A0A077Z930_TRITR Loading...

SET domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z930, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 711 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.7	Very low	42.8	Very low	212 Å²	212	125.4 Å²	125.4	100%	1.044	72%	0.722	S	S	*	*				0	66.1	0	-80.7	-168.7	172	0	0	109.5	G3	M1-G3 PolarHBondContact O-N 2.9Å
2	D	30.7	Very low	46.4	Very low	167 Å²	167	121.4 Å²	121.4	89%	0.893	70%	0.702	S	S	*	*			trans	-104.3	23.5	-140.4	-43.5	-64.8	0	0	0	113.6
3	G	30.6	Very low	49.4	Very low	75 Å²	75	120 Å²	120	77%	0.773	69%	0.685	S	S	*	*	S	Bend	trans	-117.5	22.6	-175.8	0	0	0	0	0	115.2	M1	M1-G3 PolarHBondContact O-N 2.9Å
4	K	31.2	Very low	52	Low	194 Å²	194	112.9 Å²	112.9	84%	0.843	64%	0.644	S	S	*	*			trans	-131.2	3.8	-178	-80.3	-167.4	174.5	-177	0	117.2	G6	K4-G6 PolarHBondContact O-N 2.92Å
5	L	33.1	Very low	53.9	Low	150 Å²	150	110.5 Å²	110.5	79%	0.785	63%	0.632	S	S	*	*			trans	-78.4	50.9	166.4	-86.7	76.9	0	0	0	111
6	G	26.9	Very low	55.7	Low	67 Å²	67	109.4 Å²	109.4	69%	0.691	62%	0.62	S	S	*	*			trans	-102.3	-16	-168.1	0	0	0	0	0	116.3	K4 S8	K4-G6 PolarHBondContact O-N 2.92Å; G6-S8 PolarHBondContact O-N 2.94Å; G6-S8 VanDerWaalsContact O-N 3.09Å
7	E	34.3	Very low	57.6	Low	160 Å²	160	103.4 Å²	103.4	75%	0.748	59%	0.585	S	S	*	*	S	Bend	trans	-76.6	96.6	173.2	-74	-174.5	168.7	0	0	109	L9	E7-L9 PolarHBondContact O-N 3.03Å
8	S	39.7	Very low	59.1	Low	105 Å²	105	100.6 Å²	100.6	73%	0.734	57%	0.571	S	S	*	*			trans	-65.5	98.7	179.7	-173.1	0	0	0	0	111	G6 S10	G6-S8 PolarHBondContact O-N 2.94Å; G6-S8 VanDerWaalsContact O-N 3.09Å; S8-S10 PolarHBondContact O-N 3.12Å
9	L	57.9	Low	60.6	Low	84 Å²	84	97.1 Å²	97.1	44%	0.44	55%	0.548	S	S	.	.			trans	-74.6	64.1	170.3	-73.1	168.5	0	0	0	110.3	E7 F11	E7-L9 PolarHBondContact O-N 3.03Å; L9-F11 PolarHBondContact O-N 2.99Å
10	S	72.2	Confident	61.7	Low	103 Å²	103	95.6 Å²	95.6	72%	0.72	54%	0.541	S	S	*	.			trans	-68.9	126.8	173.9	52.5	0	0	0	0	110.7	S8	S8-S10 PolarHBondContact O-N 3.12Å
11	F	83.1	Confident	62.1	Low	62 Å²	62	92.5 Å²	92.5	27%	0.272	53%	0.526	S	S	.	.			trans	-138.2	153.9	174.6	69.1	-85.2	0	0	0	109.2	L9 Q13 V146	L9-F11 PolarHBondContact O-N 2.99Å; F11-Q13 PolarHBondContact O-N 3.38Å; F11-V146 CarbonylContact C-O 3.57Å; F11-V146 WeakPolarHBondContact CA-O 3.46Å
12	T	86.5	Confident	63.3	Low	78 Å²	78	88.3 Å²	88.3	48%	0.479	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	119.9	174	-48.3	0	0	0	0	109.8	I14 V146 K147 G148	T12-I14 HydrophobicContact CG2-CG2 4.36Å; T12-I14 PolarHBondContact O-N 3.29Å; T12-V146 PolarHBondContact N-O 3.38Å; T12-K147 CarbonylContact O-C 3.58Å; T12-K147 VanDerWaalsContact O-CA 3.28Å; T12-K147 WeakPolarHBondContact O-CA 3.5Å; T12-G148 PolarHBondContact O-N 2.89Å
13	Q	85.7	Confident	64.5	Low	103 Å²	103	88.3 Å²	88.3	48%	0.481	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	124.7	172.8	-170.1	174.5	2.5	0	0	110.2	F11 G148	F11-Q13 PolarHBondContact O-N 3.38Å; Q13-G148 CarbonylContact C-O 3.49Å; Q13-G148 VanDerWaalsContact CA-O 3.31Å; Q13-G148 WeakPolarHBondContact CA-O 3.39Å
14	I	85	Confident	65.5	Low	21 Å²	21	86.3 Å²	86.3	11%	0.108	47%	0.468	C	S	.	.			trans	-125	158.4	176.1	68.6	-175.1	0	0	0	110.2	T12 E16 V18 V107 K147 G148	T12-I14 HydrophobicContact CG2-CG2 4.36Å; T12-I14 PolarHBondContact O-N 3.29Å; I14-E16 VanDerWaalsContact CD1-O 3.3Å; I14-E16 WeakPolarHBondContact CD1-O 3.37Å; I14-E16 WeakPolarHBondContact CG1-O 3.47Å; I14-V18 HydrophobicContact CD1-CG2 4.19Å; I14-V107 HydrophobicContact CD1-CB 4.33Å; I14-V107 HydrophobicContact CD1-CG2 4.18Å; I14-V107 HydrophobicContact CG1-CB 4.24Å; I14-V107 HydrophobicContact CG1-CG2 3.64Å; I14-K147 HydrophobicContact CD1-CB 3.95Å; I14-K147 HydrophobicContact CG2-CB 3.99Å; I14-G148 PolarHBondContact N-O 2.66Å
15	T	80.4	Confident	66.1	Low	77 Å²	77	81 Å²	81	47%	0.472	46%	0.461	S	S	.	.	S	Bend	trans	-114.2	4.3	-178.8	73.6	0	0	0	0	114.2	K74	T15-K74 WeakPolarHBondContact O-CE 3.26Å; T15-K74 PolarHBondContact O-NZ 3.41Å; T15-K74 PolarHBondContact OG1-NZ 2.86Å
16	E	82.7	Confident	66.5	Low	92 Å²	92	76.4 Å²	76.4	43%	0.43	44%	0.437	S	S	.	.	S	Bend	trans	-162.2	170.3	168.9	64.8	-179.8	148.2	0	0	110.4	I14 R174	I14-E16 VanDerWaalsContact CD1-O 3.3Å; I14-E16 WeakPolarHBondContact CD1-O 3.37Å; I14-E16 WeakPolarHBondContact CG1-O 3.47Å; E16-R174 IonicContact OE2-CZ 3.51Å; E16-R174 IonicContact OE2-NH1 2.67Å; E16-R174 IonicContact OE2-NH2 3.2Å; E16-R174 PolarHBondContact OE2-NH2 3.45Å
17	N	88.1	Confident	66.9	Low	7 Å²	7	77.2 Å²	77.2	4%	0.037	43%	0.43	C	S	.	.			trans	-64.7	133.5	-180	-85	-20.8	0	0	0	114.5	Y19 V107 G108 V110 I142	N17-Y19 HydrophobicContact CB-CD2 4.37Å; N17-Y19 HydrophobicContact CB-CE2 3.59Å; N17-V107 VanDerWaalsContact OD1-CA 3.29Å; N17-V107 WeakPolarHBondContact OD1-CA 3.4Å; N17-G108 WeakPolarHBondContact CA-O 3.38Å; N17-G108 PolarHBondContact OD1-N 3.14Å; N17-G108 PolarHBondContact OD1-O 2.83Å; N17-V110 HydrophobicContact CB-CG2 3.67Å; N17-I142 WeakPolarHBondContact ND2-CD1 3.25Å
18	V	85.4	Confident	66.9	Low	54 Å²	54	73.5 Å²	73.5	33%	0.327	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109.8	174.5	176.6	0	0	0	0	109.2	I14 G108 E109 V110	I14-V18 HydrophobicContact CD1-CG2 4.19Å; V18-G108 PolarHBondContact N-O 3.44Å; V18-E109 CarbonylContact O-C 3.57Å; V18-E109 VanDerWaalsContact O-CA 3.26Å; V18-E109 WeakPolarHBondContact O-CA 3.08Å; V18-V110 PolarHBondContact O-N 3.27Å
19	Y	86.7	Confident	66.6	Low	34 Å²	34	75.2 Å²	75.2	13%	0.133	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	130	-176.4	-65.6	-99.6	0	0	0	110.6	N17 Y24 V110 R172 T173	N17-Y19 HydrophobicContact CB-CD2 4.37Å; N17-Y19 HydrophobicContact CB-CE2 3.59Å; Y19-Y24 AromaticContact CD1-CD1 3.71Å; Y19-Y24 HydrophobicContact CD1-CD1 3.71Å; Y19-Y24 AromaticContact CD1-CD2 3.48Å; Y19-Y24 HydrophobicContact CD1-CD2 3.48Å; Y19-Y24 VanDerWaalsContact CD1-CD2 3.48Å; Y19-Y24 HydrophobicContact CD1-CE1 4.26Å; Y19-Y24 HydrophobicContact CD1-CE2 4.07Å; Y19-Y24 AromaticContact CD1-CG 3.3Å; Y19-Y24 HydrophobicContact CD1-CG 3.3Å; Y19-Y24 AromaticContact CE1-CD1 3.92Å; Y19-Y24 HydrophobicContact CE1-CD1 3.92Å; Y19-Y24 HydrophobicContact CE1-CD2 4.47Å; Y19-Y24 HydrophobicContact CE1-CE1 4.41Å; Y19-Y24 AromaticContact CE1-CG 3.98Å; Y19-Y24 HydrophobicContact CE1-CG 3.98Å; Y19-Y24 HydrophobicContact CG-CD2 4.06Å; Y19-Y24 AromaticContact CG-CG 3.98Å; Y19-Y24 HydrophobicContact CG-CG 3.98Å; Y19-V110 HydrophobicContact CD1-CB 3.55Å; Y19-V110 HydrophobicContact CD1-CG1 3.77Å; Y19-V110 HydrophobicContact CD1-CG2 3.89Å; Y19-V110 HydrophobicContact CD2-CG2 4.47Å; Y19-V110 HydrophobicContact CE1-CB 3.74Å; Y19-V110 HydrophobicContact CE1-CG1 3.71Å; Y19-V110 HydrophobicContact CE1-CG2 3.66Å; Y19-V110 HydrophobicContact CE2-CG2 4.24Å; Y19-V110 HydrophobicContact CG-CB 4.09Å; Y19-V110 HydrophobicContact CG-CG2 4.29Å; Y19-R172 HydrophobicContact CE1-CG 4.46Å; Y19-T173 PolarHBondContact OH-O 3.23Å
20	V	82.9	Confident	65.4	Low	66 Å²	66	74.9 Å²	74.9	40%	0.4	41%	0.413	S	S	.	.			trans	-93.5	-14.8	-171.2	179.3	0	0	0	0	113.3	E109 V110 L111 A115	V20-E109 HydrophobicContact CG2-CB 3.91Å; V20-V110 WeakPolarHBondContact CB-O 3.33Å; V20-V110 PolarHBondContact N-O 3.17Å; V20-L111 HydrophobicContact CB-CD2 3.92Å; V20-L111 HydrophobicContact CG1-CD2 4.15Å; V20-L111 HydrophobicContact CG2-CD2 3.71Å; V20-A115 HydrophobicContact CG1-CB 4.49Å
21	S	71.1	Confident	63.5	Low	32 Å²	32	74.7 Å²	74.7	22%	0.224	40%	0.403	C	S	.	.	S	Bend	trans	-119.6	154	175.4	81.1	0	0	0	0	112.8	K23 Y24 S112	S21-K23 PolarHBondContact O-N 2.69Å; S21-K23 VanDerWaalsContact O-N 3.11Å; S21-Y24 WeakPolarHBondContact O-CD2 3.31Å; S21-Y24 WeakPolarHBondContact OG-CE2 3.35Å; S21-S112 PolarHBondContact OG-OG 2.93Å
22	D	54.2	Low	61.2	Low	123 Å²	123	76.2 Å²	76.2	66%	0.658	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-68.1	-9	-176.4	-65.5	-57.2	0	0	0	114.5	Y24 A25	D22-Y24 PolarHBondContact O-N 3.33Å; D22-A25 PolarHBondContact O-N 3.42Å; D22-A25 VanDerWaalsContact O-N 3.17Å
23	K	56.2	Low	58.8	Low	167 Å²	167	74.5 Å²	74.5	73%	0.726	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-56	-20	-179.8	-71.7	-173.3	176.8	-179.2	0	113.9	S21	S21-K23 PolarHBondContact O-N 2.69Å; S21-K23 VanDerWaalsContact O-N 3.11Å
24	Y	52.5	Low	56.6	Low	33 Å²	33	70.4 Å²	70.4	13%	0.129	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-103.9	20.2	-175.4	-46.8	-84	0	0	0	113.8	Y19 S21 D22 I26 S112 D140 R172	Y19-Y24 AromaticContact CD1-CD1 3.71Å; Y19-Y24 HydrophobicContact CD1-CD1 3.71Å; Y19-Y24 AromaticContact CD1-CD2 3.48Å; Y19-Y24 HydrophobicContact CD1-CD2 3.48Å; Y19-Y24 VanDerWaalsContact CD1-CD2 3.48Å; Y19-Y24 HydrophobicContact CD1-CE1 4.26Å; Y19-Y24 HydrophobicContact CD1-CE2 4.07Å; Y19-Y24 AromaticContact CD1-CG 3.3Å; Y19-Y24 HydrophobicContact CD1-CG 3.3Å; Y19-Y24 AromaticContact CE1-CD1 3.92Å; Y19-Y24 HydrophobicContact CE1-CD1 3.92Å; Y19-Y24 HydrophobicContact CE1-CD2 4.47Å; Y19-Y24 HydrophobicContact CE1-CE1 4.41Å; Y19-Y24 AromaticContact CE1-CG 3.98Å; Y19-Y24 HydrophobicContact CE1-CG 3.98Å; Y19-Y24 HydrophobicContact CG-CD2 4.06Å; Y19-Y24 AromaticContact CG-CG 3.98Å; Y19-Y24 HydrophobicContact CG-CG 3.98Å; S21-Y24 WeakPolarHBondContact O-CD2 3.31Å; S21-Y24 WeakPolarHBondContact OG-CE2 3.35Å; D22-Y24 PolarHBondContact O-N 3.33Å; Y24-I26 PolarHBondContact O-N 3.29Å; Y24-S112 WeakPolarHBondContact OH-CB 3.32Å; Y24-D140 WeakPolarHBondContact CE1-OD2 3.46Å; Y24-D140 VanDerWaalsContact CZ-OD2 3.26Å; Y24-D140 PolarHBondContact OH-OD1 2.76Å; Y24-D140 PolarHBondContact OH-OD2 3.04Å; Y24-R172 PolarHBondContact O-NE 2.81Å; Y24-R172 PolarHBondContact O-NH2 2.81Å
25	A	44	Very low	54.3	Low	82 Å²	82	75.5 Å²	75.5	68%	0.678	41%	0.405	S	S	*	.			trans	-55.6	105.1	168.1	0	0	0	0	0	109.9	D22 P27	D22-A25 PolarHBondContact O-N 3.42Å; D22-A25 VanDerWaalsContact O-N 3.17Å; A25-P27 WeakPolarHBondContact O-CD 3.36Å
26	I	41.3	Very low	52.2	Low	55 Å²	55	76.4 Å²	76.4	28%	0.282	40%	0.4	S	S	.	.			trans	-62.2	122.7	-175.2	-59.7	174.7	0	0	0	108.3	Y24 V28 F30	Y24-I26 PolarHBondContact O-N 3.29Å; I26-V28 PolarHBondContact O-N 2.93Å; I26-V28 VanDerWaalsContact O-N 3.14Å; I26-F30 HydrophobicContact CG2-CB 4.01Å
27	P	34.2	Very low	49.8	Very low	84 Å²	84	74 Å²	74	55%	0.545	39%	0.393	S	S	.	.			trans	-58.7	121.5	173.6	-22.7	33.7	0	0	0	109.1	A25 L29 F30	A25-P27 WeakPolarHBondContact O-CD 3.36Å; P27-L29 PolarHBondContact O-N 2.94Å; P27-F30 PolarHBondContact O-N 3.21Å
28	V	34.3	Very low	47.2	Very low	82 Å²	82	76.6 Å²	76.6	50%	0.497	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-53.7	-27.4	-168.6	-178.1	0	0	0	0	112.9	I26 F30 L31 H32 M656	I26-V28 PolarHBondContact O-N 2.93Å; I26-V28 VanDerWaalsContact O-N 3.14Å; V28-F30 PolarHBondContact O-N 3.11Å; V28-L31 PolarHBondContact O-N 3.14Å; V28-L31 VanDerWaalsContact O-N 3.15Å; V28-H32 PolarHBondContact O-CD2 2.89Å; V28-M656 HydrophobicContact CG1-CE 4.47Å
29	L	34.2	Very low	44.8	Very low	140 Å²	140	77.4 Å²	77.4	73%	0.733	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-50	-36.8	171.2	-90.4	70.5	0	0	0	114.2	P27 L31 H32	P27-L29 PolarHBondContact O-N 2.94Å; L29-L31 VanDerWaalsContact C-N 3.27Å; L29-L31 PolarHBondContact O-N 2.61Å; L29-H32 PolarHBondContact O-N 3.38Å; L29-H32 VanDerWaalsContact O-N 3.14Å
30	F	32.5	Very low	42.1	Very low	77 Å²	77	80.1 Å²	80.1	34%	0.338	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-67.5	-25	-177.5	-103.7	-80.7	0	0	0	113.6	I26 P27 V28 Y56 L170	I26-F30 HydrophobicContact CG2-CB 4.01Å; P27-F30 PolarHBondContact O-N 3.21Å; V28-F30 PolarHBondContact O-N 3.11Å; F30-Y56 HydrophobicContact CD1-CE2 4.41Å; F30-Y56 HydrophobicContact CE1-CE2 4.09Å; F30-L170 HydrophobicContact CD1-CB 4.37Å; F30-L170 HydrophobicContact CD1-CD2 3.98Å
31	L	32.3	Very low	40.2	Very low	100 Å²	100	81.4 Å²	81.4	52%	0.524	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-75.8	-22.7	174.5	-89.3	149.4	0	0	0	112.8	V28 L29 V33	V28-L31 PolarHBondContact O-N 3.14Å; V28-L31 VanDerWaalsContact O-N 3.15Å; L29-L31 VanDerWaalsContact C-N 3.27Å; L29-L31 PolarHBondContact O-N 2.61Å; L31-V33 VanDerWaalsContact C-N 3.35Å; L31-V33 PolarHBondContact O-N 3Å
32	H	34.2	Very low	38.6	Very low	94 Å²	94	83.4 Å²	83.4	44%	0.435	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-78.4	-11.2	-175	-85.4	-103.9	0	0	0	114.9	V28 L29	V28-H32 PolarHBondContact O-CD2 2.89Å; L29-H32 PolarHBondContact O-N 3.38Å; L29-H32 VanDerWaalsContact O-N 3.14Å
33	V	37.4	Very low	37.7	Very low	42 Å²	42	84.3 Å²	84.3	26%	0.255	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-97.7	-7.2	-172.1	-145.6	0	0	0	0	113.6	L31 H35 S53 Y56	L31-V33 VanDerWaalsContact C-N 3.35Å; L31-V33 PolarHBondContact O-N 3Å; V33-H35 PolarHBondContact O-N 3.12Å; V33-S53 WeakPolarHBondContact CG1-OG 3.36Å; V33-S53 PolarHBondContact O-N 2.93Å; V33-S53 VanDerWaalsContact O-N 3.13Å; V33-Y56 HydrophobicContact CB-CD2 4.01Å; V33-Y56 HydrophobicContact CB-CG 4.46Å; V33-Y56 HydrophobicContact CG1-CD2 3.87Å; V33-Y56 HydrophobicContact CG1-CG 4.16Å; V33-Y56 HydrophobicContact CG2-CD2 4.47Å
34	L	38.5	Very low	36.4	Very low	16 Å²	16	80.1 Å²	80.1	8%	0.084	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	96.6	172.5	-60.3	-177.2	0	0	0	109.5	Y36 I50 A52 L170	L34-Y36 HydrophobicContact CB-CE2 4.11Å; L34-Y36 WeakPolarHBondContact O-CD2 3.43Å; L34-Y36 WeakPolarHBondContact O-CE2 3.37Å; L34-I50 HydrophobicContact CB-CG2 4.46Å; L34-I50 HydrophobicContact CD2-CG2 4.04Å; L34-A52 HydrophobicContact CD2-CB 3.75Å; L34-L170 HydrophobicContact CD1-CD2 4.47Å
35	H	38.1	Very low	35.1	Very low	128 Å²	128	80.9 Å²	80.9	59%	0.593	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	144.4	162.6	-81.8	-115.9	0	0	0	109.4	V33 V51	V33-H35 PolarHBondContact O-N 3.12Å; H35-V51 CarbonylContact C-O 3.59Å; H35-V51 WeakPolarHBondContact CA-O 3.45Å; H35-V51 WeakPolarHBondContact CB-O 3.37Å; H35-V51 PolarHBondContact N-O 2.74Å; H35-V51 CarbonylContact O-C 3.59Å; H35-V51 VanDerWaalsContact O-C 3.25Å; H35-V51 PolarHBondContact O-N 3.12Å
36	Y	36.6	Very low	34.3	Very low	96 Å²	96	81.6 Å²	81.6	38%	0.376	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.5	176.6	-62.3	-90.7	0	0	0	108.1	L34 V48 K49 I50	L34-Y36 HydrophobicContact CB-CE2 4.11Å; L34-Y36 WeakPolarHBondContact O-CD2 3.43Å; L34-Y36 WeakPolarHBondContact O-CE2 3.37Å; Y36-V48 HydrophobicContact CD1-CG1 3.67Å; Y36-V48 HydrophobicContact CG-CG1 4.38Å; Y36-K49 CarbonylContact C-O 3.54Å; Y36-K49 WeakPolarHBondContact CA-O 3.17Å; Y36-I50 HydrophobicContact CD1-CG1 3.94Å; Y36-I50 HydrophobicContact CE1-CD1 4.03Å; Y36-I50 HydrophobicContact CE1-CG1 3.85Å
37	S	32	Very low	33.7	Very low	41 Å²	41	80.8 Å²	80.8	29%	0.287	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.2	167.2	65.5	0	0	0	0	109.1	K49 V51	S37-K49 PolarHBondContact N-O 3.24Å; S37-K49 PolarHBondContact O-N 2.99Å; S37-K49 VanDerWaalsContact OG-CB 3.23Å; S37-K49 WeakPolarHBondContact OG-CB 3.48Å; S37-V51 VanDerWaalsContact OG-CG2 3.28Å; S37-V51 WeakPolarHBondContact OG-CG2 3.2Å
38	V	32.6	Very low	33.5	Very low	63 Å²	63	80.8 Å²	80.8	38%	0.382	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	100.9	175.6	176	0	0	0	0	107.9	I46	V38-I46 HydrophobicContact CG1-CG2 3.61Å
39	E	35.4	Very low	33.5	Very low	70 Å²	70	81.8 Å²	81.8	33%	0.327	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131.3	171	-75	174.2	-171.3	0	0	109.4	S47 K49	E39-S47 PolarHBondContact N-O 3.2Å; E39-S47 PolarHBondContact O-N 3.06Å; E39-S47 PolarHBondContact O-OG 2.76Å; E39-S47 VanDerWaalsContact O-OG 3.06Å; E39-K49 VanDerWaalsContact OE1-CD 3.26Å; E39-K49 WeakPolarHBondContact OE1-CD 3.35Å; E39-K49 IonicContact OE1-NZ 2.63Å; E39-K49 PolarHBondContact OE1-NZ 3.07Å; E39-K49 WeakPolarHBondContact OE2-CE 3.49Å; E39-K49 IonicContact OE2-NZ 2.74Å; E39-K49 PolarHBondContact OE2-NZ 2.91Å
40	T	30.1	Very low	33.6	Very low	92 Å²	92	77.4 Å²	77.4	56%	0.564	45%	0.447	S	S	*	.			trans	-98	88.1	177.6	47.4	0	0	0	0	110.2	A42	T40-A42 PolarHBondContact O-N 3.37Å; T40-A42 VanDerWaalsContact O-N 3.14Å
41	N	43.6	Very low	33.8	Very low	93 Å²	93	77.1 Å²	77.1	50%	0.497	45%	0.451	S	S	.	.			trans	-84.5	89.7	-178.2	-69.1	-5.5	0	0	0	109.7	A45 S47	N41-A45 PolarHBondContact N-O 3.22Å; N41-A45 WeakPolarHBondContact O-CB 3.01Å; N41-S47 PolarHBondContact ND2-OG 3.41Å; N41-S47 VanDerWaalsContact ND2-OG 3.1Å
42	A	36.2	Very low	34.1	Very low	73 Å²	73	72.7 Å²	72.7	60%	0.603	43%	0.429	S	S	*	.	S	Bend	trans	69.9	157.4	-171.1	0	0	0	0	0	114.1	T40 G44 A45	T40-A42 PolarHBondContact O-N 3.37Å; T40-A42 VanDerWaalsContact O-N 3.14Å; A42-G44 PolarHBondContact O-N 3.17Å; A42-A45 PolarHBondContact O-N 2.95Å
43	P	34.6	Very low	34.2	Very low	142 Å²	142	68.9 Å²	68.9	92%	0.922	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	100.8	-176.9	26.3	-35	0	0	0	111.5
44	G	30.8	Very low	34.1	Very low	79 Å²	79	75.3 Å²	75.3	81%	0.814	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.7	-27	176.9	0	0	0	0	0	113.8	A42	A42-G44 PolarHBondContact O-N 3.17Å
45	A	25.2	Very low	34.1	Very low	50 Å²	50	80.5 Å²	80.5	41%	0.413	46%	0.461	S	S	.	.			trans	-92.3	135.2	178.4	0	0	0	0	0	111.7	N41 A42	N41-A45 PolarHBondContact N-O 3.22Å; N41-A45 WeakPolarHBondContact O-CB 3.01Å; A42-A45 PolarHBondContact O-N 2.95Å
46	I	26.5	Very low	33.9	Very low	96 Å²	96	76.1 Å²	76.1	49%	0.492	44%	0.44	S	S	.	.			trans	-122.6	97.2	-179.6	-60.6	176.1	0	0	0	106.3	V38 V48	V38-I46 HydrophobicContact CG1-CG2 3.61Å; I46-V48 HydrophobicContact CG2-CG2 4.28Å
47	S	28.9	Very low	33.8	Very low	39 Å²	39	73.9 Å²	73.9	27%	0.273	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	115.4	170.6	35.4	0	0	0	0	109.3	E39 N41 K49	E39-S47 PolarHBondContact N-O 3.2Å; E39-S47 PolarHBondContact O-N 3.06Å; E39-S47 PolarHBondContact O-OG 2.76Å; E39-S47 VanDerWaalsContact O-OG 3.06Å; N41-S47 PolarHBondContact ND2-OG 3.41Å; N41-S47 VanDerWaalsContact ND2-OG 3.1Å; S47-K49 PolarHBondContact O-N 3.14Å
48	V	29.8	Very low	33.9	Very low	83 Å²	83	78.9 Å²	78.9	50%	0.503	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	100.7	173.7	-177.1	0	0	0	0	108.4	Y36 I46	Y36-V48 HydrophobicContact CD1-CG1 3.67Å; Y36-V48 HydrophobicContact CG-CG1 4.38Å; I46-V48 HydrophobicContact CG2-CG2 4.28Å
