5	-173.2	172.1	-168.5	-4.2	115.2	L51	L51-R53 PolarHBondContact O-N 3.48Å; L51-R53 VanDerWaalsContact O-N 3.14Å
54	S	40.8	Very low	45.1	Very low	93 Å²	93	101 Å²	101	65%	0.65	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-104.6	3.7	176.3	54	0	0	0	0	113.5	Y52	Y52-S54 VanDerWaalsContact C-N 3.31Å; Y52-S54 PolarHBondContact O-N 3.32Å
55	V	42.3	Very low	45.3	Very low	44 Å²	44	105 Å²	105	27%	0.267	53%	0.526	S	S	.	.	S	Bend	trans	-93.9	122.4	-176.7	180	0	0	0	0	107.6	Y52 S59 L60	Y52-V55 PolarHBondContact O-N 3.5Å; V55-S59 WeakPolarHBondContact CG1-OG 3.43Å; V55-L60 HydrophobicContact CB-CD2 4.2Å; V55-L60 HydrophobicContact CB-CG 4.37Å; V55-L60 HydrophobicContact CG1-CD2 3.99Å; V55-L60 HydrophobicContact CG1-CG 4.01Å
56	S	43.9	Very low	45.6	Very low	63 Å²	63	99.3 Å²	99.3	44%	0.441	50%	0.503	S	S	.	.			trans	-51.3	146.4	176.3	72.8	0	0	0	0	110.6	S58 S59 L60	S56-S58 WeakPolarHBondContact CB-OG 3.32Å; S56-S58 PolarHBondContact O-N 3.41Å; S56-S58 VanDerWaalsContact O-N 3.07Å; S56-S58 PolarHBondContact OG-OG 3.22Å; S56-S59 WeakPolarHBondContact CA-OG 3.29Å; S56-S59 PolarHBondContact N-OG 3.07Å; S56-S59 WeakPolarHBondContact O-CA 3.45Å; S56-S59 PolarHBondContact O-N 3.27Å; S56-S59 PolarHBondContact O-OG 3.2Å; S56-S59 PolarHBondContact OG-N 3.46Å; S56-S59 PolarHBondContact OG-OG 3.09Å; S56-L60 PolarHBondContact O-N 3.26Å
57	V	44.3	Very low	45.8	Very low	114 Å²	114	98 Å²	98	69%	0.691	49%	0.492	S	S	*	.	H	α-helix	trans	-52.2	-34.8	178.3	174.5	0	0	0	0	111.6	S59 L60	V57-S59 VanDerWaalsContact C-N 3.28Å; V57-S59 PolarHBondContact O-N 3.44Å; V57-L60 PolarHBondContact O-N 3Å
58	S	42.3	Very low	46.2	Very low	60 Å²	60	99.1 Å²	99.1	42%	0.42	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-22.9	173.8	30.8	0	0	0	0	115.5	S56 S61	S56-S58 WeakPolarHBondContact CB-OG 3.32Å; S56-S58 PolarHBondContact O-N 3.41Å; S56-S58 VanDerWaalsContact O-N 3.07Å; S56-S58 PolarHBondContact OG-OG 3.22Å; S58-S61 PolarHBondContact O-OG 2.89Å
59	S	49.8	Very low	46.4	Very low	40 Å²	40	97.6 Å²	97.6	28%	0.28	50%	0.496	S	S	.	.	H	α-helix	trans	-94.6	-15.3	177.5	33.7	0	0	0	0	113.1	V55 S56 V57	V55-S59 WeakPolarHBondContact CG1-OG 3.43Å; S56-S59 WeakPolarHBondContact CA-OG 3.29Å; S56-S59 PolarHBondContact N-OG 3.07Å; S56-S59 WeakPolarHBondContact O-CA 3.45Å; S56-S59 PolarHBondContact O-N 3.27Å; S56-S59 PolarHBondContact O-OG 3.2Å; S56-S59 PolarHBondContact OG-N 3.46Å; S56-S59 PolarHBondContact OG-OG 3.09Å; V57-S59 VanDerWaalsContact C-N 3.28Å; V57-S59 PolarHBondContact O-N 3.44Å
60	L	44.5	Very low	46.9	Very low	18 Å²	18	90.7 Å²	90.7	9%	0.094	48%	0.477	C	S	.	.	H	α-helix	trans	-77.4	-26.5	173.6	-69.9	170.5	0	0	0	112.1	Y52 V55 S56 V57 C62 Y63 T66	Y52-L60 HydrophobicContact CD1-CD2 3.46Å; Y52-L60 VanDerWaalsContact CD1-CD2 3.46Å; Y52-L60 HydrophobicContact CE1-CD2 4.38Å; Y52-L60 HydrophobicContact CG-CD2 3.99Å; V55-L60 HydrophobicContact CB-CD2 4.2Å; V55-L60 HydrophobicContact CB-CG 4.37Å; V55-L60 HydrophobicContact CG1-CD2 3.99Å; V55-L60 HydrophobicContact CG1-CG 4.01Å; S56-L60 PolarHBondContact O-N 3.26Å; V57-L60 PolarHBondContact O-N 3Å; L60-C62 PolarHBondContact O-N 3.4Å; L60-C62 VanDerWaalsContact O-N 3.11Å; L60-Y63 PolarHBondContact O-N 3.45Å; L60-T66 HydrophobicContact CB-CG2 4.17Å; L60-T66 HydrophobicContact CD2-CG2 4.25Å; L60-T66 WeakPolarHBondContact O-CG2 3.43Å
61	S	45.2	Very low	47	Very low	88 Å²	88	88.9 Å²	88.9	62%	0.615	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.6	175.3	51.6	0	0	0	0	114.3	S58	S58-S61 PolarHBondContact O-OG 2.89Å
62	C	43.9	Very low	47.4	Very low	101 Å²	101	91.4 Å²	91.4	68%	0.682	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.6	-178	-60.1	0	0	0	0	114	L60	L60-C62 PolarHBondContact O-N 3.4Å; L60-C62 VanDerWaalsContact O-N 3.11Å
63	Y	49.5	Very low	47.8	Very low	125 Å²	125	96.8 Å²	96.8	49%	0.49	53%	0.527	S	S	.	.			trans	-93	127.1	-179.2	-71.3	-86.9	0	0	0	110.4	Y52 L60 D65 T66	Y52-Y63 HydrophobicContact CE1-CD1 4.48Å; Y52-Y63 HydrophobicContact CE1-CD2 4.14Å; Y52-Y63 HydrophobicContact CE1-CE2 4.28Å; Y52-Y63 HydrophobicContact CE1-CG 4.24Å; L60-Y63 PolarHBondContact O-N 3.45Å; Y63-D65 PolarHBondContact O-N 3.34Å; Y63-D65 VanDerWaalsContact O-N 3.09Å; Y63-T66 PolarHBondContact O-N 2.97Å; Y63-T66 PolarHBondContact O-OG1 2.93Å
64	R	50.1	Low	48.3	Very low	209 Å²	209	88.6 Å²	88.6	79%	0.789	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.1	-177.9	-76	-171.1	174	176.5	0.9	114.2
65	D	54.2	Low	48.7	Very low	118 Å²	118	94 Å²	94	63%	0.631	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	19.4	-171.8	-58.5	-22.2	0	0	0	113.9	Y63 D67	Y63-D65 PolarHBondContact O-N 3.34Å; Y63-D65 VanDerWaalsContact O-N 3.09Å; D65-D67 VanDerWaalsContact C-N 3.27Å; D65-D67 PolarHBondContact O-N 2.85Å
66	T	53	Low	48.9	Very low	12 Å²	12	99.9 Å²	99.9	7%	0.074	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.8	-178.7	48.1	0	0	0	0	114.7	L60 Y63 D68 V69 V70	L60-T66 HydrophobicContact CB-CG2 4.17Å; L60-T66 HydrophobicContact CD2-CG2 4.25Å; L60-T66 WeakPolarHBondContact O-CG2 3.43Å; Y63-T66 PolarHBondContact O-N 2.97Å; Y63-T66 PolarHBondContact O-OG1 2.93Å; T66-D68 PolarHBondContact O-N 2.86Å; T66-V69 PolarHBondContact O-N 3.2Å; T66-V69 VanDerWaalsContact O-N 3.15Å; T66-V70 PolarHBondContact O-N 3.46Å
67	D	53	Low	49	Very low	63 Å²	63	100.6 Å²	100.6	34%	0.337	54%	0.539	S	S	.	.	H	α-helix	trans	-61.4	-31	-179.4	-69.7	-33.9	0	0	0	112.2	D65	D65-D67 VanDerWaalsContact C-N 3.27Å; D65-D67 PolarHBondContact O-N 2.85Å
68	D	56.4	Low	48.8	Very low	151 Å²	151	100.7 Å²	100.7	81%	0.807	54%	0.542	S	S	*	.	H	α-helix	trans	-82.9	-16.9	-179.4	-71.7	-13.3	0	0	0	113.5	T66	T66-D68 PolarHBondContact O-N 2.86Å
69	V	48.8	Very low	48.4	Very low	67 Å²	67	103 Å²	103	41%	0.406	56%	0.558	S	S	.	*	H	α-helix	trans	-103.2	-33.9	-169	-177.8	0	0	0	0	112.5	Y52 T66	Y52-V69 HydrophobicContact CD2-CG1 3.85Å; Y52-V69 HydrophobicContact CE2-CG1 4.43Å; Y52-V69 HydrophobicContact CE2-CG2 4.49Å; T66-V69 PolarHBondContact O-N 3.2Å; T66-V69 VanDerWaalsContact O-N 3.15Å
70	V	52.1	Low	47.8	Very low	59 Å²	59	110.6 Å²	110.6	36%	0.358	58%	0.582	S	S	.	*	H	α-helix	trans	-94.6	-15.9	-176.3	-175	0	0	0	0	111.8	T66 I72	T66-V70 PolarHBondContact O-N 3.46Å; V70-I72 HydrophobicContact CG1-CB 4.24Å; V70-I72 HydrophobicContact CG1-CD1 4.31Å; V70-I72 HydrophobicContact CG1-CG1 4.47Å; V70-I72 PolarHBondContact O-N 2.9Å
71	G	46.6	Very low	47.5	Very low	74 Å²	74	112.8 Å²	112.8	76%	0.763	60%	0.599	S	S	*	*	S	Bend	trans	66.8	-2.9	-177.6	0	0	0	0	0	114.2
72	I	50.8	Low	47.2	Very low	114 Å²	114	112.3 Å²	112.3	59%	0.585	60%	0.596	S	S	*	*	S	Bend	trans	-112	114.8	174.2	-58.4	164.8	0	0	0	105.8	V70 L74	V70-I72 HydrophobicContact CG1-CB 4.24Å; V70-I72 HydrophobicContact CG1-CD1 4.31Å; V70-I72 HydrophobicContact CG1-CG1 4.47Å; V70-I72 PolarHBondContact O-N 2.9Å; I72-L74 PolarHBondContact O-N 3.44Å
73	K	52.9	Low	47.2	Very low	185 Å²	185	112.7 Å²	112.7	80%	0.804	59%	0.59	S	S	*	*			trans	-58.6	104.8	170.5	-82.1	-176.5	176.4	178.5	0	108.1	K75	K73-K75 PolarHBondContact O-N 2.91Å; K73-K75 VanDerWaalsContact O-N 3.07Å
74	L	50	Low	47.2	Very low	62 Å²	62	109.2 Å²	109.2	33%	0.325	58%	0.584	S	S	.	*			trans	-70.2	108.4	173.8	-73.6	167.8	0	0	0	106.3	I72 K76	I72-L74 PolarHBondContact O-N 3.44Å; L74-K76 PolarHBondContact O-N 2.94Å
75	K	49.9	Very low	47.1	Very low	208 Å²	208	103.7 Å²	103.7	90%	0.904	58%	0.575	S	S	*	*			trans	-55.7	108.1	171.1	-86.7	-175.5	176.2	179	0	107.4	K73 S77	K73-K75 PolarHBondContact O-N 2.91Å; K73-K75 VanDerWaalsContact O-N 3.07Å; K75-S77 PolarHBondContact O-N 3.1Å; K75-S77 VanDerWaalsContact O-N 3.1Å
76	K	46.9	Very low	46.9	Very low	167 Å²	167	101.5 Å²	101.5	73%	0.726	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-56.2	117.4	167.6	-67.1	179.9	-179	173.7	0	106.3	L74	L74-K76 PolarHBondContact O-N 2.94Å
77	S	45	Very low	46.9	Very low	78 Å²	78	104.4 Å²	104.4	55%	0.545	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-59.7	127.2	174.9	46.6	0	0	0	0	107.7	K75 S79	K75-S77 PolarHBondContact O-N 3.1Å; K75-S77 VanDerWaalsContact O-N 3.1Å; S77-S79 PolarHBondContact O-N 3.43Å; S77-S79 VanDerWaalsContact O-N 3.12Å
78	P	40.6	Very low	46.9	Very low	115 Å²	115	105.1 Å²	105.1	75%	0.747	60%	0.596	S	S	*	*	S	Bend	trans	-62.8	120.4	170.3	26.4	-29.7	0	0	0	105.8
79	S	34.4	Very low	46.5	Very low	109 Å²	109	102 Å²	102	76%	0.762	58%	0.579	S	S	*	*			trans	56.6	85.4	171.9	51.6	0	0	0	0	116.5	S77	S77-S79 PolarHBondContact O-N 3.43Å; S77-S79 VanDerWaalsContact O-N 3.12Å
80	Y	35.7	Very low	46.4	Very low	200 Å²	200	102.7 Å²	102.7	78%	0.784	59%	0.585	S	S	*	*			trans	-124.2	96.2	146.8	-96.2	-89.6	0	0	0	109.6	S82	Y80-S82 PolarHBondContact O-N 3.28Å
81	S	39	Very low	46.3	Very low	63 Å²	63	106.6 Å²	106.6	44%	0.441	59%	0.594	S	S	.	*			trans	-38.7	113.2	160.7	155.1	0	0	0	0	112.3	L83	S81-L83 PolarHBondContact O-N 2.81Å
82	S	39.1	Very low	46.3	Very low	78 Å²	78	108.6 Å²	108.6	55%	0.545	59%	0.588	S	S	.	*	S	Bend	trans	37.7	23.1	137.5	64.2	0	0	0	0	121.5	Y80	Y80-S82 PolarHBondContact O-N 3.28Å
83	L	42.8	Very low	46.1	Very low	109 Å²	109	107.1 Å²	107.1	57%	0.571	59%	0.586	S	S	*	*			trans	-125.9	123.6	-179.1	-75.6	173.1	0	0	0	108.7	S81 H87	S81-L83 PolarHBondContact O-N 2.81Å; L83-H87 HydrophobicContact CB-CB 3.67Å; L83-H87 HydrophobicContact CD2-CB 4.18Å; L83-H87 HydrophobicContact CG-CB 4.34Å
84	S	50.6	Low	46	Very low	52 Å²	52	102.9 Å²	102.9	36%	0.364	57%	0.566	S	S	.	*			trans	-47.9	154.2	-179.2	56.7	0	0	0	0	111.6	S86 H87	S84-S86 WeakPolarHBondContact CB-OG 3.3Å; S84-S86 PolarHBondContact O-N 3.41Å; S84-S86 PolarHBondContact OG-OG 3.01Å; S84-H87 WeakPolarHBondContact O-CA 3.38Å; S84-H87 WeakPolarHBondContact O-CB 3.17Å; S84-H87 PolarHBondContact O-N 3.05Å; S84-H87 PolarHBondContact OG-ND1 3.35Å
85	P	47.6	Very low	46	Very low	93 Å²	93	102.7 Å²	102.7	60%	0.604	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-50.1	-26.4	175.4	-27.9	34.2	0	0	0	114.3	H87 A88	P85-H87 VanDerWaalsContact C-N 3.34Å; P85-H87 PolarHBondContact O-N 3.03Å; P85-A88 PolarHBondContact O-N 2.99Å
86	S	50.5	Low	45.8	Very low	72 Å²	72	97.3 Å²	97.3	50%	0.503	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-68.1	-24.9	172.8	45.2	0	0	0	0	114.7	S84 R94	S84-S86 WeakPolarHBondContact CB-OG 3.3Å; S84-S86 PolarHBondContact O-N 3.41Å; S84-S86 PolarHBondContact OG-OG 3.01Å; S86-R94 WeakPolarHBondContact O-CD 3.25Å; S86-R94 WeakPolarHBondContact O-CG 3.41Å; S86-R94 PolarHBondContact O-NE 3.29Å
87	H	52.5	Low	45.5	Very low	74 Å²	74	95.6 Å²	95.6	34%	0.343	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-87.2	0.2	175.9	-80.4	93.3	0	0	0	114	L83 S84 P85 R94	L83-H87 HydrophobicContact CB-CB 3.67Å; L83-H87 HydrophobicContact CD2-CB 4.18Å; L83-H87 HydrophobicContact CG-CB 4.34Å; S84-H87 WeakPolarHBondContact O-CA 3.38Å; S84-H87 WeakPolarHBondContact O-CB 3.17Å; S84-H87 PolarHBondContact O-N 3.05Å; S84-H87 PolarHBondContact OG-ND1 3.35Å; P85-H87 VanDerWaalsContact C-N 3.34Å; P85-H87 PolarHBondContact O-N 3.03Å; H87-R94 PolarHBondContact O-NH2 3.46Å
88	A	52.7	Low	45.2	Very low	77 Å²	77	101.4 Å²	101.4	64%	0.636	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-89.8	-15	172.5	0	0	0	0	0	112.9	P85	P85-A88 PolarHBondContact O-N 2.99Å
89	L	48.7	Very low	45.2	Very low	86 Å²	86	105.4 Å²	105.4	45%	0.45	56%	0.559	S	S	.	*	S	Bend	trans	-77.1	148.3	178.9	-67.2	172.9	0	0	0	111.1	C93 R94	L89-C93 HydrophobicContact CB-CB 4Å; L89-R94 HydrophobicContact CB-CG 4.1Å; L89-R94 PolarHBondContact O-NE 2.91Å; L89-R94 PolarHBondContact O-NH2 2.7Å
90	P	46.1	Very low	45.5	Very low	82 Å²	82	106.5 Å²	106.5	53%	0.532	56%	0.555	S	S	.	*			trans	-52.9	149.6	167	-24.7	34.4	0	0	0	111.4	D92 C93 R94	P90-D92 PolarHBondContact O-N 3.08Å; P90-C93 WeakPolarHBondContact O-CA 3.01Å; P90-C93 WeakPolarHBondContact O-CB 3.48Å; P90-C93 PolarHBondContact O-N 2.82Å; P90-R94 PolarHBondContact O-N 2.76Å
91	Y	49.7	Very low	45.6	Very low	140 Å²	140	103.7 Å²	103.7	55%	0.549	55%	0.549	S	S	.	.	H	α-helix	trans	-53.6	-39.7	-175.9	-170.7	-95	0	0	0	112.4	C93 R94 V95 Y208	Y91-C93 PolarHBondContact O-N 3.48Å; Y91-C93 VanDerWaalsContact O-N 3.15Å; Y91-R94 WeakPolarHBondContact O-CB 3.36Å; Y91-R94 PolarHBondContact O-N 3.41Å; Y91-V95 HydrophobicContact CD1-CG2 4.18Å; Y91-V95 HydrophobicContact CE1-CG2 3.73Å; Y91-V95 HydrophobicContact CE2-CG2 4.37Å; Y91-V95 PolarHBondContact O-N 3.46Å; Y91-V95 VanDerWaalsContact O-N 3.16Å; Y91-Y208 HydrophobicContact CE2-CE1 4.32Å
92	D	46.3	Very low	45.9	Very low	117 Å²	117	110 Å²	110	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-61.1	-22.3	176.9	-47.5	-25.9	0	0	0	113.2	P90	P90-D92 PolarHBondContact O-N 3.08Å
93	C	47.6	Very low	46	Very low	82 Å²	82	112.3 Å²	112.3	55%	0.554	58%	0.576	S	S	*	*	H	α-helix	trans	-97.5	-10.4	175.6	-57.7	0	0	0	0	113.2	L89 P90 Y91	L89-C93 HydrophobicContact CB-CB 4Å; P90-C93 WeakPolarHBondContact O-CA 3.01Å; P90-C93 WeakPolarHBondContact O-CB 3.48Å; P90-C93 PolarHBondContact O-N 2.82Å; Y91-C93 PolarHBondContact O-N 3.48Å; Y91-C93 VanDerWaalsContact O-N 3.15Å
94	R	50.4	Low	46	Very low	97 Å²	97	118 Å²	118	37%	0.366	59%	0.59	S	S	.	*	H	α-helix	trans	-89.2	-34.4	176.7	-62.7	-173.8	-160.3	170.6	10.8	112.3	S86 H87 L89 P90 Y91 P96	S86-R94 WeakPolarHBondContact O-CD 3.25Å; S86-R94 WeakPolarHBondContact O-CG 3.41Å; S86-R94 PolarHBondContact O-NE 3.29Å; H87-R94 PolarHBondContact O-NH2 3.46Å; L89-R94 HydrophobicContact CB-CG 4.1Å; L89-R94 PolarHBondContact O-NE 2.91Å; L89-R94 PolarHBondContact O-NH2 2.7Å; P90-R94 PolarHBondContact O-N 2.76Å; Y91-R94 WeakPolarHBondContact O-CB 3.36Å; Y91-R94 PolarHBondContact O-N 3.41Å; R94-P96 WeakPolarHBondContact O-CD 3.4Å
95	V	49.4	Very low	45.6	Very low	58 Å²	58	121.4 Å²	121.4	35%	0.352	61%	0.611	S	S	.	*	S	Bend	trans	-92.9	113.8	178.8	-176	0	0	0	0	107.4	Y91 H97	Y91-V95 HydrophobicContact CD1-CG2 4.18Å; Y91-V95 HydrophobicContact CE1-CG2 3.73Å; Y91-V95 HydrophobicContact CE2-CG2 4.37Å; Y91-V95 PolarHBondContact O-N 3.46Å; Y91-V95 VanDerWaalsContact O-N 3.16Å; V95-H97 PolarHBondContact O-N 2.9Å
96	P	45.9	Very low	45.1	Very low	94 Å²	94	126 Å²	126	61%	0.61	62%	0.622	S	S	*	*			trans	-60.4	113.4	167.5	25	-30.3	0	0	0	106.9	R94 R98	R94-P96 WeakPolarHBondContact O-CD 3.4Å; P96-R98 PolarHBondContact O-N 2.83Å
97	H	41.6	Very low	44.8	Very low	131 Å²	131	131.3 Å²	131.3	61%	0.606	64%	0.638	S	S	*	*			trans	-60.2	85.5	164.7	-77.9	-76.1	0	0	0	107.3	V95 Y99	V95-H97 PolarHBondContact O-N 2.9Å; H97-Y99 HydrophobicContact CB-CD2 4.44Å; H97-Y99 HydrophobicContact CB-CE2 4.16Å; H97-Y99 PolarHBondContact O-N 3.09Å
98	R	38.3	Very low	44.3	Very low	201 Å²	201	133.3 Å²	133.3	76%	0.758	66%	0.655	S	S	*	*			trans	-72.6	94.3	162.8	-66.2	-173.1	-179.9	-174.2	0.4	104.5	P96 I100	P96-R98 PolarHBondContact O-N 2.83Å; R98-I100 HydrophobicContact CB-CD1 4.49Å; R98-I100 HydrophobicContact CB-CG1 3.9Å; R98-I100 PolarHBondContact O-N 3.34Å
99	Y	39.9	Very low	43.9	Very low	199 Å²	199	138.4 Å²	138.4	78%	0.78	67%	0.666	S	S	*	*			trans	-60.8	81.3	152.3	-65.6	-85.6	0	0	0	105.9	H97 E101	H97-Y99 HydrophobicContact CB-CD2 4.44Å; H97-Y99 HydrophobicContact CB-CE2 4.16Å; H97-Y99 PolarHBondContact O-N 3.09Å; Y99-E101 PolarHBondContact O-N 3Å
100	I	40.3	Very low	43.7	Very low	132 Å²	132	138.6 Å²	138.6	68%	0.677	67%	0.671	S	S	*	*			trans	-74.6	80.7	158.9	-52.4	178.2	0	0	0	102.8	R98 Q102	R98-I100 HydrophobicContact CB-CD1 4.49Å; R98-I100 HydrophobicContact CB-CG1 3.9Å; R98-I100 PolarHBondContact O-N 3.34Å; I100-Q102 PolarHBondContact O-N 2.94Å; I100-Q102 VanDerWaalsContact O-N 3.16Å
101	E	39.7	Very low	43.4	Very low	141 Å²	141	142 Å²	142	66%	0.659	68%	0.68	S	S	*	*			trans	-48.2	126.2	155.2	-71	-176.7	167.3	0	0	105.4	Y99 I103	Y99-E101 PolarHBondContact O-N 3Å; E101-I103 HydrophobicContact CB-CD1 4.21Å; E101-I103 HydrophobicContact CB-CG1 3.98Å; E101-I103 PolarHBondContact O-N 2.79Å