49	K	34.5	Very low	34.3	Very low	104 Å²	104	82.8 Å²	82.8	45%	0.452	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.5	166.9	-100.9	167.7	176.4	158.6	0	108.7	Y36 S37 E39 S47 V51	Y36-K49 CarbonylContact C-O 3.54Å; Y36-K49 WeakPolarHBondContact CA-O 3.17Å; S37-K49 PolarHBondContact N-O 3.24Å; S37-K49 PolarHBondContact O-N 2.99Å; S37-K49 VanDerWaalsContact OG-CB 3.23Å; S37-K49 WeakPolarHBondContact OG-CB 3.48Å; E39-K49 VanDerWaalsContact OE1-CD 3.26Å; E39-K49 WeakPolarHBondContact OE1-CD 3.35Å; E39-K49 IonicContact OE1-NZ 2.63Å; E39-K49 PolarHBondContact OE1-NZ 3.07Å; E39-K49 WeakPolarHBondContact OE2-CE 3.49Å; E39-K49 IonicContact OE2-NZ 2.74Å; E39-K49 PolarHBondContact OE2-NZ 2.91Å; S47-K49 PolarHBondContact O-N 3.14Å; K49-V51 HydrophobicContact CB-CG2 4.39Å; K49-V51 PolarHBondContact O-N 2.91Å
50	I	36.3	Very low	34.4	Very low	48 Å²	48	80.7 Å²	80.7	25%	0.246	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	106.9	169.9	-56.1	-176.6	0	0	0	107	L34 Y36 W65 L72	L34-I50 HydrophobicContact CB-CG2 4.46Å; L34-I50 HydrophobicContact CD2-CG2 4.04Å; Y36-I50 HydrophobicContact CD1-CG1 3.94Å; Y36-I50 HydrophobicContact CE1-CD1 4.03Å; Y36-I50 HydrophobicContact CE1-CG1 3.85Å; I50-W65 WeakPolarHBondContact O-CH2 3.35Å; I50-L72 HydrophobicContact CD1-CB 4.09Å; I50-L72 HydrophobicContact CD1-CD1 3.57Å; I50-L72 HydrophobicContact CD1-CG 4.41Å
51	V	37.1	Very low	34.8	Very low	70 Å²	70	80.6 Å²	80.6	42%	0.424	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	79.8	174	-177.1	0	0	0	0	105.9	H35 S37 K49 S53	H35-V51 CarbonylContact C-O 3.59Å; H35-V51 WeakPolarHBondContact CA-O 3.45Å; H35-V51 WeakPolarHBondContact CB-O 3.37Å; H35-V51 PolarHBondContact N-O 2.74Å; H35-V51 CarbonylContact O-C 3.59Å; H35-V51 VanDerWaalsContact O-C 3.25Å; H35-V51 PolarHBondContact O-N 3.12Å; S37-V51 VanDerWaalsContact OG-CG2 3.28Å; S37-V51 WeakPolarHBondContact OG-CG2 3.2Å; K49-V51 HydrophobicContact CB-CG2 4.39Å; K49-V51 PolarHBondContact O-N 2.91Å; V51-S53 PolarHBondContact O-N 2.93Å
52	A	37.7	Very low	34.3	Very low	7 Å²	7	81.9 Å²	81.9	6%	0.058	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	143.9	169.5	0	0	0	0	0	108.8	L34 Y56 W65	L34-A52 HydrophobicContact CD2-CB 3.75Å; A52-Y56 HydrophobicContact CB-CD1 3.51Å; A52-Y56 HydrophobicContact CB-CE1 4.37Å; A52-Y56 HydrophobicContact CB-CG 4.06Å; A52-W65 HydrophobicContact CB-CH2 4Å; A52-W65 HydrophobicContact CB-CZ2 3.47Å; A52-W65 VanDerWaalsContact CB-CZ2 3.47Å
53	S	37	Very low	34.4	Very low	15 Å²	15	85.5 Å²	85.5	11%	0.105	47%	0.474	C	S	.	.			trans	-59.7	162.8	-165.3	80.1	0	0	0	0	112.8	V33 V51 E55 Y56 A57	V33-S53 WeakPolarHBondContact CG1-OG 3.36Å; V33-S53 PolarHBondContact O-N 2.93Å; V33-S53 VanDerWaalsContact O-N 3.13Å; V51-S53 PolarHBondContact O-N 2.93Å; S53-E55 WeakPolarHBondContact CB-OE2 3.36Å; S53-E55 PolarHBondContact O-N 2.98Å; S53-E55 VanDerWaalsContact O-N 3.15Å; S53-E55 PolarHBondContact OG-N 2.99Å; S53-E55 PolarHBondContact OG-OE2 3.37Å; S53-Y56 PolarHBondContact O-N 3.06Å; S53-Y56 PolarHBondContact OG-N 3.1Å; S53-A57 PolarHBondContact O-N 2.89Å
54	K	34.7	Very low	34.7	Very low	177 Å²	177	81.9 Å²	81.9	77%	0.77	45%	0.445	S	S	*	.	H	α-helix	trans	-57.6	-28.6	175.3	-90.5	-174.9	175.2	177.3	0	112.2	Q58	K54-Q58 WeakPolarHBondContact O-CB 3.38Å; K54-Q58 WeakPolarHBondContact O-CG 3.24Å; K54-Q58 PolarHBondContact O-N 3.36Å
55	E	37.4	Very low	35.1	Very low	125 Å²	125	80.9 Å²	80.9	58%	0.584	42%	0.417	S	S	*	.	H	α-helix	trans	-67	-43.4	171.4	-54.2	100.6	151.4	0	0	112.1	S53 Q58 H59	S53-E55 WeakPolarHBondContact CB-OE2 3.36Å; S53-E55 PolarHBondContact O-N 2.98Å; S53-E55 VanDerWaalsContact O-N 3.15Å; S53-E55 PolarHBondContact OG-N 2.99Å; S53-E55 PolarHBondContact OG-OE2 3.37Å; E55-Q58 PolarHBondContact O-N 2.96Å; E55-H59 PolarHBondContact O-N 3.36Å
56	Y	35.5	Very low	35.9	Very low	36 Å²	36	82.1 Å²	82.1	14%	0.141	42%	0.419	C	S	.	.	H	α-helix	trans	-66.7	-40.1	177.5	-152.5	-109.9	0	0	0	111.9	F30 V33 A52 S53 Q58 H59 V60	F30-Y56 HydrophobicContact CD1-CE2 4.41Å; F30-Y56 HydrophobicContact CE1-CE2 4.09Å; V33-Y56 HydrophobicContact CB-CD2 4.01Å; V33-Y56 HydrophobicContact CB-CG 4.46Å; V33-Y56 HydrophobicContact CG1-CD2 3.87Å; V33-Y56 HydrophobicContact CG1-CG 4.16Å; V33-Y56 HydrophobicContact CG2-CD2 4.47Å; A52-Y56 HydrophobicContact CB-CD1 3.51Å; A52-Y56 HydrophobicContact CB-CE1 4.37Å; A52-Y56 HydrophobicContact CB-CG 4.06Å; S53-Y56 PolarHBondContact O-N 3.06Å; S53-Y56 PolarHBondContact OG-N 3.1Å; Y56-Q58 PolarHBondContact O-N 2.95Å; Y56-H59 PolarHBondContact O-N 2.84Å; Y56-H59 VanDerWaalsContact O-N 3.12Å; Y56-V60 HydrophobicContact CD1-CG2 3.66Å; Y56-V60 HydrophobicContact CD2-CG2 4.41Å; Y56-V60 HydrophobicContact CE1-CG2 3.45Å; Y56-V60 VanDerWaalsContact CE1-CG2 3.45Å; Y56-V60 HydrophobicContact CE2-CG2 4.22Å; Y56-V60 HydrophobicContact CG-CG2 4.16Å; Y56-V60 WeakPolarHBondContact O-CB 3.39Å; Y56-V60 PolarHBondContact O-N 3.03Å
57	A	33.7	Very low	36.8	Very low	49 Å²	49	80 Å²	80	41%	0.405	41%	0.405	S	S	.	.	H	α-helix	trans	-66.7	-15.5	174.4	0	0	0	0	0	114.6	S53 W65	S53-A57 PolarHBondContact O-N 2.89Å; A57-W65 VanDerWaalsContact CA-NE1 3.35Å; A57-W65 HydrophobicContact CB-CZ2 4.39Å
58	Q	34.4	Very low	37.7	Very low	145 Å²	145	79 Å²	79	68%	0.678	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-5.5	173	-75.3	171.3	3.4	0	0	113.5	K54 E55 Y56	K54-Q58 WeakPolarHBondContact O-CB 3.38Å; K54-Q58 WeakPolarHBondContact O-CG 3.24Å; K54-Q58 PolarHBondContact O-N 3.36Å; E55-Q58 PolarHBondContact O-N 2.96Å; Y56-Q58 PolarHBondContact O-N 2.95Å
59	H	40.2	Very low	38.1	Very low	146 Å²	146	76.8 Å²	76.8	68%	0.676	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	-22.8	-175.6	-69	-3.5	0	0	0	114	E55 Y56	E55-H59 PolarHBondContact O-N 3.36Å; Y56-H59 PolarHBondContact O-N 2.84Å; Y56-H59 VanDerWaalsContact O-N 3.12Å
60	V	38.5	Very low	38.8	Very low	25 Å²	25	74.3 Å²	74.3	15%	0.152	38%	0.378	C	S	.	.	S	Bend	trans	-87.5	133.8	172.6	172.7	0	0	0	0	109.9	Y56 E64 W65	Y56-V60 HydrophobicContact CD1-CG2 3.66Å; Y56-V60 HydrophobicContact CD2-CG2 4.41Å; Y56-V60 HydrophobicContact CE1-CG2 3.45Å; Y56-V60 VanDerWaalsContact CE1-CG2 3.45Å; Y56-V60 HydrophobicContact CE2-CG2 4.22Å; Y56-V60 HydrophobicContact CG-CG2 4.16Å; Y56-V60 WeakPolarHBondContact O-CB 3.39Å; Y56-V60 PolarHBondContact O-N 3.03Å; V60-E64 HydrophobicContact CG1-CB 3.52Å; V60-W65 HydrophobicContact CG1-CB 4.09Å; V60-W65 HydrophobicContact CG1-CG 4.1Å
61	N	39.1	Very low	39.4	Very low	91 Å²	91	72.3 Å²	72.3	49%	0.487	37%	0.367	S	S	.	.			trans	-60.9	140.9	177.2	-171	-50.6	0	0	0	109.9	K63 E64 W65	N61-K63 PolarHBondContact O-N 2.96Å; N61-K63 PolarHBondContact OD1-N 3.2Å; N61-E64 HydrophobicContact CB-CB 4.26Å; N61-E64 HydrophobicContact CB-CG 3.96Å; N61-E64 WeakPolarHBondContact CB-OE2 3.28Å; N61-E64 PolarHBondContact N-OE2 2.95Å; N61-E64 WeakPolarHBondContact O-CA 3.42Å; N61-E64 WeakPolarHBondContact O-CB 3.31Å; N61-E64 PolarHBondContact O-N 3.06Å; N61-W65 PolarHBondContact O-N 2.92Å
62	V	33.2	Very low	40	Very low	119 Å²	119	72.5 Å²	72.5	72%	0.721	37%	0.365	S	S	*	.	H	α-helix	trans	-51.5	-35	178.5	-178	0	0	0	0	111.8	W65 V66	V62-W65 PolarHBondContact O-N 3.49Å; V62-V66 WeakPolarHBondContact O-CG2 3.37Å; V62-V66 PolarHBondContact O-N 2.87Å; V62-V66 VanDerWaalsContact O-N 3.13Å
63	K	37.8	Very low	40.8	Very low	149 Å²	149	77.7 Å²	77.7	65%	0.648	39%	0.389	S	S	*	.	H	α-helix	trans	-64	-47.3	173.5	-64.8	-174.8	177.2	-176.6	0	112.8	N61 W65 V66 Y67	N61-K63 PolarHBondContact O-N 2.96Å; N61-K63 PolarHBondContact OD1-N 3.2Å; K63-W65 VanDerWaalsContact C-N 3.32Å; K63-W65 PolarHBondContact O-N 2.93Å; K63-V66 PolarHBondContact O-N 2.7Å; K63-Y67 HydrophobicContact CB-CE2 4.46Å; K63-Y67 WeakPolarHBondContact O-CD2 3.27Å; K63-Y67 PolarHBondContact O-N 3.27Å; K63-Y67 VanDerWaalsContact O-N 3.08Å
64	E	40.9	Very low	42.1	Very low	67 Å²	67	81 Å²	81	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-38.9	177.2	-67.5	170.4	140.5	0	0	111.1	V60 N61 Y67 V68	V60-E64 HydrophobicContact CG1-CB 3.52Å; N61-E64 HydrophobicContact CB-CB 4.26Å; N61-E64 HydrophobicContact CB-CG 3.96Å; N61-E64 WeakPolarHBondContact CB-OE2 3.28Å; N61-E64 PolarHBondContact N-OE2 2.95Å; N61-E64 WeakPolarHBondContact O-CA 3.42Å; N61-E64 WeakPolarHBondContact O-CB 3.31Å; N61-E64 PolarHBondContact O-N 3.06Å; E64-Y67 PolarHBondContact O-N 2.83Å; E64-V68 WeakPolarHBondContact O-CB 3.43Å; E64-V68 VanDerWaalsContact O-CG2 3.26Å; E64-V68 WeakPolarHBondContact O-CG2 3.12Å; E64-V68 PolarHBondContact O-N 3.04Å
65	W	39	Very low	43.9	Very low	57 Å²	57	78 Å²	78	22%	0.216	39%	0.39	C	S	.	.	H	α-helix	trans	-64	-44.5	178.8	-128.6	114.2	0	0	0	112.3	I50 A52 A57 V60 N61 V62 K63 V68 S69	I50-W65 WeakPolarHBondContact O-CH2 3.35Å; A52-W65 HydrophobicContact CB-CH2 4Å; A52-W65 HydrophobicContact CB-CZ2 3.47Å; A52-W65 VanDerWaalsContact CB-CZ2 3.47Å; A57-W65 VanDerWaalsContact CA-NE1 3.35Å; A57-W65 HydrophobicContact CB-CZ2 4.39Å; V60-W65 HydrophobicContact CG1-CB 4.09Å; V60-W65 HydrophobicContact CG1-CG 4.1Å; N61-W65 PolarHBondContact O-N 2.92Å; V62-W65 PolarHBondContact O-N 3.49Å; K63-W65 VanDerWaalsContact C-N 3.32Å; K63-W65 PolarHBondContact O-N 2.93Å; W65-V68 PolarHBondContact O-N 2.74Å; W65-S69 PolarHBondContact O-N 2.63Å; W65-S69 PolarHBondContact O-OG 2.86Å
66	V	41.2	Very low	46.3	Very low	76 Å²	76	74.5 Å²	74.5	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-43.6	174.3	171	0	0	0	0	110.8	V62 K63 S69 L70	V62-V66 WeakPolarHBondContact O-CG2 3.37Å; V62-V66 PolarHBondContact O-N 2.87Å; V62-V66 VanDerWaalsContact O-N 3.13Å; K63-V66 PolarHBondContact O-N 2.7Å; V66-S69 WeakPolarHBondContact O-CB 3.31Å; V66-S69 PolarHBondContact O-N 3.03Å; V66-L70 HydrophobicContact CG1-CD1 3.92Å; V66-L70 WeakPolarHBondContact O-CG 3.25Å; V66-L70 PolarHBondContact O-N 3.24Å
67	Y	46.6	Very low	49.1	Very low	51 Å²	51	75.7 Å²	75.7	20%	0.2	38%	0.378	C	S	.	.	H	α-helix	trans	-73.5	-31.8	178.8	-64.7	-47	0	0	0	113.9	K63 E64 S69 L70 N71 R165 F178	K63-Y67 HydrophobicContact CB-CE2 4.46Å; K63-Y67 WeakPolarHBondContact O-CD2 3.27Å; K63-Y67 PolarHBondContact O-N 3.27Å; K63-Y67 VanDerWaalsContact O-N 3.08Å; E64-Y67 PolarHBondContact O-N 2.83Å; Y67-S69 VanDerWaalsContact C-N 3.28Å; Y67-S69 PolarHBondContact O-N 3.19Å; Y67-L70 HydrophobicContact CD1-CD1 4.03Å; Y67-L70 HydrophobicContact CE1-CD1 4.36Å; Y67-N71 WeakPolarHBondContact O-CB 3.32Å; Y67-N71 PolarHBondContact O-N 2.68Å; Y67-R165 PolarHBondContact OH-NH1 2.7Å; Y67-F178 AromaticContact CD1-CE1 3.9Å; Y67-F178 HydrophobicContact CD1-CE1 3.9Å; Y67-F178 AromaticContact CD1-CZ 3.98Å; Y67-F178 HydrophobicContact CD1-CZ 3.98Å; Y67-F178 HydrophobicContact CE1-CD1 4.38Å; Y67-F178 AromaticContact CE1-CE1 3.36Å; Y67-F178 HydrophobicContact CE1-CE1 3.36Å; Y67-F178 AromaticContact CE1-CZ 3.81Å; Y67-F178 HydrophobicContact CE1-CZ 3.81Å; Y67-F178 AromaticContact CZ-CE1 3.87Å
68	V	46.2	Very low	51.9	Low	19 Å²	19	78.9 Å²	78.9	12%	0.115	38%	0.382	C	S	.	.	H	α-helix	trans	-60.8	-40.9	168.9	164.5	0	0	0	0	110.2	E64 W65 L72 V169	E64-V68 WeakPolarHBondContact O-CB 3.43Å; E64-V68 VanDerWaalsContact O-CG2 3.26Å; E64-V68 WeakPolarHBondContact O-CG2 3.12Å; E64-V68 PolarHBondContact O-N 3.04Å; W65-V68 PolarHBondContact O-N 2.74Å; V68-L72 HydrophobicContact CG1-CD1 3.69Å; V68-L72 HydrophobicContact CG1-CG 4.49Å; V68-L72 VanDerWaalsContact O-CB 3.26Å; V68-L72 WeakPolarHBondContact O-CB 3.31Å; V68-L72 WeakPolarHBondContact O-CD1 3.23Å; V68-L72 WeakPolarHBondContact O-CG 3.28Å; V68-L72 PolarHBondContact O-N 3.16Å; V68-V169 HydrophobicContact CG2-CG2 4.31Å
69	S	38.7	Very low	54.8	Low	37 Å²	37	73 Å²	73	26%	0.259	36%	0.355	S	S	.	.	H	α-helix	trans	-63.6	-57.1	176.6	-52.7	0	0	0	0	111.3	W65 V66 Y67 N71 L72 Q73	W65-S69 PolarHBondContact O-N 2.63Å; W65-S69 PolarHBondContact O-OG 2.86Å; V66-S69 WeakPolarHBondContact O-CB 3.31Å; V66-S69 PolarHBondContact O-N 3.03Å; Y67-S69 VanDerWaalsContact C-N 3.28Å; Y67-S69 PolarHBondContact O-N 3.19Å; S69-N71 VanDerWaalsContact C-N 3.34Å; S69-N71 PolarHBondContact O-N 3.45Å; S69-L72 PolarHBondContact O-N 2.94Å; S69-Q73 WeakPolarHBondContact O-CG 3.45Å; S69-Q73 PolarHBondContact O-N 3.16Å; S69-Q73 PolarHBondContact O-OE1 2.9Å
70	L	49.3	Very low	57.3	Low	52 Å²	52	68.5 Å²	68.5	27%	0.272	34%	0.336	S	S	.	.	H	α-helix	trans	-58.1	-42.2	-179.7	-69.9	168.2	0	0	0	112.9	V66 Y67 Q73 K74	V66-L70 HydrophobicContact CG1-CD1 3.92Å; V66-L70 WeakPolarHBondContact O-CG 3.25Å; V66-L70 PolarHBondContact O-N 3.24Å; Y67-L70 HydrophobicContact CD1-CD1 4.03Å; Y67-L70 HydrophobicContact CE1-CD1 4.36Å; L70-Q73 PolarHBondContact O-N 2.87Å; L70-K74 PolarHBondContact O-N 3.43Å
71	N	49.8	Very low	59.9	Low	5 Å²	5	70.3 Å²	70.3	3%	0.027	35%	0.347	C	S	.	.	H	α-helix	trans	-78.5	-23.2	-176.4	-157.9	85.2	0	0	0	113.1	Y67 S69 K74 F102 E105 W167	Y67-N71 WeakPolarHBondContact O-CB 3.32Å; Y67-N71 PolarHBondContact O-N 2.68Å; S69-N71 VanDerWaalsContact C-N 3.34Å; S69-N71 PolarHBondContact O-N 3.45Å; N71-K74 WeakPolarHBondContact O-CG 3.31Å; N71-F102 VanDerWaalsContact OD1-CZ 3.29Å; N71-F102 WeakPolarHBondContact OD1-CZ 3.4Å; N71-E105 PolarHBondContact ND2-OE2 3.43Å; N71-E105 PolarHBondContact OD1-OE2 2.87Å; N71-W167 HydrophobicContact CB-CZ2 4.35Å; N71-W167 WeakPolarHBondContact OD1-CZ2 3.5Å
72	L	49.4	Very low	62.5	Low	74 Å²	74	68.5 Å²	68.5	39%	0.387	34%	0.335	S	S	.	.	H	α-helix	trans	-81.1	-29.6	169.6	-70.3	172.8	0	0	0	112.2	I50 V68 S69 K74	I50-L72 HydrophobicContact CD1-CB 4.09Å; I50-L72 HydrophobicContact CD1-CD1 3.57Å; I50-L72 HydrophobicContact CD1-CG 4.41Å; V68-L72 HydrophobicContact CG1-CD1 3.69Å; V68-L72 HydrophobicContact CG1-CG 4.49Å; V68-L72 VanDerWaalsContact O-CB 3.26Å; V68-L72 WeakPolarHBondContact O-CB 3.31Å; V68-L72 WeakPolarHBondContact O-CD1 3.23Å; V68-L72 WeakPolarHBondContact O-CG 3.28Å; V68-L72 PolarHBondContact O-N 3.16Å; S69-L72 PolarHBondContact O-N 2.94Å; L72-K74 VanDerWaalsContact C-N 3.32Å
73	Q	54.4	Low	65.3	Low	117 Å²	117	66 Å²	66	55%	0.547	33%	0.327	S	S	.	.	H	α-helix	trans	-75.4	-18.9	171.8	-68	174.7	-80.6	0	0	113.1	S69 L70 E75	S69-Q73 WeakPolarHBondContact O-CG 3.45Å; S69-Q73 PolarHBondContact O-N 3.16Å; S69-Q73 PolarHBondContact O-OE1 2.9Å; L70-Q73 PolarHBondContact O-N 2.87Å; Q73-E75 VanDerWaalsContact C-N 3.27Å; Q73-E75 HydrophobicContact CB-CG 4.04Å; Q73-E75 PolarHBondContact O-N 3.2Å
74	K	63.5	Low	67.8	Low	84 Å²	84	59.5 Å²	59.5	37%	0.365	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	36.9	177.4	-64.7	-179.9	176.3	172.6	0	113.5	T15 L70 N71 L72 Y76	T15-K74 WeakPolarHBondContact O-CE 3.26Å; T15-K74 PolarHBondContact O-NZ 3.41Å; T15-K74 PolarHBondContact OG1-NZ 2.86Å; L70-K74 PolarHBondContact O-N 3.43Å; N71-K74 WeakPolarHBondContact O-CG 3.31Å; L72-K74 VanDerWaalsContact C-N 3.32Å; K74-Y76 PolarHBondContact O-N 2.94Å
75	E	72.7	Confident	70.1	Confident	114 Å²	114	59.2 Å²	59.2	53%	0.533	32%	0.316	S	S	.	.			trans	-75.2	63.5	177.5	-64.3	-173.6	176.7	0	0	111.8	Q73	Q73-E75 VanDerWaalsContact C-N 3.27Å; Q73-E75 HydrophobicContact CB-CG 4.04Å; Q73-E75 PolarHBondContact O-N 3.2Å
76	Y	88.9	Confident	72.3	Confident	51 Å²	51	64.5 Å²	64.5	20%	0.2	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.1	146	174.5	-55.9	-28.1	0	0	0	110.9	K74 F102 I103 I104 E105	K74-Y76 PolarHBondContact O-N 2.94Å; Y76-F102 AromaticContact CD1-CE1 3.76Å; Y76-F102 HydrophobicContact CD1-CE1 3.76Å; Y76-F102 HydrophobicContact CD1-CZ 4.19Å; Y76-F102 AromaticContact CE1-CE1 3.76Å; Y76-F102 HydrophobicContact CE1-CE1 3.76Å; Y76-F102 AromaticContact CE1-CZ 3.89Å; Y76-F102 HydrophobicContact CE1-CZ 3.89Å; Y76-I103 VanDerWaalsContact CA-O 3.29Å; Y76-I103 WeakPolarHBondContact CA-O 3.21Å; Y76-I104 HydrophobicContact CD1-CB 4.39Å; Y76-I104 HydrophobicContact CD1-CG1 4.16Å; Y76-I104 HydrophobicContact CD2-CD1 4.36Å; Y76-I104 HydrophobicContact CD2-CG1 4.01Å; Y76-I104 HydrophobicContact CE1-CG1 4.34Å; Y76-I104 HydrophobicContact CE2-CG1 4.2Å; Y76-I104 HydrophobicContact CG-CB 4.44Å; Y76-I104 HydrophobicContact CG-CG1 4Å; Y76-E105 HydrophobicContact CE1-CB 4.24Å
77	K	92.7	Very high	74.4	Confident	62 Å²	62	63 Å²	63	27%	0.27	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-69.8	160.4	177.1	-59.5	-61.7	178.8	-169.7	0	111.5	L79 E95 I97 F102 I103	K77-L79 PolarHBondContact O-N 3.44Å; K77-E95 VanDerWaalsContact CA-OE1 3.3Å; K77-E95 WeakPolarHBondContact CA-OE1 3.45Å; K77-E95 WeakPolarHBondContact CD-OE1 3.3Å; K77-I97 HydrophobicContact CB-CD1 3.93Å; K77-I97 HydrophobicContact CB-CG1 4.26Å; K77-I97 HydrophobicContact CG-CD1 4.04Å; K77-I97 HydrophobicContact CG-CG1 4.11Å; K77-I97 HydrophobicContact CG-CG2 4.42Å; K77-F102 VanDerWaalsContact CE-O 3.29Å; K77-F102 WeakPolarHBondContact CE-O 3.43Å; K77-F102 WeakPolarHBondContact CG-O 3.36Å; K77-I103 HydrophobicContact CB-CG2 4.34Å; K77-I103 HydrophobicContact CG-CG2 4.49Å; K77-I103 PolarHBondContact N-O 3.39Å
78	K	92.9	Very high	76.3	Confident	116 Å²	116	62.1 Å²	62.1	50%	0.504	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-71.8	124.6	171.9	-59.4	-172.5	-166.3	82.5	0	109.8	A94 E95	K78-A94 HydrophobicContact CB-CB 3.98Å; K78-A94 PolarHBondContact O-N 3.13Å; K78-E95 HydrophobicContact CB-CB 4.35Å; K78-E95 HydrophobicContact CB-CG 4.02Å; K78-E95 HydrophobicContact CG-CG 4.42Å; K78-E95 WeakPolarHBondContact CG-OE2 3.47Å; K78-E95 PolarHBondContact N-OE1 3.37Å; K78-E95 IonicContact NZ-OE2 2.68Å; K78-E95 PolarHBondContact NZ-OE2 3.31Å
79	L	94.9	Very high	78.4	Confident	21 Å²	21	64.1 Å²	64.1	11%	0.11	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.1	-173	-62.9	177.6	0	0	0	110.6	K77 I91 I103 I104 L150 L189	K77-L79 PolarHBondContact O-N 3.44Å; L79-I91 HydrophobicContact CB-CG2 3.94Å; L79-I91 HydrophobicContact CD1-CG2 4.13Å; L79-I91 HydrophobicContact CD2-CG2 3.84Å; L79-I91 HydrophobicContact CG-CG2 4.17Å; L79-I103 HydrophobicContact CD1-CG2 4.22Å; L79-I103 HydrophobicContact CD2-CG2 4.03Å; L79-I104 HydrophobicContact CD1-CB 4.5Å; L79-I104 HydrophobicContact CD1-CD1 4.16Å; L79-L150 HydrophobicContact CB-CD1 4.34Å; L79-L189 HydrophobicContact CD2-CD1 3.47Å; L79-L189 VanDerWaalsContact CD2-CD1 3.47Å; L79-L189 HydrophobicContact CD2-CG 4.41Å
80	D	93.2	Very high	81	Confident	51 Å²	51	62.4 Å²	62.4	27%	0.273	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.2	175.8	-100.6	7.6	0	0	0	110	I91 R92 A94	D80-I91 CarbonylContact O-C 3.59Å; D80-I91 WeakPolarHBondContact O-CA 3.25Å; D80-R92 HydrophobicContact CB-CG 3.47Å; D80-R92 VanDerWaalsContact CB-CG 3.47Å; D80-R92 PolarHBondContact N-O 2.99Å; D80-R92 PolarHBondContact O-N 3.5Å; D80-R92 IonicContact OD2-CZ 2.94Å; D80-R92 VanDerWaalsContact OD2-CZ 3.28Å; D80-R92 IonicContact OD2-NE 2.67Å; D80-R92 PolarHBondContact OD2-NE 2.77Å; D80-R92 IonicContact OD2-NH2 2.7Å; D80-R92 PolarHBondContact OD2-NH2 3.3Å; D80-A94 HydrophobicContact CB-CB 4.38Å
81	V	93.6	Very high	83.2	Confident	63 Å²	63	59.9 Å²	59.9	38%	0.382	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	135.9	166.1	-175	0	0	0	0	109.2	L89 G90 I91 L150 L153	V81-L89 HydrophobicContact CG1-CB 4.39Å; V81-L89 HydrophobicContact CG1-CD1 4.27Å; V81-L89 HydrophobicContact CG1-CD2 4.34Å; V81-G90 WeakPolarHBondContact CA-O 3.39Å; V81-I91 HydrophobicContact CG2-CD1 3.81Å; V81-L150 HydrophobicContact CG2-CD2 3.88Å; V81-L153 HydrophobicContact CG1-CD1 4Å; V81-L153 HydrophobicContact CG2-CD1 4.13Å
82	F	93.1	Very high	85.4	Confident	53 Å²	53	63.9 Å²	63.9	23%	0.232	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	168.3	175.1	80.8	-76.3	0	0	0	112.5	A84 L89 G90 R92 E188	F82-A84 HydrophobicContact CE2-CB 3.99Å; F82-A84 HydrophobicContact CZ-CB 3.95Å; F82-A84 PolarHBondContact O-N 3.39Å; F82-L89 CarbonylContact O-C 3.55Å; F82-L89 WeakPolarHBondContact O-CA 3.4Å; F82-G90 WeakPolarHBondContact CD1-O 3.28Å; F82-G90 PolarHBondContact N-O 3.05Å; F82-G90 PolarHBondContact O-N 2.64Å; F82-R92 HydrophobicContact CD1-CB 3.97Å; F82-R92 HydrophobicContact CD1-CG 4.12Å; F82-R92 HydrophobicContact CE1-CB 4.04Å; F82-E188 HydrophobicContact CE1-CB 4Å; F82-E188 HydrophobicContact CE1-CG 3.84Å; F82-E188 HydrophobicContact CZ-CB 3.82Å; F82-E188 HydrophobicContact CZ-CG 3.77Å
83	A	93	Very high	87.7	Confident	68 Å²	68	60.4 Å²	60.4	56%	0.562	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	106.2	175.6	0	0	0	0	0	110.9	G85	A83-G85 PolarHBondContact O-N 2.77Å; A83-G85 VanDerWaalsContact O-N 3.15Å
84	A	89	Confident	89.7	Confident	11 Å²	11	56.5 Å²	56.5	9%	0.091	30%	0.304	C	S	.	.			trans	-86.2	32.9	-177.5	0	0	0	0	0	113.2	F82 K86 K87 G88	F82-A84 HydrophobicContact CE2-CB 3.99Å; F82-A84 HydrophobicContact CZ-CB 3.95Å; F82-A84 PolarHBondContact O-N 3.39Å; A84-K86 PolarHBondContact O-N 2.61Å; A84-K87 HydrophobicContact CB-CB 4.01Å; A84-K87 WeakPolarHBondContact O-CB 3.33Å; A84-K87 PolarHBondContact O-N 3.46Å; A84-K87 VanDerWaalsContact O-N 3.12Å; A84-G88 PolarHBondContact N-O 2.81Å
85	G	89.2	Confident	91.2	Very high	62 Å²	62	54.8 Å²	54.8	64%	0.639	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	56.3	-122.7	179.3	0	0	0	0	0	113	A83 K87 G88	A83-G85 PolarHBondContact O-N 2.77Å; A83-G85 VanDerWaalsContact O-N 3.15Å; G85-K87 PolarHBondContact O-N 3.15Å; G85-K87 VanDerWaalsContact O-N 3.14Å; G85-G88 PolarHBondContact O-N 2.98Å; G85-G88 VanDerWaalsContact O-N 3.08Å
86	K	85.2	Confident	92.4	Very high	167 Å²	167	55.6 Å²	55.6	73%	0.726	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-65.4	-11.6	-179.3	-65.4	-173.6	179.3	-178.5	0	114.4	A84 Y206	A84-K86 PolarHBondContact O-N 2.61Å; K86-Y206 HydrophobicContact CB-CD1 4.24Å; K86-Y206 HydrophobicContact CB-CD2 3.57Å; K86-Y206 HydrophobicContact CB-CE2 3.95Å; K86-Y206 HydrophobicContact CB-CG 3.73Å; K86-Y206 HydrophobicContact CD-CD1 3.89Å; K86-Y206 HydrophobicContact CD-CD2 4.49Å; K86-Y206 HydrophobicContact CD-CE1 3.74Å; K86-Y206 HydrophobicContact CD-CE2 4.36Å; K86-Y206 HydrophobicContact CD-CG 4.26Å
87	K	85.7	Confident	92.5	Very high	44 Å²	44	53.1 Å²	53.1	19%	0.191	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-83.4	-12.2	174.2	-63.6	179.8	-79.5	168.9	0	113.1	A84 G85 N155 E188 Y206	A84-K87 HydrophobicContact CB-CB 4.01Å; A84-K87 WeakPolarHBondContact O-CB 3.33Å; A84-K87 PolarHBondContact O-N 3.46Å; A84-K87 VanDerWaalsContact O-N 3.12Å; G85-K87 PolarHBondContact O-N 3.15Å; G85-K87 VanDerWaalsContact O-N 3.14Å; K87-N155 HydrophobicContact CD-CB 4.24Å; K87-E188 IonicContact NZ-OE1 3.74Å; K87-E188 PolarHBondContact NZ-OE1 3.3Å; K87-E188 IonicContact NZ-OE2 3.01Å; K87-E188 PolarHBondContact NZ-OE2 3.23Å; K87-Y206 WeakPolarHBondContact CD-O 3.45Å; K87-Y206 WeakPolarHBondContact CE-O 3.21Å
88	G	87.5	Confident	92.4	Very high	34 Å²	34	56.4 Å²	56.4	35%	0.351	30%	0.302	S	S	.	.			trans	92.8	-123.3	-173.2	0	0	0	0	0	111	A84 G85	A84-G88 PolarHBondContact N-O 2.81Å; G85-G88 PolarHBondContact O-N 2.98Å; G85-G88 VanDerWaalsContact O-N 3.08Å
89	L	90.5	Very high	92.1	Very high	61 Å²	61	54.3 Å²	54.3	32%	0.319	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	159.4	170.8	-63.5	178.2	0	0	0	110.8	V81 F82 L153 N155	V81-L89 HydrophobicContact CG1-CB 4.39Å; V81-L89 HydrophobicContact CG1-CD1 4.27Å; V81-L89 HydrophobicContact CG1-CD2 4.34Å; F82-L89 CarbonylContact O-C 3.55Å; F82-L89 WeakPolarHBondContact O-CA 3.4Å; L89-L153 HydrophobicContact CB-CD2 4.34Å; L89-L153 HydrophobicContact CD1-CD1 4.34Å; L89-L153 HydrophobicContact CD1-CD2 4.49Å; L89-N155 PolarHBondContact O-ND2 3.3Å
90	G	92.2	Very high	91.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	164.4	172.2	0	0	0	0	0	111.3	V81 F82 L153 N155	V81-G90 WeakPolarHBondContact CA-O 3.39Å; F82-G90 WeakPolarHBondContact CD1-O 3.28Å; F82-G90 PolarHBondContact N-O 3.05Å; F82-G90 PolarHBondContact O-N 2.64Å; G90-L153 CarbonylContact C-O 3.56Å; G90-L153 WeakPolarHBondContact CA-O 3.14Å; G90-N155 WeakPolarHBondContact CA-ND2 3.29Å
91	I	95.9	Very high	91	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	140.8	169	-64.2	-58.2	0	0	0	109.5	L79 D80 V81 L150 L153 I154 E188 L189	L79-I91 HydrophobicContact CB-CG2 3.94Å; L79-I91 HydrophobicContact CD1-CG2 4.13Å; L79-I91 HydrophobicContact CD2-CG2 3.84Å; L79-I91 HydrophobicContact CG-CG2 4.17Å; D80-I91 CarbonylContact O-C 3.59Å; D80-I91 WeakPolarHBondContact O-CA 3.25Å; V81-I91 HydrophobicContact CG2-CD1 3.81Å; I91-L150 HydrophobicContact CD1-CB 4.12Å; I91-L150 HydrophobicContact CD1-CD2 4.46Å; I91-L150 WeakPolarHBondContact CG1-O 3.29Å; I91-L153 HydrophobicContact CD1-CB 3.89Å; I91-L153 HydrophobicContact CD1-CD1 4.36Å; I91-L153 HydrophobicContact CG1-CB 3.77Å; I91-L153 PolarHBondContact N-O 3.2Å; I91-I154 HydrophobicContact CB-CG1 3.76Å; I91-I154 HydrophobicContact CG1-CG1 3.72Å; I91-I154 HydrophobicContact CG2-CG1 4.17Å; I91-E188 CarbonylContact O-C 3.48Å; I91-E188 WeakPolarHBondContact O-CA 3.36Å; I91-L189 HydrophobicContact CG2-CB 4.3Å; I91-L189 HydrophobicContact CG2-CD1 3.92Å; I91-L189 HydrophobicContact CG2-CG 4.09Å; I91-L189 PolarHBondContact O-N 3.14Å
92	R	96.7	Very high	90.6	Very high	89 Å²	89	54.2 Å²	54.2	34%	0.336	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	156.7	168.5	69.9	-173.6	-174.2	-168.3	-2.3	111.4	D80 F82 A94 E187	D80-R92 HydrophobicContact CB-CG 3.47Å; D80-R92 VanDerWaalsContact CB-CG 3.47Å; D80-R92 PolarHBondContact N-O 2.99Å; D80-R92 PolarHBondContact O-N 3.5Å; D80-R92 IonicContact OD2-CZ 2.94Å; D80-R92 VanDerWaalsContact OD2-CZ 3.28Å; D80-R92 IonicContact OD2-NE 2.67Å; D80-R92 PolarHBondContact OD2-NE 2.77Å; D80-R92 IonicContact OD2-NH2 2.7Å; D80-R92 PolarHBondContact OD2-NH2 3.3Å; F82-R92 HydrophobicContact CD1-CB 3.97Å; F82-R92 HydrophobicContact CD1-CG 4.12Å; F82-R92 HydrophobicContact CE1-CB 4.04Å; R92-A94 PolarHBondContact O-N 2.9Å; R92-E187 CarbonylContact C-O 3.55Å; R92-E187 WeakPolarHBondContact CA-O 3.24Å; R92-E187 VanDerWaalsContact CB-O 3.27Å; R92-E187 WeakPolarHBondContact CB-O 3.21Å
93	A	97.2	Very high	90.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.2	175.3	0	0	0	0	0	110.8	E95 I97 I183 G186 E187 L189	A93-E95 WeakPolarHBondContact CB-O 3.45Å; A93-I97 HydrophobicContact CB-CD1 4Å; A93-I97 HydrophobicContact CB-CG1 4.34Å; A93-I183 HydrophobicContact CB-CG2 4.03Å; A93-G186 PolarHBondContact O-N 3.32Å; A93-E187 PolarHBondContact N-O 2.82Å; A93-L189 HydrophobicContact CB-CD2 4.32Å
94	A	96.3	Very high	90.4	Very high	36 Å²	36	48.8 Å²	48.8	30%	0.298	26%	0.258	S	S	.	.	S	Bend	trans	-98.9	0.6	174.6	0	0	0	0	0	112.8	K78 D80 R92	K78-A94 HydrophobicContact CB-CB 3.98Å; K78-A94 PolarHBondContact O-N 3.13Å; D80-A94 HydrophobicContact CB-CB 4.38Å; R92-A94 PolarHBondContact O-N 2.9Å
95	E	95.6	Very high	90.5	Very high	48 Å²	48	48.2 Å²	48.2	22%	0.224	25%	0.254	C	S	.	.	S	Bend	trans	-145	160.4	168.1	67.6	-167.8	166	0	0	108.5	K77 K78 A93 I97	K77-E95 VanDerWaalsContact CA-OE1 3.3Å; K77-E95 WeakPolarHBondContact CA-OE1 3.45Å; K77-E95 WeakPolarHBondContact CD-OE1 3.3Å; K78-E95 HydrophobicContact CB-CB 4.35Å; K78-E95 HydrophobicContact CB-CG 4.02Å; K78-E95 HydrophobicContact CG-CG 4.42Å; K78-E95 WeakPolarHBondContact CG-OE2 3.47Å; K78-E95 PolarHBondContact N-OE1 3.37Å; K78-E95 IonicContact NZ-OE2 2.68Å; K78-E95 PolarHBondContact NZ-OE2 3.31Å; A93-E95 WeakPolarHBondContact CB-O 3.45Å; E95-I97 PolarHBondContact O-N 2.99Å
96	R	96.2	Very high	90.6	Very high	130 Å²	130	45.8 Å²	45.8	49%	0.491	23%	0.225	S	C	.	.			trans	-66.6	130.4	175.8	-178.2	-174.6	-179	120.2	2.1	109.7	D182 E184	R96-D182 IonicContact CZ-OD2 3.02Å; R96-D182 IonicContact NE-OD2 3.36Å; R96-D182 PolarHBondContact NE-OD2 2.83Å; R96-D182 IonicContact NH2-OD2 3.92Å; R96-D182 PolarHBondContact NH2-OD2 2.98Å; R96-E184 IonicContact CZ-OE1 2.69Å; R96-E184 VanDerWaalsContact CZ-OE1 3.25Å; R96-E184 IonicContact CZ-OE2 3.28Å; R96-E184 IonicContact NE-OE2 3.73Å; R96-E184 IonicContact NH1-OE1 3.88Å; R96-E184 PolarHBondContact NH1-OE1 3.35Å; R96-E184 IonicContact NH1-OE2 3.25Å; R96-E184 PolarHBondContact NH1-OE2 2.92Å; R96-E184 VanDerWaalsContact NH1-OE2 3.14Å; R96-E184 IonicContact NH2-OE1 2.73Å
97	I	92.2	Very high	90.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-110.4	126.2	177.7	-53.8	175.9	0	0	0	107.9	K77 A93 E95 I103 A179 D182 I183 L189	K77-I97 HydrophobicContact CB-CD1 3.93Å; K77-I97 HydrophobicContact CB-CG1 4.26Å; K77-I97 HydrophobicContact CG-CD1 4.04Å; K77-I97 HydrophobicContact CG-CG1 4.11Å; K77-I97 HydrophobicContact CG-CG2 4.42Å; A93-I97 HydrophobicContact CB-CD1 4Å; A93-I97 HydrophobicContact CB-CG1 4.34Å; E95-I97 PolarHBondContact O-N 2.99Å; I97-I103 HydrophobicContact CD1-CD1 4.11Å; I97-I103 HydrophobicContact CD1-CG1 4.26Å; I97-I103 HydrophobicContact CD1-CG2 4.27Å; I97-I103 HydrophobicContact CG2-CD1 4.29Å; I97-I103 HydrophobicContact CG2-CG1 4.14Å; I97-A179 HydrophobicContact CG2-CB 4.14Å; I97-D182 WeakPolarHBondContact O-CA 3.49Å; I97-I183 HydrophobicContact CB-CB 4.22Å; I97-I183 PolarHBondContact N-O 3.06Å; I97-I183 PolarHBondContact O-N 3.44Å; I97-L189 HydrophobicContact CD1-CD2 4.44Å
98	Q	89.4	Confident	91.2	Very high	131 Å²	131	35.8 Å²	35.8	61%	0.612	18%	0.182	S	C	*	.			trans	-78.8	153.6	176.9	-70.1	173.9	-28.2	0	0	111.2	S101 A179 D182	Q98-S101 WeakPolarHBondContact O-CB 3.47Å; Q98-S101 PolarHBondContact O-N 2.85Å; Q98-S101 PolarHBondContact O-OG 3.45Å; Q98-A179 WeakPolarHBondContact O-CB 3.29Å; Q98-D182 VanDerWaalsContact CA-OD1 3.31Å; Q98-D182 WeakPolarHBondContact CA-OD1 3.46Å
99	D	86.8	Confident	91.4	Very high	71 Å²	71	34.8 Å²	34.8	38%	0.38	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	148.7	171.8	-175.4	29.2	0	0	0	112.8	S101 L180 K181 D182	D99-S101 PolarHBondContact O-N 2.85Å; D99-L180 WeakPolarHBondContact OD1-CA 3.26Å; D99-K181 PolarHBondContact OD1-N 3.41Å; D99-K181 VanDerWaalsContact OD1-N 3.13Å; D99-D182 PolarHBondContact N-OD1 2.92Å
100	L	82.3	Confident	91.4	Very high	95 Å²	95	31.9 Å²	31.9	50%	0.497	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	-2.3	-176.5	-50.2	179.4	0	0	0	116.2	A179	L100-A179 PolarHBondContact N-O 3.32Å
101	S	82.6	Confident	91.3	Very high	23 Å²	23	32 Å²	32	16%	0.161	15%	0.153	C	C	.	.			trans	-57.7	139.9	176.2	-68.2	0	0	0	0	111.7	Q98 D99 F178 A179	Q98-S101 WeakPolarHBondContact O-CB 3.47Å; Q98-S101 PolarHBondContact O-N 2.85Å; Q98-S101 PolarHBondContact O-OG 3.45Å; D99-S101 PolarHBondContact O-N 2.85Å; S101-F178 CarbonylContact O-C 3.54Å; S101-F178 WeakPolarHBondContact O-CA 3.26Å; S101-A179 PolarHBondContact O-N 3.28Å
102	F	86.1	Confident	90.8	Very high	16 Å²	16	32.5 Å²	32.5	7%	0.07	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	138.2	162.2	-177.1	-128.3	0	0	0	110	N71 Y76 K77 E105 W167 F178	N71-F102 VanDerWaalsContact OD1-CZ 3.29Å; N71-F102 WeakPolarHBondContact OD1-CZ 3.4Å; Y76-F102 AromaticContact CD1-CE1 3.76Å; Y76-F102 HydrophobicContact CD1-CE1 3.76Å; Y76-F102 HydrophobicContact CD1-CZ 4.19Å; Y76-F102 AromaticContact CE1-CE1 3.76Å; Y76-F102 HydrophobicContact CE1-CE1 3.76Å; Y76-F102 AromaticContact CE1-CZ 3.89Å; Y76-F102 HydrophobicContact CE1-CZ 3.89Å; K77-F102 VanDerWaalsContact CE-O 3.29Å; K77-F102 WeakPolarHBondContact CE-O 3.43Å; K77-F102 WeakPolarHBondContact CG-O 3.36Å; F102-E105 HydrophobicContact CZ-CB 4.29Å; F102-W167 HydrophobicContact CE2-CH2 4.09Å; F102-F178 HydrophobicContact CB-CD1 4.09Å; F102-F178 HydrophobicContact CB-CE1 3.7Å; F102-F178 HydrophobicContact CB-CZ 4.45Å; F102-F178 HydrophobicContact CD2-CD1 4.29Å; F102-F178 AromaticContact CD2-CE1 3.69Å; F102-F178 HydrophobicContact CD2-CE1 3.69Å; F102-F178 HydrophobicContact CD2-CE2 4.13Å; F102-F178 AromaticContact CD2-CZ 3.61Å; F102-F178 HydrophobicContact CD2-CZ 3.61Å; F102-F178 HydrophobicContact CE2-CZ 4.3Å; F102-F178 HydrophobicContact CG-CE1 4.11Å; F102-F178 HydrophobicContact CG-CZ 4.4Å
103	I	89.4	Confident	90.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-58.9	-179.2	-55.1	-175.6	0	0	0	110.6	Y76 K77 L79 I97 I177 A179 I183 L189	Y76-I103 VanDerWaalsContact CA-O 3.29Å; Y76-I103 WeakPolarHBondContact CA-O 3.21Å; K77-I103 HydrophobicContact CB-CG2 4.34Å; K77-I103 HydrophobicContact CG-CG2 4.49Å; K77-I103 PolarHBondContact N-O 3.39Å; L79-I103 HydrophobicContact CD1-CG2 4.22Å; L79-I103 HydrophobicContact CD2-CG2 4.03Å; I97-I103 HydrophobicContact CD1-CD1 4.11Å; I97-I103 HydrophobicContact CD1-CG1 4.26Å; I97-I103 HydrophobicContact CD1-CG2 4.27Å; I97-I103 HydrophobicContact CG2-CD1 4.29Å; I97-I103 HydrophobicContact CG2-CG1 4.14Å; I103-I177 WeakPolarHBondContact CB-O 3.42Å; I103-I177 HydrophobicContact CD1-CG2 4.39Å; I103-I177 PolarHBondContact N-O 2.81Å; I103-A179 HydrophobicContact CD1-CB 4.43Å; I103-I183 HydrophobicContact CD1-CD1 4.22Å; I103-L189 HydrophobicContact CD1-CD1 4.16Å; I103-L189 HydrophobicContact CG2-CD1 3.71Å
104	I	91.8	Very high	89.5	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	147.4	-176.5	-166	163.7	0	0	0	111.5	Y76 L79 N149 L150 I154 G176 I177	Y76-I104 HydrophobicContact CD1-CB 4.39Å; Y76-I104 HydrophobicContact CD1-CG1 4.16Å; Y76-I104 HydrophobicContact CD2-CD1 4.36Å; Y76-I104 HydrophobicContact CD2-CG1 4.01Å; Y76-I104 HydrophobicContact CE1-CG1 4.34Å; Y76-I104 HydrophobicContact CE2-CG1 4.2Å; Y76-I104 HydrophobicContact CG-CB 4.44Å; Y76-I104 HydrophobicContact CG-CG1 4Å; L79-I104 HydrophobicContact CD1-CB 4.5Å; L79-I104 HydrophobicContact CD1-CD1 4.16Å; I104-N149 WeakPolarHBondContact CD1-OD1 3.47Å; I104-L150 HydrophobicContact CD1-CB 4.17Å; I104-I154 HydrophobicContact CG2-CD1 4.04Å; I104-G176 WeakPolarHBondContact O-CA 3.48Å; I104-I177 HydrophobicContact CG2-CB 4.3Å; I104-I177 HydrophobicContact CG2-CD1 4.22Å; I104-I177 PolarHBondContact O-N 3.36Å
105	E	91	Very high	89	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.4	168.1	-166.8	-176.5	157.3	0	0	109.5	N71 Y76 F102 V107 N149 R174 A175	N71-E105 PolarHBondContact ND2-OE2 3.43Å; N71-E105 PolarHBondContact OD1-OE2 2.87Å; Y76-E105 HydrophobicContact CE1-CB 4.24Å; F102-E105 HydrophobicContact CZ-CB 4.29Å; E105-V107 HydrophobicContact CB-CG1 3.87Å; E105-V107 HydrophobicContact CG-CG1 3.63Å; E105-V107 PolarHBondContact O-N 3.33Å; E105-N149 PolarHBondContact O-ND2 3.47Å; E105-R174 VanDerWaalsContact CD-NH1 3.3Å; E105-R174 VanDerWaalsContact OE1-CD 3.22Å; E105-R174 WeakPolarHBondContact OE1-CD 3.43Å; E105-R174 WeakPolarHBondContact OE1-CG 3.34Å; E105-R174 IonicContact OE1-CZ 3.95Å; E105-R174 IonicContact OE1-NE 2.76Å; E105-R174 IonicContact OE1-NH1 3.77Å; E105-R174 PolarHBondContact OE1-NH1 2.81Å; E105-R174 IonicContact OE2-CZ 3.14Å; E105-R174 IonicContact OE2-NH1 3.19Å; E105-R174 PolarHBondContact OE2-NH1 3.13Å; E105-A175 VanDerWaalsContact CG-O 3.28Å; E105-A175 WeakPolarHBondContact CG-O 3.35Å
106	Y	92.8	Very high	88.6	Confident	11 Å²	11	35.4 Å²	35.4	4%	0.043	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	102.6	171.5	-166.8	-79.2	0	0	0	108.8	Y132 M134 I142 A144 S151 A175 I177	Y106-Y132 PolarHBondContact OH-O 2.61Å; Y106-M134 HydrophobicContact CD1-CB 4.07Å; Y106-M134 HydrophobicContact CD1-CE 3.88Å; Y106-M134 HydrophobicContact CD1-SD 3.74Å; Y106-M134 HydrophobicContact CD2-CE 3.43Å; Y106-M134 VanDerWaalsContact CD2-CE 3.43Å; Y106-M134 HydrophobicContact CD2-SD 4.25Å; Y106-M134 HydrophobicContact CE1-CB 3.77Å; Y106-M134 HydrophobicContact CE1-CE 4.07Å; Y106-M134 HydrophobicContact CE1-SD 4.28Å; Y106-M134 HydrophobicContact CE2-CE 3.64Å; Y106-M134 HydrophobicContact CG-CE 3.57Å; Y106-M134 HydrophobicContact CG-SD 3.73Å; Y106-I142 HydrophobicContact CD1-CB 4.41Å; Y106-I142 HydrophobicContact CD1-CG2 4.02Å; Y106-I142 HydrophobicContact CE1-CB 4.49Å; Y106-I142 HydrophobicContact CE1-CG2 4.12Å; Y106-I142 WeakPolarHBondContact O-CD1 3.28Å; Y106-A144 HydrophobicContact CE1-CB 3.89Å; Y106-S151 WeakPolarHBondContact CA-OG 3.47Å; Y106-S151 WeakPolarHBondContact CD2-OG 3.3Å; Y106-A175 PolarHBondContact N-O 2.9Å; Y106-I177 HydrophobicContact CD2-CD1 4.22Å
107	V	91	Very high	88.1	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.			trans	-113.4	146	-173.1	-56.3	0	0	0	0	112.1	I14 N17 E105 A144 G148 N149	I14-V107 HydrophobicContact CD1-CB 4.33Å; I14-V107 HydrophobicContact CD1-CG2 4.18Å; I14-V107 HydrophobicContact CG1-CB 4.24Å; I14-V107 HydrophobicContact CG1-CG2 3.64Å; N17-V107 VanDerWaalsContact OD1-CA 3.29Å; N17-V107 WeakPolarHBondContact OD1-CA 3.4Å; E105-V107 HydrophobicContact CB-CG1 3.87Å; E105-V107 HydrophobicContact CG-CG1 3.63Å; E105-V107 PolarHBondContact O-N 3.33Å; V107-A144 WeakPolarHBondContact O-CB 3.47Å; V107-G148 VanDerWaalsContact O-CA 3.28Å; V107-G148 WeakPolarHBondContact O-CA 3.06Å; V107-N149 HydrophobicContact CG2-CB 3.82Å; V107-N149 WeakPolarHBondContact CG2-ND2 3.29Å
108	G	92.3	Very high	87.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.			trans	-168.1	-158.4	176.1	0	0	0	0	0	112.9	N17 V18 I142 K147	N17-G108 WeakPolarHBondContact CA-O 3.38Å; N17-G108 PolarHBondContact OD1-N 3.14Å; N17-G108 PolarHBondContact OD1-O 2.83Å; V18-G108 PolarHBondContact N-O 3.44Å; G108-I142 VanDerWaalsContact N-CG2 3.25Å; G108-K147 WeakPolarHBondContact CA-O 3.31Å