102	Q	43.9	Very low	43.2	Very low	195 Å²	195	139.5 Å²	139.5	91%	0.911	68%	0.676	S	S	*	*			trans	-67.6	53.5	178.3	-68.1	178.8	-23	0	0	110.4	I100 R104	I100-Q102 PolarHBondContact O-N 2.94Å; I100-Q102 VanDerWaalsContact O-N 3.16Å; Q102-R104 PolarHBondContact O-N 3.49Å; Q102-R104 VanDerWaalsContact O-N 3.09Å
103	I	42.5	Very low	43.1	Very low	127 Å²	127	141.6 Å²	141.6	65%	0.651	68%	0.675	S	S	*	*			trans	-68.3	106.9	167.4	-58.2	171.5	0	0	0	104.1	E101	E101-I103 HydrophobicContact CB-CD1 4.21Å; E101-I103 HydrophobicContact CB-CG1 3.98Å; E101-I103 PolarHBondContact O-N 2.79Å
104	R	42	Very low	42.8	Very low	228 Å²	228	144.5 Å²	144.5	86%	0.86	68%	0.676	S	S	*	*			trans	-46.6	127.3	168.7	-71.6	-176.3	-175.8	-178.4	1.1	107	Q102 K106	Q102-R104 PolarHBondContact O-N 3.49Å; Q102-R104 VanDerWaalsContact O-N 3.09Å; R104-K106 PolarHBondContact O-N 3.07Å
105	P	41.5	Very low	42.6	Very low	124 Å²	124	145.7 Å²	145.7	81%	0.805	69%	0.689	S	S	*	*			trans	-54.5	114.2	179.9	21.1	-31.1	0	0	0	107.7	Q107	P105-Q107 PolarHBondContact O-N 3.36Å
106	K	38.2	Very low	42.6	Very low	189 Å²	189	148.4 Å²	148.4	82%	0.822	70%	0.701	S	S	*	*			trans	-58.3	115	173.3	-174.3	178.1	-179.6	-178.9	0	105.7	R104 V108	R104-K106 PolarHBondContact O-N 3.07Å; K106-V108 PolarHBondContact O-N 3.29Å
107	Q	42.7	Very low	42.8	Very low	183 Å²	183	146.7 Å²	146.7	86%	0.855	69%	0.691	S	S	*	*			trans	-54	112.3	169.8	-100.4	177.9	-20.5	0	0	106.5	P105 E109	P105-Q107 PolarHBondContact O-N 3.36Å; Q107-E109 PolarHBondContact O-N 3.45Å; Q107-E109 VanDerWaalsContact O-N 3.11Å
108	V	42.5	Very low	43	Very low	116 Å²	116	143.9 Å²	143.9	70%	0.703	68%	0.676	S	S	*	*			trans	-70.7	106	168.4	179.7	0	0	0	0	104.2	K106 T110	K106-V108 PolarHBondContact O-N 3.29Å; V108-T110 HydrophobicContact CG1-CG2 3.99Å; V108-T110 PolarHBondContact O-N 3.14Å
109	E	44.7	Very low	43.7	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	66%	0.658	S	S	*	*			trans	-60.5	91	161.4	-71	-179	178.2	0	0	106	Q107 E111	Q107-E109 PolarHBondContact O-N 3.45Å; Q107-E109 VanDerWaalsContact O-N 3.11Å; E109-E111 VanDerWaalsContact C-N 3.31Å; E109-E111 PolarHBondContact O-N 3.28Å
110	T	43.8	Very low	44.5	Very low	90 Å²	90	133.2 Å²	133.2	55%	0.552	66%	0.656	S	S	*	*			trans	-69.7	98.6	170.7	46.9	0	0	0	0	105.8	V108 N112	V108-T110 HydrophobicContact CG1-CG2 3.99Å; V108-T110 PolarHBondContact O-N 3.14Å; T110-N112 PolarHBondContact O-N 3.49Å
111	E	40.3	Very low	45.1	Very low	153 Å²	153	134.3 Å²	134.3	72%	0.715	65%	0.653	S	S	*	*			trans	-49.3	117.9	165.9	-76.5	-177.4	174.9	0	0	107.3	E109 W113	E109-E111 VanDerWaalsContact C-N 3.31Å; E109-E111 PolarHBondContact O-N 3.28Å; E111-W113 VanDerWaalsContact O-CD1 3.32Å; E111-W113 PolarHBondContact O-N 3.43Å
112	N	46.4	Very low	46	Very low	88 Å²	88	131.9 Å²	131.9	47%	0.471	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	8.4	-175.2	-96.7	-21.7	0	0	0	113.9	T110 Y114 L115 N116	T110-N112 PolarHBondContact O-N 3.49Å; N112-Y114 VanDerWaalsContact C-N 3.25Å; N112-Y114 PolarHBondContact O-N 3.1Å; N112-L115 PolarHBondContact O-N 3.36Å; N112-N116 HydrophobicContact CB-CB 4.49Å; N112-N116 WeakPolarHBondContact CB-ND2 3.06Å; N112-N116 WeakPolarHBondContact O-CB 3.38Å; N112-N116 PolarHBondContact O-N 2.59Å
113	W	43.4	Very low	46.7	Very low	161 Å²	161	127.5 Å²	127.5	61%	0.61	62%	0.619	S	S	*	*	H	α-helix	trans	-60.4	-35.4	177	87.7	-83.7	0	0	0	112	E111 S117	E111-W113 VanDerWaalsContact O-CD1 3.32Å; E111-W113 PolarHBondContact O-N 3.43Å; W113-S117 PolarHBondContact O-OG 3.4Å
114	Y	41	Very low	47.5	Very low	142 Å²	142	128.3 Å²	128.3	56%	0.557	61%	0.614	S	S	*	*	H	α-helix	trans	-83.4	-21.4	178.6	-131.8	-93.7	0	0	0	113.6	N112 Y118	N112-Y114 VanDerWaalsContact C-N 3.25Å; N112-Y114 PolarHBondContact O-N 3.1Å; Y114-Y118 WeakPolarHBondContact O-CB 3Å
115	L	47.5	Very low	48.3	Very low	122 Å²	122	124.4 Å²	124.4	64%	0.639	60%	0.6	S	S	*	*	H	α-helix	trans	-99.7	-31.6	-175.3	-85.7	153	0	0	0	113.5	N112	N112-L115 PolarHBondContact O-N 3.36Å
116	N	49.2	Very low	49.1	Very low	116 Å²	116	120.7 Å²	120.7	62%	0.62	57%	0.574	S	S	*	*	H	α-helix	trans	-101.4	-31.5	-175.3	-70.3	-8.7	0	0	0	114	N112	N112-N116 HydrophobicContact CB-CB 4.49Å; N112-N116 WeakPolarHBondContact CB-ND2 3.06Å; N112-N116 WeakPolarHBondContact O-CB 3.38Å; N112-N116 PolarHBondContact O-N 2.59Å
117	S	49.9	Very low	50	Low	57 Å²	57	114.2 Å²	114.2	40%	0.399	55%	0.548	S	S	.	.	S	Bend	trans	-90.6	-30.9	179.4	3.4	0	0	0	0	112.8	W113 T119 Q122	W113-S117 PolarHBondContact O-OG 3.4Å; S117-T119 VanDerWaalsContact C-N 3.28Å; S117-T119 PolarHBondContact O-N 2.91Å; S117-Q122 PolarHBondContact O-NE2 2.8Å; S117-Q122 PolarHBondContact O-OE1 3.49Å
118	Y	45	Very low	51	Low	73 Å²	73	110.3 Å²	110.3	29%	0.286	53%	0.532	S	S	.	.			trans	-88.9	66.8	-170.7	-145.3	-107.8	0	0	0	111.4	Y114 Q122 F123 T126	Y114-Y118 WeakPolarHBondContact O-CB 3Å; Y118-Q122 HydrophobicContact CD2-CB 4.4Å; Y118-F123 HydrophobicContact CD1-CB 4.16Å; Y118-F123 HydrophobicContact CE1-CB 3.64Å; Y118-F123 AromaticContact CE1-CD2 3.57Å; Y118-F123 HydrophobicContact CE1-CD2 3.57Å; Y118-F123 HydrophobicContact CE1-CG 4.05Å; Y118-T126 PolarHBondContact OH-OG1 3.49Å
119	T	53.1	Low	52.1	Low	63 Å²	63	110.8 Å²	110.8	39%	0.387	53%	0.531	S	S	.	.			trans	-59.6	153	173.2	55	0	0	0	0	110.3	S117 Y121 Q122 F123	S117-T119 VanDerWaalsContact C-N 3.28Å; S117-T119 PolarHBondContact O-N 2.91Å; T119-Y121 PolarHBondContact O-N 3.25Å; T119-Q122 WeakPolarHBondContact O-CA 3.06Å; T119-Q122 PolarHBondContact O-N 3.06Å; T119-Q122 PolarHBondContact OG1-N 2.79Å; T119-F123 PolarHBondContact O-N 2.66Å
120	P	56.3	Low	52.7	Low	113 Å²	113	107.6 Å²	107.6	73%	0.734	52%	0.519	S	S	*	.	H	α-helix	trans	-50.5	-28.4	171.7	-25.5	32.7	0	0	0	112.8	R124	P120-R124 WeakPolarHBondContact O-CB 3.42Å; P120-R124 PolarHBondContact O-N 3.43Å
121	Y	54.5	Low	52.7	Low	155 Å²	155	106 Å²	106	61%	0.608	52%	0.52	S	S	*	.	H	α-helix	trans	-66.5	-48.2	172.4	-176.4	-94.8	0	0	0	112.9	T119 R124 R125	T119-Y121 PolarHBondContact O-N 3.25Å; Y121-R124 PolarHBondContact O-N 3.25Å; Y121-R125 VanDerWaalsContact O-CB 3.3Å; Y121-R125 WeakPolarHBondContact O-CB 3.48Å; Y121-R125 PolarHBondContact O-N 3.34Å
122	Q	58.8	Low	52.9	Low	90 Å²	90	100.7 Å²	100.7	42%	0.421	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-41.3	174.2	-74.5	-162.7	9.4	0	0	111.7	S117 Y118 T119 R124 R125 T126	S117-Q122 PolarHBondContact O-NE2 2.8Å; S117-Q122 PolarHBondContact O-OE1 3.49Å; Y118-Q122 HydrophobicContact CD2-CB 4.4Å; T119-Q122 WeakPolarHBondContact O-CA 3.06Å; T119-Q122 PolarHBondContact O-N 3.06Å; T119-Q122 PolarHBondContact OG1-N 2.79Å; Q122-R124 PolarHBondContact O-N 2.93Å; Q122-R125 CarbonylContact O-C 3.47Å; Q122-R125 PolarHBondContact O-N 3.48Å; Q122-T126 PolarHBondContact O-N 2.81Å; Q122-T126 PolarHBondContact O-OG1 2.82Å
123	F	58.6	Low	52.5	Low	102 Å²	102	98.7 Å²	98.7	45%	0.447	49%	0.492	S	S	.	.	H	α-helix	trans	-58.4	-49.5	174.3	178.9	-115.1	0	0	0	111.7	Y118 T119 R125 T126 M127	Y118-F123 HydrophobicContact CD1-CB 4.16Å; Y118-F123 HydrophobicContact CE1-CB 3.64Å; Y118-F123 AromaticContact CE1-CD2 3.57Å; Y118-F123 HydrophobicContact CE1-CD2 3.57Å; Y118-F123 HydrophobicContact CE1-CG 4.05Å; T119-F123 PolarHBondContact O-N 2.66Å; F123-R125 VanDerWaalsContact C-N 3.29Å; F123-R125 PolarHBondContact O-N 2.87Å; F123-T126 WeakPolarHBondContact CA-OG1 3.32Å; F123-T126 PolarHBondContact O-N 3.47Å; F123-T126 PolarHBondContact O-OG1 2.85Å; F123-M127 HydrophobicContact CD1-CG 4.34Å; F123-M127 HydrophobicContact CD2-CG 3.96Å; F123-M127 HydrophobicContact CE1-CE 4.3Å; F123-M127 HydrophobicContact CE1-CG 4.11Å; F123-M127 HydrophobicContact CE2-CE 4.23Å; F123-M127 HydrophobicContact CE2-CG 3.76Å; F123-M127 HydrophobicContact CE2-SD 4.05Å; F123-M127 HydrophobicContact CG-CG 4.31Å; F123-M127 HydrophobicContact CZ-CE 3.7Å; F123-M127 HydrophobicContact CZ-CG 3.86Å; F123-M127 HydrophobicContact CZ-SD 4.12Å; F123-M127 VanDerWaalsContact O-CB 3.32Å; F123-M127 WeakPolarHBondContact O-CB 3.1Å; F123-M127 WeakPolarHBondContact O-CG 3.5Å; F123-M127 PolarHBondContact O-N 2.83Å
124	R	58.7	Low	52.6	Low	145 Å²	145	95.4 Å²	95.4	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-59.6	-40.4	176.3	-169.4	178.9	-171.7	-172.5	2.1	111.3	P120 Y121 Q122 M127 L128 E378	P120-R124 WeakPolarHBondContact O-CB 3.42Å; P120-R124 PolarHBondContact O-N 3.43Å; Y121-R124 PolarHBondContact O-N 3.25Å; Q122-R124 PolarHBondContact O-N 2.93Å; R124-M127 PolarHBondContact O-N 3.03Å; R124-L128 HydrophobicContact CG-CD1 4.25Å; R124-L128 WeakPolarHBondContact O-CB 3.25Å; R124-L128 VanDerWaalsContact O-CG 3.22Å; R124-L128 WeakPolarHBondContact O-CG 3.36Å; R124-L128 PolarHBondContact O-N 3.16Å; R124-E378 IonicContact NH1-OE1 3.76Å
125	R	58.3	Low	52.8	Low	146 Å²	146	97.5 Å²	97.5	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-66.8	-47.4	177.4	-165.9	176.6	174.2	-179.3	0.1	112	Y121 Q122 F123 M127 L128 D129	Y121-R125 VanDerWaalsContact O-CB 3.3Å; Y121-R125 WeakPolarHBondContact O-CB 3.48Å; Y121-R125 PolarHBondContact O-N 3.34Å; Q122-R125 CarbonylContact O-C 3.47Å; Q122-R125 PolarHBondContact O-N 3.48Å; F123-R125 VanDerWaalsContact C-N 3.29Å; F123-R125 PolarHBondContact O-N 2.87Å; R125-M127 VanDerWaalsContact C-N 3.31Å; R125-M127 PolarHBondContact O-N 2.95Å; R125-L128 WeakPolarHBondContact O-CB 3.13Å; R125-L128 PolarHBondContact O-N 2.79Å; R125-D129 WeakPolarHBondContact O-CB 3.4Å; R125-D129 VanDerWaalsContact O-CG 3.28Å; R125-D129 PolarHBondContact O-N 3.47Å
126	T	59.2	Low	52.5	Low	45 Å²	45	98.7 Å²	98.7	28%	0.276	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-36.9	171.9	30.4	0	0	0	0	112.3	Y118 Q122 F123 L128 D129 L130	Y118-T126 PolarHBondContact OH-OG1 3.49Å; Q122-T126 PolarHBondContact O-N 2.81Å; Q122-T126 PolarHBondContact O-OG1 2.82Å; F123-T126 WeakPolarHBondContact CA-OG1 3.32Å; F123-T126 PolarHBondContact O-N 3.47Å; F123-T126 PolarHBondContact O-OG1 2.85Å; T126-L128 VanDerWaalsContact C-N 3.33Å; T126-D129 PolarHBondContact O-N 3.18Å; T126-L130 WeakPolarHBondContact O-CB 3.45Å; T126-L130 WeakPolarHBondContact O-CD1 3.32Å; T126-L130 WeakPolarHBondContact O-CG 3.26Å; T126-L130 PolarHBondContact O-N 2.75Å
127	M	57	Low	52.1	Low	54 Å²	54	100.6 Å²	100.6	27%	0.266	53%	0.533	S	S	.	.	H	α-helix	trans	-73.2	-26.7	178.1	-68.2	-78	-94.7	0	0	112.4	F123 R124 R125 C132 C133	F123-M127 HydrophobicContact CD1-CG 4.34Å; F123-M127 HydrophobicContact CD2-CG 3.96Å; F123-M127 HydrophobicContact CE1-CE 4.3Å; F123-M127 HydrophobicContact CE1-CG 4.11Å; F123-M127 HydrophobicContact CE2-CE 4.23Å; F123-M127 HydrophobicContact CE2-CG 3.76Å; F123-M127 HydrophobicContact CE2-SD 4.05Å; F123-M127 HydrophobicContact CG-CG 4.31Å; F123-M127 HydrophobicContact CZ-CE 3.7Å; F123-M127 HydrophobicContact CZ-CG 3.86Å; F123-M127 HydrophobicContact CZ-SD 4.12Å; F123-M127 VanDerWaalsContact O-CB 3.32Å; F123-M127 WeakPolarHBondContact O-CB 3.1Å; F123-M127 WeakPolarHBondContact O-CG 3.5Å; F123-M127 PolarHBondContact O-N 2.83Å; R124-M127 PolarHBondContact O-N 3.03Å; R125-M127 VanDerWaalsContact C-N 3.31Å; R125-M127 PolarHBondContact O-N 2.95Å; M127-C132 PolarHBondContact O-N 3.27Å; M127-C132 HydrophobicContact SD-CB 3.89Å; M127-C133 HydrophobicContact CB-CB 4.43Å; M127-C133 WeakPolarHBondContact CB-SG 3.5Å; M127-C133 PolarHBondContact O-N 3.03Å
128	L	63.3	Low	51.3	Low	101 Å²	101	101.6 Å²	101.6	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-74.2	-44.8	168.4	-75.3	167.2	0	0	0	111.7	R124 R125 T126 G131 C133	R124-L128 HydrophobicContact CG-CD1 4.25Å; R124-L128 WeakPolarHBondContact O-CB 3.25Å; R124-L128 VanDerWaalsContact O-CG 3.22Å; R124-L128 WeakPolarHBondContact O-CG 3.36Å; R124-L128 PolarHBondContact O-N 3.16Å; R125-L128 WeakPolarHBondContact O-CB 3.13Å; R125-L128 PolarHBondContact O-N 2.79Å; T126-L128 VanDerWaalsContact C-N 3.33Å; L128-G131 PolarHBondContact O-N 3.41Å; L128-C133 HydrophobicContact CD2-CB 4.31Å
129	D	65	Low	50.7	Low	125 Å²	125	104 Å²	104	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-67.6	-38.6	179.6	-72.5	-19.3	0	0	0	112.1	R125 T126 G131	R125-D129 WeakPolarHBondContact O-CB 3.4Å; R125-D129 VanDerWaalsContact O-CG 3.28Å; R125-D129 PolarHBondContact O-N 3.47Å; T126-D129 PolarHBondContact O-N 3.18Å; D129-G131 PolarHBondContact O-N 3.35Å
130	L	57.1	Low	50	Low	119 Å²	119	112.8 Å²	112.8	62%	0.623	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	2.3	176.2	-67.5	166.6	0	0	0	113.1	T126 C132	T126-L130 WeakPolarHBondContact O-CB 3.45Å; T126-L130 WeakPolarHBondContact O-CD1 3.32Å; T126-L130 WeakPolarHBondContact O-CG 3.26Å; T126-L130 PolarHBondContact O-N 2.75Å; L130-C132 HydrophobicContact CB-CB 4.43Å; L130-C132 PolarHBondContact O-N 3.31Å; L130-C132 PolarHBondContact O-SG 3.09Å
131	G	45.4	Very low	48.9	Very low	55 Å²	55	112.9 Å²	112.9	57%	0.567	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.1	14	-178	0	0	0	0	0	114.5	L128 D129	L128-G131 PolarHBondContact O-N 3.41Å; D129-G131 PolarHBondContact O-N 3.35Å
132	C	43.9	Very low	47.9	Very low	42 Å²	42	110 Å²	110	28%	0.284	60%	0.596	S	S	.	*			trans	-82.6	-27.4	-173.3	-68	0	0	0	0	112.6	M127 L130 R159	M127-C132 PolarHBondContact O-N 3.27Å; M127-C132 HydrophobicContact SD-CB 3.89Å; L130-C132 HydrophobicContact CB-CB 4.43Å; L130-C132 PolarHBondContact O-N 3.31Å; L130-C132 PolarHBondContact O-SG 3.09Å; C132-R159 PolarHBondContact O-NH1 2.68Å; C132-R159 PolarHBondContact O-NH2 3.49Å
133	C	38.5	Very low	46.7	Very low	47 Å²	47	112.7 Å²	112.7	32%	0.318	61%	0.613	S	S	.	*	S	Bend	trans	-80.5	126.1	168.6	-80.7	0	0	0	0	110	M127 L128 K135	M127-C133 HydrophobicContact CB-CB 4.43Å; M127-C133 WeakPolarHBondContact CB-SG 3.5Å; M127-C133 PolarHBondContact O-N 3.03Å; L128-C133 HydrophobicContact CD2-CB 4.31Å; C133-K135 PolarHBondContact O-N 2.96Å
134	A	43.8	Very low	45.6	Very low	91 Å²	91	114.2 Å²	114.2	75%	0.752	63%	0.63	S	S	*	*			trans	-50.9	112.3	169.3	0	0	0	0	0	108.8	L136	A134-L136 PolarHBondContact O-N 3.16Å; A134-L136 VanDerWaalsContact O-N 3.12Å
135	K	46.2	Very low	44.3	Very low	187 Å²	187	116.4 Å²	116.4	81%	0.813	65%	0.649	S	S	*	*			trans	-47.7	124.1	166.7	-75.1	-179	176.5	178.3	0	106.5	C133 T137	C133-K135 PolarHBondContact O-N 2.96Å; K135-T137 PolarHBondContact O-N 3.03Å
136	L	41	Very low	43.2	Very low	147 Å²	147	113 Å²	113	77%	0.77	65%	0.652	S	S	*	*			trans	-51.2	117.1	172.2	-96.8	99.3	0	0	0	106.7	A134 S138	A134-L136 PolarHBondContact O-N 3.16Å; A134-L136 VanDerWaalsContact O-N 3.12Å; L136-S138 PolarHBondContact O-N 2.9Å
137	T	40.2	Very low	41.8	Very low	155 Å²	155	116.3 Å²	116.3	95%	0.951	67%	0.672	S	S	*	*			trans	-68.7	68.7	168.5	40.3	0	0	0	0	108.7	K135	K135-T137 PolarHBondContact O-N 3.03Å
138	S	33.8	Very low	40.5	Very low	79 Å²	79	124 Å²	124	55%	0.552	70%	0.7	S	S	*	*			trans	-119.8	134.9	157.2	59.2	0	0	0	0	105.8	L136	L136-S138 PolarHBondContact O-N 2.9Å
139	C	31.2	Very low	39.5	Very low	124 Å²	124	124.4 Å²	124.4	84%	0.838	71%	0.709	S	S	*	*			trans	82.3	67.1	-179.9	-42.8	0	0	0	0	115.4
140	R	38.8	Very low	38.1	Very low	247 Å²	247	123 Å²	123	93%	0.932	71%	0.709	S	S	*	*			trans	-114.4	105.2	140.4	-108.3	-175.8	176.5	171.4	-1	108.2	S142	R140-S142 PolarHBondContact O-N 2.77Å
141	P	33.8	Very low	37	Very low	114 Å²	114	124.8 Å²	124.8	74%	0.74	72%	0.719	S	S	*	*			trans	-62.2	135.5	161.7	7.2	4.9	0	0	0	107.3
142	S	33.6	Very low	36.6	Very low	95 Å²	95	130 Å²	130	66%	0.664	73%	0.728	S	S	*	*	S	Bend	trans	-48.4	142.8	164.9	57.3	0	0	0	0	109.3	R140	R140-S142 PolarHBondContact O-N 2.77Å
143	N	32.4	Very low	36.4	Very low	147 Å²	147	136 Å²	136	79%	0.786	76%	0.756	S	S	*	*			trans	92.8	60	164.5	-40.7	-24.3	0	0	0	117.1