109	E	91.5	Very high	87.8	Confident	14 Å²	14	34.9 Å²	34.9	7%	0.065	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.9	167.9	-63.2	-165.3	132	0	0	110.1	V18 V20 R119 D143 K147	V18-E109 CarbonylContact O-C 3.57Å; V18-E109 VanDerWaalsContact O-CA 3.26Å; V18-E109 WeakPolarHBondContact O-CA 3.08Å; V20-E109 HydrophobicContact CG2-CB 3.91Å; E109-R119 IonicContact OE2-CZ 3.32Å; E109-R119 IonicContact OE2-NH1 2.75Å; E109-R119 PolarHBondContact OE2-NH1 3.47Å; E109-R119 IonicContact OE2-NH2 3.17Å; E109-R119 PolarHBondContact OE2-NH2 2.66Å; E109-D143 PolarHBondContact N-O 2.88Å; E109-D143 PolarHBondContact O-N 3.23Å; E109-K147 HydrophobicContact CG-CB 4.1Å; E109-K147 HydrophobicContact CG-CD 3.9Å; E109-K147 HydrophobicContact CG-CG 4.03Å; E109-K147 WeakPolarHBondContact OE1-CD 3.26Å; E109-K147 WeakPolarHBondContact OE1-CE 3.42Å; E109-K147 IonicContact OE1-NZ 2.61Å; E109-K147 PolarHBondContact OE1-NZ 3.37Å
110	V	90.8	Very high	87.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.8	178.9	-171.5	0	0	0	0	109.7	N17 V18 Y19 V20 L136 D140 V141 I142	N17-V110 HydrophobicContact CB-CG2 3.67Å; V18-V110 PolarHBondContact O-N 3.27Å; Y19-V110 HydrophobicContact CD1-CB 3.55Å; Y19-V110 HydrophobicContact CD1-CG1 3.77Å; Y19-V110 HydrophobicContact CD1-CG2 3.89Å; Y19-V110 HydrophobicContact CD2-CG2 4.47Å; Y19-V110 HydrophobicContact CE1-CB 3.74Å; Y19-V110 HydrophobicContact CE1-CG1 3.71Å; Y19-V110 HydrophobicContact CE1-CG2 3.66Å; Y19-V110 HydrophobicContact CE2-CG2 4.24Å; Y19-V110 HydrophobicContact CG-CB 4.09Å; Y19-V110 HydrophobicContact CG-CG2 4.29Å; V20-V110 WeakPolarHBondContact CB-O 3.33Å; V20-V110 PolarHBondContact N-O 3.17Å; V110-L136 HydrophobicContact CG1-CD1 4.36Å; V110-D140 HydrophobicContact CG1-CB 3.88Å; V110-V141 WeakPolarHBondContact CA-O 3.47Å; V110-I142 HydrophobicContact CG2-CG1 4.34Å
111	L	89.3	Confident	87.9	Confident	1 Å²	1	35 Å²	35	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.9	-176.3	-53.1	177.7	0	0	0	110.3	V20 L116 R119 D140 V141 D143	V20-L111 HydrophobicContact CB-CD2 3.92Å; V20-L111 HydrophobicContact CG1-CD2 4.15Å; V20-L111 HydrophobicContact CG2-CD2 3.71Å; L111-L116 HydrophobicContact CB-CB 4.05Å; L111-L116 HydrophobicContact CB-CD1 4.4Å; L111-L116 HydrophobicContact CD1-CD1 4.22Å; L111-R119 HydrophobicContact CD1-CB 3.69Å; L111-R119 HydrophobicContact CD1-CG 3.59Å; L111-D140 CarbonylContact O-C 3.56Å; L111-D140 WeakPolarHBondContact O-CA 3.31Å; L111-V141 PolarHBondContact N-O 2.82Å; L111-V141 PolarHBondContact O-N 3.47Å; L111-D143 HydrophobicContact CD1-CB 3.69Å; L111-D143 HydrophobicContact CG-CB 4.29Å
112	S	85.6	Confident	88.1	Confident	11 Å²	11	38.4 Å²	38.4	8%	0.077	20%	0.203	C	C	.	.			trans	-146.4	131.2	-175.8	67.3	0	0	0	0	110.2	S21 Y24 D114 A115	S21-S112 PolarHBondContact OG-OG 2.93Å; Y24-S112 WeakPolarHBondContact OH-CB 3.32Å; S112-D114 PolarHBondContact O-N 3.02Å; S112-A115 PolarHBondContact O-N 3.31Å
113	G	83.2	Confident	88.1	Confident	44 Å²	44	38.3 Å²	38.3	45%	0.454	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	-127.5	177.4	0	0	0	0	0	112.7	A115 L116 L117	G113-A115 PolarHBondContact O-N 3.41Å; G113-L116 WeakPolarHBondContact O-CB 3.35Å; G113-L116 PolarHBondContact O-N 2.88Å; G113-L117 PolarHBondContact O-N 3.33Å
114	D	83.7	Confident	87.5	Confident	132 Å²	132	42.4 Å²	42.4	71%	0.706	22%	0.224	S	C	*	.	H	α-helix	trans	-57.5	-35	-173.5	-45	-56.9	0	0	0	113.1	S112 L116 L117 E118	S112-D114 PolarHBondContact O-N 3.02Å; D114-L116 PolarHBondContact O-N 2.83Å; D114-L117 PolarHBondContact O-N 2.82Å; D114-L117 VanDerWaalsContact O-N 3.15Å; D114-E118 WeakPolarHBondContact O-CB 3.42Å; D114-E118 PolarHBondContact O-N 2.69Å
115	A	86.5	Confident	87.1	Confident	26 Å²	26	46.8 Å²	46.8	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-22.4	177.2	0	0	0	0	0	113.6	V20 S112 G113 R119	V20-A115 HydrophobicContact CG1-CB 4.49Å; S112-A115 PolarHBondContact O-N 3.31Å; G113-A115 PolarHBondContact O-N 3.41Å; A115-R119 WeakPolarHBondContact O-CB 3.48Å
116	L	87.1	Confident	86.7	Confident	33 Å²	33	52.1 Å²	52.1	17%	0.173	28%	0.279	C	S	.	.	H	α-helix	trans	-81.5	-45.5	170.7	175.6	60.7	0	0	0	110.9	L111 G113 D114 E118 R119 V120 M133 V141	L111-L116 HydrophobicContact CB-CB 4.05Å; L111-L116 HydrophobicContact CB-CD1 4.4Å; L111-L116 HydrophobicContact CD1-CD1 4.22Å; G113-L116 WeakPolarHBondContact O-CB 3.35Å; G113-L116 PolarHBondContact O-N 2.88Å; D114-L116 PolarHBondContact O-N 2.83Å; L116-E118 VanDerWaalsContact C-N 3.35Å; L116-E118 PolarHBondContact O-N 3.02Å; L116-R119 WeakPolarHBondContact O-CB 3.34Å; L116-R119 PolarHBondContact O-N 3.19Å; L116-R119 VanDerWaalsContact O-N 3.17Å; L116-V120 HydrophobicContact CD1-CG2 4.13Å; L116-V120 WeakPolarHBondContact O-CG2 3.31Å; L116-V120 PolarHBondContact O-N 3.45Å; L116-M133 HydrophobicContact CD1-CE 4.18Å; L116-V141 HydrophobicContact CD1-CB 3.9Å; L116-V141 HydrophobicContact CD1-CG1 4.12Å; L116-V141 HydrophobicContact CD1-CG2 4.02Å; L116-V141 HydrophobicContact CD2-CB 4.15Å; L116-V141 HydrophobicContact CD2-CG2 3.53Å; L116-V141 HydrophobicContact CG-CG2 4.43Å
117	L	85.1	Confident	86	Confident	120 Å²	120	54.1 Å²	54.1	63%	0.628	30%	0.303	S	S	*	.	H	α-helix	trans	-59.7	-45.6	178.9	-62.4	176.7	0	0	0	111.5	G113 D114 R119 V120 H121	G113-L117 PolarHBondContact O-N 3.33Å; D114-L117 PolarHBondContact O-N 2.82Å; D114-L117 VanDerWaalsContact O-N 3.15Å; L117-R119 VanDerWaalsContact C-N 3.31Å; L117-R119 PolarHBondContact O-N 3.36Å; L117-V120 PolarHBondContact O-N 3.48Å; L117-H121 WeakPolarHBondContact O-CB 3.35Å; L117-H121 PolarHBondContact O-N 2.91Å
118	E	88	Confident	85.2	Confident	113 Å²	113	56 Å²	56	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-63.4	-37.6	176.9	-157.1	-122.5	140.5	0	0	111.5	D114 L116 R122	D114-E118 WeakPolarHBondContact O-CB 3.42Å; D114-E118 PolarHBondContact O-N 2.69Å; L116-E118 VanDerWaalsContact C-N 3.35Å; L116-E118 PolarHBondContact O-N 3.02Å; E118-R122 VanDerWaalsContact O-CB 3.24Å; E118-R122 WeakPolarHBondContact O-CB 3.35Å; E118-R122 PolarHBondContact O-N 2.86Å; E118-R122 IonicContact OE1-CZ 3.74Å; E118-R122 IonicContact OE1-NE 3.58Å; E118-R122 IonicContact OE1-NH2 2.71Å; E118-R122 PolarHBondContact OE1-NH2 3.45Å; E118-R122 IonicContact OE2-NH2 2.93Å; E118-R122 PolarHBondContact OE2-NH2 3.13Å
119	R	87.8	Confident	84.1	Confident	16 Å²	16	62.5 Å²	62.5	6%	0.06	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-47.6	175.6	-172.7	70.4	59.6	115.6	-7.3	112.3	E109 L111 A115 L116 L117 R122 Y123 M133 D143	E109-R119 IonicContact OE2-CZ 3.32Å; E109-R119 IonicContact OE2-NH1 2.75Å; E109-R119 PolarHBondContact OE2-NH1 3.47Å; E109-R119 IonicContact OE2-NH2 3.17Å; E109-R119 PolarHBondContact OE2-NH2 2.66Å; L111-R119 HydrophobicContact CD1-CB 3.69Å; L111-R119 HydrophobicContact CD1-CG 3.59Å; A115-R119 WeakPolarHBondContact O-CB 3.48Å; L116-R119 WeakPolarHBondContact O-CB 3.34Å; L116-R119 PolarHBondContact O-N 3.19Å; L116-R119 VanDerWaalsContact O-N 3.17Å; L117-R119 VanDerWaalsContact C-N 3.31Å; L117-R119 PolarHBondContact O-N 3.36Å; R119-R122 PolarHBondContact O-N 2.79Å; R119-Y123 HydrophobicContact CG-CD2 4.17Å; R119-Y123 HydrophobicContact CG-CE2 3.78Å; R119-Y123 PolarHBondContact O-N 3.34Å; R119-M133 HydrophobicContact CB-CE 4.36Å; R119-M133 HydrophobicContact CG-CE 3.68Å; R119-D143 WeakPolarHBondContact CD-OD2 3.09Å; R119-D143 WeakPolarHBondContact CG-OD2 3.25Å; R119-D143 IonicContact CZ-OD2 2.83Å; R119-D143 IonicContact NE-OD2 2.66Å; R119-D143 IonicContact NH1-OD2 2.68Å; R119-D143 PolarHBondContact NH1-OD2 2.81Å
120	V	84.3	Confident	83	Confident	45 Å²	45	66 Å²	66	27%	0.273	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-50.3	178.7	171.8	0	0	0	0	109.7	L116 L117 R122 Y123 D124 M133	L116-V120 HydrophobicContact CD1-CG2 4.13Å; L116-V120 WeakPolarHBondContact O-CG2 3.31Å; L116-V120 PolarHBondContact O-N 3.45Å; L117-V120 PolarHBondContact O-N 3.48Å; V120-R122 VanDerWaalsContact C-N 3.32Å; V120-R122 PolarHBondContact O-N 3.18Å; V120-Y123 CarbonylContact O-C 3.57Å; V120-Y123 WeakPolarHBondContact O-CA 3.47Å; V120-Y123 PolarHBondContact O-N 2.79Å; V120-D124 VanDerWaalsContact O-CG 3.3Å; V120-D124 PolarHBondContact O-N 3.44Å; V120-M133 HydrophobicContact CG2-CE 4Å; V120-M133 HydrophobicContact CG2-SD 4.27Å
121	H	86.1	Confident	82.2	Confident	123 Å²	123	68.6 Å²	68.6	57%	0.569	37%	0.369	S	S	*	.	H	α-helix	trans	-56.7	-44.4	176.8	-178.1	64.9	0	0	0	112.4	L117 Y123 D124 V125	L117-H121 WeakPolarHBondContact O-CB 3.35Å; L117-H121 PolarHBondContact O-N 2.91Å; H121-Y123 VanDerWaalsContact C-N 3.26Å; H121-Y123 PolarHBondContact O-N 3.26Å; H121-D124 PolarHBondContact O-N 3.44Å; H121-V125 WeakPolarHBondContact O-CG2 3.38Å; H121-V125 PolarHBondContact O-N 3.39Å
122	R	87.6	Confident	82.1	Confident	95 Å²	95	69.7 Å²	69.7	36%	0.358	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-31.8	176	-161.9	-168.6	-58.1	157.4	-3.6	112.6	E118 R119 V120 N126	E118-R122 VanDerWaalsContact O-CB 3.24Å; E118-R122 WeakPolarHBondContact O-CB 3.35Å; E118-R122 PolarHBondContact O-N 2.86Å; E118-R122 IonicContact OE1-CZ 3.74Å; E118-R122 IonicContact OE1-NE 3.58Å; E118-R122 IonicContact OE1-NH2 2.71Å; E118-R122 PolarHBondContact OE1-NH2 3.45Å; E118-R122 IonicContact OE2-NH2 2.93Å; E118-R122 PolarHBondContact OE2-NH2 3.13Å; R119-R122 PolarHBondContact O-N 2.79Å; V120-R122 VanDerWaalsContact C-N 3.32Å; V120-R122 PolarHBondContact O-N 3.18Å; R122-N126 VanDerWaalsContact O-CB 3.26Å; R122-N126 WeakPolarHBondContact O-CB 3.49Å; R122-N126 VanDerWaalsContact O-CG 3.27Å; R122-N126 PolarHBondContact O-N 2.85Å; R122-N126 PolarHBondContact O-ND2 3Å; R122-N126 VanDerWaalsContact O-ND2 3.16Å
123	Y	85.3	Confident	82.2	Confident	15 Å²	15	70.4 Å²	70.4	6%	0.059	38%	0.375	C	S	.	.	H	α-helix	trans	-82.3	-27.9	176.4	-71.8	-8.9	0	0	0	113.8	R119 V120 H121 G127 V128 R131 M133 D143 T145	R119-Y123 HydrophobicContact CG-CD2 4.17Å; R119-Y123 HydrophobicContact CG-CE2 3.78Å; R119-Y123 PolarHBondContact O-N 3.34Å; V120-Y123 CarbonylContact O-C 3.57Å; V120-Y123 WeakPolarHBondContact O-CA 3.47Å; V120-Y123 PolarHBondContact O-N 2.79Å; H121-Y123 VanDerWaalsContact C-N 3.26Å; H121-Y123 PolarHBondContact O-N 3.26Å; Y123-G127 PolarHBondContact O-N 3.25Å; Y123-V128 HydrophobicContact CD1-CB 4.23Å; Y123-V128 HydrophobicContact CD1-CG1 4.49Å; Y123-V128 HydrophobicContact CD1-CG2 3.75Å; Y123-V128 HydrophobicContact CE1-CG2 4.43Å; Y123-V128 HydrophobicContact CG-CB 4.14Å; Y123-V128 HydrophobicContact CG-CG1 4.42Å; Y123-V128 HydrophobicContact CG-CG2 4.15Å; Y123-V128 PolarHBondContact O-N 3.48Å; Y123-R131 PolarHBondContact O-NH2 2.97Å; Y123-M133 HydrophobicContact CD2-CE 3.92Å; Y123-M133 HydrophobicContact CE2-CE 3.98Å; Y123-D143 WeakPolarHBondContact CE2-OD2 3.49Å; Y123-D143 PolarHBondContact OH-OD2 2.88Å; Y123-D143 VanDerWaalsContact OH-OD2 3.09Å; Y123-T145 HydrophobicContact CE2-CG2 4.16Å; Y123-T145 VanDerWaalsContact OH-CB 3.27Å; Y123-T145 WeakPolarHBondContact OH-CB 3.4Å; Y123-T145 WeakPolarHBondContact OH-CG2 3.36Å
124	D	76.9	Confident	82.4	Confident	85 Å²	85	69.3 Å²	69.3	46%	0.455	36%	0.359	S	S	.	.	H	α-helix	trans	-67.7	-53	169.4	-61.8	-32.8	0	0	0	110.5	V120 H121 N126 G127 R131	V120-D124 VanDerWaalsContact O-CG 3.3Å; V120-D124 PolarHBondContact O-N 3.44Å; H121-D124 PolarHBondContact O-N 3.44Å; D124-N126 VanDerWaalsContact C-N 3.34Å; D124-N126 PolarHBondContact O-N 3.47Å; D124-G127 PolarHBondContact O-N 3.33Å; D124-G127 VanDerWaalsContact O-N 3.1Å; D124-R131 IonicContact OD1-CZ 3.98Å; D124-R131 IonicContact OD1-NH1 2.89Å; D124-R131 PolarHBondContact OD1-NH1 2.91Å; D124-R131 IonicContact OD1-NH2 3.67Å; D124-R131 PolarHBondContact OD1-NH2 3.42Å
125	V	83.3	Confident	82.6	Confident	99 Å²	99	65.7 Å²	65.7	60%	0.6	34%	0.344	S	S	*	.	H	α-helix	trans	-60.8	-40.3	-179.2	171.8	0	0	0	0	112.1	H121 G127	H121-V125 WeakPolarHBondContact O-CG2 3.38Å; H121-V125 PolarHBondContact O-N 3.39Å; V125-G127 VanDerWaalsContact C-N 3.31Å; V125-G127 PolarHBondContact O-N 2.96Å
126	N	83.8	Confident	82.5	Confident	112 Å²	112	64.9 Å²	64.9	60%	0.599	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	2.1	178.9	-67.3	-23.6	0	0	0	114.1	R122 D124 V128	R122-N126 VanDerWaalsContact O-CB 3.26Å; R122-N126 WeakPolarHBondContact O-CB 3.49Å; R122-N126 VanDerWaalsContact O-CG 3.27Å; R122-N126 PolarHBondContact O-N 2.85Å; R122-N126 PolarHBondContact O-ND2 3Å; R122-N126 VanDerWaalsContact O-ND2 3.16Å; D124-N126 VanDerWaalsContact C-N 3.34Å; D124-N126 PolarHBondContact O-N 3.47Å; N126-V128 VanDerWaalsContact C-N 3.35Å; N126-V128 HydrophobicContact CB-CG2 4.05Å; N126-V128 PolarHBondContact O-N 3.14Å
127	G	76.8	Confident	81.8	Confident	52 Å²	52	69 Å²	69	54%	0.536	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	32.9	177.3	0	0	0	0	0	114.8	Y123 D124 V125 K129	Y123-G127 PolarHBondContact O-N 3.25Å; D124-G127 PolarHBondContact O-N 3.33Å; D124-G127 VanDerWaalsContact O-N 3.1Å; V125-G127 VanDerWaalsContact C-N 3.31Å; V125-G127 PolarHBondContact O-N 2.96Å; G127-K129 PolarHBondContact O-N 3.29Å; G127-K129 VanDerWaalsContact O-N 3.09Å
128	V	74.2	Confident	81.2	Confident	41 Å²	41	67.2 Å²	67.2	25%	0.248	35%	0.349	C	S	.	.			trans	-69.9	106.5	-174.2	-179.6	0	0	0	0	110.6	Y123 N126 H130	Y123-V128 HydrophobicContact CD1-CB 4.23Å; Y123-V128 HydrophobicContact CD1-CG1 4.49Å; Y123-V128 HydrophobicContact CD1-CG2 3.75Å; Y123-V128 HydrophobicContact CE1-CG2 4.43Å; Y123-V128 HydrophobicContact CG-CB 4.14Å; Y123-V128 HydrophobicContact CG-CG1 4.42Å; Y123-V128 HydrophobicContact CG-CG2 4.15Å; Y123-V128 PolarHBondContact O-N 3.48Å; N126-V128 VanDerWaalsContact C-N 3.35Å; N126-V128 HydrophobicContact CB-CG2 4.05Å; N126-V128 PolarHBondContact O-N 3.14Å; V128-H130 WeakPolarHBondContact CG1-O 3.3Å
129	K	69.2	Low	80.7	Confident	136 Å²	136	64.5 Å²	64.5	59%	0.591	35%	0.351	S	S	*	.			trans	-69.5	-38.1	-172.8	-59.8	172.1	-170.4	157.5	0	114.2	G127 Q203	G127-K129 PolarHBondContact O-N 3.29Å; G127-K129 VanDerWaalsContact O-N 3.09Å; K129-Q203 PolarHBondContact O-NE2 3.06Å
130	H	68.6	Low	80.6	Confident	88 Å²	88	64.3 Å²	64.3	41%	0.407	35%	0.352	S	S	.	.			trans	-106.7	112.1	-179.3	-62.6	-67.5	0	0	0	109.3	V128 Y132	V128-H130 WeakPolarHBondContact CG1-O 3.3Å; H130-Y132 HydrophobicContact CB-CD2 4.46Å; H130-Y132 HydrophobicContact CB-CE2 3.62Å
131	R	74.6	Confident	80.8	Confident	53 Å²	53	62.4 Å²	62.4	20%	0.2	34%	0.34	C	S	.	.			trans	-102	121.4	176.4	-62.9	179.1	-173.9	-151.9	-12.4	108.1	Y123 D124 M133	Y123-R131 PolarHBondContact O-NH2 2.97Å; D124-R131 IonicContact OD1-CZ 3.98Å; D124-R131 IonicContact OD1-NH1 2.89Å; D124-R131 PolarHBondContact OD1-NH1 2.91Å; D124-R131 IonicContact OD1-NH2 3.67Å; D124-R131 PolarHBondContact OD1-NH2 3.42Å; R131-M133 VanDerWaalsContact C-N 3.33Å; R131-M133 PolarHBondContact O-N 3.14Å
132	Y	86.1	Confident	81.1	Confident	24 Å²	24	56.6 Å²	56.6	9%	0.094	31%	0.313	C	S	.	.			trans	-103	49.7	-177.5	-57.3	-86.7	0	0	0	110.1	Y106 H130 A144 T145 R152	Y106-Y132 PolarHBondContact OH-O 2.61Å; H130-Y132 HydrophobicContact CB-CD2 4.46Å; H130-Y132 HydrophobicContact CB-CE2 3.62Å; Y132-A144 PolarHBondContact O-N 3.47Å; Y132-T145 HydrophobicContact CD2-CG2 4Å; Y132-T145 PolarHBondContact N-OG1 2.9Å; Y132-R152 HydrophobicContact CD1-CB 3.79Å; Y132-R152 HydrophobicContact CD1-CG 4.37Å; Y132-R152 WeakPolarHBondContact CD1-O 3.5Å; Y132-R152 HydrophobicContact CE1-CB 4.34Å; Y132-R152 HydrophobicContact CE1-CG 4.46Å; Y132-R152 WeakPolarHBondContact CE1-O 3.43Å; Y132-R152 VanDerWaalsContact CE2-NH2 3.3Å; Y132-R152 HydrophobicContact CG-CB 4.37Å; Y132-R152 VanDerWaalsContact CZ-NH1 3.32Å; Y132-R152 PolarHBondContact OH-NH1 3.26Å
133	M	87.4	Confident	81.3	Confident	26 Å²	26	52 Å²	52	13%	0.128	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	137.6	-175.3	-74.7	174.3	167.7	0	0	111.1	L116 R119 V120 Y123 R131 V141 I142 D143	L116-M133 HydrophobicContact CD1-CE 4.18Å; R119-M133 HydrophobicContact CB-CE 4.36Å; R119-M133 HydrophobicContact CG-CE 3.68Å; V120-M133 HydrophobicContact CG2-CE 4Å; V120-M133 HydrophobicContact CG2-SD 4.27Å; Y123-M133 HydrophobicContact CD2-CE 3.92Å; Y123-M133 HydrophobicContact CE2-CE 3.98Å; R131-M133 VanDerWaalsContact C-N 3.33Å; R131-M133 PolarHBondContact O-N 3.14Å; M133-V141 HydrophobicContact CB-CG1 3.79Å; M133-V141 HydrophobicContact CG-CG1 3.94Å; M133-I142 CarbonylContact C-O 3.54Å; M133-I142 VanDerWaalsContact CA-O 3.31Å; M133-I142 WeakPolarHBondContact CA-O 3.45Å; M133-D143 HydrophobicContact CG-CB 4.35Å
134	M	88.9	Confident	81.6	Confident	21 Å²	21	51.3 Å²	51.3	10%	0.103	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	113.5	176.7	-178.2	177.4	-68.6	0	0	110.6	Y106 I142 V164 A175 F191	Y106-M134 HydrophobicContact CD1-CB 4.07Å; Y106-M134 HydrophobicContact CD1-CE 3.88Å; Y106-M134 HydrophobicContact CD1-SD 3.74Å; Y106-M134 HydrophobicContact CD2-CE 3.43Å; Y106-M134 VanDerWaalsContact CD2-CE 3.43Å; Y106-M134 HydrophobicContact CD2-SD 4.25Å; Y106-M134 HydrophobicContact CE1-CB 3.77Å; Y106-M134 HydrophobicContact CE1-CE 4.07Å; Y106-M134 HydrophobicContact CE1-SD 4.28Å; Y106-M134 HydrophobicContact CE2-CE 3.64Å; Y106-M134 HydrophobicContact CG-CE 3.57Å; Y106-M134 HydrophobicContact CG-SD 3.73Å; M134-I142 PolarHBondContact N-O 3.09Å; M134-I142 PolarHBondContact O-N 2.92Å; M134-V164 HydrophobicContact CE-CG1 4.34Å; M134-V164 HydrophobicContact CE-CG2 3.74Å; M134-V164 HydrophobicContact SD-CG1 3.76Å; M134-V164 HydrophobicContact SD-CG2 4.27Å; M134-A175 HydrophobicContact SD-CB 3.83Å; M134-F191 HydrophobicContact CE-CE2 3.9Å; M134-F191 HydrophobicContact CE-CZ 3.64Å
135	S	86.4	Confident	82.2	Confident	57 Å²	57	48.2 Å²	48.2	40%	0.399	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	137.8	-177.3	-12.4	0	0	0	0	112.5	K166	S135-K166 WeakPolarHBondContact O-CE 3.19Å; S135-K166 PolarHBondContact O-NZ 2.56Å
136	L	84.3	Confident	82.3	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.042	27%	0.268	C	S	.	.			trans	-98	165.8	173.5	-59.7	178.7	0	0	0	110.7	V110 N138 G139 D140 I142 T173 A175	V110-L136 HydrophobicContact CG1-CD1 4.36Å; L136-N138 WeakPolarHBondContact CB-OD1 3.41Å; L136-N138 PolarHBondContact O-N 3.28Å; L136-G139 PolarHBondContact O-N 3.19Å; L136-D140 HydrophobicContact CB-CB 4.19Å; L136-D140 HydrophobicContact CD1-CB 4.09Å; L136-D140 PolarHBondContact N-O 3.3Å; L136-I142 HydrophobicContact CD1-CD1 4.21Å; L136-I142 HydrophobicContact CD1-CG1 3.83Å; L136-I142 HydrophobicContact CD2-CD1 3.91Å; L136-I142 HydrophobicContact CD2-CG1 4.09Å; L136-I142 HydrophobicContact CG-CD1 4.37Å; L136-I142 HydrophobicContact CG-CG1 4.01Å; L136-T173 HydrophobicContact CB-CG2 4.22Å; L136-T173 HydrophobicContact CD2-CG2 4.09Å; L136-A175 HydrophobicContact CD2-CB 4.01Å
137	D	73.4	Confident	82.6	Confident	120 Å²	120	44.3 Å²	44.3	64%	0.642	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-8.9	-168.9	-58.4	-38.2	0	0	0	114.4	K166	D137-K166 WeakPolarHBondContact OD1-CD 3.34Å; D137-K166 WeakPolarHBondContact OD1-CE 3.38Å; D137-K166 IonicContact OD1-NZ 2.85Å; D137-K166 PolarHBondContact OD1-NZ 3.36Å; D137-K166 WeakPolarHBondContact OD2-CD 3.31Å
138	N	71.9	Confident	83.3	Confident	82 Å²	82	41.8 Å²	41.8	44%	0.439	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	10	178.5	61.9	-43.8	0	0	0	113.6	L136 D140	L136-N138 WeakPolarHBondContact CB-OD1 3.41Å; L136-N138 PolarHBondContact O-N 3.28Å; N138-D140 VanDerWaalsContact C-N 3.34Å; N138-D140 PolarHBondContact ND2-OD1 3.29Å; N138-D140 PolarHBondContact ND2-OD2 3.41Å
139	G	77.1	Confident	84.1	Confident	56 Å²	56	40.2 Å²	40.2	58%	0.577	22%	0.217	S	C	*	.	S	Bend	trans	87.5	-3.8	-178.9	0	0	0	0	0	115	L136	L136-G139 PolarHBondContact O-N 3.19Å
140	D	86.1	Confident	85.2	Confident	12 Å²	12	34.8 Å²	34.8	6%	0.064	19%	0.194	C	C	.	.			trans	-70.7	158.9	170	-60.4	-9.7	0	0	0	110.9	Y24 V110 L111 L136 N138	Y24-D140 WeakPolarHBondContact CE1-OD2 3.46Å; Y24-D140 VanDerWaalsContact CZ-OD2 3.26Å; Y24-D140 PolarHBondContact OH-OD1 2.76Å; Y24-D140 PolarHBondContact OH-OD2 3.04Å; V110-D140 HydrophobicContact CG1-CB 3.88Å; L111-D140 CarbonylContact O-C 3.56Å; L111-D140 WeakPolarHBondContact O-CA 3.31Å; L136-D140 HydrophobicContact CB-CB 4.19Å; L136-D140 HydrophobicContact CD1-CB 4.09Å; L136-D140 PolarHBondContact N-O 3.3Å; N138-D140 VanDerWaalsContact C-N 3.34Å; N138-D140 PolarHBondContact ND2-OD1 3.29Å; N138-D140 PolarHBondContact ND2-OD2 3.41Å
141	V	89.2	Confident	86.4	Confident	6 Å²	6	30.6 Å²	30.6	4%	0.036	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.6	173.5	172.6	0	0	0	0	109.9	V110 L111 L116 M133	V110-V141 WeakPolarHBondContact CA-O 3.47Å; L111-V141 PolarHBondContact N-O 2.82Å; L111-V141 PolarHBondContact O-N 3.47Å; L116-V141 HydrophobicContact CD1-CB 3.9Å; L116-V141 HydrophobicContact CD1-CG1 4.12Å; L116-V141 HydrophobicContact CD1-CG2 4.02Å; L116-V141 HydrophobicContact CD2-CB 4.15Å; L116-V141 HydrophobicContact CD2-CG2 3.53Å; L116-V141 HydrophobicContact CG-CG2 4.43Å; M133-V141 HydrophobicContact CB-CG1 3.79Å; M133-V141 HydrophobicContact CG-CG1 3.94Å
142	I	91.4	Very high	87.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.8	165.7	-53.6	-176.6	0	0	0	108	N17 Y106 G108 V110 M133 M134 L136 A175	N17-I142 WeakPolarHBondContact ND2-CD1 3.25Å; Y106-I142 HydrophobicContact CD1-CB 4.41Å; Y106-I142 HydrophobicContact CD1-CG2 4.02Å; Y106-I142 HydrophobicContact CE1-CB 4.49Å; Y106-I142 HydrophobicContact CE1-CG2 4.12Å; Y106-I142 WeakPolarHBondContact O-CD1 3.28Å; G108-I142 VanDerWaalsContact N-CG2 3.25Å; V110-I142 HydrophobicContact CG2-CG1 4.34Å; M133-I142 CarbonylContact C-O 3.54Å; M133-I142 VanDerWaalsContact CA-O 3.31Å; M133-I142 WeakPolarHBondContact CA-O 3.45Å; M134-I142 PolarHBondContact N-O 3.09Å; M134-I142 PolarHBondContact O-N 2.92Å; L136-I142 HydrophobicContact CD1-CD1 4.21Å; L136-I142 HydrophobicContact CD1-CG1 3.83Å; L136-I142 HydrophobicContact CD2-CD1 3.91Å; L136-I142 HydrophobicContact CD2-CG1 4.09Å; L136-I142 HydrophobicContact CG-CD1 4.37Å; L136-I142 HydrophobicContact CG-CG1 4.01Å; I142-A175 HydrophobicContact CD1-CB 4.11Å
143	D	91.8	Very high	87.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	101	171.1	177.4	16.2	0	0	0	110.1	E109 L111 R119 Y123 M133 T145	E109-D143 PolarHBondContact N-O 2.88Å; E109-D143 PolarHBondContact O-N 3.23Å; L111-D143 HydrophobicContact CD1-CB 3.69Å; L111-D143 HydrophobicContact CG-CB 4.29Å; R119-D143 WeakPolarHBondContact CD-OD2 3.09Å; R119-D143 WeakPolarHBondContact CG-OD2 3.25Å; R119-D143 IonicContact CZ-OD2 2.83Å; R119-D143 IonicContact NE-OD2 2.66Å; R119-D143 IonicContact NH1-OD2 2.68Å; R119-D143 PolarHBondContact NH1-OD2 2.81Å; Y123-D143 WeakPolarHBondContact CE2-OD2 3.49Å; Y123-D143 PolarHBondContact OH-OD2 2.88Å; Y123-D143 VanDerWaalsContact OH-OD2 3.09Å; M133-D143 HydrophobicContact CG-CB 4.35Å; D143-T145 PolarHBondContact O-N 3.01Å; D143-T145 WeakPolarHBondContact OD1-CB 3.43Å; D143-T145 PolarHBondContact OD1-N 2.82Å; D143-T145 PolarHBondContact OD1-OG1 2.92Å
144	A	92.9	Very high	87.9	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	12.2	178.2	0	0	0	0	0	113.6	Y106 V107 Y132 K147 R152	Y106-A144 HydrophobicContact CE1-CB 3.89Å; V107-A144 WeakPolarHBondContact O-CB 3.47Å; Y132-A144 PolarHBondContact O-N 3.47Å; A144-K147 CarbonylContact C-O 3.59Å; A144-K147 VanDerWaalsContact CA-O 3.23Å; A144-K147 WeakPolarHBondContact CA-O 3.17Å; A144-R152 HydrophobicContact CB-CB 3.96Å; A144-R152 PolarHBondContact O-NE 2.94Å
145	T	88	Confident	88.1	Confident	20 Å²	20	26.9 Å²	26.9	12%	0.123	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-51.4	-173.1	-55	0	0	0	0	111.6	Y123 Y132 D143 R152	Y123-T145 HydrophobicContact CE2-CG2 4.16Å; Y123-T145 VanDerWaalsContact OH-CB 3.27Å; Y123-T145 WeakPolarHBondContact OH-CB 3.4Å; Y123-T145 WeakPolarHBondContact OH-CG2 3.36Å; Y132-T145 HydrophobicContact CD2-CG2 4Å; Y132-T145 PolarHBondContact N-OG1 2.9Å; D143-T145 PolarHBondContact O-N 3.01Å; D143-T145 WeakPolarHBondContact OD1-CB 3.43Å; D143-T145 PolarHBondContact OD1-N 2.82Å; D143-T145 PolarHBondContact OD1-OG1 2.92Å; T145-R152 PolarHBondContact O-NH2 2.98Å
146	V	87.1	Confident	88.4	Confident	67 Å²	67	24.4 Å²	24.4	41%	0.406	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-38.6	-177.1	-176.9	0	0	0	0	112.4	F11 T12	F11-V146 CarbonylContact C-O 3.57Å; F11-V146 WeakPolarHBondContact CA-O 3.46Å; T12-V146 PolarHBondContact N-O 3.38Å
147	K	89.2	Confident	88.7	Confident	61 Å²	61	24.5 Å²	24.5	27%	0.265	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.1	-179.9	-49.5	-175.7	-180	141.5	0	108.3	T12 I14 G108 E109 A144	T12-K147 CarbonylContact O-C 3.58Å; T12-K147 VanDerWaalsContact O-CA 3.28Å; T12-K147 WeakPolarHBondContact O-CA 3.5Å; I14-K147 HydrophobicContact CD1-CB 3.95Å; I14-K147 HydrophobicContact CG2-CB 3.99Å; G108-K147 WeakPolarHBondContact CA-O 3.31Å; E109-K147 HydrophobicContact CG-CB 4.1Å; E109-K147 HydrophobicContact CG-CD 3.9Å; E109-K147 HydrophobicContact CG-CG 4.03Å; E109-K147 WeakPolarHBondContact OE1-CD 3.26Å; E109-K147 WeakPolarHBondContact OE1-CE 3.42Å; E109-K147 IonicContact OE1-NZ 2.61Å; E109-K147 PolarHBondContact OE1-NZ 3.37Å; A144-K147 CarbonylContact C-O 3.59Å; A144-K147 VanDerWaalsContact CA-O 3.23Å; A144-K147 WeakPolarHBondContact CA-O 3.17Å
148	G	90.5	Very high	89.3	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.6	-162.3	-178.1	0	0	0	0	0	113.9	T12 Q13 I14 V107	T12-G148 PolarHBondContact O-N 2.89Å; Q13-G148 CarbonylContact C-O 3.49Å; Q13-G148 VanDerWaalsContact CA-O 3.31Å; Q13-G148 WeakPolarHBondContact CA-O 3.39Å; I14-G148 PolarHBondContact N-O 2.66Å; V107-G148 VanDerWaalsContact O-CA 3.28Å; V107-G148 WeakPolarHBondContact O-CA 3.06Å
149	N	91	Very high	90.1	Very high	7 Å²	7	19.7 Å²	19.7	4%	0.037	12%	0.12	C	C	.	.			trans	-132.7	-166.8	169.1	75.6	24.3	0	0	0	110.7	I104 E105 V107 S151 R152	I104-N149 WeakPolarHBondContact CD1-OD1 3.47Å; E105-N149 PolarHBondContact O-ND2 3.47Å; V107-N149 HydrophobicContact CG2-CB 3.82Å; V107-N149 WeakPolarHBondContact CG2-ND2 3.29Å; N149-S151 PolarHBondContact O-N 2.9Å; N149-S151 VanDerWaalsContact O-N 3.13Å; N149-S151 WeakPolarHBondContact OD1-CB 3.29Å; N149-S151 PolarHBondContact OD1-N 2.85Å; N149-S151 PolarHBondContact OD1-OG 3.44Å; N149-R152 WeakPolarHBondContact O-CD 3.49Å; N149-R152 VanDerWaalsContact O-CG 3.23Å; N149-R152 WeakPolarHBondContact O-CG 3.46Å; N149-R152 PolarHBondContact O-N 2.88Å
150	L	92.5	Very high	91	Very high	23 Å²	23	18.4 Å²	18.4	12%	0.12	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-58.5	-21.5	180	-65	178.2	0	0	0	114.6	L79 V81 I91 I104 R152 L153	L79-L150 HydrophobicContact CB-CD1 4.34Å; V81-L150 HydrophobicContact CG2-CD2 3.88Å; I91-L150 HydrophobicContact CD1-CB 4.12Å; I91-L150 HydrophobicContact CD1-CD2 4.46Å; I91-L150 WeakPolarHBondContact CG1-O 3.29Å; I104-L150 HydrophobicContact CD1-CB 4.17Å; L150-R152 PolarHBondContact O-N 2.93Å; L150-R152 VanDerWaalsContact O-N 3.11Å; L150-L153 PolarHBondContact O-N 2.93Å
151	S	93.8	Very high	91.3	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-55.8	-30	179.4	75.2	0	0	0	0	113.2	Y106 N149 L153 I154	Y106-S151 WeakPolarHBondContact CA-OG 3.47Å; Y106-S151 WeakPolarHBondContact CD2-OG 3.3Å; N149-S151 PolarHBondContact O-N 2.9Å; N149-S151 VanDerWaalsContact O-N 3.13Å; N149-S151 WeakPolarHBondContact OD1-CB 3.29Å; N149-S151 PolarHBondContact OD1-N 2.85Å; N149-S151 PolarHBondContact OD1-OG 3.44Å; S151-L153 PolarHBondContact O-N 2.98Å; S151-L153 VanDerWaalsContact O-N 3.14Å; S151-I154 WeakPolarHBondContact O-CB 3.35Å; S151-I154 PolarHBondContact O-N 3.09Å; S151-I154 VanDerWaalsContact O-N 3.16Å
152	R	93	Very high	91.5	Very high	11 Å²	11	17.8 Å²	17.8	4%	0.042	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-62.1	-17.4	178.2	78	-166.1	-67	-73.5	12.9	113.1	Y132 A144 T145 N149 L150	Y132-R152 HydrophobicContact CD1-CB 3.79Å; Y132-R152 HydrophobicContact CD1-CG 4.37Å; Y132-R152 WeakPolarHBondContact CD1-O 3.5Å; Y132-R152 HydrophobicContact CE1-CB 4.34Å; Y132-R152 HydrophobicContact CE1-CG 4.46Å; Y132-R152 WeakPolarHBondContact CE1-O 3.43Å; Y132-R152 VanDerWaalsContact CE2-NH2 3.3Å; Y132-R152 HydrophobicContact CG-CB 4.37Å; Y132-R152 VanDerWaalsContact CZ-NH1 3.32Å; Y132-R152 PolarHBondContact OH-NH1 3.26Å; A144-R152 HydrophobicContact CB-CB 3.96Å; A144-R152 PolarHBondContact O-NE 2.94Å; T145-R152 PolarHBondContact O-NH2 2.98Å; N149-R152 WeakPolarHBondContact O-CD 3.49Å; N149-R152 VanDerWaalsContact O-CG 3.23Å; N149-R152 WeakPolarHBondContact O-CG 3.46Å; N149-R152 PolarHBondContact O-N 2.88Å; L150-R152 PolarHBondContact O-N 2.93Å; L150-R152 VanDerWaalsContact O-N 3.11Å
153	L	93.8	Very high	91.4	Very high	16 Å²	16	20.6 Å²	20.6	8%	0.084	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-102	4.1	-179.2	-55.7	-179.2	0	0	0	113.1	V81 L89 G90 I91 L150 S151	V81-L153 HydrophobicContact CG1-CD1 4Å; V81-L153 HydrophobicContact CG2-CD1 4.13Å; L89-L153 HydrophobicContact CB-CD2 4.34Å; L89-L153 HydrophobicContact CD1-CD1 4.34Å; L89-L153 HydrophobicContact CD1-CD2 4.49Å; G90-L153 CarbonylContact C-O 3.56Å; G90-L153 WeakPolarHBondContact CA-O 3.14Å; I91-L153 HydrophobicContact CD1-CB 3.89Å; I91-L153 HydrophobicContact CD1-CD1 4.36Å; I91-L153 HydrophobicContact CG1-CB 3.77Å; I91-L153 PolarHBondContact N-O 3.2Å; L150-L153 PolarHBondContact O-N 2.93Å; S151-L153 PolarHBondContact O-N 2.98Å; S151-L153 VanDerWaalsContact O-N 3.14Å
154	I	94.6	Very high	91.3	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-79.8	118.8	175.9	-65.5	173.1	0	0	0	108.4	I91 I104 S151 I177 L189 F191 Y193	I91-I154 HydrophobicContact CB-CG1 3.76Å; I91-I154 HydrophobicContact CG1-CG1 3.72Å; I91-I154 HydrophobicContact CG2-CG1 4.17Å; I104-I154 HydrophobicContact CG2-CD1 4.04Å; S151-I154 WeakPolarHBondContact O-CB 3.35Å; S151-I154 PolarHBondContact O-N 3.09Å; S151-I154 VanDerWaalsContact O-N 3.16Å; I154-I177 HydrophobicContact CD1-CD1 3.52Å; I154-I177 HydrophobicContact CD1-CG2 4.48Å; I154-L189 HydrophobicContact CD1-CD1 4.29Å; I154-L189 HydrophobicContact CG1-CB 4.31Å; I154-L189 HydrophobicContact CG2-CB 4.05Å; I154-L189 WeakPolarHBondContact CG2-O 3.14Å; I154-F191 HydrophobicContact CB-CD1 4.38Å; I154-F191 HydrophobicContact CB-CE1 4.02Å; I154-F191 HydrophobicContact CG2-CD1 3.51Å; I154-F191 HydrophobicContact CG2-CE1 3.66Å; I154-Y193 PolarHBondContact O-OH 3.43Å; I154-Y193 VanDerWaalsContact O-OH 3.08Å
155	N	93.3	Very high	90.8	Very high	17 Å²	17	26 Å²	26	9%	0.091	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	169.1	-167.4	-83.1	-47.7	0	0	0	114.3	K87 L89 G90 E188 S190 F191 Y193	K87-N155 HydrophobicContact CD-CB 4.24Å; L89-N155 PolarHBondContact O-ND2 3.3Å; G90-N155 WeakPolarHBondContact CA-ND2 3.29Å; N155-E188 WeakPolarHBondContact CB-OE1 3.1Å; N155-E188 PolarHBondContact ND2-OE1 2.9Å; N155-S190 WeakPolarHBondContact O-CA 3.45Å; N155-S190 VanDerWaalsContact O-CB 3.26Å; N155-S190 WeakPolarHBondContact O-CB 3.22Å; N155-F191 PolarHBondContact O-N 2.75Å; N155-F191 VanDerWaalsContact O-N 3.15Å; N155-Y193 VanDerWaalsContact C-CE1 3.5Å; N155-Y193 WeakPolarHBondContact CA-OH 3.37Å
156	H	91.6	Very high	90.5	Very high	5 Å²	5	28.7 Å²	28.7	2%	0.023	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.7	167.2	-177.2	40.2	0	0	0	112.4	C158 F191 D192 Y193 C205 R213 L216	H156-C158 PolarHBondContact NE2-SG 3.48Å; H156-F191 WeakPolarHBondContact CA-O 3.42Å; H156-F191 PolarHBondContact ND1-O 2.85Å; H156-F191 VanDerWaalsContact ND1-O 3.09Å; H156-D192 IonicContact CE1-OD1 3.56Å; H156-D192 PolarHBondContact CE1-OD1 3.21Å; H156-D192 IonicContact ND1-OD1 3.27Å; H156-Y193 HydrophobicContact CB-CD1 3.92Å; H156-Y193 HydrophobicContact CB-CD2 3.71Å; H156-Y193 HydrophobicContact CB-CE1 4.04Å; H156-Y193 HydrophobicContact CB-CE2 3.85Å; H156-Y193 HydrophobicContact CB-CG 3.78Å; H156-Y193 PolarHBondContact ND1-N 2.93Å; H156-C205 VanDerWaalsContact CD2-SG 3.58Å; H156-R213 PolarHBondContact CE1-NH2 2.91Å; H156-R213 VanDerWaalsContact CE1-NH2 3.26Å; H156-R213 PolarHBondContact NE2-NH2 2.74Å; H156-L216 HydrophobicContact CB-CD2 4Å
157	S	91.5	Very high	89.7	Confident	10 Å²	10	26.6 Å²	26.6	7%	0.07	13%	0.131	C	C	.	.			trans	-130.9	145.7	154.9	-174.4	0	0	0	0	112.3	D159 S190 F191	S157-D159 VanDerWaalsContact C-N 3.32Å; S157-D159 WeakPolarHBondContact CB-O 3.37Å; S157-D159 PolarHBondContact OG-N 2.97Å; S157-D159 VanDerWaalsContact OG-N 3.08Å; S157-D159 PolarHBondContact OG-O 2.92Å; S157-S190 WeakPolarHBondContact CB-OG 3.28Å; S157-F191 PolarHBondContact N-O 3.01Å
158	C	86.1	Confident	88.6	Confident	15 Å²	15	28.8 Å²	28.8	10%	0.101	14%	0.143	C	C	.	.	S	Bend	trans	-78.1	-18.5	169.1	-60	0	0	0	0	112.5	H156 N211 R213	H156-C158 PolarHBondContact NE2-SG 3.48Å; C158-N211 WeakPolarHBondContact CB-OD1 3.49Å; C158-N211 PolarHBondContact O-ND2 2.89Å; C158-N211 PolarHBondContact O-OD1 3.11Å; C158-R213 HydrophobicContact CB-CG 4.42Å; C158-R213 PolarHBondContact SG-N 3.15Å; C158-R213 VanDerWaalsContact SG-N 3.36Å
159	D	88.1	Confident	87.2	Confident	87 Å²	87	29.2 Å²	29.2	47%	0.465	15%	0.146	S	C	.	.	S	Bend	trans	-118.2	86.5	161	-178.4	45.3	0	0	0	108.4	S157 K181 A209	S157-D159 VanDerWaalsContact C-N 3.32Å; S157-D159 WeakPolarHBondContact CB-O 3.37Å; S157-D159 PolarHBondContact OG-N 2.97Å; S157-D159 VanDerWaalsContact OG-N 3.08Å; S157-D159 PolarHBondContact OG-O 2.92Å; D159-K181 IonicContact OD2-NZ 3.88Å; D159-A209 HydrophobicContact CB-CB 3.77Å
160	P	95.1	Very high	85.9	Confident	29 Å²	29	30.8 Å²	30.8	19%	0.188	15%	0.154	C	C	.	.			trans	-81.6	151.1	-175.1	31.6	-34.6	0	0	0	113.2	L180 S190	P160-L180 HydrophobicContact CG-CD1 4.2Å; P160-S190 VanDerWaalsContact CB-O 3.25Å; P160-S190 WeakPolarHBondContact CB-O 3.45Å
161	N	93.8	Very high	84.5	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.016	17%	0.171	C	C	.	.	S	Bend	trans	-99.7	-7.6	167.9	60.8	10.4	0	0	0	113.2	L180 K181 I183 E187 E188 L189 S190	N161-L180 PolarHBondContact O-N 3.47Å; N161-K181 HydrophobicContact CB-CD 4.45Å; N161-K181 VanDerWaalsContact CB-CE 3.42Å; N161-K181 HydrophobicContact CB-CG 4.22Å; N161-I183 HydrophobicContact CB-CD1 4.04Å; N161-I183 HydrophobicContact CB-CG1 4.22Å; N161-E187 PolarHBondContact ND2-OE1 2.87Å; N161-E188 PolarHBondContact ND2-O 2.9Å; N161-L189 WeakPolarHBondContact OD1-CA 3.31Å; N161-S190 PolarHBondContact N-O 3.01Å; N161-S190 PolarHBondContact OD1-N 3.24Å; N161-S190 PolarHBondContact OD1-O 3.41Å
162	C	93.1	Very high	83.4	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	155.7	179.3	-60.3	0	0	0	0	112.8	I177 F178 L180 S190 F191	C162-I177 HydrophobicContact CB-CG2 3.68Å; C162-F178 CarbonylContact C-O 3.6Å; C162-F178 WeakPolarHBondContact CA-O 3.39Å; C162-L180 WeakPolarHBondContact O-CD1 3.37Å; C162-S190 WeakPolarHBondContact CB-O 3.28Å; C162-S190 PolarHBondContact N-O 3.18Å; C162-F191 HydrophobicContact CB-CB 4.31Å; C162-F191 WeakPolarHBondContact O-CA 3.23Å; C162-F191 VanDerWaalsContact O-CB 3.26Å; C162-F191 WeakPolarHBondContact O-CB 3.35Å
163	I	88.8	Confident	82.6	Confident	59 Å²	59	34.8 Å²	34.8	30%	0.303	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.6	171.9	-173	164.5	0	0	0	111.1	R165 F178 L180	I163-R165 HydrophobicContact CG2-CG 4.44Å; I163-F178 HydrophobicContact CG2-CB 4.11Å; I163-F178 PolarHBondContact N-O 3.47Å; I163-F178 PolarHBondContact O-N 3.04Å; I163-L180 HydrophobicContact CB-CD1 4.01Å; I163-L180 HydrophobicContact CB-CD2 3.73Å; I163-L180 HydrophobicContact CB-CG 3.76Å; I163-L180 HydrophobicContact CD1-CD2 4.22Å; I163-L180 HydrophobicContact CG2-CD2 3.59Å; I163-L180 HydrophobicContact CG2-CG 3.84Å
164	V	89.1	Confident	82.2	Confident	36 Å²	36	35 Å²	35	22%	0.218	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	123.4	165.8	-179.8	0	0	0	0	108.4	M134 A175 G176 I177 F191	M134-V164 HydrophobicContact CE-CG1 4.34Å; M134-V164 HydrophobicContact CE-CG2 3.74Å; M134-V164 HydrophobicContact SD-CG1 3.76Å; M134-V164 HydrophobicContact SD-CG2 4.27Å; V164-A175 HydrophobicContact CG1-CB 4.12Å; V164-G176 WeakPolarHBondContact CA-O 3.5Å; V164-I177 HydrophobicContact CG2-CG1 4.24Å; V164-F191 HydrophobicContact CG2-CD1 4.26Å; V164-F191 HydrophobicContact CG2-CD2 3.62Å; V164-F191 HydrophobicContact CG2-CE1 4.3Å; V164-F191 HydrophobicContact CG2-CE2 3.65Å; V164-F191 HydrophobicContact CG2-CG 3.95Å; V164-F191 HydrophobicContact CG2-CZ 4.02Å
165	R	83.5	Confident	81.8	Confident	79 Å²	79	34.9 Å²	34.9	30%	0.298	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	145.8	163.7	-60.6	-179.7	178.3	163.1	4.7	108.7	Y67 I163 W167 A175 G176 F178	Y67-R165 PolarHBondContact OH-NH1 2.7Å; I163-R165 HydrophobicContact CG2-CG 4.44Å; R165-W167 WeakPolarHBondContact O-CZ3 3.2Å; R165-A175 WeakPolarHBondContact O-CA 3.44Å; R165-G176 PolarHBondContact N-O 3.45Å; R165-G176 PolarHBondContact O-N 3.46Å; R165-F178 HydrophobicContact CB-CD2 3.82Å; R165-F178 HydrophobicContact CB-CE2 3.74Å; R165-F178 HydrophobicContact CG-CD2 3.76Å; R165-F178 HydrophobicContact CG-CE2 4.16Å
166	K	82.1	Confident	81.6	Confident	76 Å²	76	34.1 Å²	34.1	33%	0.33	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	145.3	173	-58.9	168.9	-169.7	-179.8	0	108.5	S135 D137 T173 R174 A175	S135-K166 WeakPolarHBondContact O-CE 3.19Å; S135-K166 PolarHBondContact O-NZ 2.56Å; D137-K166 WeakPolarHBondContact OD1-CD 3.34Å; D137-K166 WeakPolarHBondContact OD1-CE 3.38Å; D137-K166 IonicContact OD1-NZ 2.85Å; D137-K166 PolarHBondContact OD1-NZ 3.36Å; D137-K166 WeakPolarHBondContact OD2-CD 3.31Å; K166-T173 HydrophobicContact CB-CG2 4.26Å; K166-R174 VanDerWaalsContact CA-O 3.27Å; K166-R174 WeakPolarHBondContact CA-O 3.45Å; K166-A175 HydrophobicContact CG-CB 4.24Å