144	V	37.1	Very low	36.2	Very low	133 Å²	133	138 Å²	138	81%	0.806	77%	0.771	S	S	*	*			trans	-146.3	109.6	150.1	-170.8	0	0	0	0	110.3	A146	V144-A146 HydrophobicContact CG1-CB 4.14Å; V144-A146 PolarHBondContact O-N 3.15Å
145	M	30.3	Very low	35.7	Very low	191 Å²	191	144.3 Å²	144.3	94%	0.941	78%	0.777	S	S	*	*			trans	-67.2	115.6	155	-88.5	-147.5	160	0	0	108.8
146	A	35.2	Very low	35.3	Very low	75 Å²	75	144.2 Å²	144.2	62%	0.62	77%	0.773	S	S	*	*			trans	-159.3	100.1	165.4	0	0	0	0	0	105.2	V144	V144-A146 HydrophobicContact CG1-CB 4.14Å; V144-A146 PolarHBondContact O-N 3.15Å
147	T	31.1	Very low	35.2	Very low	114 Å²	114	142.2 Å²	142.2	70%	0.699	77%	0.769	S	S	*	*				59	100.5	68.8	-25.6	0	0	0	0	111.6
148	Y	29.7	Very low	35.1	Very low	216 Å²	216	142.2 Å²	142.2	85%	0.847	75%	0.752	S	S	*	*			trans	77	169.8	173.6	-58.8	-74	0	0	0	118.5
149	P	41.7	Very low	35.5	Very low	110 Å²	110	145.5 Å²	145.5	71%	0.714	75%	0.753	S	S	*	*				-130.5	174.3	-76.1	37.2	-19.3	0	0	0	112
150	S	35.5	Very low	36	Very low	96 Å²	96	146.6 Å²	146.6	67%	0.671	75%	0.75	S	S	*	*			trans	-167.6	118.4	148.7	55.1	0	0	0	0	112.7	H152	S150-H152 PolarHBondContact O-N 3.16Å
151	D	33.3	Very low	36.2	Very low	155 Å²	155	138.2 Å²	138.2	83%	0.829	73%	0.729	S	S	*	*			trans	-78.7	40.7	-175.4	-71.4	-42.9	0	0	0	114.4
152	H	38.2	Very low	36.5	Very low	165 Å²	165	141.5 Å²	141.5	76%	0.764	73%	0.729	S	S	*	*			trans	-127.9	36.5	-178.1	-60.1	-49.4	0	0	0	113.3	S150 S154	S150-H152 PolarHBondContact O-N 3.16Å; H152-S154 PolarHBondContact O-N 2.93Å
153	L	38.1	Very low	36.8	Very low	167 Å²	167	143.1 Å²	143.1	87%	0.874	72%	0.724	S	S	*	*			trans	-59.3	100.1	173.9	-86	153.1	0	0	0	110.5	Y155	L153-Y155 PolarHBondContact O-N 3.35Å
154	S	34.3	Very low	37.5	Very low	91 Å²	91	138.6 Å²	138.6	64%	0.636	71%	0.712	S	S	*	*			trans	-53.9	131.3	172.9	-40.3	0	0	0	0	109.7	H152 Y156	H152-S154 PolarHBondContact O-N 2.93Å; S154-Y156 PolarHBondContact O-N 2.7Å
155	Y	35.2	Very low	38	Very low	222 Å²	222	135.9 Å²	135.9	87%	0.871	69%	0.693	S	S	*	*	S	Bend	trans	-66.3	29.7	-168.2	-148.2	-97.2	0	0	0	115.7	L153 P157	L153-Y155 PolarHBondContact O-N 3.35Å; Y155-P157 WeakPolarHBondContact O-CD 3.21Å
156	Y	36.1	Very low	38.9	Very low	186 Å²	186	132.7 Å²	132.7	73%	0.729	68%	0.675	S	S	*	*			trans	-115.6	93.9	-179.9	-82.1	-80	0	0	0	111	S154 Y158	S154-Y156 PolarHBondContact O-N 2.7Å; Y156-Y158 PolarHBondContact O-N 3.28Å
157	P	39.4	Very low	39.5	Very low	104 Å²	104	139.3 Å²	139.3	68%	0.675	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	8.9	-178.9	28.7	-34	0	0	0	114.4	Y155	Y155-P157 WeakPolarHBondContact O-CD 3.21Å
158	Y	39.3	Very low	40.2	Very low	155 Å²	155	142.8 Å²	142.8	61%	0.608	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-6.2	-170.3	-62.1	-73.9	0	0	0	115	Y156	Y156-Y158 PolarHBondContact O-N 3.28Å
159	R	42.3	Very low	41	Very low	148 Å²	148	138.6 Å²	138.6	56%	0.558	67%	0.674	S	S	*	*	H	α-helix	trans	-79.3	-39.3	-165.4	-142.3	177.1	-173.3	-164.4	-0.3	114.2	C132	C132-R159 PolarHBondContact O-NH1 2.68Å; C132-R159 PolarHBondContact O-NH2 3.49Å
160	D	40.7	Very low	41.3	Very low	147 Å²	147	139.6 Å²	139.6	79%	0.786	67%	0.674	S	S	*	*	H	α-helix	trans	-87.7	-24.8	-171.6	-69	-15.5	0	0	0	114.2	G164	D160-G164 WeakPolarHBondContact O-CA 3.42Å; D160-G164 PolarHBondContact O-N 2.97Å; D160-G164 VanDerWaalsContact O-N 3.09Å
161	S	43.4	Very low	41.7	Very low	71 Å²	71	141 Å²	141	50%	0.497	67%	0.67	S	S	.	*	H	α-helix	trans	-81.8	-26.3	-179	48.2	0	0	0	0	113.7	N165	S161-N165 PolarHBondContact O-ND2 3.27Å
162	Y	38.9	Very low	42.4	Very low	184 Å²	184	137.5 Å²	137.5	72%	0.722	66%	0.657	S	S	*	*	H	α-helix	trans	-82.1	-38.6	-179.4	-151.4	-93.2	0	0	0	112.3
163	F	41.4	Very low	42.6	Very low	129 Å²	129	139.7 Å²	139.7	57%	0.566	66%	0.66	S	S	*	*	H	α-helix	trans	-96.7	-28.2	-177.8	-66.8	-77.8	0	0	0	113.6	N165 Q166	F163-N165 PolarHBondContact O-N 3.5Å; F163-Q166 PolarHBondContact O-N 2.87Å
164	G	46.8	Very low	42.8	Very low	52 Å²	52	137.3 Å²	137.3	54%	0.536	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-17.9	178.4	0	0	0	0	0	115	D160	D160-G164 WeakPolarHBondContact O-CA 3.42Å; D160-G164 PolarHBondContact O-N 2.97Å; D160-G164 VanDerWaalsContact O-N 3.09Å
165	N	46.9	Very low	43.3	Very low	76 Å²	76	139.3 Å²	139.3	41%	0.406	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	3.8	-179.1	-84.4	-29.4	0	0	0	114.9	S161 F163 R167 W168 M169	S161-N165 PolarHBondContact O-ND2 3.27Å; F163-N165 PolarHBondContact O-N 3.5Å; N165-R167 PolarHBondContact O-N 2.84Å; N165-W168 WeakPolarHBondContact O-CB 3.21Å; N165-W168 PolarHBondContact O-N 2.84Å; N165-M169 PolarHBondContact O-N 2.71Å
166	Q	50.2	Low	43.7	Very low	123 Å²	123	140.1 Å²	140.1	58%	0.575	64%	0.641	S	S	*	*	H	α-helix	trans	-60.9	-31.3	175.2	-77	-177.5	-11.2	0	0	112.8	F163 M169 N170	F163-Q166 PolarHBondContact O-N 2.87Å; Q166-M169 PolarHBondContact O-N 3.33Å; Q166-N170 PolarHBondContact O-N 3.03Å
167	R	47.8	Very low	44	Very low	214 Å²	214	133 Å²	133	81%	0.808	62%	0.619	S	S	*	*	H	α-helix	trans	-69.5	-30.6	172.2	-77.7	-173.9	176.6	-176	0	113.3	N165	N165-R167 PolarHBondContact O-N 2.84Å
168	W	45.4	Very low	44.4	Very low	187 Å²	187	132.5 Å²	132.5	71%	0.708	62%	0.617	S	S	*	*	H	α-helix	trans	-77.5	-30.6	176.7	-69.9	78.5	0	0	0	112.1	N165 N170 H171	N165-W168 WeakPolarHBondContact O-CB 3.21Å; N165-W168 PolarHBondContact O-N 2.84Å; W168-N170 VanDerWaalsContact C-N 3.31Å; W168-H171 PolarHBondContact O-N 2.77Å
169	M	46.3	Very low	44.7	Very low	128 Å²	128	127.9 Å²	127.9	63%	0.631	60%	0.603	S	S	*	*	H	α-helix	trans	-72.4	-22.3	172.5	-66.5	-144.6	-178	0	0	113.5	N165 Q166 H171	N165-M169 PolarHBondContact O-N 2.71Å; Q166-M169 PolarHBondContact O-N 3.33Å; M169-H171 VanDerWaalsContact C-N 3.33Å
170	N	47.8	Very low	45.1	Very low	131 Å²	131	129.3 Å²	129.3	70%	0.701	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-10.2	176.5	-77.5	-14.1	0	0	0	114	Q166 W168 S172	Q166-N170 PolarHBondContact O-N 3.03Å; W168-N170 VanDerWaalsContact C-N 3.31Å; N170-S172 PolarHBondContact O-N 2.82Å
171	H	44.4	Very low	45.7	Very low	127 Å²	127	129.5 Å²	129.5	59%	0.588	61%	0.605	S	S	*	*	S	Bend	trans	-73.4	128.8	176	-94.2	-79.4	0	0	0	110.9	W168 M169 Y173 Y174	W168-H171 PolarHBondContact O-N 2.77Å; M169-H171 VanDerWaalsContact C-N 3.33Å; H171-Y173 PolarHBondContact O-N 3.25Å; H171-Y174 PolarHBondContact O-N 2.87Å
172	S	47.6	Very low	46.2	Very low	81 Å²	81	128.9 Å²	128.9	57%	0.566	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.2	-6	178.7	31.7	0	0	0	0	117.5	N170	N170-S172 PolarHBondContact O-N 2.82Å
173	Y	43.2	Very low	47	Very low	211 Å²	211	124 Å²	124	83%	0.827	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-31.5	170	-114.2	-91.2	0	0	0	113.7	H171	H171-Y173 PolarHBondContact O-N 3.25Å
174	Y	40.7	Very low	48	Very low	117 Å²	117	119.8 Å²	119.8	46%	0.459	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-14.7	175.4	-85	-88.7	0	0	0	113.5	H171 R176 S177 L179	H171-Y174 PolarHBondContact O-N 2.87Å; Y174-R176 PolarHBondContact O-N 2.73Å; Y174-S177 PolarHBondContact O-OG 3.36Å; Y174-L179 HydrophobicContact CD1-CD1 4.03Å; Y174-L179 HydrophobicContact CE1-CD1 3.52Å
175	Q	44.8	Very low	48.6	Very low	132 Å²	132	125.1 Å²	125.1	62%	0.617	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-13.6	179.3	-71.7	-173.5	-9.5	0	0	113.7
176	R	43.5	Very low	49.3	Very low	240 Å²	240	126.9 Å²	126.9	91%	0.906	60%	0.595	S	S	*	*	S	Bend	trans	-118.2	-5.8	-177.2	-73.2	-176.1	175.7	169.4	-1.1	115	Y174	Y174-R176 PolarHBondContact O-N 2.73Å
177	S	43.9	Very low	49.7	Very low	37 Å²	37	129.5 Å²	129.5	26%	0.259	60%	0.6	S	S	.	*	S	Bend	trans	-90.6	149	-167.7	62.3	0	0	0	0	112	Y174 L179 R180	Y174-S177 PolarHBondContact O-OG 3.36Å; S177-L179 PolarHBondContact O-N 3.12Å; S177-R180 PolarHBondContact O-N 2.92Å
178	S	46.5	Very low	50.4	Low	92 Å²	92	123.4 Å²	123.4	64%	0.643	58%	0.583	S	S	*	*	H	α-helix	trans	-48.2	-11.9	175.5	-41.3	0	0	0	0	114.6	S182	S178-S182 VanDerWaalsContact O-CB 3.29Å; S178-S182 WeakPolarHBondContact O-CB 3.46Å; S178-S182 PolarHBondContact O-N 3.32Å; S178-S182 PolarHBondContact O-OG 3.26Å
179	L	45.8	Very low	51	Low	58 Å²	58	119.9 Å²	119.9	30%	0.304	57%	0.571	S	S	.	*	H	α-helix	trans	-66.4	-41.4	171.5	-76.1	165.3	0	0	0	113.5	F45 Y174 S177 Q181 S182 C183	F45-L179 HydrophobicContact CE1-CD2 3.92Å; F45-L179 HydrophobicContact CZ-CD2 4.27Å; Y174-L179 HydrophobicContact CD1-CD1 4.03Å; Y174-L179 HydrophobicContact CE1-CD1 3.52Å; S177-L179 PolarHBondContact O-N 3.12Å; L179-Q181 VanDerWaalsContact C-N 3.34Å; L179-S182 VanDerWaalsContact CA-OG 3.26Å; L179-S182 WeakPolarHBondContact CA-OG 3.38Å; L179-S182 PolarHBondContact O-N 2.9Å; L179-S182 PolarHBondContact O-OG 3.26Å; L179-S182 VanDerWaalsContact O-OG 3.12Å; L179-C183 VanDerWaalsContact O-CB 3.3Å; L179-C183 WeakPolarHBondContact O-CB 3.17Å; L179-C183 PolarHBondContact O-N 3.32Å; L179-C183 PolarHBondContact O-SG 3.45Å
180	R	51.4	Low	51.7	Low	179 Å²	179	116.9 Å²	116.9	68%	0.675	56%	0.56	S	S	*	*	H	α-helix	trans	-67.5	-39.1	176.1	-172.9	177.2	175.1	176.5	0.1	111.2	S177 A184	S177-R180 PolarHBondContact O-N 2.92Å; R180-A184 VanDerWaalsContact O-CB 3.25Å; R180-A184 WeakPolarHBondContact O-CB 3.22Å; R180-A184 PolarHBondContact O-N 3.11Å
181	Q	53.8	Low	52.5	Low	151 Å²	151	116 Å²	116	71%	0.706	55%	0.551	S	S	*	*	H	α-helix	trans	-70.6	-38.2	176.8	-75.4	179.7	-7.2	0	0	112.5	L179 A184 Y185	L179-Q181 VanDerWaalsContact C-N 3.34Å; Q181-A184 PolarHBondContact O-N 2.95Å; Q181-Y185 VanDerWaalsContact O-CB 3.28Å; Q181-Y185 WeakPolarHBondContact O-CB 3.16Å; Q181-Y185 PolarHBondContact O-N 2.97Å
182	S	52.6	Low	53.3	Low	57 Å²	57	116.2 Å²	116.2	40%	0.399	55%	0.552	S	S	.	*	H	α-helix	trans	-71.4	-37.8	175.5	51	0	0	0	0	112.4	S178 L179 Y185 L186	S178-S182 VanDerWaalsContact O-CB 3.29Å; S178-S182 WeakPolarHBondContact O-CB 3.46Å; S178-S182 PolarHBondContact O-N 3.32Å; S178-S182 PolarHBondContact O-OG 3.26Å; L179-S182 VanDerWaalsContact CA-OG 3.26Å; L179-S182 WeakPolarHBondContact CA-OG 3.38Å; L179-S182 PolarHBondContact O-N 2.9Å; L179-S182 PolarHBondContact O-OG 3.26Å; L179-S182 VanDerWaalsContact O-OG 3.12Å; S182-Y185 PolarHBondContact O-N 3.47Å; S182-L186 VanDerWaalsContact O-CB 3.29Å; S182-L186 WeakPolarHBondContact O-CB 3.28Å; S182-L186 PolarHBondContact O-N 2.86Å
183	C	56.9	Low	53.7	Low	81 Å²	81	118.7 Å²	118.7	55%	0.547	55%	0.549	S	S	.	.	H	α-helix	trans	-65.3	-38.6	171	-71.4	0	0	0	0	112	L179 R187	L179-C183 VanDerWaalsContact O-CB 3.3Å; L179-C183 WeakPolarHBondContact O-CB 3.17Å; L179-C183 PolarHBondContact O-N 3.32Å; L179-C183 PolarHBondContact O-SG 3.45Å; C183-R187 VanDerWaalsContact O-CB 3.27Å; C183-R187 WeakPolarHBondContact O-CB 3.43Å; C183-R187 PolarHBondContact O-N 3.18Å
184	A	61.9	Low	54.5	Low	42 Å²	42	113 Å²	113	35%	0.347	53%	0.532	S	S	.	.	H	α-helix	trans	-64.1	-49.4	172.7	0	0	0	0	0	111	R180 Q181 L186 R187 D188	R180-A184 VanDerWaalsContact O-CB 3.25Å; R180-A184 WeakPolarHBondContact O-CB 3.22Å; R180-A184 PolarHBondContact O-N 3.11Å; Q181-A184 PolarHBondContact O-N 2.95Å; A184-L186 VanDerWaalsContact C-N 3.33Å; A184-L186 PolarHBondContact O-N 2.8Å; A184-R187 CarbonylContact O-C 3.44Å; A184-R187 WeakPolarHBondContact O-CB 3.4Å; A184-R187 PolarHBondContact O-N 3.02Å; A184-R187 VanDerWaalsContact O-N 3.14Å; A184-D188 WeakPolarHBondContact O-CB 3.43Å; A184-D188 PolarHBondContact O-N 3.24Å
185	Y	59.1	Low	55.7	Low	163 Å²	163	110.8 Å²	110.8	64%	0.639	53%	0.528	S	S	*	.	H	α-helix	trans	-57.9	-42.5	176.3	175.9	-97	0	0	0	112.6	Q181 S182 D188 Y189	Q181-Y185 VanDerWaalsContact O-CB 3.28Å; Q181-Y185 WeakPolarHBondContact O-CB 3.16Å; Q181-Y185 PolarHBondContact O-N 2.97Å; S182-Y185 PolarHBondContact O-N 3.47Å; Y185-D188 PolarHBondContact O-N 2.7Å; Y185-Y189 WeakPolarHBondContact O-CB 3.47Å; Y185-Y189 PolarHBondContact O-N 3.13Å
186	L	61	Low	56.4	Low	114 Å²	114	110.7 Å²	110.7	60%	0.597	53%	0.527	S	S	*	.	H	α-helix	trans	-69.4	-37.2	178.7	-165.3	134.5	0	0	0	111.3	S182 A184 V190	S182-L186 VanDerWaalsContact O-CB 3.29Å; S182-L186 WeakPolarHBondContact O-CB 3.28Å; S182-L186 PolarHBondContact O-N 2.86Å; A184-L186 VanDerWaalsContact C-N 3.33Å; A184-L186 PolarHBondContact O-N 2.8Å; L186-V190 HydrophobicContact CD2-CG2 4.35Å; L186-V190 WeakPolarHBondContact O-CB 3.38Å; L186-V190 VanDerWaalsContact O-CG2 3.23Å; L186-V190 WeakPolarHBondContact O-CG2 3.41Å; L186-V190 PolarHBondContact O-N 2.68Å
187	R	58.4	Low	57	Low	177 Å²	177	102.7 Å²	102.7	67%	0.668	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-45.1	172.6	-175.1	-179.3	-75.7	173.2	-6.2	111.2	C183 A184 V190 H191	C183-R187 VanDerWaalsContact O-CB 3.27Å; C183-R187 WeakPolarHBondContact O-CB 3.43Å; C183-R187 PolarHBondContact O-N 3.18Å; A184-R187 CarbonylContact O-C 3.44Å; A184-R187 WeakPolarHBondContact O-CB 3.4Å; A184-R187 PolarHBondContact O-N 3.02Å; A184-R187 VanDerWaalsContact O-N 3.14Å; R187-V190 PolarHBondContact O-N 3.41Å; R187-H191 WeakPolarHBondContact O-CB 3.39Å; R187-H191 PolarHBondContact O-N 2.75Å
188	D	63.8	Low	57.5	Low	86 Å²	86	105.5 Å²	105.5	46%	0.46	52%	0.515	S	S	.	.	H	α-helix	trans	-66.7	-39.6	177.6	-64.4	-17.4	0	0	0	111.2	A184 Y185 H191 H192	A184-D188 WeakPolarHBondContact O-CB 3.43Å; A184-D188 PolarHBondContact O-N 3.24Å; Y185-D188 PolarHBondContact O-N 2.7Å; D188-H191 PolarHBondContact O-N 2.86Å; D188-H192 VanDerWaalsContact O-CB 3.32Å; D188-H192 WeakPolarHBondContact O-CB 3.43Å; D188-H192 PolarHBondContact O-CD2 3.4Å; D188-H192 PolarHBondContact O-N 3.26Å
189	Y	57	Low	57.8	Low	113 Å²	113	110 Å²	110	44%	0.443	52%	0.518	S	S	.	.	H	α-helix	trans	-63.6	-45.9	175.1	177.5	-97.3	0	0	0	111.8	Y185 H192 R193	Y185-Y189 WeakPolarHBondContact O-CB 3.47Å; Y185-Y189 PolarHBondContact O-N 3.13Å; Y189-H192 PolarHBondContact O-N 3.21Å; Y189-R193 WeakPolarHBondContact O-CB 3.41Å; Y189-R193 PolarHBondContact O-N 2.66Å; Y189-R193 PolarHBondContact OH-NH1 3.49Å
190	V	62.7	Low	58.1	Low	66 Å²	66	108.5 Å²	108.5	40%	0.4	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-42.7	176.3	171.2	0	0	0	0	110.4	L186 R187 R193 L194	L186-V190 HydrophobicContact CD2-CG2 4.35Å; L186-V190 WeakPolarHBondContact O-CB 3.38Å; L186-V190 VanDerWaalsContact O-CG2 3.23Å; L186-V190 WeakPolarHBondContact O-CG2 3.41Å; L186-V190 PolarHBondContact O-N 2.68Å; R187-V190 PolarHBondContact O-N 3.41Å; V190-R193 PolarHBondContact O-N 3.38Å; V190-L194 HydrophobicContact CG1-CD1 3.74Å; V190-L194 HydrophobicContact CG1-CG 4.28Å; V190-L194 WeakPolarHBondContact O-CB 3.47Å; V190-L194 VanDerWaalsContact O-CG 3.32Å; V190-L194 WeakPolarHBondContact O-CG 3.49Å; V190-L194 PolarHBondContact O-N 2.74Å
191	H	63.4	Low	58	Low	111 Å²	111	104.1 Å²	104.1	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-49.3	174.4	-103.1	-69.6	0	0	0	112.2	R187 D188 R193 L194 D195	R187-H191 WeakPolarHBondContact O-CB 3.39Å; R187-H191 PolarHBondContact O-N 2.75Å; D188-H191 PolarHBondContact O-N 2.86Å; H191-R193 VanDerWaalsContact C-N 3.28Å; H191-R193 PolarHBondContact O-N 2.92Å; H191-L194 PolarHBondContact O-N 2.71Å; H191-D195 VanDerWaalsContact O-CB 3.28Å; H191-D195 WeakPolarHBondContact O-CB 3.3Å; H191-D195 PolarHBondContact O-N 3.27Å
192	H	60.3	Low	57.5	Low	132 Å²	132	100 Å²	100	61%	0.611	49%	0.488	S	S	*	.	H	α-helix	trans	-64.9	-33.5	178.7	-78.3	-51.1	0	0	0	112.7	D188 Y189 H196	D188-H192 VanDerWaalsContact O-CB 3.32Å; D188-H192 WeakPolarHBondContact O-CB 3.43Å; D188-H192 PolarHBondContact O-CD2 3.4Å; D188-H192 PolarHBondContact O-N 3.26Å; Y189-H192 PolarHBondContact O-N 3.21Å; H192-H196 WeakPolarHBondContact O-CB 3.32Å; H192-H196 PolarHBondContact O-N 2.77Å