167	W	69.9	Low	81.6	Confident	23 Å²	23	33.9 Å²	33.9	9%	0.087	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	162.1	178.2	66.4	95	0	0	0	110.7	N71 F102 R165 T173 R174 G176 F178	N71-W167 HydrophobicContact CB-CZ2 4.35Å; N71-W167 WeakPolarHBondContact OD1-CZ2 3.5Å; F102-W167 HydrophobicContact CE2-CH2 4.09Å; R165-W167 WeakPolarHBondContact O-CZ3 3.2Å; W167-T173 WeakPolarHBondContact O-CA 3.4Å; W167-R174 HydrophobicContact CZ2-CB 4.22Å; W167-R174 PolarHBondContact N-O 2.94Å; W167-R174 PolarHBondContact O-N 3.37Å; W167-G176 VanDerWaalsContact CZ3-N 3.25Å; W167-F178 HydrophobicContact CE3-CE2 4.41Å; W167-F178 AromaticContact CZ3-CE2 3.81Å; W167-F178 HydrophobicContact CZ3-CE2 3.81Å; W167-F178 HydrophobicContact CZ3-CZ 4.2Å
168	M	65	Low	81.4	Confident	107 Å²	107	33.4 Å²	33.4	53%	0.527	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.2	179.5	-163.3	176.5	-68.2	0	0	110.7	R172	M168-R172 WeakPolarHBondContact CA-O 3.3Å
169	V	62.7	Low	81.6	Confident	9 Å²	9	32.7 Å²	32.7	6%	0.055	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117	172.6	-178.8	0	0	0	0	108.3	V68 G171 R172 R174	V68-V169 HydrophobicContact CG2-CG2 4.31Å; V169-G171 VanDerWaalsContact C-N 3.26Å; V169-G171 PolarHBondContact O-N 3.15Å; V169-R172 PolarHBondContact N-O 3.27Å; V169-R172 PolarHBondContact O-N 2.91Å; V169-R174 HydrophobicContact CG2-CG 4.49Å
170	L	61.7	Low	81.6	Confident	40 Å²	40	32 Å²	32	21%	0.209	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	43.6	178.3	-54.9	173.4	0	0	0	112.8	F30 L34 R172	F30-L170 HydrophobicContact CD1-CB 4.37Å; F30-L170 HydrophobicContact CD1-CD2 3.98Å; L34-L170 HydrophobicContact CD1-CD2 4.47Å; L170-R172 VanDerWaalsContact C-N 3.29Å; L170-R172 PolarHBondContact O-N 3.12Å
171	G	63.2	Low	81.3	Confident	45 Å²	45	34.5 Å²	34.5	46%	0.464	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-0.8	-178.5	0	0	0	0	0	115.9	V169	V169-G171 VanDerWaalsContact C-N 3.26Å; V169-G171 PolarHBondContact O-N 3.15Å
172	R	70.7	Confident	81.2	Confident	52 Å²	52	37.5 Å²	37.5	20%	0.196	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.4	179.5	-67.9	173.6	168.4	-170.2	-3.3	111.4	Y19 Y24 M168 V169 L170 R174	Y19-R172 HydrophobicContact CE1-CG 4.46Å; Y24-R172 PolarHBondContact O-NE 2.81Å; Y24-R172 PolarHBondContact O-NH2 2.81Å; M168-R172 WeakPolarHBondContact CA-O 3.3Å; V169-R172 PolarHBondContact N-O 3.27Å; V169-R172 PolarHBondContact O-N 2.91Å; L170-R172 VanDerWaalsContact C-N 3.29Å; L170-R172 PolarHBondContact O-N 3.12Å; R172-R174 PolarHBondContact O-N 2.96Å
173	T	78	Confident	81.3	Confident	21 Å²	21	37.5 Å²	37.5	13%	0.129	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	130.1	171	-43.9	0	0	0	0	109.9	Y19 L136 K166 W167	Y19-T173 PolarHBondContact OH-O 3.23Å; L136-T173 HydrophobicContact CB-CG2 4.22Å; L136-T173 HydrophobicContact CD2-CG2 4.09Å; K166-T173 HydrophobicContact CB-CG2 4.26Å; W167-T173 WeakPolarHBondContact O-CA 3.4Å
174	R	83.9	Confident	81.7	Confident	19 Å²	19	39 Å²	39	7%	0.072	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	158.6	168.9	-70.5	179.9	-179.9	-118.3	4	109.3	E16 E105 K166 W167 V169 R172	E16-R174 IonicContact OE2-CZ 3.51Å; E16-R174 IonicContact OE2-NH1 2.67Å; E16-R174 IonicContact OE2-NH2 3.2Å; E16-R174 PolarHBondContact OE2-NH2 3.45Å; E105-R174 VanDerWaalsContact CD-NH1 3.3Å; E105-R174 VanDerWaalsContact OE1-CD 3.22Å; E105-R174 WeakPolarHBondContact OE1-CD 3.43Å; E105-R174 WeakPolarHBondContact OE1-CG 3.34Å; E105-R174 IonicContact OE1-CZ 3.95Å; E105-R174 IonicContact OE1-NE 2.76Å; E105-R174 IonicContact OE1-NH1 3.77Å; E105-R174 PolarHBondContact OE1-NH1 2.81Å; E105-R174 IonicContact OE2-CZ 3.14Å; E105-R174 IonicContact OE2-NH1 3.19Å; E105-R174 PolarHBondContact OE2-NH1 3.13Å; K166-R174 VanDerWaalsContact CA-O 3.27Å; K166-R174 WeakPolarHBondContact CA-O 3.45Å; W167-R174 HydrophobicContact CZ2-CB 4.22Å; W167-R174 PolarHBondContact N-O 2.94Å; W167-R174 PolarHBondContact O-N 3.37Å; V169-R174 HydrophobicContact CG2-CG 4.49Å; R172-R174 PolarHBondContact O-N 2.96Å
175	A	87.7	Confident	82.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.6	177.3	0	0	0	0	0	109.8	E105 Y106 M134 L136 I142 V164 R165 K166	E105-A175 VanDerWaalsContact CG-O 3.28Å; E105-A175 WeakPolarHBondContact CG-O 3.35Å; Y106-A175 PolarHBondContact N-O 2.9Å; M134-A175 HydrophobicContact SD-CB 3.83Å; L136-A175 HydrophobicContact CD2-CB 4.01Å; I142-A175 HydrophobicContact CD1-CB 4.11Å; V164-A175 HydrophobicContact CG1-CB 4.12Å; R165-A175 WeakPolarHBondContact O-CA 3.44Å; K166-A175 HydrophobicContact CG-CB 4.24Å
176	G	88	Confident	82.7	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	163.3	-178.7	0	0	0	0	0	113	I104 V164 R165 W167 F178	I104-G176 WeakPolarHBondContact O-CA 3.48Å; V164-G176 WeakPolarHBondContact CA-O 3.5Å; R165-G176 PolarHBondContact N-O 3.45Å; R165-G176 PolarHBondContact O-N 3.46Å; W167-G176 VanDerWaalsContact CZ3-N 3.25Å; G176-F178 WeakPolarHBondContact O-CD2 3.25Å
177	I	91.1	Very high	83.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.9	-158.1	-61.1	174.2	0	0	0	108.9	I103 I104 Y106 I154 C162 V164 F191	I103-I177 WeakPolarHBondContact CB-O 3.42Å; I103-I177 HydrophobicContact CD1-CG2 4.39Å; I103-I177 PolarHBondContact N-O 2.81Å; I104-I177 HydrophobicContact CG2-CB 4.3Å; I104-I177 HydrophobicContact CG2-CD1 4.22Å; I104-I177 PolarHBondContact O-N 3.36Å; Y106-I177 HydrophobicContact CD2-CD1 4.22Å; I154-I177 HydrophobicContact CD1-CD1 3.52Å; I154-I177 HydrophobicContact CD1-CG2 4.48Å; C162-I177 HydrophobicContact CB-CG2 3.68Å; V164-I177 HydrophobicContact CG2-CG1 4.24Å; I177-F191 HydrophobicContact CD1-CD1 4.26Å; I177-F191 HydrophobicContact CD1-CE1 3.9Å
178	F	88.8	Confident	84.7	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.5	-178.5	-63.9	-93.8	0	0	0	110.2	Y67 S101 F102 C162 I163 R165 W167 G176	Y67-F178 AromaticContact CD1-CE1 3.9Å; Y67-F178 HydrophobicContact CD1-CE1 3.9Å; Y67-F178 AromaticContact CD1-CZ 3.98Å; Y67-F178 HydrophobicContact CD1-CZ 3.98Å; Y67-F178 HydrophobicContact CE1-CD1 4.38Å; Y67-F178 AromaticContact CE1-CE1 3.36Å; Y67-F178 HydrophobicContact CE1-CE1 3.36Å; Y67-F178 AromaticContact CE1-CZ 3.81Å; Y67-F178 HydrophobicContact CE1-CZ 3.81Å; Y67-F178 AromaticContact CZ-CE1 3.87Å; S101-F178 CarbonylContact O-C 3.54Å; S101-F178 WeakPolarHBondContact O-CA 3.26Å; F102-F178 HydrophobicContact CB-CD1 4.09Å; F102-F178 HydrophobicContact CB-CE1 3.7Å; F102-F178 HydrophobicContact CB-CZ 4.45Å; F102-F178 HydrophobicContact CD2-CD1 4.29Å; F102-F178 AromaticContact CD2-CE1 3.69Å; F102-F178 HydrophobicContact CD2-CE1 3.69Å; F102-F178 HydrophobicContact CD2-CE2 4.13Å; F102-F178 AromaticContact CD2-CZ 3.61Å; F102-F178 HydrophobicContact CD2-CZ 3.61Å; F102-F178 HydrophobicContact CE2-CZ 4.3Å; F102-F178 HydrophobicContact CG-CE1 4.11Å; F102-F178 HydrophobicContact CG-CZ 4.4Å; C162-F178 CarbonylContact C-O 3.6Å; C162-F178 WeakPolarHBondContact CA-O 3.39Å; I163-F178 HydrophobicContact CG2-CB 4.11Å; I163-F178 PolarHBondContact N-O 3.47Å; I163-F178 PolarHBondContact O-N 3.04Å; R165-F178 HydrophobicContact CB-CD2 3.82Å; R165-F178 HydrophobicContact CB-CE2 3.74Å; R165-F178 HydrophobicContact CG-CD2 3.76Å; R165-F178 HydrophobicContact CG-CE2 4.16Å; W167-F178 HydrophobicContact CE3-CE2 4.41Å; W167-F178 AromaticContact CZ3-CE2 3.81Å; W167-F178 HydrophobicContact CZ3-CE2 3.81Å; W167-F178 HydrophobicContact CZ3-CZ 4.2Å; G176-F178 WeakPolarHBondContact O-CD2 3.25Å
179	A	88.5	Confident	86.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	147.7	169.2	0	0	0	0	0	111.7	I97 Q98 L100 S101 I103 I183	I97-A179 HydrophobicContact CG2-CB 4.14Å; Q98-A179 WeakPolarHBondContact O-CB 3.29Å; L100-A179 PolarHBondContact N-O 3.32Å; S101-A179 PolarHBondContact O-N 3.28Å; I103-A179 HydrophobicContact CD1-CB 4.43Å; A179-I183 HydrophobicContact CB-CD1 4.15Å; A179-I183 HydrophobicContact CB-CG1 4.48Å
180	L	88.4	Confident	87.7	Confident	73 Å²	73	35.5 Å²	35.5	38%	0.382	20%	0.199	S	C	.	.	S	Bend	trans	-108	-8.8	170.9	-78.4	174.9	0	0	0	113.5	D99 P160 N161 C162 I163	D99-L180 WeakPolarHBondContact OD1-CA 3.26Å; P160-L180 HydrophobicContact CG-CD1 4.2Å; N161-L180 PolarHBondContact O-N 3.47Å; C162-L180 WeakPolarHBondContact O-CD1 3.37Å; I163-L180 HydrophobicContact CB-CD1 4.01Å; I163-L180 HydrophobicContact CB-CD2 3.73Å; I163-L180 HydrophobicContact CB-CG 3.76Å; I163-L180 HydrophobicContact CD1-CD2 4.22Å; I163-L180 HydrophobicContact CG2-CD2 3.59Å; I163-L180 HydrophobicContact CG2-CG 3.84Å
181	K	89.5	Confident	89.2	Confident	81 Å²	81	34.3 Å²	34.3	35%	0.352	19%	0.192	S	C	.	.	S	Bend	trans	-162.9	168.1	-179.8	55.1	-174	179.1	-168.3	0	107.5	D99 D159 N161 I183	D99-K181 PolarHBondContact OD1-N 3.41Å; D99-K181 VanDerWaalsContact OD1-N 3.13Å; D159-K181 IonicContact OD2-NZ 3.88Å; N161-K181 HydrophobicContact CB-CD 4.45Å; N161-K181 VanDerWaalsContact CB-CE 3.42Å; N161-K181 HydrophobicContact CB-CG 4.22Å; K181-I183 WeakPolarHBondContact O-CG1 3.09Å; K181-I183 PolarHBondContact O-N 2.9Å
182	D	90.9	Very high	90.4	Very high	66 Å²	66	34.1 Å²	34.1	35%	0.353	18%	0.18	S	C	.	.			trans	-58.6	137.3	165.5	-93	35.2	0	0	0	110.1	R96 I97 Q98 D99	R96-D182 IonicContact CZ-OD2 3.02Å; R96-D182 IonicContact NE-OD2 3.36Å; R96-D182 PolarHBondContact NE-OD2 2.83Å; R96-D182 IonicContact NH2-OD2 3.92Å; R96-D182 PolarHBondContact NH2-OD2 2.98Å; I97-D182 WeakPolarHBondContact O-CA 3.49Å; Q98-D182 VanDerWaalsContact CA-OD1 3.31Å; Q98-D182 WeakPolarHBondContact CA-OD1 3.46Å; D99-D182 PolarHBondContact N-OD1 2.92Å
183	I	95	Very high	91	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-121.9	124	-178.5	-49.3	-176.4	0	0	0	108	A93 I97 I103 N161 A179 K181 E187 L189	A93-I183 HydrophobicContact CB-CG2 4.03Å; I97-I183 HydrophobicContact CB-CB 4.22Å; I97-I183 PolarHBondContact N-O 3.06Å; I97-I183 PolarHBondContact O-N 3.44Å; I103-I183 HydrophobicContact CD1-CD1 4.22Å; N161-I183 HydrophobicContact CB-CD1 4.04Å; N161-I183 HydrophobicContact CB-CG1 4.22Å; A179-I183 HydrophobicContact CB-CD1 4.15Å; A179-I183 HydrophobicContact CB-CG1 4.48Å; K181-I183 WeakPolarHBondContact O-CG1 3.09Å; K181-I183 PolarHBondContact O-N 2.9Å; I183-E187 HydrophobicContact CG2-CB 3.81Å; I183-E187 HydrophobicContact CG2-CG 4.11Å; I183-L189 HydrophobicContact CD1-CD2 3.66Å; I183-L189 HydrophobicContact CG2-CD2 3.83Å
184	E	97.2	Very high	90.6	Very high	91 Å²	91	39.4 Å²	39.4	43%	0.425	20%	0.203	S	C	.	.			trans	-88.5	161.4	-176.3	-65	-71.5	-169	0	0	112.8	R96 G186 E187	R96-E184 IonicContact CZ-OE1 2.69Å; R96-E184 VanDerWaalsContact CZ-OE1 3.25Å; R96-E184 IonicContact CZ-OE2 3.28Å; R96-E184 IonicContact NE-OE2 3.73Å; R96-E184 IonicContact NH1-OE1 3.88Å; R96-E184 PolarHBondContact NH1-OE1 3.35Å; R96-E184 IonicContact NH1-OE2 3.25Å; R96-E184 PolarHBondContact NH1-OE2 2.92Å; R96-E184 VanDerWaalsContact NH1-OE2 3.14Å; R96-E184 IonicContact NH2-OE1 2.73Å; E184-G186 PolarHBondContact O-N 3.15Å; E184-E187 PolarHBondContact N-OE2 2.76Å; E184-E187 VanDerWaalsContact O-CB 3.29Å; E184-E187 WeakPolarHBondContact O-CB 3.29Å; E184-E187 PolarHBondContact O-N 3.19Å; E184-E187 VanDerWaalsContact O-N 3.09Å
185	V	97.4	Very high	89.5	Confident	96 Å²	96	39.9 Å²	39.9	58%	0.582	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	123.6	-179.1	-174.4	0	0	0	0	110.5
186	G	96.4	Very high	87.7	Confident	41 Å²	41	42.9 Å²	42.9	42%	0.423	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	-8.5	-178.5	0	0	0	0	0	115.2	A93 E184	A93-G186 PolarHBondContact O-N 3.32Å; E184-G186 PolarHBondContact O-N 3.15Å
187	E	97.1	Very high	85.5	Confident	64 Å²	64	44.9 Å²	44.9	30%	0.299	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-70.3	135.3	176.6	-169	-175.2	150.9	0	0	111.4	R92 A93 N161 I183 E184 L189	R92-E187 CarbonylContact C-O 3.55Å; R92-E187 WeakPolarHBondContact CA-O 3.24Å; R92-E187 VanDerWaalsContact CB-O 3.27Å; R92-E187 WeakPolarHBondContact CB-O 3.21Å; A93-E187 PolarHBondContact N-O 2.82Å; N161-E187 PolarHBondContact ND2-OE1 2.87Å; I183-E187 HydrophobicContact CG2-CB 3.81Å; I183-E187 HydrophobicContact CG2-CG 4.11Å; E184-E187 PolarHBondContact N-OE2 2.76Å; E184-E187 VanDerWaalsContact O-CB 3.29Å; E184-E187 WeakPolarHBondContact O-CB 3.29Å; E184-E187 PolarHBondContact O-N 3.19Å; E184-E187 VanDerWaalsContact O-N 3.09Å; E187-L189 PolarHBondContact O-N 2.96Å
188	E	97.1	Very high	83.2	Confident	46 Å²	46	50.6 Å²	50.6	22%	0.215	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-69	125	178.1	178.4	173.7	-175.3	0	0	111.1	F82 K87 I91 N155 N161	F82-E188 HydrophobicContact CE1-CB 4Å; F82-E188 HydrophobicContact CE1-CG 3.84Å; F82-E188 HydrophobicContact CZ-CB 3.82Å; F82-E188 HydrophobicContact CZ-CG 3.77Å; K87-E188 IonicContact NZ-OE1 3.74Å; K87-E188 PolarHBondContact NZ-OE1 3.3Å; K87-E188 IonicContact NZ-OE2 3.01Å; K87-E188 PolarHBondContact NZ-OE2 3.23Å; I91-E188 CarbonylContact O-C 3.48Å; I91-E188 WeakPolarHBondContact O-CA 3.36Å; N155-E188 WeakPolarHBondContact CB-OE1 3.1Å; N155-E188 PolarHBondContact ND2-OE1 2.9Å; N161-E188 PolarHBondContact ND2-O 2.9Å
189	L	96.9	Very high	81.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-72.5	132	171.8	-60.4	-163.9	0	0	0	110.1	L79 I91 A93 I97 I103 I154 N161 I183 E187	L79-L189 HydrophobicContact CD2-CD1 3.47Å; L79-L189 VanDerWaalsContact CD2-CD1 3.47Å; L79-L189 HydrophobicContact CD2-CG 4.41Å; I91-L189 HydrophobicContact CG2-CB 4.3Å; I91-L189 HydrophobicContact CG2-CD1 3.92Å; I91-L189 HydrophobicContact CG2-CG 4.09Å; I91-L189 PolarHBondContact O-N 3.14Å; A93-L189 HydrophobicContact CB-CD2 4.32Å; I97-L189 HydrophobicContact CD1-CD2 4.44Å; I103-L189 HydrophobicContact CD1-CD1 4.16Å; I103-L189 HydrophobicContact CG2-CD1 3.71Å; I154-L189 HydrophobicContact CD1-CD1 4.29Å; I154-L189 HydrophobicContact CG1-CB 4.31Å; I154-L189 HydrophobicContact CG2-CB 4.05Å; I154-L189 WeakPolarHBondContact CG2-O 3.14Å; N161-L189 WeakPolarHBondContact OD1-CA 3.31Å; I183-L189 HydrophobicContact CD1-CD2 3.66Å; I183-L189 HydrophobicContact CG2-CD2 3.83Å; E187-L189 PolarHBondContact O-N 2.96Å
190	S	95.4	Very high	79.3	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.07	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	144.1	179.2	58.4	0	0	0	0	113.3	N155 S157 P160 N161 C162	N155-S190 WeakPolarHBondContact O-CA 3.45Å; N155-S190 VanDerWaalsContact O-CB 3.26Å; N155-S190 WeakPolarHBondContact O-CB 3.22Å; S157-S190 WeakPolarHBondContact CB-OG 3.28Å; P160-S190 VanDerWaalsContact CB-O 3.25Å; P160-S190 WeakPolarHBondContact CB-O 3.45Å; N161-S190 PolarHBondContact N-O 3.01Å; N161-S190 PolarHBondContact OD1-N 3.24Å; N161-S190 PolarHBondContact OD1-O 3.41Å; C162-S190 WeakPolarHBondContact CB-O 3.28Å; C162-S190 PolarHBondContact N-O 3.18Å
191	F	92.3	Very high	77.3	Confident	14 Å²	14	58 Å²	58	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	163.2	173.7	60.4	-90.1	0	0	0	111.9	M134 I154 N155 H156 S157 C162 V164 I177 Y193	M134-F191 HydrophobicContact CE-CE2 3.9Å; M134-F191 HydrophobicContact CE-CZ 3.64Å; I154-F191 HydrophobicContact CB-CD1 4.38Å; I154-F191 HydrophobicContact CB-CE1 4.02Å; I154-F191 HydrophobicContact CG2-CD1 3.51Å; I154-F191 HydrophobicContact CG2-CE1 3.66Å; N155-F191 PolarHBondContact O-N 2.75Å; N155-F191 VanDerWaalsContact O-N 3.15Å; H156-F191 WeakPolarHBondContact CA-O 3.42Å; H156-F191 PolarHBondContact ND1-O 2.85Å; H156-F191 VanDerWaalsContact ND1-O 3.09Å; S157-F191 PolarHBondContact N-O 3.01Å; C162-F191 HydrophobicContact CB-CB 4.31Å; C162-F191 WeakPolarHBondContact O-CA 3.23Å; C162-F191 VanDerWaalsContact O-CB 3.26Å; C162-F191 WeakPolarHBondContact O-CB 3.35Å; V164-F191 HydrophobicContact CG2-CD1 4.26Å; V164-F191 HydrophobicContact CG2-CD2 3.62Å; V164-F191 HydrophobicContact CG2-CE1 4.3Å; V164-F191 HydrophobicContact CG2-CE2 3.65Å; V164-F191 HydrophobicContact CG2-CG 3.95Å; V164-F191 HydrophobicContact CG2-CZ 4.02Å; I177-F191 HydrophobicContact CD1-CD1 4.26Å; I177-F191 HydrophobicContact CD1-CE1 3.9Å; F191-Y193 AromaticContact CD2-CD1 3.8Å; F191-Y193 HydrophobicContact CD2-CD1 3.8Å; F191-Y193 HydrophobicContact CD2-CE1 4.35Å; F191-Y193 HydrophobicContact CE1-CE1 4.23Å; F191-Y193 AromaticContact CE2-CD1 3.45Å; F191-Y193 HydrophobicContact CE2-CD1 3.45Å; F191-Y193 VanDerWaalsContact CE2-CD1 3.45Å; F191-Y193 AromaticContact CE2-CE1 3.84Å; F191-Y193 HydrophobicContact CE2-CE1 3.84Å; F191-Y193 HydrophobicContact CG-CD1 4.5Å; F191-Y193 AromaticContact CZ-CD1 3.89Å; F191-Y193 HydrophobicContact CZ-CD1 3.89Å; F191-Y193 AromaticContact CZ-CE1 3.76Å; F191-Y193 HydrophobicContact CZ-CE1 3.76Å; F191-Y193 PolarHBondContact O-N 2.77Å
192	D	87.4	Confident	75.9	Confident	42 Å²	42	60 Å²	60	23%	0.225	32%	0.317	C	S	.	.			trans	-74.8	113.5	167.1	-172.8	3.1	0	0	0	109.1	H156 Q194 R213	H156-D192 IonicContact CE1-OD1 3.56Å; H156-D192 PolarHBondContact CE1-OD1 3.21Å; H156-D192 IonicContact ND1-OD1 3.27Å; D192-Q194 HydrophobicContact CB-CG 4.04Å; D192-Q194 VanDerWaalsContact CG-CG 3.48Å; D192-Q194 PolarHBondContact O-N 2.75Å; D192-Q194 PolarHBondContact OD1-N 2.85Å; D192-Q194 WeakPolarHBondContact OD2-CG 3.48Å; D192-R213 IonicContact OD1-CZ 2.86Å; D192-R213 VanDerWaalsContact OD1-CZ 3.32Å; D192-R213 IonicContact OD1-NH1 3.88Å; D192-R213 PolarHBondContact OD1-NH1 2.84Å; D192-R213 IonicContact OD1-NH2 2.92Å; D192-R213 PolarHBondContact OD1-NH2 3.49Å; D192-R213 IonicContact OD2-CZ 2.79Å; D192-R213 IonicContact OD2-NH1 2.7Å; D192-R213 PolarHBondContact OD2-NH1 2.71Å; D192-R213 IonicContact OD2-NH2 2.69Å