193	R	56.2	Low	57.3	Low	134 Å²	134	103.1 Å²	103.1	51%	0.506	49%	0.492	S	S	.	.	H	α-helix	trans	-73.5	-42.2	176.8	-170.8	163.7	-176.5	158.8	-0.2	111.8	Y189 V190 H191 H196 D197	Y189-R193 WeakPolarHBondContact O-CB 3.41Å; Y189-R193 PolarHBondContact O-N 2.66Å; Y189-R193 PolarHBondContact OH-NH1 3.49Å; V190-R193 PolarHBondContact O-N 3.38Å; H191-R193 VanDerWaalsContact C-N 3.28Å; H191-R193 PolarHBondContact O-N 2.92Å; R193-H196 PolarHBondContact O-N 3.37Å; R193-D197 VanDerWaalsContact O-CB 3.3Å; R193-D197 WeakPolarHBondContact O-CB 3.35Å; R193-D197 VanDerWaalsContact O-CG 3.22Å; R193-D197 PolarHBondContact O-N 2.84Å
194	L	61.3	Low	56.7	Low	91 Å²	91	102.7 Å²	102.7	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-65.2	-43.8	172.6	-72.2	171.5	0	0	0	111.2	V190 H191 H196 D197 D198	V190-L194 HydrophobicContact CG1-CD1 3.74Å; V190-L194 HydrophobicContact CG1-CG 4.28Å; V190-L194 WeakPolarHBondContact O-CB 3.47Å; V190-L194 VanDerWaalsContact O-CG 3.32Å; V190-L194 WeakPolarHBondContact O-CG 3.49Å; V190-L194 PolarHBondContact O-N 2.74Å; H191-L194 PolarHBondContact O-N 2.71Å; L194-H196 VanDerWaalsContact C-N 3.28Å; L194-H196 PolarHBondContact O-N 2.72Å; L194-D197 PolarHBondContact O-N 3.38Å; L194-D198 WeakPolarHBondContact O-CB 3.22Å; L194-D198 PolarHBondContact O-N 3.37Å
195	D	65	Low	55.5	Low	70 Å²	70	110.7 Å²	110.7	37%	0.374	50%	0.504	S	S	.	.	H	α-helix	trans	-59.8	-38.7	173	-83.5	-1	0	0	0	111.5	H191 R199	H191-D195 VanDerWaalsContact O-CB 3.28Å; H191-D195 WeakPolarHBondContact O-CB 3.3Å; H191-D195 PolarHBondContact O-N 3.27Å; D195-R199 WeakPolarHBondContact O-CB 3.37Å; D195-R199 WeakPolarHBondContact O-CD 3.4Å; D195-R199 WeakPolarHBondContact O-CG 3.32Å; D195-R199 PolarHBondContact O-N 3.49Å
196	H	60.4	Low	54.5	Low	130 Å²	130	107.1 Å²	107.1	60%	0.602	49%	0.494	S	S	*	.	H	α-helix	trans	-71.8	-42.4	176.9	-172.5	-69.9	0	0	0	111.4	H192 R193 L194 S200	H192-H196 WeakPolarHBondContact O-CB 3.32Å; H192-H196 PolarHBondContact O-N 2.77Å; R193-H196 PolarHBondContact O-N 3.37Å; L194-H196 VanDerWaalsContact C-N 3.28Å; L194-H196 PolarHBondContact O-N 2.72Å; H196-S200 WeakPolarHBondContact O-CB 3.37Å; H196-S200 PolarHBondContact O-N 2.8Å; H196-S200 PolarHBondContact O-OG 2.96Å
197	D	55.2	Low	53.5	Low	72 Å²	72	105.1 Å²	105.1	39%	0.385	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-45.7	177.4	-72.6	-15.4	0	0	0	109.8	R193 L194 S200 L201	R193-D197 VanDerWaalsContact O-CB 3.3Å; R193-D197 WeakPolarHBondContact O-CB 3.35Å; R193-D197 VanDerWaalsContact O-CG 3.22Å; R193-D197 PolarHBondContact O-N 2.84Å; L194-D197 PolarHBondContact O-N 3.38Å; D197-S200 WeakPolarHBondContact CA-OG 3.23Å; D197-S200 CarbonylContact O-C 3.59Å; D197-S200 WeakPolarHBondContact O-CA 3.49Å; D197-S200 PolarHBondContact O-N 3.1Å; D197-S200 PolarHBondContact O-OG 2.76Å; D197-L201 WeakPolarHBondContact O-CG 3.41Å; D197-L201 PolarHBondContact O-N 3.01Å
198	D	54.1	Low	52.7	Low	97 Å²	97	103.2 Å²	103.2	52%	0.519	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-39.4	175	-74.1	-17.6	0	0	0	112.6	L194 S200 L201 P202	L194-D198 WeakPolarHBondContact O-CB 3.22Å; L194-D198 PolarHBondContact O-N 3.37Å; D198-S200 VanDerWaalsContact C-N 3.27Å; D198-S200 PolarHBondContact O-N 2.89Å; D198-L201 PolarHBondContact O-N 2.84Å; D198-P202 WeakPolarHBondContact O-CD 3.2Å
199	R	54.4	Low	51.6	Low	186 Å²	186	106 Å²	106	70%	0.702	49%	0.493	S	S	*	.	H	α-helix	trans	-66.2	-31.9	169.6	-77.5	174.2	-177.3	176.6	4.3	111.9	D195 Y203	D195-R199 WeakPolarHBondContact O-CB 3.37Å; D195-R199 WeakPolarHBondContact O-CD 3.4Å; D195-R199 WeakPolarHBondContact O-CG 3.32Å; D195-R199 PolarHBondContact O-N 3.49Å; R199-Y203 WeakPolarHBondContact O-CD2 3.27Å; R199-Y203 WeakPolarHBondContact O-CE2 3.39Å
200	S	50.5	Low	51.3	Low	26 Å²	26	111.7 Å²	111.7	18%	0.182	51%	0.514	C	S	.	.	H	α-helix	trans	-79	-27.3	178.8	79.5	0	0	0	0	113.1	H196 D197 D198 Y203 I204	H196-S200 WeakPolarHBondContact O-CB 3.37Å; H196-S200 PolarHBondContact O-N 2.8Å; H196-S200 PolarHBondContact O-OG 2.96Å; D197-S200 WeakPolarHBondContact CA-OG 3.23Å; D197-S200 CarbonylContact O-C 3.59Å; D197-S200 WeakPolarHBondContact O-CA 3.49Å; D197-S200 PolarHBondContact O-N 3.1Å; D197-S200 PolarHBondContact O-OG 2.76Å; D198-S200 VanDerWaalsContact C-N 3.27Å; D198-S200 PolarHBondContact O-N 2.89Å; S200-Y203 CarbonylContact O-C 3.51Å; S200-Y203 WeakPolarHBondContact O-CA 3.45Å; S200-Y203 WeakPolarHBondContact O-CB 3.46Å; S200-Y203 PolarHBondContact O-N 3.23Å; S200-I204 WeakPolarHBondContact O-CG1 3.48Å; S200-I204 PolarHBondContact O-N 3.49Å
201	L	49.5	Very low	50.9	Low	88 Å²	88	109.7 Å²	109.7	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-58.4	-41.4	-174.6	-87.3	171.3	0	0	0	114.2	D197 D198 Y203 I204 R205	D197-L201 WeakPolarHBondContact O-CG 3.41Å; D197-L201 PolarHBondContact O-N 3.01Å; D198-L201 PolarHBondContact O-N 2.84Å; L201-Y203 VanDerWaalsContact C-N 3.32Å; L201-Y203 PolarHBondContact O-N 3.33Å; L201-I204 PolarHBondContact O-N 2.91Å; L201-R205 PolarHBondContact O-N 2.88Å
202	P	44.8	Very low	50.6	Low	63 Å²	63	107.9 Å²	107.9	41%	0.409	50%	0.499	S	S	.	.	H	α-helix	trans	-59	-43.2	169.9	-23.6	31.9	0	0	0	111.8	D198 I204 R205 E206	D198-P202 WeakPolarHBondContact O-CD 3.2Å; P202-I204 VanDerWaalsContact C-N 3.33Å; P202-I204 PolarHBondContact O-N 3.12Å; P202-R205 PolarHBondContact O-N 2.94Å; P202-E206 WeakPolarHBondContact O-CB 3.32Å; P202-E206 VanDerWaalsContact O-CG 3.29Å; P202-E206 WeakPolarHBondContact O-CG 3.47Å; P202-E206 PolarHBondContact O-N 2.86Å
203	Y	47.3	Very low	50.6	Low	123 Å²	123	110.6 Å²	110.6	48%	0.482	51%	0.505	S	S	.	.	H	α-helix	trans	-70.9	-26.9	177.7	-55	-72.3	0	0	0	112.9	R199 S200 L201 S207	R199-Y203 WeakPolarHBondContact O-CD2 3.27Å; R199-Y203 WeakPolarHBondContact O-CE2 3.39Å; S200-Y203 CarbonylContact O-C 3.51Å; S200-Y203 WeakPolarHBondContact O-CA 3.45Å; S200-Y203 WeakPolarHBondContact O-CB 3.46Å; S200-Y203 PolarHBondContact O-N 3.23Å; L201-Y203 VanDerWaalsContact C-N 3.32Å; L201-Y203 PolarHBondContact O-N 3.33Å; Y203-S207 WeakPolarHBondContact O-CB 2.96Å; Y203-S207 PolarHBondContact O-N 2.77Å; Y203-S207 PolarHBondContact O-OG 2.79Å
204	I	43.4	Very low	50.5	Low	73 Å²	73	109.8 Å²	109.8	37%	0.374	51%	0.511	S	S	.	.	H	α-helix	trans	-71.1	-46.8	172.9	-66.8	168.1	0	0	0	109.2	S200 L201 P202 E206 S207 Y208	S200-I204 WeakPolarHBondContact O-CG1 3.48Å; S200-I204 PolarHBondContact O-N 3.49Å; L201-I204 PolarHBondContact O-N 2.91Å; P202-I204 VanDerWaalsContact C-N 3.33Å; P202-I204 PolarHBondContact O-N 3.12Å; I204-E206 PolarHBondContact O-N 3.42Å; I204-S207 WeakPolarHBondContact CA-OG 2.94Å; I204-S207 PolarHBondContact O-N 3.41Å; I204-S207 PolarHBondContact O-OG 3.14Å; I204-S207 VanDerWaalsContact O-OG 3.06Å; I204-Y208 HydrophobicContact CG2-CD2 4.14Å; I204-Y208 HydrophobicContact CG2-CE2 3.83Å; I204-Y208 WeakPolarHBondContact O-CD2 3.29Å; I204-Y208 PolarHBondContact O-N 3.35Å
205	R	37.4	Very low	50.2	Low	209 Å²	209	109.5 Å²	109.5	79%	0.789	51%	0.507	S	S	*	.	H	α-helix	trans	-60.1	-44.2	174.7	-83.2	-174.1	171.9	-177.1	-1.9	112.1	L201 P202 S207	L201-R205 PolarHBondContact O-N 2.88Å; P202-R205 PolarHBondContact O-N 2.94Å; R205-S207 PolarHBondContact O-N 3.44Å
206	E	39	Very low	49.7	Very low	89 Å²	89	113.3 Å²	113.3	42%	0.416	52%	0.516	S	S	.	.	H	α-helix	trans	-86.8	3.2	179.9	-56.6	175.4	-176.6	0	0	114.6	P202 I204 R219	P202-E206 WeakPolarHBondContact O-CB 3.32Å; P202-E206 VanDerWaalsContact O-CG 3.29Å; P202-E206 WeakPolarHBondContact O-CG 3.47Å; P202-E206 PolarHBondContact O-N 2.86Å; I204-E206 PolarHBondContact O-N 3.42Å; E206-R219 PolarHBondContact O-NH2 3.11Å; E206-R219 IonicContact OE2-CZ 3.54Å; E206-R219 IonicContact OE2-NE 3.55Å; E206-R219 IonicContact OE2-NH2 2.76Å; E206-R219 PolarHBondContact OE2-NH2 2.85Å
207	S	40.5	Very low	49.3	Very low	72 Å²	72	112.8 Å²	112.8	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-99.2	-19.4	172.2	53.3	0	0	0	0	112.7	Y203 I204 R205	Y203-S207 WeakPolarHBondContact O-CB 2.96Å; Y203-S207 PolarHBondContact O-N 2.77Å; Y203-S207 PolarHBondContact O-OG 2.79Å; I204-S207 WeakPolarHBondContact CA-OG 2.94Å; I204-S207 PolarHBondContact O-N 3.41Å; I204-S207 PolarHBondContact O-OG 3.14Å; I204-S207 VanDerWaalsContact O-OG 3.06Å; R205-S207 PolarHBondContact O-N 3.44Å
208	Y	40.3	Very low	49.2	Very low	136 Å²	136	113.2 Å²	113.2	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-80.6	-21.9	167.8	-74.4	-70.9	0	0	0	112.6	Y91 I204	Y91-Y208 HydrophobicContact CE2-CE1 4.32Å; I204-Y208 HydrophobicContact CG2-CD2 4.14Å; I204-Y208 HydrophobicContact CG2-CE2 3.83Å; I204-Y208 WeakPolarHBondContact O-CD2 3.29Å; I204-Y208 PolarHBondContact O-N 3.35Å
209	E	42.1	Very low	49	Very low	145 Å²	145	111.2 Å²	111.2	68%	0.678	50%	0.499	S	S	*	.	S	Bend	trans	-91	131	164.2	-69.6	177.7	172.3	0	0	109.1	P211	E209-P211 WeakPolarHBondContact O-CD 3.28Å; E209-P211 VanDerWaalsContact O-N 3.14Å
210	R	49.4	Very low	48.9	Very low	233 Å²	233	109.6 Å²	109.6	88%	0.879	50%	0.498	S	S	*	.			trans	-65.4	113	179	-86.6	-178.5	173.1	146.8	-1.4	108.9	T212	R210-T212 PolarHBondContact O-N 3.39Å
211	P	54	Low	49	Very low	23 Å²	23	115.1 Å²	115.1	15%	0.149	52%	0.519	C	S	.	.			trans	-64.7	138.3	-179.5	24.5	-32.4	0	0	0	110.5	E209 E215 R216	E209-P211 WeakPolarHBondContact O-CD 3.28Å; E209-P211 VanDerWaalsContact O-N 3.14Å; P211-E215 WeakPolarHBondContact CA-OE2 3.25Å; P211-E215 HydrophobicContact CB-CB 3.91Å; P211-R216 HydrophobicContact CB-CG 4.12Å; P211-R216 HydrophobicContact CG-CG 3.86Å; P211-R216 PolarHBondContact O-NE 3.43Å
212	T	56.8	Low	49.2	Very low	73 Å²	73	120.6 Å²	120.6	45%	0.448	53%	0.534	S	S	.	.			trans	-59.6	158.9	172.5	64	0	0	0	0	110.2	R210 N214 E215 R216	R210-T212 PolarHBondContact O-N 3.39Å; T212-N214 PolarHBondContact O-N 2.97Å; T212-E215 PolarHBondContact N-OE2 2.62Å; T212-E215 PolarHBondContact O-N 3Å; T212-E215 VanDerWaalsContact O-N 3.09Å; T212-E215 WeakPolarHBondContact OG1-CG 3.37Å; T212-E215 PolarHBondContact OG1-N 3.31Å; T212-E215 PolarHBondContact OG1-OE1 2.8Å; T212-E215 PolarHBondContact OG1-OE2 2.98Å; T212-R216 PolarHBondContact O-N 2.97Å; T212-R216 VanDerWaalsContact O-N 3.08Å
213	Y	61.3	Low	49.2	Very low	189 Å²	189	118.5 Å²	118.5	74%	0.741	52%	0.523	S	S	*	.	H	α-helix	trans	-55.5	-37.8	-179.3	-175.9	-92.7	0	0	0	112.1	R216 F217	Y213-R216 PolarHBondContact O-N 2.86Å; Y213-F217 PolarHBondContact O-N 3.1Å
214	N	55	Low	48.5	Very low	117 Å²	117	114.3 Å²	114.3	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-66.5	-40.8	176.8	-69.9	-12.2	0	0	0	112.4	T212 R216 F217 L218	T212-N214 PolarHBondContact O-N 2.97Å; N214-R216 PolarHBondContact O-N 3.26Å; N214-F217 PolarHBondContact O-N 2.94Å; N214-L218 WeakPolarHBondContact O-CG 3.45Å; N214-L218 PolarHBondContact O-N 3.49Å
215	E	54.3	Low	48.4	Very low	85 Å²	85	120.7 Å²	120.7	40%	0.397	55%	0.546	S	S	.	.	H	α-helix	trans	-66	-35.5	176.3	-75.5	154	-144.7	0	0	112.5	P211 T212 F217 L218 R219	P211-E215 WeakPolarHBondContact CA-OE2 3.25Å; P211-E215 HydrophobicContact CB-CB 3.91Å; T212-E215 PolarHBondContact N-OE2 2.62Å; T212-E215 PolarHBondContact O-N 3Å; T212-E215 VanDerWaalsContact O-N 3.09Å; T212-E215 WeakPolarHBondContact OG1-CG 3.37Å; T212-E215 PolarHBondContact OG1-N 3.31Å; T212-E215 PolarHBondContact OG1-OE1 2.8Å; T212-E215 PolarHBondContact OG1-OE2 2.98Å; E215-F217 VanDerWaalsContact C-N 3.34Å; E215-F217 PolarHBondContact O-N 3.28Å; E215-L218 PolarHBondContact O-N 3.09Å; E215-R219 WeakPolarHBondContact O-CB 3.43Å; E215-R219 WeakPolarHBondContact O-CG 3.3Å; E215-R219 PolarHBondContact O-N 2.97Å
216	R	54.2	Low	48.6	Very low	150 Å²	150	116.1 Å²	116.1	57%	0.566	55%	0.546	S	S	*	.	H	α-helix	trans	-63.2	-41.6	173.6	-66.8	-175.9	-157	-175.3	4.9	111.9	P211 T212 Y213 N214 R219 F220	P211-R216 HydrophobicContact CB-CG 4.12Å; P211-R216 HydrophobicContact CG-CG 3.86Å; P211-R216 PolarHBondContact O-NE 3.43Å; T212-R216 PolarHBondContact O-N 2.97Å; T212-R216 VanDerWaalsContact O-N 3.08Å; Y213-R216 PolarHBondContact O-N 2.86Å; N214-R216 PolarHBondContact O-N 3.26Å; R216-R219 PolarHBondContact O-N 3.07Å; R216-F220 PolarHBondContact O-N 2.69Å
217	F	51.5	Low	48.5	Very low	120 Å²	120	116.4 Å²	116.4	53%	0.526	55%	0.554	S	S	.	*	H	α-helix	trans	-66.7	-43	177.3	-173.6	-95	0	0	0	111.6	Y213 N214 E215 R219 F220 F221	Y213-F217 PolarHBondContact O-N 3.1Å; N214-F217 PolarHBondContact O-N 2.94Å; E215-F217 VanDerWaalsContact C-N 3.34Å; E215-F217 PolarHBondContact O-N 3.28Å; F217-R219 VanDerWaalsContact C-N 3.34Å; F217-R219 PolarHBondContact O-N 3.35Å; F217-F220 WeakPolarHBondContact O-CB 3.3Å; F217-F220 PolarHBondContact O-N 2.88Å; F217-F221 HydrophobicContact CD1-CD2 4.35Å; F217-F221 AromaticContact CE1-CD2 3.79Å; F217-F221 HydrophobicContact CE1-CD2 3.79Å; F217-F221 AromaticContact CE1-CE2 3.88Å; F217-F221 HydrophobicContact CE1-CE2 3.88Å; F217-F221 HydrophobicContact CE2-CD2 4.49Å; F217-F221 HydrophobicContact CE2-CE2 4.24Å; F217-F221 AromaticContact CZ-CD2 3.88Å; F217-F221 HydrophobicContact CZ-CD2 3.88Å; F217-F221 AromaticContact CZ-CE2 3.55Å; F217-F221 HydrophobicContact CZ-CE2 3.55Å; F217-F221 PolarHBondContact O-N 3.39Å
218	L	54.2	Low	47.9	Very low	80 Å²	80	116.5 Å²	116.5	42%	0.419	56%	0.559	S	S	.	*	H	α-helix	trans	-65.2	-35	175.9	-72.7	170.7	0	0	0	112.5	N214 E215 F221 R222	N214-L218 WeakPolarHBondContact O-CG 3.45Å; N214-L218 PolarHBondContact O-N 3.49Å; E215-L218 PolarHBondContact O-N 3.09Å; L218-F221 PolarHBondContact O-N 2.97Å; L218-R222 WeakPolarHBondContact O-CB 3.14Å; L218-R222 WeakPolarHBondContact O-CG 3.32Å; L218-R222 PolarHBondContact O-N 3.33Å
219	R	49.6	Very low	47.4	Very low	55 Å²	55	118.1 Å²	118.1	21%	0.208	57%	0.569	C	S	.	*	H	α-helix	trans	-63.3	-40.9	173.3	-80.2	-177.5	-176.8	176.1	14.2	112.7	E206 E215 R216 F217 F221 G223	E206-R219 PolarHBondContact O-NH2 3.11Å; E206-R219 IonicContact OE2-CZ 3.54Å; E206-R219 IonicContact OE2-NE 3.55Å; E206-R219 IonicContact OE2-NH2 2.76Å; E206-R219 PolarHBondContact OE2-NH2 2.85Å; E215-R219 WeakPolarHBondContact O-CB 3.43Å; E215-R219 WeakPolarHBondContact O-CG 3.3Å; E215-R219 PolarHBondContact O-N 2.97Å; R216-R219 PolarHBondContact O-N 3.07Å; F217-R219 VanDerWaalsContact C-N 3.34Å; F217-R219 PolarHBondContact O-N 3.35Å; R219-F221 VanDerWaalsContact C-N 3.28Å; R219-F221 PolarHBondContact O-N 3.42Å; R219-G223 PolarHBondContact O-N 2.9Å; R219-G223 VanDerWaalsContact O-N 3.1Å
220	F	52.2	Low	47.1	Very low	152 Å²	152	116.3 Å²	116.3	67%	0.667	57%	0.568	S	S	*	*	H	α-helix	trans	-61.7	-37.8	175.6	-176.4	-97.1	0	0	0	111.8	R216 F217	R216-F220 PolarHBondContact O-N 2.69Å; F217-F220 WeakPolarHBondContact O-CB 3.3Å; F217-F220 PolarHBondContact O-N 2.88Å
221	F	53.3	Low	46.2	Very low	143 Å²	143	108.4 Å²	108.4	63%	0.627	56%	0.559	S	S	*	*	H	α-helix	trans	-79.6	-40.6	178.2	-100.3	-85.8	0	0	0	114.1	F217 L218 R219	F217-F221 HydrophobicContact CD1-CD2 4.35Å; F217-F221 AromaticContact CE1-CD2 3.79Å; F217-F221 HydrophobicContact CE1-CD2 3.79Å; F217-F221 AromaticContact CE1-CE2 3.88Å; F217-F221 HydrophobicContact CE1-CE2 3.88Å; F217-F221 HydrophobicContact CE2-CD2 4.49Å; F217-F221 HydrophobicContact CE2-CE2 4.24Å; F217-F221 AromaticContact CZ-CD2 3.88Å; F217-F221 HydrophobicContact CZ-CD2 3.88Å; F217-F221 AromaticContact CZ-CE2 3.55Å; F217-F221 HydrophobicContact CZ-CE2 3.55Å; F217-F221 PolarHBondContact O-N 3.39Å; L218-F221 PolarHBondContact O-N 2.97Å; R219-F221 VanDerWaalsContact C-N 3.28Å; R219-F221 PolarHBondContact O-N 3.42Å
222	R	52.6	Low	45	Very low	203 Å²	203	113 Å²	113	77%	0.766	59%	0.586	S	S	*	*	H	α-helix	trans	-72.9	-29.9	-178.1	-73.4	-179.9	178.6	175.2	-0.3	113.2	L218 G224	L218-R222 WeakPolarHBondContact O-CB 3.14Å; L218-R222 WeakPolarHBondContact O-CG 3.32Å; L218-R222 PolarHBondContact O-N 3.33Å; R222-G224 VanDerWaalsContact C-N 3.34Å; R222-G224 PolarHBondContact O-N 2.92Å
223	G	45.1	Very low	43.6	Very low	19 Å²	19	114.6 Å²	114.6	20%	0.196	60%	0.599	C	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-15.8	-177.6	0	0	0	0	0	114.9	R219 T227	R219-G223 PolarHBondContact O-N 2.9Å; R219-G223 VanDerWaalsContact O-N 3.1Å; G223-T227 WeakPolarHBondContact CA-OG1 3.29Å; G223-T227 PolarHBondContact O-OG1 3.47Å
224	G	32.8	Very low	42.2	Very low	35 Å²	35	113.4 Å²	113.4	36%	0.361	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	58.4	163.6	-168.8	0	0	0	0	0	112.5	R222 S226 T227	R222-G224 VanDerWaalsContact C-N 3.34Å; R222-G224 PolarHBondContact O-N 2.92Å; G224-S226 PolarHBondContact O-N 3.43Å; G224-T227 PolarHBondContact O-N 2.79Å
225	Q	41.3	Very low	41	Very low	207 Å²	207	112 Å²	112	97%	0.967	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-7.5	179.7	-72	177.3	-18.7	0	0	114
226	S	41.2	Very low	40	Very low	112 Å²	112	115.3 Å²	115.3	78%	0.783	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-6	-174.1	57.8	0	0	0	0	115.7	G224	G224-S226 PolarHBondContact O-N 3.43Å
227	T	36.6	Very low	38.8	Very low	95 Å²	95	112.2 Å²	112.2	58%	0.583	62%	0.622	S	S	*	*			trans	-130	13.3	-178.9	73.2	0	0	0	0	115.5	G223 G224 F229	G223-T227 WeakPolarHBondContact CA-OG1 3.29Å; G223-T227 PolarHBondContact O-OG1 3.47Å; G224-T227 PolarHBondContact O-N 2.79Å; T227-F229 PolarHBondContact O-N 2.79Å
228	A	28	Very low	38.2	Very low	75 Å²	75	112 Å²	112	62%	0.62	64%	0.636	S	S	*	*			trans	-73.6	70.6	174.1	0	0	0	0	0	112.1	V230	A228-V230 VanDerWaalsContact C-N 3.31Å
229	F	30.4	Very low	37.3	Very low	169 Å²	169	113.9 Å²	113.9	74%	0.741	65%	0.646	S	S	*	*			trans	-97.7	60.7	161.5	-138.8	-86.2	0	0	0	109.1	T227	T227-F229 PolarHBondContact O-N 2.79Å
230	V	34.8	Very low	36.8	Very low	107 Å²	107	115.1 Å²	115.1	65%	0.648	66%	0.657	S	S	*	*	S	Bend	trans	-96.9	120.6	157.7	178.2	0	0	0	0	104.7	A228 T232	A228-V230 VanDerWaalsContact C-N 3.31Å; V230-T232 VanDerWaalsContact C-N 3.33Å; V230-T232 PolarHBondContact O-N 2.78Å
231	G	30.3	Very low	36	Very low	68 Å²	68	111 Å²	111	70%	0.701	66%	0.657	S	S	*	*			trans	-50.6	97.6	177.5	0	0	0	0	0	110.3
232	T	28.8	Very low	35.5	Very low	118 Å²	118	107.5 Å²	107.5	72%	0.724	65%	0.65	S	S	*	*			trans	-68.5	130.7	166.8	40.6	0	0	0	0	106.3	V230 L234	V230-T232 VanDerWaalsContact C-N 3.33Å; V230-T232 PolarHBondContact O-N 2.78Å; T232-L234 PolarHBondContact O-N 2.79Å
233	P	28.1	Very low	35.1	Very low	108 Å²	108	102.1 Å²	102.1	70%	0.701	64%	0.636	S	S	*	*			trans	-54.8	128	171.1	22.1	-30.7	0	0	0	108.3	S235	P233-S235 PolarHBondContact O-N 2.95Å
234	L	31.8	Very low	34.9	Very low	163 Å²	163	106 Å²	106	85%	0.853	65%	0.652	S	S	*	*	S	Bend	trans	-63.5	17.1	-177.9	-101.6	143.5	0	0	0	114.6	T232	T232-L234 PolarHBondContact O-N 2.79Å
235	S	29.9	Very low	35.4	Very low	87 Å²	87	112 Å²	112	61%	0.608	67%	0.668	S	S	*	*			trans	-138.9	104.4	167	58.8	0	0	0	0	108.4	P233	P233-S235 PolarHBondContact O-N 2.95Å
236	L	32.7	Very low	35.5	Very low	156 Å²	156	106.9 Å²	106.9	82%	0.817	65%	0.648	S	S	*	*			trans	-53.1	131.7	151.8	-86.6	125.2	0	0	0	106.7	S238	L236-S238 PolarHBondContact O-N 3.49Å
237	P	30.2	Very low	35.5	Very low	84 Å²	84	106 Å²	106	55%	0.545	63%	0.634	S	S	.	*			trans	-59.9	112.3	168.7	-10.8	23.3	0	0	0	106.6	N239 L240	P237-N239 PolarHBondContact O-N 3.19Å; P237-L240 HydrophobicContact CB-CD1 3.92Å; P237-L240 HydrophobicContact CG-CD1 3.59Å; P237-L240 PolarHBondContact O-N 2.82Å
238	S	39.2	Very low	35.7	Very low	116 Å²	116	110.2 Å²	110.2	81%	0.811	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-0.2	176.9	39.8	0	0	0	0	113.3	L236	L236-S238 PolarHBondContact O-N 3.49Å
239	N	35.1	Very low	36.2	Very low	120 Å²	120	113.4 Å²	113.4	64%	0.642	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	9.1	180	-69.6	-11	0	0	0	114.9	P237 G241 S242	P237-N239 PolarHBondContact O-N 3.19Å; N239-G241 PolarHBondContact O-N 2.87Å; N239-S242 PolarHBondContact O-N 3.37Å; N239-S242 PolarHBondContact O-OG 3.29Å
240	L	38.2	Very low	36.6	Very low	81 Å²	81	112.8 Å²	112.8	42%	0.424	65%	0.647	S	S	.	*	H	α-helix	trans	-67.9	-5.8	178.6	-104.9	127.6	0	0	0	115.1	P237 L244	P237-L240 HydrophobicContact CB-CD1 3.92Å; P237-L240 HydrophobicContact CG-CD1 3.59Å; P237-L240 PolarHBondContact O-N 2.82Å; L240-L244 HydrophobicContact CD2-CD1 3.86Å; L240-L244 HydrophobicContact CD2-CG 4.32Å; L240-L244 WeakPolarHBondContact O-CB 3.26Å; L240-L244 PolarHBondContact O-N 2.65Å
241	G	35.7	Very low	36.6	Very low	66 Å²	66	117.2 Å²	117.2	68%	0.68	65%	0.653	S	S	*	*	H	α-helix	trans	-72.4	-26.8	177.5	0	0	0	0	0	115.1	N239	N239-G241 PolarHBondContact O-N 2.87Å
242	S	42.1	Very low	36.9	Very low	68 Å²	68	118.5 Å²	118.5	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-90.2	-36	177.5	51	0	0	0	0	112.5	N239 K245	N239-S242 PolarHBondContact O-N 3.37Å; N239-S242 PolarHBondContact O-OG 3.29Å; S242-K245 PolarHBondContact O-N 3.39Å
243	D	44.1	Very low	37.4	Very low	90 Å²	90	118.2 Å²	118.2	48%	0.481	65%	0.65	S	S	.	*	H	α-helix	trans	-81.7	-22.5	-173.9	-68.1	-15.8	0	0	0	113.5	K245 N246 L247	D243-K245 PolarHBondContact O-N 2.79Å; D243-N246 PolarHBondContact O-N 3Å; D243-N246 VanDerWaalsContact O-N 3.15Å; D243-L247 PolarHBondContact O-N 3.34Å
244	L	41.1	Very low	37.7	Very low	101 Å²	101	121.5 Å²	121.5	53%	0.529	66%	0.656	S	S	.	*	H	α-helix	trans	-68.5	-20.8	170.2	-97	153.3	0	0	0	113.4	L240 K248	L240-L244 HydrophobicContact CD2-CD1 3.86Å; L240-L244 HydrophobicContact CD2-CG 4.32Å; L240-L244 WeakPolarHBondContact O-CB 3.26Å; L240-L244 PolarHBondContact O-N 2.65Å; L244-K248 PolarHBondContact O-N 3.07Å
245	K	43	Very low	37.7	Very low	161 Å²	161	124.9 Å²	124.9	70%	0.7	66%	0.657	S	S	*	*	H	α-helix	trans	-78	-32	169.8	-81.9	-176.7	176	179.1	0	111.9	S242 D243	S242-K245 PolarHBondContact O-N 3.39Å; D243-K245 PolarHBondContact O-N 2.79Å
246	N	44	Very low	38	Very low	100 Å²	100	126.7 Å²	126.7	54%	0.535	67%	0.665	S	S	.	*	H	α-helix	trans	-77.1	-35.8	177.2	-64.7	-20.5	0	0	0	111.6	D243 K248 M249 E250	D243-N246 PolarHBondContact O-N 3Å; D243-N246 VanDerWaalsContact O-N 3.15Å; N246-K248 PolarHBondContact O-N 2.92Å; N246-M249 PolarHBondContact O-N 3.38Å; N246-M249 VanDerWaalsContact O-N 3.07Å; N246-E250 PolarHBondContact O-N 3.26Å
247	L	41.8	Very low	37.9	Very low	93 Å²	93	128.9 Å²	128.9	49%	0.487	67%	0.668	S	S	.	*	H	α-helix	trans	-67.8	-21.1	172.6	-83.5	157.9	0	0	0	113.9	D243 M249 Y251	D243-L247 PolarHBondContact O-N 3.34Å; L247-M249 VanDerWaalsContact C-N 3.33Å; L247-Y251 HydrophobicContact CD2-CE2 4.45Å
248	K	39.7	Very low	37.9	Very low	184 Å²	184	132.7 Å²	132.7	80%	0.8	68%	0.683	S	S	*	*	H	α-helix	trans	-79.5	-12.1	171.9	-103.9	-178.5	175.7	-179.8	0	113.9	L244 N246	L244-K248 PolarHBondContact O-N 3.07Å; N246-K248 PolarHBondContact O-N 2.92Å
249	M	39.4	Very low	37.5	Very low	142 Å²	142	131.4 Å²	131.4	70%	0.7	67%	0.674	S	S	*	*	H	α-helix	trans	-102.9	-29.1	-178.4	-78.6	-86.5	-79.2	0	0	113	N246 L247 S252	N246-M249 PolarHBondContact O-N 3.38Å; N246-M249 VanDerWaalsContact O-N 3.07Å; L247-M249 VanDerWaalsContact C-N 3.33Å; M249-S252 PolarHBondContact O-OG 3.12Å
250	E	37.9	Very low	37.4	Very low	155 Å²	155	134.7 Å²	134.7	72%	0.724	68%	0.683	S	S	*	*	H	α-helix	trans	-79.9	-15.3	-178.8	-92	-179.4	154.8	0	0	115.4	N246	N246-E250 PolarHBondContact O-N 3.26Å
251	Y	35.6	Very low	37.3	Very low	200 Å²	200	136.3 Å²	136.3	78%	0.784	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	12.6	175.7	-81.2	-83	0	0	0	114.5	L247	L247-Y251 HydrophobicContact CD2-CE2 4.45Å
252	S	36.9	Very low	37.3	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	0	-179.2	77.1	0	0	0	0	115.5	M249	M249-S252 PolarHBondContact O-OG 3.12Å
253	T	38.1	Very low	36.9	Very low	113 Å²	113	146.6 Å²	146.6	69%	0.693	72%	0.718	S	S	*	*	S	Bend	trans	-123.3	4.4	-170.8	41.8	0	0	0	0	117.1
254	H	36.3	Very low	36.5	Very low	176 Å²	176	154 Å²	154	82%	0.815	74%	0.74	S	S	*	*			trans	-105.7	90.8	168.4	-95	-78.8	0	0	0	112.4
255	R	30.7	Very low	36.1	Very low	235 Å²	235	158.3 Å²	158.3	89%	0.887	76%	0.755	S	S	*	*			trans	-56.4	154.7	153.7	-93.9	174.1	170.8	175.8	-2.6	109.8
256	T	36.2	Very low	35.6	Very low	124 Å²	124	158.6 Å²	158.6	76%	0.761	76%	0.758	S	S	*	*			trans	80.6	107.3	-170.1	78.2	0	0	0	0	111.2
257	F	30.5	Very low	35	Very low	203 Å²	203	164.2 Å²	164.2	89%	0.89	77%	0.774	S	S	*	*			cis	-147.7	127.4	38.5	-133.4	-103	0	0	0	109.6
258	L	30.3	Very low	34.5	Very low	163 Å²	163	168.7 Å²	168.7	85%	0.853	79%	0.792	S	S	*	*			trans	-72.1	129.6	173.5	-71.6	123.4	0	0	0	109.9
259	S	31.6	Very low	34.2	Very low	89 Å²	89	166.2 Å²	166.2	62%	0.622	79%	0.786	S	S	*	*			trans	174.2	-12.5	137.3	54.5	0	0	0	0	117.6
260	F	32.7	Very low	33.8	Very low	189 Å²	189	165 Å²	165	83%	0.829	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-83.2	-12.3	-177	-111.3	-91.3	0	0	0	115.9	K262	F260-K262 VanDerWaalsContact C-N 3.27Å; F260-K262 PolarHBondContact O-N 2.76Å
261	S	35.1	Very low	33.6	Very low	115 Å²	115	165.6 Å²	165.6	80%	0.804	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-86.2	11	176.1	87.3	0	0	0	0	114.4
262	K	35.6	Very low	33.4	Very low	169 Å²	169	164.2 Å²	164.2	74%	0.735	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-104.1	-8.1	173	-82.3	-172.6	175.8	-178.4	0	114.2	F260	F260-K262 VanDerWaalsContact C-N 3.27Å; F260-K262 PolarHBondContact O-N 2.76Å
263	F	33.5	Very low	33.2	Very low	181 Å²	181	163.2 Å²	163.2	79%	0.794	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-10.2	179.3	-144.6	-96.7	0	0	0	114.3
264	W	36.2	Very low	32.7	Very low	245 Å²	245	165.2 Å²	165.2	93%	0.928	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	18.8	-178.1	-109.7	74.6	0	0	0	115
265	K	32.2	Very low	32.4	Very low	193 Å²	193	166 Å²	166	84%	0.839	81%	0.813	S	S	*	*	S	Bend	trans	-134.1	18.4	-175.8	-104.8	-177.4	179.9	-178.7	0	116.5
266	Q	33.4	Very low	32.4	Very low	167 Å²	167	160.3 Å²	160.3	78%	0.78	80%	0.804	S	S	*	*	S	Bend	trans	-135.2	29.5	-172.5	-151.4	153.6	-5.3	0	0	117.4
267	Y	31.5	Very low	32	Very low	218 Å²	218	165.1 Å²	165.1	86%	0.855	81%	0.809	S	S	*	*			trans	-139.6	63.3	153.9	-88.3	-80.5	0	0	0	110.7	I269	Y267-I269 HydrophobicContact CD1-CD1 4.09Å; Y267-I269 HydrophobicContact CD1-CG1 4.43Å; Y267-I269 HydrophobicContact CE1-CD1 4.04Å
268	H	31.3	Very low	31.9	Very low	187 Å²	187	160.5 Å²	160.5	87%	0.866	80%	0.803	S	S	*	*			trans	-92.5	96.9	147.2	-106.9	-83.5	0	0	0	105.9
269	I	33.4	Very low	31.8	Very low	131 Å²	131	156.8 Å²	156.8	67%	0.672	80%	0.795	S	S	*	*			trans	-108.9	103	159.5	-65.9	177.9	0	0	0	106.2	Y267	Y267-I269 HydrophobicContact CD1-CD1 4.09Å; Y267-I269 HydrophobicContact CD1-CG1 4.43Å; Y267-I269 HydrophobicContact CE1-CD1 4.04Å
270	T	31.8	Very low	31.8	Very low	116 Å²	116	159.9 Å²	159.9	71%	0.712	81%	0.805	S	S	*	*			trans	-42.4	136.4	161.5	45.3	0	0	0	0	111.8
271	L	31.8	Very low	31.8	Very low	168 Å²	168	161.8 Å²	161.8	88%	0.88	81%	0.806	S	S	*	*			trans	-162	85.5	143.8	-99.5	164.4	0	0	0	108.2
272	N	32.5	Very low	31.6	Very low	171 Å²	171	165 Å²	165	91%	0.914	81%	0.809	S	S	*	*			trans	-78.3	129.9	153.6	-81.7	-24.5	0	0	0	107
273	G	31.5	Very low	31.2	Very low	75 Å²	75	162 Å²	162	77%	0.773	81%	0.809	S	S	*	*			trans	154	112.1	167.8	0	0	0	0	0	114.2
274	N	28.4	Very low	31.1	Very low	154 Å²	154	160.3 Å²	160.3	82%	0.824	81%	0.813	S	S	*	*			trans	-58.2	162.5	179.1	-62.4	-38	0	0	0	114.9
275	F	30.2	Very low	30.8	Very low	194 Å²	194	156.1 Å²	156.1	85%	0.851	81%	0.808	S	S	*	*			trans	134	98.1	153.8	-81	-76.4	0	0	0	109.7
276	V	30.2	Very low	30.5	Very low	115 Å²	115	158.7 Å²	158.7	70%	0.697	81%	0.813	S	S	*	*				79.6	118.1	76	175.2	0	0	0	0	114
277	Y	27.6	Very low	30.4	Very low	224 Å²	224	158.8 Å²	158.8	88%	0.878	81%	0.813	S	S	*	*			trans	67.4	118.9	160.5	-85.3	-70.7	0	0	0	122
278	S	29.8	Very low	30.5	Very low	107 Å²	107	157.8 Å²	157.8	75%	0.748	82%	0.816	S	S	*	*				130.5	109.9	112.2	-174.9	0	0	0	0	115.1
279	A	28	Very low	30.6	Very low	84 Å²	84	160.2 Å²	160.2	69%	0.694	82%	0.817	S	S	*	*			trans	6.8	122.8	152	0	0	0	0	0	118.9
280	D	31.9	Very low	30.4	Very low	154 Å²	154	164.5 Å²	164.5	82%	0.824	83%	0.825	S	S	*	*				178.2	157.6	94.7	-116.9	-23.2	0	0	0	112.1
281	R	32.4	Very low	30.5	Very low	230 Å²	230	164.4 Å²	164.4	87%	0.868	82%	0.824	S	S	*	*			trans	80.6	87.2	172.2	-59.9	179.1	176.3	-177.1	-2	116.6
282	Q	30.2	Very low	30.9	Very low	183 Å²	183	160.7 Å²	160.7	86%	0.855	81%	0.812	S	S	*	*				68.8	111.8	80.7	-70.6	-165.5	-11.3	0	0	116
283	S	26.5	Very low	30.8	Very low	105 Å²	105	158.5 Å²	158.5	73%	0.734	80%	0.8	S	S	*	*			trans	65.9	84	142.5	64.4	0	0	0	0	119.7
284	V	31.3	Very low	30.9	Very low	146 Å²	146	162.8 Å²	162.8	89%	0.885	80%	0.8	S	S	*	*			trans	-131.4	120.6	138.7	179.1	0	0	0	0	107.9
285	L	31	Very low	31.3	Very low	157 Å²	157	162.6 Å²	162.6	82%	0.822	79%	0.792	S	S	*	*			trans	-67.6	129.4	-163.3	-89.4	126.8	0	0	0	113.5	H287	L285-H287 PolarHBondContact O-N 3.48Å
286	W	26.4	Very low	31.4	Very low	247 Å²	247	160.3 Å²	160.3	94%	0.936	78%	0.782	S	S	*	*			trans	-54.4	115.4	157.1	-79.6	42.3	0	0	0	111.7
287	H	30.9	Very low	31.6	Very low	168 Å²	168	158.9 Å²	158.9	78%	0.778	77%	0.773	S	S	*	*			trans	-150.1	8.4	159.6	-116.2	-42.2	0	0	0	118.4	L285	L285-H287 PolarHBondContact O-N 3.48Å
288	E	34.2	Very low	32	Very low	197 Å²	197	151.8 Å²	151.8	92%	0.921	76%	0.756	S	S	*	*	S	Bend	trans	-101	6.6	-173.5	-89.6	-173.2	154.6	0	0	117.4
289	R	31.9	Very low	32.2	Very low	239 Å²	239	150.9 Å²	150.9	90%	0.902	75%	0.749	S	S	*	*	S	Bend	trans	-130.7	29.8	-173.4	-74	-169.7	177.6	-176.5	0.5	116.9
290	R	30.5	Very low	32.4	Very low	220 Å²	220	154.6 Å²	154.6	83%	0.83	75%	0.746	S	S	*	*	S	Bend	trans	-112.7	6	179.9	-104.1	-176.2	178.2	178.3	-0.2	117.5
291	V	32.3	Very low	32.5	Very low	115 Å²	115	157.1 Å²	157.1	70%	0.697	74%	0.744	S	S	*	*	S	Bend	trans	-101.5	-6.1	-175.6	-177.9	0	0	0	0	114.6
292	S	40.5	Very low	32.7	Very low	90 Å²	90	157.1 Å²	157.1	63%	0.629	74%	0.744	S	S	*	*	S	Bend	trans	-102.2	0.7	-175.5	71.9	0	0	0	0	116.9
293	L	31.5	Very low	32.9	Very low	124 Å²	124	156.5 Å²	156.5	65%	0.649	74%	0.741	S	S	*	*	S	Bend	trans	-110.6	-31.1	-179	-98.3	149.6	0	0	0	114.3	F296 V297	L293-F296 PolarHBondContact O-N 2.95Å; L293-V297 WeakPolarHBondContact O-CG2 3.39Å; L293-V297 PolarHBondContact O-N 3.25Å
294	E	33.7	Very low	33.2	Very low	166 Å²	166	158.9 Å²	158.9	78%	0.776	74%	0.738	S	S	*	*	H	α-helix	trans	-75.6	-27.6	176.8	-71.2	-174.5	162.1	0	0	113.3	S298	E294-S298 PolarHBondContact O-N 2.85Å
295	K	36.8	Very low	33.3	Very low	150 Å²	150	156 Å²	156	65%	0.652	73%	0.73	S	S	*	*	H	α-helix	trans	-80.1	-22.5	170.7	-72.5	-177.5	176.8	179.2	0	113.2	C299	K295-C299 PolarHBondContact O-N 2.76Å; K295-C299 PolarHBondContact O-SG 2.81Å
296	F	32.6	Very low	33.5	Very low	146 Å²	146	156.3 Å²	156.3	64%	0.64	73%	0.727	S	S	*	*	H	α-helix	trans	-81.6	-33.8	176.4	-146.6	-96.7	0	0	0	111.5	L293 Y300	L293-F296 PolarHBondContact O-N 2.95Å; F296-Y300 VanDerWaalsContact O-CB 3.26Å; F296-Y300 WeakPolarHBondContact O-CB 3.12Å; F296-Y300 PolarHBondContact O-N 3.48Å; F296-Y300 VanDerWaalsContact O-N 3.16Å
297	V	34.4	Very low	33.8	Very low	84 Å²	84	149.6 Å²	149.6	51%	0.509	71%	0.713	S	S	.	*	H	α-helix	trans	-78.5	-28.8	176.4	176.3	0	0	0	0	112.6	L293 W301	L293-V297 WeakPolarHBondContact O-CG2 3.39Å; L293-V297 PolarHBondContact O-N 3.25Å; V297-W301 PolarHBondContact O-N 3.42Å
298	S	35.5	Very low	33.9	Very low	75 Å²	75	149.3 Å²	149.3	52%	0.524	72%	0.717	S	S	.	*	H	α-helix	trans	-78.2	-28.8	174.4	84	0	0	0	0	113.8	E294 W302	E294-S298 PolarHBondContact O-N 2.85Å; S298-W302 PolarHBondContact O-N 3.03Å
299	C	34.3	Very low	33.8	Very low	89 Å²	89	145.2 Å²	145.2	60%	0.601	71%	0.707	S	S	*	*	H	α-helix	trans	-79.6	-28	173.4	-66.2	0	0	0	0	112.9	K295	K295-C299 PolarHBondContact O-N 2.76Å; K295-C299 PolarHBondContact O-SG 2.81Å