193	Y	84.2	Confident	74.9	Confident	60 Å²	60	60.1 Å²	60.1	24%	0.235	32%	0.316	C	S	.	.			trans	-62.9	-23.6	176	-74.6	2	0	0	0	112.5	I154 N155 H156 F191 F195	I154-Y193 PolarHBondContact O-OH 3.43Å; I154-Y193 VanDerWaalsContact O-OH 3.08Å; N155-Y193 VanDerWaalsContact C-CE1 3.5Å; N155-Y193 WeakPolarHBondContact CA-OH 3.37Å; H156-Y193 HydrophobicContact CB-CD1 3.92Å; H156-Y193 HydrophobicContact CB-CD2 3.71Å; H156-Y193 HydrophobicContact CB-CE1 4.04Å; H156-Y193 HydrophobicContact CB-CE2 3.85Å; H156-Y193 HydrophobicContact CB-CG 3.78Å; H156-Y193 PolarHBondContact ND1-N 2.93Å; F191-Y193 AromaticContact CD2-CD1 3.8Å; F191-Y193 HydrophobicContact CD2-CD1 3.8Å; F191-Y193 HydrophobicContact CD2-CE1 4.35Å; F191-Y193 HydrophobicContact CE1-CE1 4.23Å; F191-Y193 AromaticContact CE2-CD1 3.45Å; F191-Y193 HydrophobicContact CE2-CD1 3.45Å; F191-Y193 VanDerWaalsContact CE2-CD1 3.45Å; F191-Y193 AromaticContact CE2-CE1 3.84Å; F191-Y193 HydrophobicContact CE2-CE1 3.84Å; F191-Y193 HydrophobicContact CG-CD1 4.5Å; F191-Y193 AromaticContact CZ-CD1 3.89Å; F191-Y193 HydrophobicContact CZ-CD1 3.89Å; F191-Y193 AromaticContact CZ-CE1 3.76Å; F191-Y193 HydrophobicContact CZ-CE1 3.76Å; F191-Y193 PolarHBondContact O-N 2.77Å; Y193-F195 AromaticContact CD2-CD2 3.98Å; Y193-F195 HydrophobicContact CD2-CD2 3.98Å; Y193-F195 HydrophobicContact CD2-CE1 4.2Å; Y193-F195 AromaticContact CD2-CE2 3.37Å; Y193-F195 HydrophobicContact CD2-CE2 3.37Å; Y193-F195 AromaticContact CD2-CZ 3.49Å; Y193-F195 HydrophobicContact CD2-CZ 3.49Å; Y193-F195 VanDerWaalsContact CD2-CZ 3.49Å; Y193-F195 HydrophobicContact CE2-CE2 4.04Å; Y193-F195 HydrophobicContact CE2-CZ 4.03Å; Y193-F195 HydrophobicContact CG-CE2 4.3Å; Y193-F195 HydrophobicContact CG-CZ 4.23Å; Y193-F195 PolarHBondContact O-N 2.96Å
194	Q	69.7	Low	73.9	Confident	123 Å²	123	63.7 Å²	63.7	58%	0.575	34%	0.337	S	S	*	.			trans	53.8	19	-179.6	-62.5	-179.6	50.4	0	0	115.2	D192 D196	D192-Q194 HydrophobicContact CB-CG 4.04Å; D192-Q194 VanDerWaalsContact CG-CG 3.48Å; D192-Q194 PolarHBondContact O-N 2.75Å; D192-Q194 PolarHBondContact OD1-N 2.85Å; D192-Q194 WeakPolarHBondContact OD2-CG 3.48Å; Q194-D196 PolarHBondContact O-N 2.89Å
195	F	60.3	Low	73.3	Confident	30 Å²	30	59.8 Å²	59.8	13%	0.132	32%	0.32	C	S	.	.			trans	-46.9	127.8	-176.3	-74.7	-29.7	0	0	0	112.7	Y193 M200 L216 S218 S221	Y193-F195 AromaticContact CD2-CD2 3.98Å; Y193-F195 HydrophobicContact CD2-CD2 3.98Å; Y193-F195 HydrophobicContact CD2-CE1 4.2Å; Y193-F195 AromaticContact CD2-CE2 3.37Å; Y193-F195 HydrophobicContact CD2-CE2 3.37Å; Y193-F195 AromaticContact CD2-CZ 3.49Å; Y193-F195 HydrophobicContact CD2-CZ 3.49Å; Y193-F195 VanDerWaalsContact CD2-CZ 3.49Å; Y193-F195 HydrophobicContact CE2-CE2 4.04Å; Y193-F195 HydrophobicContact CE2-CZ 4.03Å; Y193-F195 HydrophobicContact CG-CE2 4.3Å; Y193-F195 HydrophobicContact CG-CZ 4.23Å; Y193-F195 PolarHBondContact O-N 2.96Å; F195-M200 HydrophobicContact CD2-SD 4.04Å; F195-M200 HydrophobicContact CE1-SD 4.43Å; F195-M200 HydrophobicContact CE2-CE 4.35Å; F195-M200 HydrophobicContact CE2-SD 3.41Å; F195-M200 WeakPolarHBondContact CE2-SD 3.42Å; F195-M200 HydrophobicContact CZ-SD 3.66Å; F195-L216 HydrophobicContact CD2-CB 4.07Å; F195-L216 HydrophobicContact CE2-CB 4.45Å; F195-L216 HydrophobicContact CE2-CD1 4.41Å; F195-S218 PolarHBondContact O-N 2.83Å; F195-S218 VanDerWaalsContact O-N 3.12Å; F195-S221 PolarHBondContact O-OG 2.88Å
196	D	50.6	Low	72.9	Confident	63 Å²	63	60.5 Å²	60.5	34%	0.337	31%	0.313	S	S	.	.			trans	-79.5	145.9	164.2	-94.3	-35.7	0	0	0	110.7	Q194 H198 E199 S221 K224	Q194-D196 PolarHBondContact O-N 2.89Å; D196-H198 PolarHBondContact O-N 3.42Å; D196-E199 PolarHBondContact O-N 3.34Å; D196-S221 WeakPolarHBondContact OD1-CB 3.29Å; D196-S221 PolarHBondContact OD1-OG 3.22Å; D196-K224 WeakPolarHBondContact OD1-CD 3.32Å; D196-K224 IonicContact OD1-NZ 3.78Å; D196-K224 PolarHBondContact OD1-NZ 3.02Å; D196-K224 IonicContact OD2-NZ 2.79Å; D196-K224 PolarHBondContact OD2-NZ 2.97Å
197	V	41.5	Very low	72.5	Confident	42 Å²	42	59.6 Å²	59.6	26%	0.255	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-11	-168.8	159.2	0	0	0	0	113.8	A217	V197-A217 HydrophobicContact CG2-CB 3.81Å
198	H	43.7	Very low	71.9	Confident	120 Å²	120	60.1 Å²	60.1	56%	0.556	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.2	-174.6	-61.1	73.5	0	0	0	115	D196 R228	D196-H198 PolarHBondContact O-N 3.42Å; H198-R228 PolarHBondContact NE2-NH1 2.94Å
199	E	47.9	Very low	71.5	Confident	90 Å²	90	59 Å²	59	42%	0.421	32%	0.321	S	S	.	.	S	Bend	trans	-100.9	-19.5	-170.2	-64.4	-175.7	160.1	0	0	114.8	D196	D196-E199 PolarHBondContact O-N 3.34Å
200	M	46	Very low	71	Confident	40 Å²	40	64.6 Å²	64.6	20%	0.197	37%	0.368	C	S	.	.	S	Bend	trans	-145.9	142.9	-175.4	-65.9	-179.1	66.2	0	0	112	F195 Q203	F195-M200 HydrophobicContact CD2-SD 4.04Å; F195-M200 HydrophobicContact CE1-SD 4.43Å; F195-M200 HydrophobicContact CE2-CE 4.35Å; F195-M200 HydrophobicContact CE2-SD 3.41Å; F195-M200 WeakPolarHBondContact CE2-SD 3.42Å; F195-M200 HydrophobicContact CZ-SD 3.66Å; M200-Q203 HydrophobicContact CE-CG 4.19Å; M200-Q203 VanDerWaalsContact CE-NE2 3.27Å
201	S	47.8	Very low	70.4	Confident	100 Å²	100	68.6 Å²	68.6	70%	0.699	39%	0.388	S	S	*	.			trans	-56.3	152.3	163.5	55.1	0	0	0	0	110.4	Q203	S201-Q203 VanDerWaalsContact C-N 3.31Å; S201-Q203 PolarHBondContact O-N 3.13Å
202	M	58.2	Low	69.9	Low	123 Å²	123	70.2 Å²	70.2	61%	0.606	40%	0.4	S	S	*	.			trans	-64.8	82.7	-171.4	-63.5	-173.1	-167.6	0	0	112.8	V215 L222	M202-V215 HydrophobicContact CB-CG1 4.32Å; M202-L222 HydrophobicContact CE-CD2 4.07Å; M202-L222 HydrophobicContact SD-CD2 4.19Å
203	Q	69.9	Low	69.6	Low	68 Å²	68	70.4 Å²	70.4	32%	0.318	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-72.7	130.7	176.3	-69	-169.5	0.6	0	0	110.3	K129 M200 S201 V215 L216	K129-Q203 PolarHBondContact O-NE2 3.06Å; M200-Q203 HydrophobicContact CE-CG 4.19Å; M200-Q203 VanDerWaalsContact CE-NE2 3.27Å; S201-Q203 VanDerWaalsContact C-N 3.31Å; S201-Q203 PolarHBondContact O-N 3.13Å; Q203-V215 CarbonylContact O-C 3.5Å; Q203-V215 VanDerWaalsContact O-CA 3.25Å; Q203-V215 WeakPolarHBondContact O-CA 3.26Å; Q203-V215 WeakPolarHBondContact O-CB 3.13Å; Q203-L216 HydrophobicContact CB-CD1 3.82Å; Q203-L216 HydrophobicContact CB-CG 4.08Å; Q203-L216 PolarHBondContact O-N 3Å
204	V	75.6	Confident	69.2	Low	74 Å²	74	69.4 Å²	69.4	45%	0.448	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-65.6	134.6	178.8	179.6	0	0	0	0	110.2	Y206 G214	V204-Y206 HydrophobicContact CB-CE1 4.19Å; V204-Y206 HydrophobicContact CB-CE2 4.21Å; V204-Y206 HydrophobicContact CG1-CD1 4.15Å; V204-Y206 HydrophobicContact CG1-CE1 3.56Å; V204-Y206 HydrophobicContact CG1-CE2 4.43Å; V204-G214 WeakPolarHBondContact CA-O 3.27Å
205	C	84	Confident	69.6	Low	10 Å²	10	64.6 Å²	64.6	7%	0.068	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-84	118	178.1	-175.2	0	0	0	0	111.2	H156 C207 G214 L216	H156-C205 VanDerWaalsContact CD2-SG 3.58Å; C205-C207 PolarHBondContact SG-SG 3.44Å; C205-G214 PolarHBondContact N-O 2.74Å; C205-L216 HydrophobicContact CB-CD2 4.03Å
206	Y	88.6	Confident	70.2	Confident	110 Å²	110	64.4 Å²	64.4	43%	0.431	39%	0.385	S	S	.	.			trans	-104.8	34.2	176.8	-57.5	-61.6	0	0	0	112.7	K86 K87 V204	K86-Y206 HydrophobicContact CB-CD1 4.24Å; K86-Y206 HydrophobicContact CB-CD2 3.57Å; K86-Y206 HydrophobicContact CB-CE2 3.95Å; K86-Y206 HydrophobicContact CB-CG 3.73Å; K86-Y206 HydrophobicContact CD-CD1 3.89Å; K86-Y206 HydrophobicContact CD-CD2 4.49Å; K86-Y206 HydrophobicContact CD-CE1 3.74Å; K86-Y206 HydrophobicContact CD-CE2 4.36Å; K86-Y206 HydrophobicContact CD-CG 4.26Å; K87-Y206 WeakPolarHBondContact CD-O 3.45Å; K87-Y206 WeakPolarHBondContact CE-O 3.21Å; V204-Y206 HydrophobicContact CB-CE1 4.19Å; V204-Y206 HydrophobicContact CB-CE2 4.21Å; V204-Y206 HydrophobicContact CG1-CD1 4.15Å; V204-Y206 HydrophobicContact CG1-CE1 3.56Å; V204-Y206 HydrophobicContact CG1-CE2 4.43Å
207	C	87.8	Confident	70.7	Confident	23 Å²	23	61.9 Å²	61.9	16%	0.155	37%	0.374	C	S	.	.			trans	-73.3	-25.3	179.9	70.8	0	0	0	0	114.3	C205 A209 C212	C205-C207 PolarHBondContact SG-SG 3.44Å; C207-A209 PolarHBondContact O-N 2.82Å; C207-C212 VanDerWaalsContact SG-SG 3.7Å
208	G	86.2	Confident	71.2	Confident	75 Å²	75	60.5 Å²	60.5	77%	0.773	37%	0.366	S	S	*	.			trans	77.1	-4.9	-179.8	0	0	0	0	0	115.8
209	A	88.6	Confident	71.1	Confident	22 Å²	22	57.6 Å²	57.6	18%	0.182	36%	0.356	C	S	.	.			trans	-63.7	144.2	178.6	0	0	0	0	0	112.4	D159 C207 N211 C212	D159-A209 HydrophobicContact CB-CB 3.77Å; C207-A209 PolarHBondContact O-N 2.82Å; A209-N211 VanDerWaalsContact CB-OD1 3.26Å; A209-N211 WeakPolarHBondContact CB-OD1 3.48Å; A209-N211 PolarHBondContact O-N 2.8Å; A209-N211 VanDerWaalsContact O-N 3.13Å; A209-C212 WeakPolarHBondContact O-CB 3.39Å; A209-C212 PolarHBondContact O-N 3.16Å
210	A	85.3	Confident	70.7	Confident	118 Å²	118	62.4 Å²	62.4	98%	0.975	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.7	-178.8	0	0	0	0	0	113.9
211	N	83.4	Confident	70.2	Confident	93 Å²	93	60.7 Å²	60.7	50%	0.497	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	17.7	175.5	70.1	-9	0	0	0	113.2	C158 A209 R213	C158-N211 WeakPolarHBondContact CB-OD1 3.49Å; C158-N211 PolarHBondContact O-ND2 2.89Å; C158-N211 PolarHBondContact O-OD1 3.11Å; A209-N211 VanDerWaalsContact CB-OD1 3.26Å; A209-N211 WeakPolarHBondContact CB-OD1 3.48Å; A209-N211 PolarHBondContact O-N 2.8Å; A209-N211 VanDerWaalsContact O-N 3.13Å; N211-R213 PolarHBondContact O-N 3.01Å
212	C	82.3	Confident	69.6	Low	48 Å²	48	58.5 Å²	58.5	32%	0.324	34%	0.342	S	S	.	.			trans	-56.2	131.9	-172.3	-177.5	0	0	0	0	113.1	C207 A209 G214	C207-C212 VanDerWaalsContact SG-SG 3.7Å; A209-C212 WeakPolarHBondContact O-CB 3.39Å; A209-C212 PolarHBondContact O-N 3.16Å; C212-G214 PolarHBondContact O-N 3.14Å; C212-G214 PolarHBondContact SG-N 3.28Å; C212-G214 VanDerWaalsContact SG-N 3.44Å
213	R	79.3	Confident	68.3	Low	46 Å²	46	56.9 Å²	56.9	17%	0.174	34%	0.336	C	S	.	.			trans	-74.2	-0.9	179.8	-62.2	-167.9	-57.8	-134.4	7.1	114.8	H156 C158 D192 N211 V215 L216 V219	H156-R213 PolarHBondContact CE1-NH2 2.91Å; H156-R213 VanDerWaalsContact CE1-NH2 3.26Å; H156-R213 PolarHBondContact NE2-NH2 2.74Å; C158-R213 HydrophobicContact CB-CG 4.42Å; C158-R213 PolarHBondContact SG-N 3.15Å; C158-R213 VanDerWaalsContact SG-N 3.36Å; D192-R213 IonicContact OD1-CZ 2.86Å; D192-R213 VanDerWaalsContact OD1-CZ 3.32Å; D192-R213 IonicContact OD1-NH1 3.88Å; D192-R213 PolarHBondContact OD1-NH1 2.84Å; D192-R213 IonicContact OD1-NH2 2.92Å; D192-R213 PolarHBondContact OD1-NH2 3.49Å; D192-R213 IonicContact OD2-CZ 2.79Å; D192-R213 IonicContact OD2-NH1 2.7Å; D192-R213 PolarHBondContact OD2-NH1 2.71Å; D192-R213 IonicContact OD2-NH2 2.69Å; N211-R213 PolarHBondContact O-N 3.01Å; R213-V215 PolarHBondContact O-N 2.81Å; R213-L216 PolarHBondContact NH2-O 2.84Å; R213-V219 HydrophobicContact CB-CG2 3.74Å; R213-V219 HydrophobicContact CG-CG2 3.87Å
214	G	77	Confident	66.5	Low	40 Å²	40	55.7 Å²	55.7	41%	0.412	33%	0.33	S	S	.	.	S	Bend	trans	73.1	-34.1	-174.5	0	0	0	0	0	114.8	V204 C205 C212	V204-G214 WeakPolarHBondContact CA-O 3.27Å; C205-G214 PolarHBondContact N-O 2.74Å; C212-G214 PolarHBondContact O-N 3.14Å; C212-G214 PolarHBondContact SG-N 3.28Å; C212-G214 VanDerWaalsContact SG-N 3.44Å
215	V	77.8	Confident	64.4	Low	22 Å²	22	56 Å²	56	13%	0.133	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-127.6	158.9	176.8	-65.2	0	0	0	0	111.9	M202 Q203 R213 A217 L222	M202-V215 HydrophobicContact CB-CG1 4.32Å; Q203-V215 CarbonylContact O-C 3.5Å; Q203-V215 VanDerWaalsContact O-CA 3.25Å; Q203-V215 WeakPolarHBondContact O-CA 3.26Å; Q203-V215 WeakPolarHBondContact O-CB 3.13Å; R213-V215 PolarHBondContact O-N 2.81Å; V215-A217 HydrophobicContact CG2-CB 4.32Å; V215-L222 HydrophobicContact CG2-CD1 3.83Å; V215-L222 HydrophobicContact CG2-CG 4.36Å
216	L	72	Confident	62	Low	25 Å²	25	64.3 Å²	64.3	13%	0.131	37%	0.374	C	S	.	.	S	Bend	trans	-66.8	-37.3	178.6	-61	-174.2	0	0	0	112.2	H156 F195 Q203 C205 R213	H156-L216 HydrophobicContact CB-CD2 4Å; F195-L216 HydrophobicContact CD2-CB 4.07Å; F195-L216 HydrophobicContact CE2-CB 4.45Å; F195-L216 HydrophobicContact CE2-CD1 4.41Å; Q203-L216 HydrophobicContact CB-CD1 3.82Å; Q203-L216 HydrophobicContact CB-CG 4.08Å; Q203-L216 PolarHBondContact O-N 3Å; C205-L216 HydrophobicContact CB-CD2 4.03Å; R213-L216 PolarHBondContact NH2-O 2.84Å
217	A	61.4	Low	59.2	Low	11 Å²	11	65.9 Å²	65.9	9%	0.091	39%	0.385	C	S	.	.	S	Bend	trans	-57.3	147.6	172.1	0	0	0	0	0	111.1	V197 V215	V197-A217 HydrophobicContact CG2-CB 3.81Å; V215-A217 HydrophobicContact CG2-CB 4.32Å
218	S	52.9	Low	56.4	Low	13 Å²	13	69.2 Å²	69.2	9%	0.091	39%	0.394	C	S	.	.			trans	-66.1	147.3	179.1	-164.1	0	0	0	0	111.2	F195 R220 S221 L222	F195-S218 PolarHBondContact O-N 2.83Å; F195-S218 VanDerWaalsContact O-N 3.12Å; S218-R220 PolarHBondContact O-N 3.41Å; S218-R220 PolarHBondContact OG-N 3.15Å; S218-S221 CarbonylContact O-C 3.55Å; S218-S221 VanDerWaalsContact O-CA 3.26Å; S218-S221 WeakPolarHBondContact O-CA 3.35Å; S218-S221 VanDerWaalsContact O-CB 3.3Å; S218-S221 WeakPolarHBondContact O-CB 3.23Å; S218-S221 PolarHBondContact O-N 2.93Å; S218-L222 PolarHBondContact O-N 2.82Å
219	V	42.2	Very low	53.7	Low	58 Å²	58	69.2 Å²	69.2	35%	0.352	38%	0.381	S	S	.	.	H	α-helix	trans	-66.5	-24.8	166	-176.7	0	0	0	0	110.3	R213 S221 L222 N223	R213-V219 HydrophobicContact CB-CG2 3.74Å; R213-V219 HydrophobicContact CG-CG2 3.87Å; V219-S221 PolarHBondContact O-N 3.48Å; V219-L222 PolarHBondContact O-N 3.14Å; V219-N223 WeakPolarHBondContact O-CB 3.28Å; V219-N223 PolarHBondContact O-N 2.87Å
220	R	39.1	Very low	51	Low	192 Å²	192	71.4 Å²	71.4	73%	0.725	39%	0.391	S	S	*	.	H	α-helix	trans	-54.8	-40.8	163	-67.4	-176.8	-178.6	157.4	2.8	110.2	S218 N223 K224	S218-R220 PolarHBondContact O-N 3.41Å; S218-R220 PolarHBondContact OG-N 3.15Å; R220-N223 CarbonylContact O-C 3.55Å; R220-N223 PolarHBondContact O-N 2.85Å; R220-K224 WeakPolarHBondContact O-CB 3.13Å; R220-K224 WeakPolarHBondContact O-CG 3.12Å; R220-K224 PolarHBondContact O-N 3.08Å
221	S	35.3	Very low	48.5	Very low	4 Å²	4	69.6 Å²	69.6	3%	0.028	37%	0.368	C	S	.	.	H	α-helix	trans	-78.5	-30.8	-178.5	-49.1	0	0	0	0	113.4	F195 D196 S218 V219 K224 S225	F195-S221 PolarHBondContact O-OG 2.88Å; D196-S221 WeakPolarHBondContact OD1-CB 3.29Å; D196-S221 PolarHBondContact OD1-OG 3.22Å; S218-S221 CarbonylContact O-C 3.55Å; S218-S221 VanDerWaalsContact O-CA 3.26Å; S218-S221 WeakPolarHBondContact O-CA 3.35Å; S218-S221 VanDerWaalsContact O-CB 3.3Å; S218-S221 WeakPolarHBondContact O-CB 3.23Å; S218-S221 PolarHBondContact O-N 2.93Å; V219-S221 PolarHBondContact O-N 3.48Å; S221-K224 PolarHBondContact O-N 3.04Å; S221-S225 PolarHBondContact O-N 3.21Å
222	L	35.3	Very low	46.1	Very low	53 Å²	53	65.8 Å²	65.8	28%	0.277	35%	0.349	S	S	.	.	H	α-helix	trans	-64.6	-41.2	166.2	-68.7	176.8	0	0	0	111.9	M202 V215 S218 V219 S225	M202-L222 HydrophobicContact CE-CD2 4.07Å; M202-L222 HydrophobicContact SD-CD2 4.19Å; V215-L222 HydrophobicContact CG2-CD1 3.83Å; V215-L222 HydrophobicContact CG2-CG 4.36Å; S218-L222 PolarHBondContact O-N 2.82Å; V219-L222 PolarHBondContact O-N 3.14Å; L222-S225 WeakPolarHBondContact O-CB 3.45Å; L222-S225 PolarHBondContact O-N 3.32Å; L222-S225 PolarHBondContact O-OG 3.38Å
223	N	30.5	Very low	43.9	Very low	89 Å²	89	69 Å²	69	48%	0.476	36%	0.359	S	S	.	.	H	α-helix	trans	-74.8	-29.2	173.7	-67.3	10	0	0	0	111.8	V219 R220 S225 Q226 E227	V219-N223 WeakPolarHBondContact O-CB 3.28Å; V219-N223 PolarHBondContact O-N 2.87Å; R220-N223 CarbonylContact O-C 3.55Å; R220-N223 PolarHBondContact O-N 2.85Å; N223-S225 PolarHBondContact O-N 3.34Å; N223-S225 VanDerWaalsContact O-N 3.17Å; N223-Q226 CarbonylContact O-C 3.37Å; N223-Q226 WeakPolarHBondContact O-CA 3.35Å; N223-Q226 PolarHBondContact O-N 2.83Å; N223-E227 PolarHBondContact O-N 2.85Å
224	K	31.2	Very low	42	Very low	43 Å²	43	67.5 Å²	67.5	19%	0.187	36%	0.355	C	S	.	.	H	α-helix	trans	-61.8	-17.1	168.4	-75.5	175.5	-176.5	-179	0	112.7	D196 R220 S221 Q226 E227 R228 P229	D196-K224 WeakPolarHBondContact OD1-CD 3.32Å; D196-K224 IonicContact OD1-NZ 3.78Å; D196-K224 PolarHBondContact OD1-NZ 3.02Å; D196-K224 IonicContact OD2-NZ 2.79Å; D196-K224 PolarHBondContact OD2-NZ 2.97Å; R220-K224 WeakPolarHBondContact O-CB 3.13Å; R220-K224 WeakPolarHBondContact O-CG 3.12Å; R220-K224 PolarHBondContact O-N 3.08Å; S221-K224 PolarHBondContact O-N 3.04Å; K224-Q226 PolarHBondContact O-N 3.5Å; K224-Q226 VanDerWaalsContact O-N 3.11Å; K224-E227 PolarHBondContact O-N 3Å; K224-R228 WeakPolarHBondContact O-CG 3.5Å; K224-R228 PolarHBondContact O-N 2.86Å; K224-R228 VanDerWaalsContact O-N 3.1Å; K224-P229 HydrophobicContact CD-CG 4.36Å
225	S	31.7	Very low	40.2	Very low	80 Å²	80	68.8 Å²	68.8	56%	0.559	36%	0.356	S	S	*	.	H	α-helix	trans	-55.2	-24.2	165.4	-44	0	0	0	0	111.7	S221 L222 N223	S221-S225 PolarHBondContact O-N 3.21Å; L222-S225 WeakPolarHBondContact O-CB 3.45Å; L222-S225 PolarHBondContact O-N 3.32Å; L222-S225 PolarHBondContact O-OG 3.38Å; N223-S225 PolarHBondContact O-N 3.34Å; N223-S225 VanDerWaalsContact O-N 3.17Å
226	Q	34.4	Very low	38.6	Very low	186 Å²	186	71.7 Å²	71.7	87%	0.869	38%	0.382	S	S	*	.	H	α-helix	trans	-112.5	-24.2	172.4	-59.7	179.9	-11.4	0	0	112.3	N223 K224	N223-Q226 CarbonylContact O-C 3.37Å; N223-Q226 WeakPolarHBondContact O-CA 3.35Å; N223-Q226 PolarHBondContact O-N 2.83Å; K224-Q226 PolarHBondContact O-N 3.5Å; K224-Q226 VanDerWaalsContact O-N 3.11Å
227	E	30.3	Very low	37.8	Very low	142 Å²	142	71.8 Å²	71.8	66%	0.664	38%	0.382	S	S	*	.	H	α-helix	trans	-123.7	45.5	-172.3	-57.4	-170.5	128.7	0	0	115.6	N223 K224 P229	N223-E227 PolarHBondContact O-N 2.85Å; K224-E227 PolarHBondContact O-N 3Å; E227-P229 VanDerWaalsContact O-CD 3.31Å; E227-P229 WeakPolarHBondContact O-CD 3.35Å
228	R	28	Very low	37.7	Very low	93 Å²	93	79.6 Å²	79.6	35%	0.351	41%	0.409	S	S	.	.			trans	-58.7	129.4	-178.9	-53.6	-171.3	-144.1	-136.6	28.3	113.7	H198 K224 Q233	H198-R228 PolarHBondContact NE2-NH1 2.94Å; K224-R228 WeakPolarHBondContact O-CG 3.5Å; K224-R228 PolarHBondContact O-N 2.86Å; K224-R228 VanDerWaalsContact O-N 3.1Å; R228-Q233 WeakPolarHBondContact CD-O 3.41Å; R228-Q233 PolarHBondContact NE-O 3.17Å; R228-Q233 PolarHBondContact NH2-O 2.96Å
229	P	28.9	Very low	38.5	Very low	76 Å²	76	88.6 Å²	88.6	49%	0.494	44%	0.441	S	S	.	.			trans	-96.3	117.8	159.1	34.4	-29.6	0	0	0	111.4	K224 E227	K224-P229 HydrophobicContact CD-CG 4.36Å; E227-P229 VanDerWaalsContact O-CD 3.31Å; E227-P229 WeakPolarHBondContact O-CD 3.35Å
230	V	33.2	Very low	40.2	Very low	67 Å²	67	86.4 Å²	86.4	41%	0.406	43%	0.427	S	S	.	.	S	Bend	trans	35.8	105.6	139.2	-162.7	0	0	0	0	116.8	I304	V230-I304 HydrophobicContact CB-CD1 3.8Å; V230-I304 HydrophobicContact CG1-CD1 3.51Å; V230-I304 HydrophobicContact CG1-CG1 4.05Å; V230-I304 HydrophobicContact CG2-CD1 3.4Å
231	V	31.8	Very low	42.3	Very low	81 Å²	81	81.1 Å²	81.1	49%	0.491	41%	0.413	S	S	.	.	S	Bend	cis	-78.4	125.1	11.2	176.4	0	0	0	0	111.5	Q233	V231-Q233 PolarHBondContact O-N 3.13Å
232	A	33	Very low	44.8	Very low	12 Å²	12	83.8 Å²	83.8	10%	0.099	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-69.1	135.6	174.4	0	0	0	0	0	109.8	L234 I304 H308	A232-L234 HydrophobicContact CB-CD2 4.06Å; A232-L234 HydrophobicContact CB-CG 4.15Å; A232-I304 HydrophobicContact CB-CG2 3.61Å; A232-H308 PolarHBondContact O-CE1 2.79Å; A232-H308 PolarHBondContact O-NE2 3.31Å; A232-H308 VanDerWaalsContact O-NE2 3.16Å