300	Y	31.6	Very low	34	Very low	161 Å²	161	145.7 Å²	145.7	63%	0.631	71%	0.709	S	S	*	*	H	α-helix	trans	-81	-19.3	178.2	-152.5	-102.1	0	0	0	113.5	F296	F296-Y300 VanDerWaalsContact O-CB 3.26Å; F296-Y300 WeakPolarHBondContact O-CB 3.12Å; F296-Y300 PolarHBondContact O-N 3.48Å; F296-Y300 VanDerWaalsContact O-N 3.16Å
301	W	34.9	Very low	34.1	Very low	207 Å²	207	144.3 Å²	144.3	78%	0.784	71%	0.709	S	S	*	*	H	α-helix	trans	-91.9	-20.7	173.8	-96.3	64.1	0	0	0	114.5	V297	V297-W301 PolarHBondContact O-N 3.42Å
302	W	36	Very low	34.3	Very low	231 Å²	231	144.3 Å²	144.3	88%	0.875	71%	0.712	S	S	*	*	H	α-helix	trans	-82.6	-27.2	175.8	-131.7	58.4	0	0	0	112.9	S298	S298-W302 PolarHBondContact O-N 3.03Å
303	H	35	Very low	33.9	Very low	169 Å²	169	152.4 Å²	152.4	78%	0.782	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-5.3	-178.5	-139.4	-23.9	0	0	0	114.8
304	K	30.8	Very low	33.9	Very low	155 Å²	155	150.4 Å²	150.4	67%	0.674	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.6	6.4	-176	-139.2	177.1	-176.4	-179.7	0	114.8
305	A	34.1	Very low	33.8	Very low	86 Å²	86	151.8 Å²	151.8	71%	0.711	73%	0.734	S	S	*	*	S	Bend	trans	-98.4	-3.3	178.2	0	0	0	0	0	114.3
306	E	35.8	Very low	33.5	Very low	163 Å²	163	153.9 Å²	153.9	76%	0.762	75%	0.746	S	S	*	*	S	Bend	trans	-106	11.3	-179.3	-72.5	-165	151.3	0	0	114.6
307	T	33.2	Very low	33.5	Very low	106 Å²	106	154.9 Å²	154.9	65%	0.65	75%	0.753	S	S	*	*			trans	-121.8	72.6	179.1	57.3	0	0	0	0	111.4
308	L	32.9	Very low	33.4	Very low	162 Å²	162	158.3 Å²	158.3	85%	0.848	76%	0.763	S	S	*	*			trans	-135.9	126.7	158.8	-83.6	172.1	0	0	0	109.4	R310	L308-R310 PolarHBondContact O-N 3.36Å
309	P	32.5	Very low	33.4	Very low	111 Å²	111	164.1 Å²	164.1	72%	0.721	78%	0.779	S	S	*	*			trans	-75.8	121.6	-175.1	31.6	-31.1	0	0	0	109	F311	P309-F311 PolarHBondContact O-N 2.78Å
310	R	34.4	Very low	33.3	Very low	249 Å²	249	163.5 Å²	163.5	94%	0.94	79%	0.788	S	S	*	*			trans	-83.6	114.6	165.4	-81.7	-172.8	175.5	179.4	-0.6	109.3	L308	L308-R310 PolarHBondContact O-N 3.36Å
311	F	32.7	Very low	33.3	Very low	191 Å²	191	160.5 Å²	160.5	84%	0.838	80%	0.796	S	S	*	*			trans	-42.5	147	172.2	-88.8	-103.5	0	0	0	114.3	P309	P309-F311 PolarHBondContact O-N 2.78Å
312	P	36.4	Very low	33.4	Very low	115 Å²	115	159.1 Å²	159.1	75%	0.747	80%	0.802	S	S	*	*			trans	-73.1	140.2	176.6	29.9	-31.3	0	0	0	111.7	A314	P312-A314 PolarHBondContact O-N 3.19Å
313	R	32.7	Very low	33.3	Very low	260 Å²	260	155.1 Å²	155.1	98%	0.981	80%	0.798	S	S	*	*			trans	-60.3	97.8	171	-72.1	174.5	177.3	164.9	-1.3	110.4
314	A	31.1	Very low	33.3	Very low	82 Å²	82	152.5 Å²	152.5	68%	0.678	79%	0.794	S	S	*	*			trans	-153.8	79	162.9	0	0	0	0	0	107.6	P312	P312-A314 PolarHBondContact O-N 3.19Å
315	F	31.3	Very low	33.4	Very low	195 Å²	195	152.4 Å²	152.4	86%	0.855	80%	0.801	S	S	*	*			trans	-176.5	78.7	161.6	-114.3	-80.6	0	0	0	106.1
316	Q	31.2	Very low	33.5	Very low	194 Å²	194	153.8 Å²	153.8	91%	0.907	81%	0.805	S	S	*	*			trans	-130.4	56	174.2	-162.6	-179.7	7.7	0	0	107.2
317	E	32.8	Very low	33.5	Very low	168 Å²	168	150 Å²	150	79%	0.785	80%	0.802	S	S	*	*	S	Bend	trans	-162.4	137.7	171.6	-102.7	162.9	-155	0	0	104.7
318	E	33	Very low	33.7	Very low	155 Å²	155	147.8 Å²	147.8	72%	0.724	80%	0.8	S	S	*	*	S	Bend	trans	86.2	118.1	-172.1	-52.6	-170.7	151.3	0	0	116.5
319	F	35	Very low	33.9	Very low	197 Å²	197	146.9 Å²	146.9	86%	0.864	79%	0.793	S	S	*	*			trans	75.3	90.6	175	-48.9	-76.2	0	0	0	114.5
320	G	31.1	Very low	34.2	Very low	76 Å²	76	150.8 Å²	150.8	78%	0.784	80%	0.795	S	S	*	*				87.8	107.6	52.1	0	0	0	0	0	108.7
321	A	32.1	Very low	34.6	Very low	98 Å²	98	145 Å²	145	81%	0.81	78%	0.781	S	S	*	*			trans	-38.7	139.6	-175.6	0	0	0	0	0	115.6
322	I	36.4	Very low	35.1	Very low	179 Å²	179	140.5 Å²	140.5	92%	0.918	77%	0.77	S	S	*	*			trans	-161.2	148.3	143.3	-90	137.6	0	0	0	109.8
323	D	35.3	Very low	35.3	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	76%	0.764	S	S	*	*			trans	-82.8	163.4	-153.4	-142.6	-16.4	0	0	0	116.2
324	V	34	Very low	35.6	Very low	115 Å²	115	134.6 Å²	134.6	70%	0.697	75%	0.75	S	S	*	*			trans	-62.7	125.5	178.3	-177	0	0	0	0	110.8
325	N	34.4	Very low	36	Very low	152 Å²	152	137.9 Å²	137.9	81%	0.813	75%	0.749	S	S	*	*			trans	159.3	95.5	147.4	-83	-29.6	0	0	0	111.6
326	S	36.1	Very low	36.3	Very low	115 Å²	115	131.4 Å²	131.4	80%	0.804	73%	0.732	S	S	*	*	S	Bend	trans	177.6	-9.6	156.6	41.4	0	0	0	0	115.6	G328	S326-G328 VanDerWaalsContact C-N 3.34Å; S326-G328 PolarHBondContact O-N 3.39Å
327	A	35	Very low	36.5	Very low	85 Å²	85	127.4 Å²	127.4	70%	0.702	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-3.6	-178.9	0	0	0	0	0	115
328	G	37.3	Very low	36.5	Very low	59 Å²	59	125.3 Å²	125.3	61%	0.608	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-6.8	-174	0	0	0	0	0	116.4	S326 T332	S326-G328 VanDerWaalsContact C-N 3.34Å; S326-G328 PolarHBondContact O-N 3.39Å; G328-T332 PolarHBondContact O-OG1 2.88Å; G328-T332 VanDerWaalsContact O-OG1 3.06Å
329	M	38	Very low	36.6	Very low	143 Å²	143	124.6 Å²	124.6	70%	0.704	72%	0.719	S	S	*	*	S	Bend	trans	-99.5	-13.4	-173	-73.3	-114.8	-64.9	0	0	114.9
330	Y	36.9	Very low	36.4	Very low	193 Å²	193	120.5 Å²	120.5	76%	0.757	71%	0.71	S	S	*	*	H	α-helix	trans	-88.4	-20.9	179.9	-94.5	-86.7	0	0	0	113.9
331	I	44.1	Very low	36.4	Very low	126 Å²	126	126.1 Å²	126.1	65%	0.646	71%	0.713	S	S	*	*	H	α-helix	trans	-87.7	-26.4	-177.4	-63.2	175.1	0	0	0	111.7
332	T	43.6	Very low	36.4	Very low	97 Å²	97	128.4 Å²	128.4	60%	0.595	72%	0.717	S	S	*	*	H	α-helix	trans	-80.3	-27.3	177.9	11.5	0	0	0	0	113.4	G328	G328-T332 PolarHBondContact O-OG1 2.88Å; G328-T332 VanDerWaalsContact O-OG1 3.06Å
333	L	40.3	Very low	36	Very low	122 Å²	122	130 Å²	130	64%	0.639	72%	0.718	S	S	*	*	H	α-helix	trans	-80.2	-26.7	178	-109.4	146.8	0	0	0	113.2
334	L	39.2	Very low	35.6	Very low	129 Å²	129	133.4 Å²	133.4	68%	0.675	72%	0.719	S	S	*	*	H	α-helix	trans	-78.8	-24.8	175.8	-89.2	156.8	0	0	0	113.6
335	F	38.7	Very low	35.3	Very low	152 Å²	152	135.4 Å²	135.4	67%	0.667	73%	0.725	S	S	*	*	H	α-helix	trans	-84.7	-19.3	174.4	-98.1	-88.7	0	0	0	114
336	A	38	Very low	34.9	Very low	59 Å²	59	138 Å²	138	49%	0.488	72%	0.724	S	S	.	*	H	α-helix	trans	-82.5	-20.3	-179.6	0	0	0	0	0	114.1
337	V	35.1	Very low	34.6	Very low	109 Å²	109	140.1 Å²	140.1	66%	0.661	73%	0.726	S	S	*	*	S	Bend	trans	-90.4	-16.7	-176.4	176.7	0	0	0	0	113.1
338	V	33.6	Very low	34.2	Very low	125 Å²	125	145.1 Å²	145.1	76%	0.758	73%	0.732	S	S	*	*	S	Bend	trans	-94.9	-10.5	-179	-179.7	0	0	0	0	112.9
339	L	33.6	Very low	33.8	Very low	139 Å²	139	149.6 Å²	149.6	73%	0.728	74%	0.742	S	S	*	*	S	Bend	trans	-107.6	12.8	-172.1	-82.9	163.2	0	0	0	115.8
340	T	31.1	Very low	33.3	Very low	111 Å²	111	150.5 Å²	150.5	68%	0.681	75%	0.748	S	S	*	*			trans	-110.7	40.1	-176.7	52	0	0	0	0	114.3
341	K	31.3	Very low	32.8	Very low	194 Å²	194	146.6 Å²	146.6	84%	0.843	75%	0.746	S	S	*	*	S	Bend	trans	-145.9	93.8	160.4	-76.6	-169.5	179.4	175.5	0	110.7
342	T	32.2	Very low	32	Very low	146 Å²	146	152 Å²	152	90%	0.896	76%	0.758	S	S	*	*			trans	164.8	91.8	136.1	37.7	0	0	0	0	109.5
343	K	29.1	Very low	31.3	Very low	213 Å²	213	155 Å²	155	93%	0.926	77%	0.77	S	S	*	*			trans	-72.5	142.3	170.2	-93.1	179.6	175	176.9	0	110.4
344	R	25.5	Very low	30.7	Very low	217 Å²	217	154.7 Å²	154.7	82%	0.819	78%	0.775	S	S	*	*			trans	-42.9	137.8	170.3	-63	166.3	178.2	175.4	-1.4	114.6
345	I	28.6	Very low	30.2	Very low	157 Å²	157	158.3 Å²	158.3	81%	0.805	79%	0.786	S	S	*	*			trans	-136	114.5	139.8	-60	-178.9	0	0	0	107.2
346	Y	26.1	Very low	29.7	Very low	206 Å²	206	159.7 Å²	159.7	81%	0.808	79%	0.792	S	S	*	*			trans	-79.7	127.8	162.9	-80.4	-97.9	0	0	0	107.5
347	L	29.6	Very low	29.5	Very low	160 Å²	160	161.6 Å²	161.6	84%	0.838	80%	0.802	S	S	*	*			trans	-154.7	130.5	155.7	-97.7	170.2	0	0	0	109.9
348	K	26.3	Very low	29	Very low	190 Å²	190	163.1 Å²	163.1	83%	0.826	81%	0.806	S	S	*	*			trans	-47.2	147.6	162	-82.6	169.8	165.5	176.2	0	110.2
349	N	28.6	Very low	28.9	Very low	153 Å²	153	162.5 Å²	162.5	82%	0.818	80%	0.802	S	S	*	*			trans	116	115	165.2	-61.2	-17.1	0	0	0	113.5	P351	N349-P351 WeakPolarHBondContact O-CD 3.13Å
350	I	27.5	Very low	28.6	Very low	163 Å²	163	164 Å²	164	84%	0.836	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-54.1	122.4	173.1	-61.4	154.7	0	0	0	109.6
351	P	27.7	Very low	28.5	Very low	111 Å²	111	167.8 Å²	167.8	72%	0.721	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-97	121	157.2	28.3	-14.6	0	0	0	108.8	N349 L353	N349-P351 WeakPolarHBondContact O-CD 3.13Å; P351-L353 PolarHBondContact O-N 2.95Å
352	R	25.9	Very low	28.3	Very low	238 Å²	238	163.1 Å²	163.1	90%	0.898	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-54.2	119.7	161.6	-67.8	174.3	170.7	169.8	-4.2	107.9	P354	R352-P354 WeakPolarHBondContact O-CD 3.48Å
353	L	28.3	Very low	28.1	Very low	160 Å²	160	158.9 Å²	158.9	84%	0.838	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.8	119.3	168.5	-88.1	158.7	0	0	0	108.3	P351	P351-L353 PolarHBondContact O-N 2.95Å
354	P	28	Very low	28.1	Very low	116 Å²	116	158 Å²	158	75%	0.753	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-75.8	124.7	170	30.9	-28.6	0	0	0	108.3	R352 K356	R352-P354 WeakPolarHBondContact O-CD 3.48Å; P354-K356 PolarHBondContact O-N 3.03Å
355	F	29.6	Very low	28.2	Very low	205 Å²	205	157.6 Å²	157.6	90%	0.899	81%	0.811	S	S	*	*			trans	-68.7	115.1	162.2	-90	-88.8	0	0	0	108	S357	F355-S357 PolarHBondContact O-N 3.38Å
356	K	28.1	Very low	28.4	Very low	182 Å²	182	157.3 Å²	157.3	79%	0.791	81%	0.809	S	S	*	*			trans	-82.8	101.6	162.1	-121.3	-174.5	176.9	-167.6	0	106.5	P354	P354-K356 PolarHBondContact O-N 3.03Å
357	S	33.2	Very low	28.5	Very low	99 Å²	99	151 Å²	151	69%	0.692	81%	0.808	S	S	*	*			trans	-91.6	98.7	165.3	54.8	0	0	0	0	108	F355 V359	F355-S357 PolarHBondContact O-N 3.38Å; S357-V359 PolarHBondContact O-N 3.02Å; S357-V359 VanDerWaalsContact O-N 3.08Å
358	D	25.4	Very low	28.5	Very low	140 Å²	140	151.5 Å²	151.5	75%	0.749	81%	0.811	S	S	*	*			trans	-79	74.1	163.1	-71.2	-29.7	0	0	0	107.9
359	V	31.8	Very low	28.6	Very low	112 Å²	112	154.5 Å²	154.5	68%	0.679	82%	0.817	S	S	*	*			trans	-141.4	106	159.9	-173.8	0	0	0	0	106.4	S357 F361	S357-V359 PolarHBondContact O-N 3.02Å; S357-V359 VanDerWaalsContact O-N 3.08Å; V359-F361 HydrophobicContact CG1-CD2 4.19Å; V359-F361 PolarHBondContact O-N 2.92Å
360	N	26.3	Very low	28.7	Very low	170 Å²	170	155.5 Å²	155.5	91%	0.909	82%	0.817	S	S	*	*			trans	-64.9	96.9	174.9	-88.4	-25	0	0	0	109.8
361	F	30.2	Very low	28.8	Very low	192 Å²	192	153.7 Å²	153.7	84%	0.842	82%	0.819	S	S	*	*			trans	-125.7	116.6	152.5	-94.5	-84.7	0	0	0	107.6	V359 G363	V359-F361 HydrophobicContact CG1-CD2 4.19Å; V359-F361 PolarHBondContact O-N 2.92Å; F361-G363 VanDerWaalsContact C-N 3.28Å; F361-G363 PolarHBondContact O-N 3.12Å
362	G	25.4	Very low	28.8	Very low	95 Å²	95	153.6 Å²	153.6	98%	0.979	82%	0.816	S	S	*	*			trans	-74.4	71.1	-174.2	0	0	0	0	0	113.1
363	G	29.2	Very low	28.9	Very low	57 Å²	57	149.1 Å²	149.1	59%	0.588	81%	0.81	S	S	*	*			trans	-118.6	113.5	170.2	0	0	0	0	0	110.6	F361 F365	F361-G363 VanDerWaalsContact C-N 3.28Å; F361-G363 PolarHBondContact O-N 3.12Å; G363-F365 PolarHBondContact O-N 3.14Å
364	K	28.3	Very low	29	Very low	195 Å²	195	151.9 Å²	151.9	85%	0.848	82%	0.816	S	S	*	*			trans	-86.2	106.4	-178.5	-163.6	-179.4	-174.3	-177.4	0	109.4	I366	K364-I366 PolarHBondContact O-N 3.36Å
365	F	28.4	Very low	29	Very low	208 Å²	208	154 Å²	154	91%	0.912	82%	0.821	S	S	*	*			trans	-64.1	124.4	172.7	-101.2	-92.4	0	0	0	111.2	G363	G363-F365 PolarHBondContact O-N 3.14Å
366	I	31.5	Very low	28.9	Very low	151 Å²	151	154.8 Å²	154.8	77%	0.774	82%	0.819	S	S	*	*			trans	-115.4	103.2	170.1	-58.8	177.1	0	0	0	108.7	K364	K364-I366 PolarHBondContact O-N 3.36Å
367	G	30.1	Very low	28.9	Very low	75 Å²	75	153.5 Å²	153.5	77%	0.773	82%	0.821	S	S	*	*			trans	66.4	106.3	146.6	0	0	0	0	0	120.6
368	N	28.9	Very low	28.7	Very low	169 Å²	169	155.8 Å²	155.8	90%	0.904	82%	0.821	S	S	*	*			trans	-86.9	132.3	159.5	-111.3	-13.7	0	0	0	110.7
369	R	28.4	Very low	28.9	Very low	253 Å²	253	155.5 Å²	155.5	96%	0.955	82%	0.824	S	S	*	*			trans	-91.8	110.4	159.2	-97.1	-174.9	173.5	-179.3	-0.8	108.6
370	Q	30.4	Very low	28.7	Very low	175 Å²	175	156 Å²	156	82%	0.818	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-76.2	132.7	167.7	-73.7	-177.1	-28.3	0	0	110.1
371	S	30.2	Very low	28.9	Very low	125 Å²	125	151.2 Å²	151.2	87%	0.874	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-90.4	116.6	156.9	71.8	0	0	0	0	109.5
372	T	27.7	Very low	28.9	Very low	108 Å²	108	149.7 Å²	149.7	66%	0.663	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-74.6	144.2	171.1	46.2	0	0	0	0	111.9
373	N	26.7	Very low	29.1	Very low	145 Å²	145	149.3 Å²	149.3	78%	0.775	81%	0.812	S	S	*	*			trans	66.5	114.4	163.1	-58.5	-17.7	0	0	0	117
374	F	30.7	Very low	29.3	Very low	218 Å²	218	153.2 Å²	153.2	96%	0.956	82%	0.819	S	S	*	*			trans	-155.2	124.3	137.5	-101.5	-72.8	0	0	0	111
375	D	28.5	Very low	29.7	Very low	159 Å²	159	149.8 Å²	149.8	85%	0.85	82%	0.815	S	S	*	*			trans	-73.5	152.2	168.5	-88.2	-42.1	0	0	0	111
376	Y	27.4	Very low	29.9	Very low	222 Å²	222	147.6 Å²	147.6	87%	0.871	81%	0.808	S	S	*	*			trans	-55.7	137.9	179.7	-90.1	-104	0	0	0	113.9
377	N	27.9	Very low	30	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	80%	0.798	S	S	*	*				-164	147.4	128.2	-98.4	-22.5	0	0	0	113.1	T379	N377-T379 PolarHBondContact O-N 3.21Å
378	E	28.8	Very low	30.1	Very low	146 Å²	146	147.5 Å²	147.5	68%	0.682	79%	0.793	S	S	*	*			trans	-47.7	125.3	179.3	-63	170.9	159.2	0	0	113	R124	R124-E378 IonicContact NH1-OE1 3.76Å
379	T	29.5	Very low	30.1	Very low	134 Å²	134	145.2 Å²	145.2	82%	0.822	78%	0.78	S	S	*	*			trans	178.3	135.9	130.5	24.5	0	0	0	0	110	N377	N377-T379 PolarHBondContact O-N 3.21Å
380	S	29	Very low	30.3	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	77%	0.77	S	S	*	*			trans	-9.1	127.4	162.8	54	0	0	0	0	117.7
381	G	29.5	Very low	30.5	Very low	70 Å²	70	138.6 Å²	138.6	72%	0.722	76%	0.759	S	S	*	*			trans	165.8	116.6	161.4	0	0	0	0	0	112	A383	G381-A383 PolarHBondContact O-N 3.45Å; G381-A383 VanDerWaalsContact O-N 3.13Å
382	N	31.5	Very low	30.5	Very low	160 Å²	160	142 Å²	142	86%	0.856	76%	0.761	S	S	*	*			trans	-47.8	114.7	172	-65.4	-18.8	0	0	0	110.4
383	A	29.6	Very low	30.6	Very low	88 Å²	88	139.3 Å²	139.3	73%	0.727	76%	0.755	S	S	*	*			trans	-99.2	82.1	167.1	0	0	0	0	0	107.7	G381 T385	G381-A383 PolarHBondContact O-N 3.45Å; G381-A383 VanDerWaalsContact O-N 3.13Å; A383-T385 PolarHBondContact O-N 3.28Å
384	N	31.7	Very low	31	Very low	138 Å²	138	136.6 Å²	136.6	74%	0.738	75%	0.747	S	S	*	*			trans	-71	104.9	162.2	-71.4	5.6	0	0	0	106.7
385	T	36.9	Very low	31.2	Very low	124 Å²	124	131.2 Å²	131.2	76%	0.761	74%	0.737	S	S	*	*			trans	-98	92	163.9	51.4	0	0	0	0	107.5	A383 S387	A383-T385 PolarHBondContact O-N 3.28Å; T385-S387 PolarHBondContact O-N 3.26Å
386	E	32.7	Very low	31.9	Very low	162 Å²	162	127.4 Å²	127.4	76%	0.757	72%	0.717	S	S	*	*			trans	-65.9	116.5	163.3	-72.6	172.2	-174	0	0	107.3
387	S	34.3	Very low	32.6	Very low	80 Å²	80	122.9 Å²	122.9	56%	0.559	70%	0.699	S	S	*	*			trans	-121.6	99.4	172.7	44.4	0	0	0	0	108.8	T385	T385-S387 PolarHBondContact O-N 3.26Å
388	E	31.9	Very low	33.3	Very low	144 Å²	144	119.1 Å²	119.1	67%	0.673	68%	0.679	S	S	*	*			trans	-71	125.7	170.6	-65	-179.6	179	0	0	109.7	Y390	E388-Y390 HydrophobicContact CB-CE2 4.07Å; E388-Y390 PolarHBondContact OE2-OH 3.15Å
389	L	30.1	Very low	34.4	Very low	120 Å²	120	116 Å²	116	63%	0.628	67%	0.666	S	S	*	*			trans	-113.9	108.6	176.2	-161.2	108	0	0	0	109.7	V391	L389-V391 HydrophobicContact CD2-CG2 3.85Å; L389-V391 PolarHBondContact O-N 3.26Å
390	Y	31.3	Very low	35.4	Very low	192 Å²	192	114.5 Å²	114.5	75%	0.753	65%	0.648	S	S	*	*			trans	-81	113.3	175.1	-66.5	-94.9	0	0	0	110	E388	E388-Y390 HydrophobicContact CB-CE2 4.07Å; E388-Y390 PolarHBondContact OE2-OH 3.15Å
391	V	34.5	Very low	36.6	Very low	97 Å²	97	113.1 Å²	113.1	59%	0.588	63%	0.631	S	S	*	*			trans	-97.9	109.6	170.6	-176.9	0	0	0	0	108.6	L389 G393	L389-V391 HydrophobicContact CD2-CG2 3.85Å; L389-V391 PolarHBondContact O-N 3.26Å; V391-G393 PolarHBondContact O-N 2.99Å
392	Q	31.1	Very low	37.9	Very low	197 Å²	197	112.9 Å²	112.9	92%	0.921	62%	0.618	S	S	*	*			trans	-83.4	96.3	173.5	-168.1	174.4	14	0	0	109.5
393	G	29.3	Very low	39.4	Very low	52 Å²	52	109.9 Å²	109.9	54%	0.536	60%	0.601	S	S	.	*	S	Bend	trans	173	106.9	174.1	0	0	0	0	0	111.6	V391	V391-G393 PolarHBondContact O-N 2.99Å
394	S	34.4	Very low	41.3	Very low	87 Å²	87	109.1 Å²	109.1	61%	0.608	60%	0.595	S	S	*	*	S	Bend	trans	72.4	127.9	-161.2	77.8	0	0	0	0	112.9	D396	S394-D396 PolarHBondContact O-N 3.48Å
395	S	36.1	Very low	43.3	Very low	106 Å²	106	107.6 Å²	107.6	74%	0.741	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	5	-168.2	37	0	0	0	0	114.7
396	D	43.6	Very low	44.9	Very low	78 Å²	78	108 Å²	108	42%	0.417	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.6	-4.3	-150.4	-50.2	-25.8	0	0	0	114	S394 L422	S394-D396 PolarHBondContact O-N 3.48Å; D396-L422 PolarHBondContact O-N 2.86Å
397	Y	41.6	Very low	47.1	Very low	127 Å²	127	103.4 Å²	103.4	50%	0.498	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.4	129.5	-176.3	-63.4	-79.4	0	0	0	113.4	A419 E421	Y397-A419 HydrophobicContact CD1-CB 4.45Å; Y397-E421 HydrophobicContact CE1-CB 4.28Å; Y397-E421 HydrophobicContact CE1-CG 4.31Å
398	L	42	Very low	49.2	Very low	78 Å²	78	108 Å²	108	41%	0.408	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	119	169.3	-145.2	146.3	0	0	0	108.5	K400 Q420 L422	L398-K400 PolarHBondContact O-N 3.27Å; L398-Q420 PolarHBondContact N-O 3.09Å; L398-Q420 PolarHBondContact O-N 2.77Å; L398-L422 HydrophobicContact CB-CD1 3.69Å; L398-L422 HydrophobicContact CB-CG 4.18Å; L398-L422 HydrophobicContact CD1-CD1 3.79Å; L398-L422 HydrophobicContact CD1-CD2 4.03Å; L398-L422 HydrophobicContact CD1-CG 4.16Å; L398-L422 HydrophobicContact CG-CD1 4.2Å
399	L	51.8	Low	51.4	Low	80 Å²	80	110.7 Å²	110.7	42%	0.419	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.7	105.1	174.9	-136.8	134.5	0	0	0	107.7	F417 N418	L399-F417 HydrophobicContact CD2-CD1 4.35Å; L399-N418 WeakPolarHBondContact CA-O 3.27Å
400	K	50.3	Low	53.7	Low	102 Å²	102	108.9 Å²	108.9	44%	0.443	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.4	129.4	-176.2	-140.8	175.6	-173.2	175	0	108.3	L398 N418	L398-K400 PolarHBondContact O-N 3.27Å; K400-N418 PolarHBondContact N-O 2.94Å; K400-N418 WeakPolarHBondContact O-CB 3.32Å
401	D	55.6	Low	55.8	Low	93 Å²	93	102.1 Å²	102.1	50%	0.497	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	50.6	97.2	170.4	-57.2	-28.8	0	0	0	116.6
402	S	56.1	Low	57.5	Low	65 Å²	65	98.5 Å²	98.5	46%	0.455	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	102.8	160.6	65.4	0	0	0	0	109.6	V416	S402-V416 WeakPolarHBondContact CA-O 3.46Å
403	I	62.8	Low	59.5	Low	98 Å²	98	92 Å²	92	50%	0.503	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.1	172.3	-59.2	174.6	0	0	0	107.8	A415 V416	I403-A415 WeakPolarHBondContact O-CA 3.38Å; I403-V416 PolarHBondContact O-N 2.97Å; I403-V416 VanDerWaalsContact O-N 3.09Å
404	A	68.8	Low	61.6	Low	71 Å²	71	93.2 Å²	93.2	59%	0.587	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	103.9	173.6	0	0	0	0	0	109.6	V413 E414 A415	A404-V413 HydrophobicContact CB-CG1 4.47Å; A404-E414 CarbonylContact C-O 3.59Å; A404-E414 VanDerWaalsContact CA-O 3.25Å; A404-E414 WeakPolarHBondContact CA-O 3.33Å; A404-A415 HydrophobicContact CB-CB 4.47Å
405	D	73.9	Confident	63.4	Low	107 Å²	107	89.9 Å²	89.9	57%	0.572	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.9	-178.2	-84.7	-17.2	0	0	0	111.6	N407 E414	D405-N407 PolarHBondContact O-N 2.72Å; D405-E414 PolarHBondContact N-O 2.93Å; D405-E414 PolarHBondContact O-N 3.27Å
406	Y	71.4	Confident	65.1	Low	133 Å²	133	86.5 Å²	86.5	52%	0.522	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	110.2	172.7	179.5	-103.8	0	0	0	110.5	K408 S412 V413	Y406-K408 HydrophobicContact CE1-CB 4.16Å; Y406-K408 HydrophobicContact CE1-CG 4.46Å; Y406-K408 PolarHBondContact O-N 3Å; Y406-S412 WeakPolarHBondContact CD2-O 3Å; Y406-V413 HydrophobicContact CD2-CG2 3.84Å
407	N	78.7	Confident	66.3	Low	64 Å²	64	87 Å²	87	34%	0.342	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	102.9	174.5	-174.3	-18.8	0	0	0	110.4	D405 K409 T410 S411 S412	D405-N407 PolarHBondContact O-N 2.72Å; N407-K409 PolarHBondContact O-N 3.21Å; N407-K409 WeakPolarHBondContact OD1-CB 3.35Å; N407-K409 PolarHBondContact OD1-N 3.45Å; N407-T410 VanDerWaalsContact CB-OG1 3.25Å; N407-T410 WeakPolarHBondContact CB-OG1 3.38Å; N407-T410 PolarHBondContact O-N 3.3Å; N407-T410 PolarHBondContact O-OG1 3.03Å; N407-T410 PolarHBondContact OD1-N 3.06Å; N407-S411 WeakPolarHBondContact O-CA 3.38Å; N407-S411 PolarHBondContact O-N 3.25Å; N407-S412 PolarHBondContact N-O 3.48Å; N407-S412 PolarHBondContact O-N 3.45Å
408	K	77	Confident	67.4	Low	178 Å²	178	82.9 Å²	82.9	77%	0.774	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-26.2	179.5	-169.1	177.2	-179.4	-179.4	0	113.6	Y406	Y406-K408 HydrophobicContact CE1-CB 4.16Å; Y406-K408 HydrophobicContact CE1-CG 4.46Å; Y406-K408 PolarHBondContact O-N 3Å
409	K	79.4	Confident	68.3	Low	200 Å²	200	80.5 Å²	80.5	87%	0.87	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-39.2	179.3	-68.2	-179.3	177.4	175.3	0	111.5	N407	N407-K409 PolarHBondContact O-N 3.21Å; N407-K409 WeakPolarHBondContact OD1-CB 3.35Å; N407-K409 PolarHBondContact OD1-N 3.45Å
410	T	77.5	Confident	68.5	Low	82 Å²	82	80 Å²	80	50%	0.503	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-10.7	-178.2	53.2	0	0	0	0	112.9	N407 S412	N407-T410 VanDerWaalsContact CB-OG1 3.25Å; N407-T410 WeakPolarHBondContact CB-OG1 3.38Å; N407-T410 PolarHBondContact O-N 3.3Å; N407-T410 PolarHBondContact O-OG1 3.03Å; N407-T410 PolarHBondContact OD1-N 3.06Å; T410-S412 WeakPolarHBondContact CB-OG 3.22Å; T410-S412 PolarHBondContact O-N 3.28Å; T410-S412 PolarHBondContact OG1-OG 2.76Å
411	S	75.5	Confident	68.7	Low	50 Å²	50	78.2 Å²	78.2	35%	0.35	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	32.6	-170.4	-53.4	0	0	0	0	112.8	N407 P445	N407-S411 WeakPolarHBondContact O-CA 3.38Å; N407-S411 PolarHBondContact O-N 3.25Å; S411-P445 WeakPolarHBondContact O-CD 3.44Å
412	S	71.5	Confident	68.6	Low	20 Å²	20	78 Å²	78	14%	0.14	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	149.4	-179.5	62.2	0	0	0	0	111.7	Y406 N407 T410 N443	Y406-S412 WeakPolarHBondContact CD2-O 3Å; N407-S412 PolarHBondContact N-O 3.48Å; N407-S412 PolarHBondContact O-N 3.45Å; T410-S412 WeakPolarHBondContact CB-OG 3.22Å; T410-S412 PolarHBondContact O-N 3.28Å; T410-S412 PolarHBondContact OG1-OG 2.76Å; S412-N443 CarbonylContact C-O 3.6Å; S412-N443 WeakPolarHBondContact CA-O 3.36Å; S412-N443 WeakPolarHBondContact CB-O 3.47Å
413	V	72.3	Confident	68.3	Low	61 Å²	61	82.2 Å²	82.2	37%	0.37	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124	165.7	179.9	0	0	0	0	107.3	A404 Y406 T442 N443	A404-V413 HydrophobicContact CB-CG1 4.47Å; Y406-V413 HydrophobicContact CD2-CG2 3.84Å; V413-T442 CarbonylContact O-C 3.59Å; V413-T442 WeakPolarHBondContact O-CA 3.29Å; V413-N443 PolarHBondContact N-O 3.4Å; V413-N443 PolarHBondContact O-N 2.8Å
414	E	73.6	Confident	67.5	Low	78 Å²	78	80.2 Å²	80.2	36%	0.364	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123	172.6	-175.7	166.6	-169.9	0	0	108.1	A404 D405 I440 S441 T442	A404-E414 CarbonylContact C-O 3.59Å; A404-E414 VanDerWaalsContact CA-O 3.25Å; A404-E414 WeakPolarHBondContact CA-O 3.33Å; D405-E414 PolarHBondContact N-O 2.93Å; D405-E414 PolarHBondContact O-N 3.27Å; E414-I440 HydrophobicContact CG-CG2 4.31Å; E414-S441 CarbonylContact C-O 3.44Å; E414-S441 WeakPolarHBondContact CA-O 3.49Å; E414-T442 HydrophobicContact CB-CG2 4.3Å; E414-T442 HydrophobicContact CG-CG2 3.97Å
415	A	72.3	Confident	66.3	Low	16 Å²	16	84.7 Å²	84.7	13%	0.132	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.8	175.3	0	0	0	0	0	109.1	I403 A404 F417 S441	I403-A415 WeakPolarHBondContact O-CA 3.38Å; A404-A415 HydrophobicContact CB-CB 4.47Å; A415-F417 HydrophobicContact CB-CE2 3.87Å; A415-F417 HydrophobicContact CB-CZ 4.21Å; A415-S441 PolarHBondContact N-O 3.12Å; A415-S441 PolarHBondContact O-N 2.99Å
416	V	71.7	Confident	65.1	Low	35 Å²	35	84.1 Å²	84.1	21%	0.212	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.8	176.5	-176.1	0	0	0	0	108.3	S402 I403 N418 L439 I440	S402-V416 WeakPolarHBondContact CA-O 3.46Å; I403-V416 PolarHBondContact O-N 2.97Å; I403-V416 VanDerWaalsContact O-N 3.09Å; V416-N418 VanDerWaalsContact CG1-OD1 3.31Å; V416-N418 WeakPolarHBondContact CG1-OD1 3.34Å; V416-L439 WeakPolarHBondContact CA-O 3.47Å; V416-I440 HydrophobicContact CG1-CG1 4.49Å; V416-I440 HydrophobicContact CG2-CG1 4.38Å
417	F	68.8	Low	63.4	Low	88 Å²	88	85.9 Å²	85.9	39%	0.386	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	117.3	173.7	-55.5	-92.8	0	0	0	108.6	L399 A415 L439	L399-F417 HydrophobicContact CD2-CD1 4.35Å; A415-F417 HydrophobicContact CB-CE2 3.87Å; A415-F417 HydrophobicContact CB-CZ 4.21Å; F417-L439 HydrophobicContact CB-CB 4.25Å; F417-L439 HydrophobicContact CD2-CD2 3.91Å; F417-L439 HydrophobicContact CE2-CD2 4.48Å; F417-L439 PolarHBondContact N-O 3.43Å; F417-L439 PolarHBondContact O-N 3.49Å
418	N	64.8	Low	61.6	Low	42 Å²	42	88 Å²	88	23%	0.225	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.5	178.1	-65.6	-8.5	0	0	0	109.8	L399 K400 V416 E438	L399-N418 WeakPolarHBondContact CA-O 3.27Å; K400-N418 PolarHBondContact N-O 2.94Å; K400-N418 WeakPolarHBondContact O-CB 3.32Å; V416-N418 VanDerWaalsContact CG1-OD1 3.31Å; V416-N418 WeakPolarHBondContact CG1-OD1 3.34Å; N418-E438 WeakPolarHBondContact OD1-CG 3.27Å
419	A	60.2	Low	59.7	Low	28 Å²	28	82.2 Å²	82.2	23%	0.231	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.2	167.6	0	0	0	0	0	108.4	Y397 D437	Y397-A419 HydrophobicContact CD1-CB 4.45Å; A419-D437 PolarHBondContact N-O 3.2Å; A419-D437 PolarHBondContact O-N 3.3Å; A419-D437 VanDerWaalsContact O-N 3.17Å
420	Q	57.3	Low	57.7	Low	68 Å²	68	80.4 Å²	80.4	32%	0.318	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.8	171.8	-169.7	176	-0.2	0	0	108.1	L398 L422	L398-Q420 PolarHBondContact N-O 3.09Å; L398-Q420 PolarHBondContact O-N 2.77Å; Q420-L422 PolarHBondContact O-N 3Å
421	E	53.9	Low	55.6	Low	66 Å²	66	84.1 Å²	84.1	31%	0.308	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	128	170.7	-162.2	175.4	176.5	0	0	108.8	Y397 P435	Y397-E421 HydrophobicContact CE1-CB 4.28Å; Y397-E421 HydrophobicContact CE1-CG 4.31Å; E421-P435 HydrophobicContact CB-CG 4.39Å; E421-P435 WeakPolarHBondContact OE2-CG 3.28Å
422	L	52.5	Low	53.6	Low	89 Å²	89	90.9 Å²	90.9	47%	0.466	49%	0.494	S	S	.	.			trans	-83.5	112.4	173.6	-84.9	136.4	0	0	0	108.6	D396 L398 Q420	D396-L422 PolarHBondContact O-N 2.86Å; L398-L422 HydrophobicContact CB-CD1 3.69Å; L398-L422 HydrophobicContact CB-CG 4.18Å; L398-L422 HydrophobicContact CD1-CD1 3.79Å; L398-L422 HydrophobicContact CD1-CD2 4.03Å; L398-L422 HydrophobicContact CD1-CG 4.16Å; L398-L422 HydrophobicContact CG-CD1 4.2Å; Q420-L422 PolarHBondContact O-N 3Å
423	D	50.1	Low	52.1	Low	152 Å²	152	96.4 Å²	96.4	81%	0.813	52%	0.52	S	S	*	.			trans	42.8	81.5	162.6	-64.7	-17.5	0	0	0	116
424	S	46.2	Very low	51	Low	57 Å²	57	96.1 Å²	96.1	40%	0.399	52%	0.524	S	S	.	.			trans	-94	120.9	146.9	68	0	0	0	0	107.8	T426	S424-T426 PolarHBondContact O-N 3.34Å; S424-T426 PolarHBondContact O-OG1 3.48Å; S424-T426 PolarHBondContact OG-OG1 2.85Å
425	D	44.2	Very low	50.2	Low	165 Å²	165	95.5 Å²	95.5	88%	0.882	53%	0.527	S	S	*	.			trans	-62.3	54.8	176.7	-78.1	-39.8	0	0	0	112.6	M427	D425-M427 VanDerWaalsContact C-N 3.31Å; D425-M427 PolarHBondContact O-N 3.3Å; D425-M427 VanDerWaalsContact O-N 3.15Å
426	T	47.7	Very low	49.4	Very low	94 Å²	94	98.8 Å²	98.8	58%	0.577	55%	0.546	S	S	*	.			trans	-91.2	68.3	178.7	45.5	0	0	0	0	109.9	S424 T428	S424-T426 PolarHBondContact O-N 3.34Å; S424-T426 PolarHBondContact O-OG1 3.48Å; S424-T426 PolarHBondContact OG-OG1 2.85Å; T426-T428 VanDerWaalsContact C-N 3.29Å; T426-T428 PolarHBondContact O-N 2.98Å
427	M	36.3	Very low	49	Very low	171 Å²	171	101.9 Å²	101.9	84%	0.842	56%	0.561	S	S	*	*			trans	-62.2	88.2	165.2	-83.7	-95.6	175	0	0	110	D425	D425-M427 VanDerWaalsContact C-N 3.31Å; D425-M427 PolarHBondContact O-N 3.3Å; D425-M427 VanDerWaalsContact O-N 3.15Å
428	T	41.9	Very low	48.9	Very low	108 Å²	108	103.4 Å²	103.4	66%	0.663	57%	0.569	S	S	*	*			trans	-109.3	85.3	164.6	48.6	0	0	0	0	109.2	T426	T426-T428 VanDerWaalsContact C-N 3.29Å; T426-T428 PolarHBondContact O-N 2.98Å
429	G	35.5	Very low	49	Very low	56 Å²	56	104.7 Å²	104.7	58%	0.577	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.6	87.2	167.5	0	0	0	0	0	115.9	F431	G429-F431 WeakPolarHBondContact O-CD2 2.93Å; G429-F431 PolarHBondContact O-N 2.87Å
430	N	38.1	Very low	49.7	Very low	163 Å²	163	108 Å²	108	87%	0.872	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.4	4.2	165.1	-65.4	-7.2	0	0	0	118.6
431	F	33.1	Very low	50.4	Low	159 Å²	159	105.9 Å²	105.9	70%	0.697	58%	0.582	S	S	*	*			trans	-126.9	115.5	176.6	-68.2	-79.2	0	0	0	109.1	G429 I433	G429-F431 WeakPolarHBondContact O-CD2 2.93Å; G429-F431 PolarHBondContact O-N 2.87Å; F431-I433 HydrophobicContact CB-CG1 4.4Å; F431-I433 PolarHBondContact O-N 3.43Å
432	E	33.5	Very low	51.4	Low	193 Å²	193	107 Å²	107	90%	0.902	59%	0.593	S	S	*	*			trans	-70.5	111.4	160.4	-80.8	174.2	174.8	0	0	107.3
433	I	39.6	Very low	52.4	Low	135 Å²	135	104.4 Å²	104.4	69%	0.692	58%	0.579	S	S	*	*			trans	-106	98.9	168.6	-57	174.9	0	0	0	105.8	F431 P435	F431-I433 HydrophobicContact CB-CG1 4.4Å; F431-I433 PolarHBondContact O-N 3.43Å; I433-P435 WeakPolarHBondContact O-CD 3.48Å
434	A	49.5	Very low	53.3	Low	55 Å²	55	98.5 Å²	98.5	46%	0.455	56%	0.555	S	S	.	*			trans	-82	118.8	168.7	0	0	0	0	0	108.4	T436	A434-T436 PolarHBondContact O-N 3Å
435	P	56.2	Low	54	Low	65 Å²	65	100.8 Å²	100.8	42%	0.422	57%	0.568	S	S	.	*			trans	-65.8	126.2	170.6	26.8	-31	0	0	0	109	E421 I433	E421-P435 HydrophobicContact CB-CG 4.39Å; E421-P435 WeakPolarHBondContact OE2-CG 3.28Å; I433-P435 WeakPolarHBondContact O-CD 3.48Å
436	T	56.4	Low	54.8	Low	86 Å²	86	100.8 Å²	100.8	53%	0.528	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.9	114.5	171.4	52.8	0	0	0	0	108.5	A434	A434-T436 PolarHBondContact O-N 3Å
437	D	62.6	Low	55.5	Low	99 Å²	99	100.1 Å²	100.1	53%	0.529	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.6	116.2	171.2	-74.3	-21.1	0	0	0	108.6	A419	A419-D437 PolarHBondContact N-O 3.2Å; A419-D437 PolarHBondContact O-N 3.3Å; A419-D437 VanDerWaalsContact O-N 3.17Å
438	E	68.1	Low	56.6	Low	120 Å²	120	98.4 Å²	98.4	56%	0.561	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104	124.5	175.6	-58.5	-163.3	157.5	0	0	110.5	N418	N418-E438 WeakPolarHBondContact OD1-CG 3.27Å
439	L	66.3	Low	57.6	Low	70 Å²	70	97.1 Å²	97.1	37%	0.366	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107	109.3	171.9	-163.8	118.3	0	0	0	110.5	V416 F417 L456	V416-L439 WeakPolarHBondContact CA-O 3.47Å; F417-L439 HydrophobicContact CB-CB 4.25Å; F417-L439 HydrophobicContact CD2-CD2 3.91Å; F417-L439 HydrophobicContact CE2-CD2 4.48Å; F417-L439 PolarHBondContact N-O 3.43Å; F417-L439 PolarHBondContact O-N 3.49Å; L439-L456 HydrophobicContact CD1-CD2 3.38Å; L439-L456 HydrophobicContact CD2-CD1 4.3Å; L439-L456 HydrophobicContact CD2-CD2 3.94Å; L439-L456 HydrophobicContact CG-CD2 4.19Å
440	I	74.4	Confident	58.9	Low	98 Å²	98	98.4 Å²	98.4	50%	0.503	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.6	178.8	-53.8	174.9	0	0	0	109.8	E414 V416 T442	E414-I440 HydrophobicContact CG-CG2 4.31Å; V416-I440 HydrophobicContact CG1-CG1 4.49Å; V416-I440 HydrophobicContact CG2-CG1 4.38Å; I440-T442 HydrophobicContact CG2-CG2 4.38Å
441	S	73.2	Confident	60.3	Low	23 Å²	23	94.1 Å²	94.1	16%	0.161	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	108.8	177.1	-176.9	0	0	0	0	110.7	E414 A415 N443	E414-S441 CarbonylContact C-O 3.44Å; E414-S441 WeakPolarHBondContact CA-O 3.49Å; A415-S441 PolarHBondContact N-O 3.12Å; A415-S441 PolarHBondContact O-N 2.99Å; S441-N443 PolarHBondContact OG-ND2 3.07Å
442	T	75	Confident	61.8	Low	89 Å²	89	87.3 Å²	87.3	55%	0.546	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	103.1	174.3	55.8	0	0	0	0	110.5	V413 E414 I440	V413-T442 CarbonylContact O-C 3.59Å; V413-T442 WeakPolarHBondContact O-CA 3.29Å; E414-T442 HydrophobicContact CB-CG2 4.3Å; E414-T442 HydrophobicContact CG-CG2 3.97Å; I440-T442 HydrophobicContact CG2-CG2 4.38Å
443	N	71.7	Confident	63.4	Low	34 Å²	34	81.3 Å²	81.3	18%	0.182	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.1	-178.6	-75.4	-35.2	0	0	0	111.2	S412 V413 S441 L447 S452	S412-N443 CarbonylContact C-O 3.6Å; S412-N443 WeakPolarHBondContact CA-O 3.36Å; S412-N443 WeakPolarHBondContact CB-O 3.47Å; V413-N443 PolarHBondContact N-O 3.4Å; V413-N443 PolarHBondContact O-N 2.8Å; S441-N443 PolarHBondContact OG-ND2 3.07Å; N443-L447 HydrophobicContact CB-CB 4.04Å; N443-L447 HydrophobicContact CB-CD1 4.45Å; N443-S452 PolarHBondContact ND2-OG 3.4Å; N443-S452 PolarHBondContact OD1-OG 2.89Å
444	G	70.8	Confident	64.9	Low	29 Å²	29	78.2 Å²	78.2	30%	0.299	47%	0.465	S	S	.	.			trans	-65.9	171.3	167.2	0	0	0	0	0	112.8	L446 L447	G444-L446 PolarHBondContact O-N 2.92Å; G444-L447 PolarHBondContact O-N 3.39Å; G444-L447 VanDerWaalsContact O-N 3.12Å
445	P	59.4	Low	65.8	Low	105 Å²	105	80.4 Å²	80.4	68%	0.682	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-3.2	-165.7	27.7	-32.1	0	0	0	115	S411	S411-P445 WeakPolarHBondContact O-CD 3.44Å
446	L	60.6	Low	66.6	Low	165 Å²	165	81.7 Å²	81.7	86%	0.864	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	-2.3	-179	-67.5	171.7	0	0	0	113.4	G444 M448	G444-L446 PolarHBondContact O-N 2.92Å; L446-M448 PolarHBondContact O-N 3.39Å
447	L	63.7	Low	67.4	Low	79 Å²	79	81.1 Å²	81.1	41%	0.414	47%	0.471	S	S	.	.			trans	-80.5	119.4	178.5	-83	164.1	0	0	0	109.9	N443 G444 N451	N443-L447 HydrophobicContact CB-CB 4.04Å; N443-L447 HydrophobicContact CB-CD1 4.45Å; G444-L447 PolarHBondContact O-N 3.39Å; G444-L447 VanDerWaalsContact O-N 3.12Å; L447-N451 HydrophobicContact CD2-CB 3.75Å
448	M	59.6	Low	67.8	Low	135 Å²	135	83.1 Å²	83.1	67%	0.665	48%	0.477	S	S	*	.			trans	-77.9	149.4	170.6	-67.5	-170.2	169.3	0	0	109.9	L446 T450 N451	L446-M448 PolarHBondContact O-N 3.39Å; M448-T450 WeakPolarHBondContact CB-OG1 3.2Å; M448-T450 PolarHBondContact O-N 2.71Å; M448-N451 WeakPolarHBondContact O-CB 3.28Å; M448-N451 PolarHBondContact O-N 3.27Å
449	A	63	Low	67.8	Low	82 Å²	82	84.6 Å²	84.6	68%	0.678	48%	0.481	S	S	*	.	H	α-helix	trans	-53	-29.1	176.2	0	0	0	0	0	113.3	N451 S452 S453	A449-N451 VanDerWaalsContact C-N 3.27Å; A449-N451 PolarHBondContact O-N 2.85Å; A449-S452 PolarHBondContact O-N 3.09Å; A449-S453 PolarHBondContact O-N 3.31Å; A449-S453 VanDerWaalsContact O-N 3.1Å
450	T	61.3	Low	67.8	Low	82 Å²	82	90 Å²	90	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-61.3	-32.2	174.4	52.4	0	0	0	0	113.3	M448 S453 V454	M448-T450 WeakPolarHBondContact CB-OG1 3.2Å; M448-T450 PolarHBondContact O-N 2.71Å; T450-S453 WeakPolarHBondContact CA-OG 3.21Å; T450-S453 PolarHBondContact O-OG 3.49Å; T450-V454 VanDerWaalsContact O-CG2 3.3Å; T450-V454 WeakPolarHBondContact O-CG2 3.16Å; T450-V454 PolarHBondContact O-N 3.39Å; T450-V454 VanDerWaalsContact O-N 3.14Å
451	N	68.8	Low	67.4	Low	73 Å²	73	90.4 Å²	90.4	39%	0.39	50%	0.5	S	S	.	.	H	α-helix	trans	-72.9	-39.8	179.1	-65.5	1	0	0	0	110.2	L447 M448 A449 S453 V454 L455	L447-N451 HydrophobicContact CD2-CB 3.75Å; M448-N451 WeakPolarHBondContact O-CB 3.28Å; M448-N451 PolarHBondContact O-N 3.27Å; A449-N451 VanDerWaalsContact C-N 3.27Å; A449-N451 PolarHBondContact O-N 2.85Å; N451-S453 VanDerWaalsContact C-N 3.35Å; N451-S453 PolarHBondContact O-N 2.9Å; N451-V454 PolarHBondContact O-N 2.94Å; N451-L455 WeakPolarHBondContact O-CG 3.18Å; N451-L455 PolarHBondContact O-N 2.8Å
452	S	64.8	Low	67.6	Low	16 Å²	16	94.1 Å²	94.1	11%	0.112	52%	0.518	C	S	.	.	H	α-helix	trans	-63	-40.6	174.4	-48.9	0	0	0	0	111.6	N443 A449 V454 L455 L456	N443-S452 PolarHBondContact ND2-OG 3.4Å; N443-S452 PolarHBondContact OD1-OG 2.89Å; A449-S452 PolarHBondContact O-N 3.09Å; S452-V454 VanDerWaalsContact C-N 3.34Å; S452-V454 PolarHBondContact O-N 3.45Å; S452-L455 PolarHBondContact O-N 3.47Å; S452-L456 WeakPolarHBondContact O-CG 3.24Å; S452-L456 PolarHBondContact O-N 2.86Å
453	S	67.3	Low	67.6	Low	67 Å²	67	96.4 Å²	96.4	47%	0.469	53%	0.526	S	S	.	.	H	α-helix	trans	-65.6	-34.4	176.2	59.7	0	0	0	0	113.4	A449 T450 N451 S457	A449-S453 PolarHBondContact O-N 3.31Å; A449-S453 VanDerWaalsContact O-N 3.1Å; T450-S453 WeakPolarHBondContact CA-OG 3.21Å; T450-S453 PolarHBondContact O-OG 3.49Å; N451-S453 VanDerWaalsContact C-N 3.35Å; N451-S453 PolarHBondContact O-N 2.9Å; S453-S457 PolarHBondContact O-N 2.96Å
454	V	69.6	Low	67.8	Low	71 Å²	71	100.1 Å²	100.1	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-67.3	-46.2	175.5	171	0	0	0	0	110.3	T450 N451 S452 L456 S457 E458	T450-V454 VanDerWaalsContact O-CG2 3.3Å; T450-V454 WeakPolarHBondContact O-CG2 3.16Å; T450-V454 PolarHBondContact O-N 3.39Å; T450-V454 VanDerWaalsContact O-N 3.14Å; N451-V454 PolarHBondContact O-N 2.94Å; S452-V454 VanDerWaalsContact C-N 3.34Å; S452-V454 PolarHBondContact O-N 3.45Å; V454-L456 VanDerWaalsContact C-N 3.29Å; V454-L456 PolarHBondContact O-N 2.8Å; V454-S457 PolarHBondContact O-N 3.5Å; V454-S457 PolarHBondContact O-OG 2.79Å; V454-E458 WeakPolarHBondContact O-CG 3.03Å; V454-E458 PolarHBondContact O-N 3.41Å
455	L	69.6	Low	68.1	Low	101 Å²	101	103.7 Å²	103.7	53%	0.529	56%	0.555	S	S	.	*	H	α-helix	trans	-60.7	-37.8	176.9	-70.1	170.8	0	0	0	112.5	N451 S452 E458 K459	N451-L455 WeakPolarHBondContact O-CG 3.18Å; N451-L455 PolarHBondContact O-N 2.8Å; S452-L455 PolarHBondContact O-N 3.47Å; L455-E458 PolarHBondContact O-N 3.26Å; L455-K459 PolarHBondContact O-N 3.31Å
456	L	71.9	Confident	68.6	Low	91 Å²	91	101.8 Å²	101.8	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-63.8	-41	172.8	-76.9	163.3	0	0	0	112.1	L439 S452 V454 E458 K459	L439-L456 HydrophobicContact CD1-CD2 3.38Å; L439-L456 HydrophobicContact CD2-CD1 4.3Å; L439-L456 HydrophobicContact CD2-CD2 3.94Å; L439-L456 HydrophobicContact CG-CD2 4.19Å; S452-L456 WeakPolarHBondContact O-CG 3.24Å; S452-L456 PolarHBondContact O-N 2.86Å; V454-L456 VanDerWaalsContact C-N 3.29Å; V454-L456 PolarHBondContact O-N 2.8Å; L456-E458 VanDerWaalsContact C-N 3.3Å; L456-E458 PolarHBondContact O-N 2.85Å; L456-K459 PolarHBondContact O-N 3.48Å
457	S	72.7	Confident	69.2	Low	75 Å²	75	99.7 Å²	99.7	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-70.3	-25.6	178.6	72.4	0	0	0	0	113.9	S453 V454	S453-S457 PolarHBondContact O-N 2.96Å; V454-S457 PolarHBondContact O-N 3.5Å; V454-S457 PolarHBondContact O-OG 2.79Å
458	E	72.6	Confident	69.7	Low	141 Å²	141	99.4 Å²	99.4	66%	0.659	53%	0.526	S	S	*	.	H	α-helix	trans	-78.1	-31.2	176.4	-73.1	179.9	174.3	0	0	112.1	V454 L455 L456 K460	V454-E458 WeakPolarHBondContact O-CG 3.03Å; V454-E458 PolarHBondContact O-N 3.41Å; L455-E458 PolarHBondContact O-N 3.26Å; L456-E458 VanDerWaalsContact C-N 3.3Å; L456-E458 PolarHBondContact O-N 2.85Å; E458-K460 VanDerWaalsContact C-N 3.32Å; E458-K460 PolarHBondContact O-N 2.74Å; E458-K460 VanDerWaalsContact O-N 3.09Å
459	K	67.8	Low	70.5	Confident	151 Å²	151	95.8 Å²	95.8	66%	0.657	51%	0.509	S	S	*	.			trans	-83.6	71.6	173.1	-74	-164.4	174.3	-170.2	0	111.4	L455 L456 F461	L455-K459 PolarHBondContact O-N 3.31Å; L456-K459 PolarHBondContact O-N 3.48Å; K459-F461 HydrophobicContact CB-CE2 4.25Å; K459-F461 HydrophobicContact CD-CE2 4.28Å; K459-F461 HydrophobicContact CD-CZ 4.11Å
460	K	66.3	Low	70.8	Confident	182 Å²	182	99.6 Å²	99.6	79%	0.791	51%	0.507	S	S	*	.			trans	-88.3	104	159.5	-73	-175.5	177.6	-175.9	0	107.8	E458	E458-K460 VanDerWaalsContact C-N 3.32Å; E458-K460 PolarHBondContact O-N 2.74Å; E458-K460 VanDerWaalsContact O-N 3.09Å
461	F	66.7	Low	71.4	Confident	108 Å²	108	100.3 Å²	100.3	47%	0.474	51%	0.511	S	S	.	.			trans	-74.7	126.1	170.2	-64.1	-79.9	0	0	0	108.7	K459 L466	K459-F461 HydrophobicContact CB-CE2 4.25Å; K459-F461 HydrophobicContact CD-CE2 4.28Å; K459-F461 HydrophobicContact CD-CZ 4.11Å; F461-L466 HydrophobicContact CB-CD1 3.88Å; F461-L466 HydrophobicContact CB-CD2 3.98Å; F461-L466 HydrophobicContact CB-CG 3.72Å; F461-L466 HydrophobicContact CD1-CD2 4.37Å; F461-L466 HydrophobicContact CG-CD2 4.1Å; F461-L466 HydrophobicContact CG-CG 4.39Å
462	D	76.8	Confident	71.4	Confident	101 Å²	101	103.1 Å²	103.1	54%	0.54	53%	0.526	S	S	.	.			trans	-71.7	148.6	168.9	-149	-17.6	0	0	0	109	D464 E465 L466	D462-D464 PolarHBondContact O-N 2.94Å; D462-E465 HydrophobicContact CB-CB 4.34Å; D462-E465 HydrophobicContact CB-CG 4.11Å; D462-E465 WeakPolarHBondContact O-CB 3.21Å; D462-E465 PolarHBondContact O-N 2.62Å; D462-L466 PolarHBondContact O-N 3.34Å
463	L	75.1	Confident	70.7	Confident	137 Å²	137	105.6 Å²	105.6	72%	0.717	55%	0.554	S	S	*	*	H	α-helix	trans	-62.4	-37.7	-175.5	-142	120.7	0	0	0	110.6	E465 L466 E467	L463-E465 VanDerWaalsContact C-N 3.33Å; L463-E465 PolarHBondContact O-N 2.75Å; L463-L466 PolarHBondContact O-N 3.25Å; L463-E467 PolarHBondContact O-N 3.45Å
464	D	76	Confident	70.3	Confident	111 Å²	111	106.2 Å²	106.2	59%	0.594	56%	0.558	S	S	*	*	H	α-helix	trans	-63.5	-37.7	174.7	-64.3	-9.1	0	0	0	111.7	D462 E467 T468	D462-D464 PolarHBondContact O-N 2.94Å; D464-E467 PolarHBondContact O-N 2.85Å; D464-T468 WeakPolarHBondContact O-CG2 3.33Å; D464-T468 PolarHBondContact O-N 2.9Å; D464-T468 PolarHBondContact O-OG1 3.27Å
465	E	75.8	Confident	69.3	Low	105 Å²	105	104.6 Å²	104.6	49%	0.491	56%	0.556	S	S	.	*	H	α-helix	trans	-68.3	-41.9	176.6	-72.3	-174.7	166.9	0	0	111.1	D462 L463 T468 I469	D462-E465 HydrophobicContact CB-CB 4.34Å; D462-E465 HydrophobicContact CB-CG 4.11Å; D462-E465 WeakPolarHBondContact O-CB 3.21Å; D462-E465 PolarHBondContact O-N 2.62Å; L463-E465 VanDerWaalsContact C-N 3.33Å; L463-E465 PolarHBondContact O-N 2.75Å; E465-T468 WeakPolarHBondContact CA-OG1 3.38Å; E465-T468 PolarHBondContact O-N 3.43Å; E465-T468 PolarHBondContact O-OG1 3.15Å; E465-I469 VanDerWaalsContact O-CG1 3.28Å; E465-I469 WeakPolarHBondContact O-CG1 3.24Å; E465-I469 PolarHBondContact O-N 3.17Å
466	L	70.5	Confident	67.9	Low	64 Å²	64	112.2 Å²	112.2	34%	0.335	59%	0.589	S	S	.	*	H	α-helix	trans	-61.5	-44.9	174.7	-74.3	167.4	0	0	0	111.3	F461 D462 L463 T468 I469 Y470	F461-L466 HydrophobicContact CB-CD1 3.88Å; F461-L466 HydrophobicContact CB-CD2 3.98Å; F461-L466 HydrophobicContact CB-CG 3.72Å; F461-L466 HydrophobicContact CD1-CD2 4.37Å; F461-L466 HydrophobicContact CG-CD2 4.1Å; F461-L466 HydrophobicContact CG-CG 4.39Å; D462-L466 PolarHBondContact O-N 3.34Å; L463-L466 PolarHBondContact O-N 3.25Å; L466-T468 VanDerWaalsContact C-N 3.31Å; L466-T468 PolarHBondContact O-N 3.44Å; L466-I469 PolarHBondContact O-N 3.25Å; L466-I469 VanDerWaalsContact O-N 3.16Å; L466-Y470 HydrophobicContact CB-CD2 4.47Å; L466-Y470 HydrophobicContact CD2-CE2 4.42Å; L466-Y470 WeakPolarHBondContact O-CD2 3.19Å; L466-Y470 PolarHBondContact O-N 3.03Å
467	E	73.3	Confident	67.7	Low	122 Å²	122	113.3 Å²	113.3	57%	0.57	60%	0.595	S	S	*	*	H	α-helix	trans	-60.8	-40.7	178.2	-165.6	174.7	-174.1	0	0	111.3	L463 D464 Y470 T471	L463-E467 PolarHBondContact O-N 3.45Å; D464-E467 PolarHBondContact O-N 2.85Å; E467-Y470 PolarHBondContact O-N 3.09Å; E467-T471 HydrophobicContact CG-CG2 4.33Å; E467-T471 WeakPolarHBondContact O-CB 3.24Å; E467-T471 VanDerWaalsContact O-CG2 3.25Å; E467-T471 WeakPolarHBondContact O-CG2 3.41Å; E467-T471 PolarHBondContact O-N 2.96Å; E467-T471 PolarHBondContact O-OG1 2.65Å
468	T	75	Confident	67.4	Low	73 Å²	73	115.3 Å²	115.3	45%	0.448	60%	0.598	S	S	.	*	H	α-helix	trans	-63.8	-42	173.5	53.6	0	0	0	0	113.2	D464 E465 L466 Y470 T471 D472	D464-T468 WeakPolarHBondContact O-CG2 3.33Å; D464-T468 PolarHBondContact O-N 2.9Å; D464-T468 PolarHBondContact O-OG1 3.27Å; E465-T468 WeakPolarHBondContact CA-OG1 3.38Å; E465-T468 PolarHBondContact O-N 3.43Å; E465-T468 PolarHBondContact O-OG1 3.15Å; L466-T468 VanDerWaalsContact C-N 3.31Å; L466-T468 PolarHBondContact O-N 3.44Å; T468-Y470 PolarHBondContact O-N 3.17Å; T468-T471 WeakPolarHBondContact CA-OG1 3.35Å; T468-T471 PolarHBondContact O-N 3.07Å; T468-T471 PolarHBondContact O-OG1 3.12Å; T468-D472 WeakPolarHBondContact O-CB 3.48Å; T468-D472 PolarHBondContact O-N 2.85Å
469	I	75	Confident	67.2	Low	58 Å²	58	113.8 Å²	113.8	30%	0.297	60%	0.595	S	S	.	*	H	α-helix	trans	-63.6	-43	179.2	-68	163.8	0	0	0	111	E465 L466 S474 G475	E465-I469 VanDerWaalsContact O-CG1 3.28Å; E465-I469 WeakPolarHBondContact O-CG1 3.24Å; E465-I469 PolarHBondContact O-N 3.17Å; L466-I469 PolarHBondContact O-N 3.25Å; L466-I469 VanDerWaalsContact O-N 3.16Å; I469-S474 PolarHBondContact O-N 3.48Å; I469-S474 PolarHBondContact O-OG 2.94Å; I469-G475 PolarHBondContact O-N 3.46Å; I469-G475 VanDerWaalsContact O-N 3.15Å
470	Y	70.7	Confident	67.1	Low	163 Å²	163	111.6 Å²	111.6	64%	0.639	59%	0.591	S	S	*	*	H	α-helix	trans	-70.5	-37.9	178.6	-80.6	-66.8	0	0	0	112.7	L466 E467 T468	L466-Y470 HydrophobicContact CB-CD2 4.47Å; L466-Y470 HydrophobicContact CD2-CE2 4.42Å; L466-Y470 WeakPolarHBondContact O-CD2 3.19Å; L466-Y470 PolarHBondContact O-N 3.03Å; E467-Y470 PolarHBondContact O-N 3.09Å; T468-Y470 PolarHBondContact O-N 3.17Å
471	T	73.1	Confident	67.2	Low	97 Å²	97	107.3 Å²	107.3	60%	0.595	58%	0.579	S	S	*	*	H	α-helix	trans	-77.2	-32.4	-178.5	50.8	0	0	0	0	113.5	E467 T468 G473	E467-T471 HydrophobicContact CG-CG2 4.33Å; E467-T471 WeakPolarHBondContact O-CB 3.24Å; E467-T471 VanDerWaalsContact O-CG2 3.25Å; E467-T471 WeakPolarHBondContact O-CG2 3.41Å; E467-T471 PolarHBondContact O-N 2.96Å; E467-T471 PolarHBondContact O-OG1 2.65Å; T468-T471 WeakPolarHBondContact CA-OG1 3.35Å; T468-T471 PolarHBondContact O-N 3.07Å; T468-T471 PolarHBondContact O-OG1 3.12Å; T471-G473 PolarHBondContact O-N 2.94Å
472	D	68.9	Low	67.2	Low	132 Å²	132	107.2 Å²	107.2	71%	0.706	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-0.5	178.6	-75.6	-14.6	0	0	0	113.5	T468 S474	T468-D472 WeakPolarHBondContact O-CB 3.48Å; T468-D472 PolarHBondContact O-N 2.85Å; D472-S474 PolarHBondContact O-N 3.42Å; D472-S474 VanDerWaalsContact O-N 3.16Å
473	G	50.8	Low	66.5	Low	67 Å²	67	107.6 Å²	107.6	69%	0.691	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.1	14.3	-176.5	0	0	0	0	0	113.5	T471	T471-G473 PolarHBondContact O-N 2.94Å
474	S	58.5	Low	65.9	Low	80 Å²	80	105.4 Å²	105.4	56%	0.559	58%	0.579	S	S	*	*			trans	-88	-13	178.5	70.3	0	0	0	0	113	I469 D472 Q476	I469-S474 PolarHBondContact O-N 3.48Å; I469-S474 PolarHBondContact O-OG 2.94Å; D472-S474 PolarHBondContact O-N 3.42Å; D472-S474 VanDerWaalsContact O-N 3.16Å; S474-Q476 VanDerWaalsContact C-N 3.35Å; S474-Q476 PolarHBondContact O-N 2.69Å
475	G	47.9	Very low	65	Low	38 Å²	38	104.9 Å²	104.9	39%	0.392	58%	0.578	S	S	.	*			trans	-75.5	78.9	173	0	0	0	0	0	112.5	I469	I469-G475 PolarHBondContact O-N 3.46Å; I469-G475 VanDerWaalsContact O-N 3.15Å
476	Q	40.8	Very low	64	Low	260 Å²	260	104.9 Å²	104.9	100%	1.215	59%	0.586	S	S	*	*			trans	-112.4	0	152.3	-84.1	-165.6	-17.1	0	0	109.9	S474	S474-Q476 VanDerWaalsContact C-N 3.35Å; S474-Q476 PolarHBondContact O-N 2.69Å

Retrieved 476 of 476 residues in 219.5 ms (Link to these results)

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