233	Q	36.4	Very low	47.3	Very low	115 Å²	115	88.9 Å²	88.9	54%	0.537	46%	0.456	S	S	.	.	P	Polyproline II helix		-79.1	116.2	119.5	-68.1	167.9	-10.8	0	0	104.9	R228 V231	R228-Q233 WeakPolarHBondContact CD-O 3.41Å; R228-Q233 PolarHBondContact NE-O 3.17Å; R228-Q233 PolarHBondContact NH2-O 2.96Å; V231-Q233 PolarHBondContact O-N 3.13Å
234	L	40.4	Very low	50.1	Low	15 Å²	15	85.9 Å²	85.9	8%	0.079	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-59	159.9	162.5	-63.6	167.2	0	0	0	107.9	A232 A236 F237 R271 I305 H308	A232-L234 HydrophobicContact CB-CD2 4.06Å; A232-L234 HydrophobicContact CB-CG 4.15Å; L234-A236 PolarHBondContact O-N 3.37Å; L234-F237 HydrophobicContact CD1-CE1 4.17Å; L234-F237 HydrophobicContact CD1-CZ 3.89Å; L234-R271 HydrophobicContact CD2-CG 4.23Å; L234-I305 HydrophobicContact CD1-CB 4.42Å; L234-I305 HydrophobicContact CD1-CG1 3.84Å; L234-I305 HydrophobicContact CD1-CG2 4.49Å; L234-I305 HydrophobicContact CD2-CG1 3.9Å; L234-H308 HydrophobicContact CD1-CB 4.01Å
235	P	38	Very low	52.9	Low	68 Å²	68	87.9 Å²	87.9	44%	0.442	45%	0.449	S	S	.	.	S	Bend	trans	-51.1	129.2	154.8	-16.6	30.5	0	0	0	106.2	F237	P235-F237 PolarHBondContact O-N 2.97Å
236	A	44.5	Very low	55.8	Low	82 Å²	82	90.3 Å²	90.3	68%	0.678	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-46.6	136.2	179.2	0	0	0	0	0	109.1	L234 R238	L234-A236 PolarHBondContact O-N 3.37Å; A236-R238 VanDerWaalsContact O-CG 3.31Å; A236-R238 WeakPolarHBondContact O-CG 3.41Å; A236-R238 PolarHBondContact O-N 2.88Å
237	F	55.5	Low	58.5	Low	27 Å²	27	83.6 Å²	83.6	12%	0.118	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-50.3	138.7	-174.2	-67.6	-74.7	0	0	0	109.7	L234 P235 M270 R271 E274 H308 W309 D312 I314	L234-F237 HydrophobicContact CD1-CE1 4.17Å; L234-F237 HydrophobicContact CD1-CZ 3.89Å; P235-F237 PolarHBondContact O-N 2.97Å; F237-M270 WeakPolarHBondContact CE1-O 3.31Å; F237-R271 WeakPolarHBondContact CD1-O 3.5Å; F237-E274 HydrophobicContact CB-CG 3.87Å; F237-H308 HydrophobicContact CE2-CB 4.31Å; F237-H308 HydrophobicContact CZ-CB 4.03Å; F237-W309 AromaticContact CE1-NE1 3.76Å; F237-W309 AromaticContact CZ-CD1 3.73Å; F237-W309 AromaticContact CZ-NE1 3.84Å; F237-D312 WeakPolarHBondContact CD2-OD2 3.19Å; F237-D312 HydrophobicContact CE2-CB 4.35Å; F237-D312 WeakPolarHBondContact CE2-OD2 3.29Å; F237-I314 HydrophobicContact CD2-CD1 4.38Å
238	R	59.3	Low	61.5	Low	175 Å²	175	77.2 Å²	77.2	66%	0.66	39%	0.392	S	S	*	.			trans	-128.8	141.3	-179.2	-57.8	-172.2	-179.9	-179.5	-3.1	107.3	A236 L240 H272 E274	A236-R238 VanDerWaalsContact O-CG 3.31Å; A236-R238 WeakPolarHBondContact O-CG 3.41Å; A236-R238 PolarHBondContact O-N 2.88Å; R238-L240 PolarHBondContact O-N 2.82Å; R238-H272 CarbonylContact O-C 3.32Å; R238-E274 WeakPolarHBondContact CA-OE1 3.43Å
239	R	68.6	Low	64.7	Low	203 Å²	203	78.3 Å²	78.3	77%	0.766	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-46	137.1	168.8	-61.5	-172.5	-179.9	-176.1	-2.3	110.8	N241 E274	R239-N241 PolarHBondContact O-N 2.91Å; R239-E274 WeakPolarHBondContact CG-OE2 3.42Å; R239-E274 VanDerWaalsContact N-CD 3.26Å; R239-E274 PolarHBondContact N-OE1 3.3Å; R239-E274 IonicContact NE-OE2 3.41Å; R239-E274 PolarHBondContact NE-OE2 3.17Å
240	L	78.8	Confident	67.8	Low	12 Å²	12	78.3 Å²	78.3	6%	0.063	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-54	139.8	171.8	-61.4	178.9	0	0	0	109.4	R238 D244 E245 L248 L269 H272 Q278	R238-L240 PolarHBondContact O-N 2.82Å; L240-D244 HydrophobicContact CB-CB 4.19Å; L240-D244 HydrophobicContact CD2-CB 3.96Å; L240-E245 HydrophobicContact CB-CG 3.67Å; L240-E245 HydrophobicContact CD1-CG 4.41Å; L240-L248 HydrophobicContact CD1-CB 4.43Å; L240-L248 HydrophobicContact CD1-CD2 3.75Å; L240-L269 HydrophobicContact CD2-CD2 4.15Å; L240-H272 HydrophobicContact CD2-CB 3.82Å; L240-H272 WeakPolarHBondContact CD2-O 3.33Å; L240-Q278 VanDerWaalsContact CD1-OE1 3.23Å
241	N	84.1	Confident	70.7	Confident	80 Å²	80	75.1 Å²	75.1	43%	0.428	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-85.2	162.2	168.6	61	79.6	0	0	0	109.5	R239 K243 D244 E245	R239-N241 PolarHBondContact O-N 2.91Å; N241-K243 PolarHBondContact O-N 2.88Å; N241-K243 WeakPolarHBondContact OD1-CB 3.15Å; N241-K243 PolarHBondContact OD1-N 3.19Å; N241-D244 VanDerWaalsContact ND2-CG 3.34Å; N241-D244 PolarHBondContact ND2-OD2 3.23Å; N241-D244 WeakPolarHBondContact O-CA 3.04Å; N241-D244 PolarHBondContact O-N 2.89Å; N241-D244 PolarHBondContact OD1-N 2.86Å; N241-E245 PolarHBondContact O-N 2.87Å
242	A	86.8	Confident	73.7	Confident	61 Å²	61	74.2 Å²	74.2	50%	0.504	38%	0.375	S	S	.	.	H	α-helix	trans	-54.6	-24.1	-175	0	0	0	0	0	115.5	Q246	A242-Q246 WeakPolarHBondContact O-CB 3.4Å; A242-Q246 WeakPolarHBondContact O-CG 3.43Å; A242-Q246 PolarHBondContact O-N 2.84Å
243	K	88	Confident	76.6	Confident	160 Å²	160	82.8 Å²	82.8	70%	0.696	41%	0.411	S	S	*	.	H	α-helix	trans	-77.1	-41	174	-180	-168.6	173.9	-169.7	0	111.6	N241 Q246 L247	N241-K243 PolarHBondContact O-N 2.88Å; N241-K243 WeakPolarHBondContact OD1-CB 3.15Å; N241-K243 PolarHBondContact OD1-N 3.19Å; K243-Q246 PolarHBondContact O-N 2.77Å; K243-L247 PolarHBondContact O-N 3.11Å
244	D	89.4	Confident	79.3	Confident	26 Å²	26	80.3 Å²	80.3	14%	0.139	40%	0.398	C	S	.	.	H	α-helix	trans	-71.6	-34.2	177	-68.9	-12.8	0	0	0	111.2	L240 N241 L247 L248 L269 H272	L240-D244 HydrophobicContact CB-CB 4.19Å; L240-D244 HydrophobicContact CD2-CB 3.96Å; N241-D244 VanDerWaalsContact ND2-CG 3.34Å; N241-D244 PolarHBondContact ND2-OD2 3.23Å; N241-D244 WeakPolarHBondContact O-CA 3.04Å; N241-D244 PolarHBondContact O-N 2.89Å; N241-D244 PolarHBondContact OD1-N 2.86Å; D244-L247 WeakPolarHBondContact O-CB 3.35Å; D244-L247 PolarHBondContact O-N 3.15Å; D244-L248 PolarHBondContact O-N 3.01Å; D244-L269 HydrophobicContact CB-CD2 3.67Å; D244-L269 WeakPolarHBondContact O-CD2 3.49Å; D244-H272 IonicContact OD2-ND1 3.53Å; D244-H272 PolarHBondContact OD2-ND1 3.48Å
245	E	89.7	Confident	81.7	Confident	85 Å²	85	81.5 Å²	81.5	40%	0.397	41%	0.414	S	S	.	.	H	α-helix	trans	-62.7	-44.7	169.7	-66.2	-179.3	138	0	0	112.2	L240 N241 L247 L248 L249	L240-E245 HydrophobicContact CB-CG 3.67Å; L240-E245 HydrophobicContact CD1-CG 4.41Å; N241-E245 PolarHBondContact O-N 2.87Å; E245-L247 VanDerWaalsContact C-N 3.28Å; E245-L247 PolarHBondContact O-N 2.8Å; E245-L248 PolarHBondContact O-N 3.4Å; E245-L249 WeakPolarHBondContact O-CG 3.32Å; E245-L249 PolarHBondContact O-N 2.78Å
246	Q	92.4	Very high	84.4	Confident	130 Å²	130	79.5 Å²	79.5	61%	0.607	40%	0.402	S	S	*	.	H	α-helix	trans	-62.2	-35.5	173.9	-76	171	22.1	0	0	112.2	A242 K243 T250	A242-Q246 WeakPolarHBondContact O-CB 3.4Å; A242-Q246 WeakPolarHBondContact O-CG 3.43Å; A242-Q246 PolarHBondContact O-N 2.84Å; K243-Q246 PolarHBondContact O-N 2.77Å; Q246-T250 VanDerWaalsContact O-CB 3.32Å; Q246-T250 WeakPolarHBondContact O-CB 3.45Å; Q246-T250 PolarHBondContact O-N 2.81Å; Q246-T250 PolarHBondContact O-OG1 3.26Å
247	L	92.5	Very high	86.7	Confident	45 Å²	45	75.8 Å²	75.8	24%	0.236	37%	0.37	C	S	.	.	H	α-helix	trans	-68.1	-44.1	174.4	-178.7	59.6	0	0	0	111.5	K243 D244 E245 T250 L251 Q265 L269	K243-L247 PolarHBondContact O-N 3.11Å; D244-L247 WeakPolarHBondContact O-CB 3.35Å; D244-L247 PolarHBondContact O-N 3.15Å; E245-L247 VanDerWaalsContact C-N 3.28Å; E245-L247 PolarHBondContact O-N 2.8Å; L247-T250 WeakPolarHBondContact O-CB 3.49Å; L247-T250 PolarHBondContact O-N 2.84Å; L247-L251 WeakPolarHBondContact O-CG 3.43Å; L247-L251 PolarHBondContact O-N 3.08Å; L247-Q265 HydrophobicContact CD1-CB 4.46Å; L247-Q265 HydrophobicContact CD1-CG 4.42Å; L247-Q265 HydrophobicContact CD2-CB 4.2Å; L247-Q265 HydrophobicContact CD2-CG 4.31Å; L247-L269 HydrophobicContact CB-CD2 4.4Å; L247-L269 HydrophobicContact CD2-CD1 4.47Å; L247-L269 HydrophobicContact CD2-CD2 4.16Å; L247-L269 HydrophobicContact CD2-CG 4.26Å; L247-L269 HydrophobicContact CG-CD1 4.19Å; L247-L269 HydrophobicContact CG-CD2 4.42Å; L247-L269 HydrophobicContact CG-CG 4.49Å
248	L	93.1	Very high	88.4	Confident	9 Å²	9	80.5 Å²	80.5	5%	0.047	39%	0.391	C	S	.	.	H	α-helix	trans	-57.7	-51.8	174.2	176.7	59.6	0	0	0	111.1	L240 D244 E245 T250 L251 I252 L269 Q278 L282	L240-L248 HydrophobicContact CD1-CB 4.43Å; L240-L248 HydrophobicContact CD1-CD2 3.75Å; D244-L248 PolarHBondContact O-N 3.01Å; E245-L248 PolarHBondContact O-N 3.4Å; L248-T250 PolarHBondContact O-N 3.46Å; L248-L251 PolarHBondContact O-N 2.88Å; L248-I252 HydrophobicContact CD1-CD1 3.89Å; L248-I252 HydrophobicContact CD1-CG1 4.15Å; L248-I252 HydrophobicContact CG-CD1 3.79Å; L248-I252 HydrophobicContact CG-CG1 4.46Å; L248-I252 WeakPolarHBondContact O-CG1 3.46Å; L248-I252 PolarHBondContact O-N 2.62Å; L248-L269 HydrophobicContact CB-CD1 3.98Å; L248-L269 HydrophobicContact CD1-CD1 4.3Å; L248-Q278 HydrophobicContact CD2-CB 4.08Å; L248-Q278 HydrophobicContact CD2-CG 3.79Å; L248-L282 HydrophobicContact CD1-CD2 3.79Å; L248-L282 HydrophobicContact CD1-CG 3.9Å
249	L	93.8	Very high	89.9	Confident	115 Å²	115	75.4 Å²	75.4	60%	0.602	38%	0.379	S	S	*	.	H	α-helix	trans	-57	-38.2	175.5	-71.3	171.7	0	0	0	112.1	E245 K253	E245-L249 WeakPolarHBondContact O-CG 3.32Å; E245-L249 PolarHBondContact O-N 2.78Å; L249-K253 WeakPolarHBondContact O-CB 3.46Å; L249-K253 PolarHBondContact O-N 3.09Å
250	T	94.8	Very high	90.8	Very high	76 Å²	76	71.7 Å²	71.7	47%	0.466	37%	0.369	S	S	.	.	H	α-helix	trans	-68.4	-32.9	177.1	-61.5	0	0	0	0	112.8	Q246 L247 L248	Q246-T250 VanDerWaalsContact O-CB 3.32Å; Q246-T250 WeakPolarHBondContact O-CB 3.45Å; Q246-T250 PolarHBondContact O-N 2.81Å; Q246-T250 PolarHBondContact O-OG1 3.26Å; L247-T250 WeakPolarHBondContact O-CB 3.49Å; L247-T250 PolarHBondContact O-N 2.84Å; L248-T250 PolarHBondContact O-N 3.46Å
251	L	94	Very high	91.2	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-75.7	-44.1	173.6	-66.8	175.7	0	0	0	111.6	L247 L248 K253 K254 L257 D262 Q265 C266 L269 L285	L247-L251 WeakPolarHBondContact O-CG 3.43Å; L247-L251 PolarHBondContact O-N 3.08Å; L248-L251 PolarHBondContact O-N 2.88Å; L251-K253 VanDerWaalsContact C-N 3.25Å; L251-K253 PolarHBondContact O-N 2.72Å; L251-K254 HydrophobicContact CD2-CD 4.21Å; L251-K254 VanDerWaalsContact O-CB 3.31Å; L251-K254 WeakPolarHBondContact O-CB 3.48Å; L251-K254 PolarHBondContact O-N 2.72Å; L251-L257 HydrophobicContact CD1-CD2 4.35Å; L251-L257 HydrophobicContact CD2-CD2 4.16Å; L251-D262 HydrophobicContact CD2-CB 4.07Å; L251-Q265 HydrophobicContact CD1-CB 4.4Å; L251-C266 HydrophobicContact CD1-CB 4.41Å; L251-L269 HydrophobicContact CD1-CD1 3.78Å; L251-L285 HydrophobicContact CB-CD1 3.82Å; L251-L285 WeakPolarHBondContact O-CD2 3.48Å
252	I	94.3	Very high	91.5	Very high	62 Å²	62	70.7 Å²	70.7	32%	0.318	37%	0.368	S	S	.	.	H	α-helix	trans	-54.2	-44.3	174.4	-68.4	168.2	0	0	0	110.4	L248 K254 G255 Q281 L285	L248-I252 HydrophobicContact CD1-CD1 3.89Å; L248-I252 HydrophobicContact CD1-CG1 4.15Å; L248-I252 HydrophobicContact CG-CD1 3.79Å; L248-I252 HydrophobicContact CG-CG1 4.46Å; L248-I252 WeakPolarHBondContact O-CG1 3.46Å; L248-I252 PolarHBondContact O-N 2.62Å; I252-K254 PolarHBondContact O-N 2.57Å; I252-G255 PolarHBondContact O-N 3.33Å; I252-Q281 HydrophobicContact CD1-CB 4.15Å; I252-Q281 HydrophobicContact CD1-CG 4.25Å; I252-Q281 VanDerWaalsContact CD1-OE1 3.25Å; I252-Q281 HydrophobicContact CG1-CB 4.48Å; I252-L285 HydrophobicContact CG1-CD1 4.05Å
253	K	94.2	Very high	91.6	Very high	193 Å²	193	67.8 Å²	67.8	84%	0.839	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.4	177.6	-139.4	172.5	-170.1	174.7	0	114.8	L249 L251	L249-K253 WeakPolarHBondContact O-CB 3.46Å; L249-K253 PolarHBondContact O-N 3.09Å; L251-K253 VanDerWaalsContact C-N 3.25Å; L251-K253 PolarHBondContact O-N 2.72Å
254	K	92.4	Very high	91.4	Very high	63 Å²	63	63.9 Å²	63.9	27%	0.274	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-19.2	172.3	-64.4	168.6	-175.4	169.2	0	112.7	L251 I252 S256 K258 D262	L251-K254 HydrophobicContact CD2-CD 4.21Å; L251-K254 VanDerWaalsContact O-CB 3.31Å; L251-K254 WeakPolarHBondContact O-CB 3.48Å; L251-K254 PolarHBondContact O-N 2.72Å; I252-K254 PolarHBondContact O-N 2.57Å; K254-S256 WeakPolarHBondContact CB-O 3.43Å; K254-S256 PolarHBondContact O-N 3.28Å; K254-S256 VanDerWaalsContact O-N 3.12Å; K254-K258 HydrophobicContact CB-CD 4.48Å; K254-K258 WeakPolarHBondContact O-CE 3.21Å; K254-K258 PolarHBondContact O-NZ 3.12Å; K254-D262 IonicContact NZ-OD1 2.61Å; K254-D262 PolarHBondContact NZ-OD1 3.46Å
255	G	92.1	Very high	91.4	Very high	40 Å²	40	65.8 Å²	65.8	41%	0.412	34%	0.342	S	S	.	.	S	Bend	trans	74.2	-21.2	-174.1	0	0	0	0	0	115.2	I252 N288	I252-G255 PolarHBondContact O-N 3.33Å; G255-N288 WeakPolarHBondContact O-CB 3.16Å
256	S	94.1	Very high	91.5	Very high	26 Å²	26	61.7 Å²	61.7	18%	0.182	32%	0.323	C	S	.	.	S	Bend	trans	-161.7	163.6	175	55.4	0	0	0	0	111	K254 N288	K254-S256 WeakPolarHBondContact CB-O 3.43Å; K254-S256 PolarHBondContact O-N 3.28Å; K254-S256 VanDerWaalsContact O-N 3.12Å; S256-N288 WeakPolarHBondContact CB-O 3.36Å
257	L	93.5	Very high	91.3	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	30%	0.298	C	S	.	.			trans	-76	130	172.1	-45.9	176.1	0	0	0	108.5	L251 D262 C266 L285 I286 S289 V293	L251-L257 HydrophobicContact CD1-CD2 4.35Å; L251-L257 HydrophobicContact CD2-CD2 4.16Å; L257-D262 HydrophobicContact CB-CB 3.84Å; L257-D262 HydrophobicContact CD2-CB 4.05Å; L257-C266 HydrophobicContact CD1-CB 3.73Å; L257-C266 HydrophobicContact CD2-CB 3.95Å; L257-L285 HydrophobicContact CD2-CB 4.16Å; L257-L285 HydrophobicContact CG-CB 4.33Å; L257-I286 HydrophobicContact CD1-CG1 3.92Å; L257-S289 VanDerWaalsContact CB-OG 3.27Å; L257-S289 WeakPolarHBondContact CB-OG 3.34Å; L257-S289 PolarHBondContact N-OG 3.22Å; L257-S289 PolarHBondContact O-OG 3Å; L257-V293 HydrophobicContact CB-CG1 3.68Å
258	K	91.2	Very high	90.9	Very high	127 Å²	127	55.8 Å²	55.8	55%	0.552	30%	0.304	S	S	*	.			trans	-114.8	-14.7	-169.1	-67	175.6	-172.7	175.5	0	113.4	K254 D262	K254-K258 HydrophobicContact CB-CD 4.48Å; K254-K258 WeakPolarHBondContact O-CE 3.21Å; K254-K258 PolarHBondContact O-NZ 3.12Å; K258-D262 WeakPolarHBondContact CA-OD2 3.42Å; K258-D262 PolarHBondContact N-OD2 3.34Å
259	T	90.8	Very high	90.7	Very high	68 Å²	68	55.4 Å²	55.4	42%	0.417	30%	0.302	S	S	.	.	S	Bend	trans	-143.3	160.7	-174.4	66.2	0	0	0	0	111.3	S261 D262 A263	T259-S261 PolarHBondContact O-N 3.38Å; T259-S261 PolarHBondContact OG1-N 3.09Å; T259-D262 WeakPolarHBondContact CB-OD2 3.45Å; T259-D262 PolarHBondContact N-OD2 2.73Å; T259-D262 WeakPolarHBondContact O-CB 3.36Å; T259-D262 PolarHBondContact O-N 2.94Å; T259-D262 PolarHBondContact OG1-N 3.08Å; T259-D262 VanDerWaalsContact OG1-N 3.16Å; T259-D262 PolarHBondContact OG1-OD2 3.31Å; T259-A263 PolarHBondContact O-N 2.67Å; T259-A263 VanDerWaalsContact O-N 3.15Å
260	F	87.5	Confident	90.4	Very high	125 Å²	125	50 Å²	50	55%	0.548	27%	0.274	S	S	.	.	H	α-helix	trans	-51.6	-36.4	168.2	179.7	-88.9	0	0	0	112.7	A263 V264 D296	F260-A263 PolarHBondContact O-N 3.14Å; F260-V264 HydrophobicContact CD1-CG2 4.07Å; F260-V264 HydrophobicContact CE1-CG2 3.59Å; F260-V264 HydrophobicContact CZ-CG2 3.85Å; F260-V264 WeakPolarHBondContact O-CG2 3.38Å; F260-V264 PolarHBondContact O-N 3.16Å; F260-D296 HydrophobicContact CD2-CB 3.84Å
261	S	86.8	Confident	89.7	Confident	63 Å²	63	50.7 Å²	50.7	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-63.7	-42.8	176.6	-166.6	0	0	0	0	112	T259 A263 V264 Q265	T259-S261 PolarHBondContact O-N 3.38Å; T259-S261 PolarHBondContact OG1-N 3.09Å; S261-A263 VanDerWaalsContact C-N 3.3Å; S261-A263 PolarHBondContact O-N 3.07Å; S261-V264 PolarHBondContact O-N 3.3Å; S261-Q265 WeakPolarHBondContact O-CB 3.38Å; S261-Q265 VanDerWaalsContact O-CG 3.24Å; S261-Q265 WeakPolarHBondContact O-CG 3.46Å; S261-Q265 PolarHBondContact O-N 3.41Å
262	D	91.2	Very high	88.9	Confident	8 Å²	8	53.8 Å²	53.8	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-38.1	175.6	-55.7	-55.2	0	0	0	111.5	L251 K254 L257 K258 T259 Q265 C266	L251-D262 HydrophobicContact CD2-CB 4.07Å; K254-D262 IonicContact NZ-OD1 2.61Å; K254-D262 PolarHBondContact NZ-OD1 3.46Å; L257-D262 HydrophobicContact CB-CB 3.84Å; L257-D262 HydrophobicContact CD2-CB 4.05Å; K258-D262 WeakPolarHBondContact CA-OD2 3.42Å; K258-D262 PolarHBondContact N-OD2 3.34Å; T259-D262 WeakPolarHBondContact CB-OD2 3.45Å; T259-D262 PolarHBondContact N-OD2 2.73Å; T259-D262 WeakPolarHBondContact O-CB 3.36Å; T259-D262 PolarHBondContact O-N 2.94Å; T259-D262 PolarHBondContact OG1-N 3.08Å; T259-D262 VanDerWaalsContact OG1-N 3.16Å; T259-D262 PolarHBondContact OG1-OD2 3.31Å; D262-Q265 PolarHBondContact O-N 3.3Å; D262-C266 WeakPolarHBondContact O-CB 3.19Å; D262-C266 PolarHBondContact O-N 3.33Å
263	A	88.3	Confident	88.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-41.7	177.3	0	0	0	0	0	112.9	T259 F260 S261 T267 V293 D296 F297	T259-A263 PolarHBondContact O-N 2.67Å; T259-A263 VanDerWaalsContact O-N 3.15Å; F260-A263 PolarHBondContact O-N 3.14Å; S261-A263 VanDerWaalsContact C-N 3.3Å; S261-A263 PolarHBondContact O-N 3.07Å; A263-T267 WeakPolarHBondContact O-CB 3.25Å; A263-T267 PolarHBondContact O-N 3.38Å; A263-T267 PolarHBondContact O-OG1 2.93Å; A263-V293 HydrophobicContact CB-CG1 4.11Å; A263-D296 HydrophobicContact CB-CB 4.47Å; A263-F297 HydrophobicContact CB-CB 4.05Å
264	V	84.4	Confident	87.3	Confident	78 Å²	78	44.7 Å²	44.7	47%	0.473	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-41.9	173.8	173.4	0	0	0	0	111.2	F260 S261 T267 G268	F260-V264 HydrophobicContact CD1-CG2 4.07Å; F260-V264 HydrophobicContact CE1-CG2 3.59Å; F260-V264 HydrophobicContact CZ-CG2 3.85Å; F260-V264 WeakPolarHBondContact O-CG2 3.38Å; F260-V264 PolarHBondContact O-N 3.16Å; S261-V264 PolarHBondContact O-N 3.3Å; V264-T267 PolarHBondContact O-N 3.46Å; V264-G268 PolarHBondContact O-N 2.74Å
265	Q	89.4	Confident	86.9	Confident	65 Å²	65	44.8 Å²	44.8	30%	0.304	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-46.2	175.9	-75.6	173.6	-6.4	0	0	111.8	L247 L251 S261 D262 G268 L269	L247-Q265 HydrophobicContact CD1-CB 4.46Å; L247-Q265 HydrophobicContact CD1-CG 4.42Å; L247-Q265 HydrophobicContact CD2-CB 4.2Å; L247-Q265 HydrophobicContact CD2-CG 4.31Å; L251-Q265 HydrophobicContact CD1-CB 4.4Å; S261-Q265 WeakPolarHBondContact O-CB 3.38Å; S261-Q265 VanDerWaalsContact O-CG 3.24Å; S261-Q265 WeakPolarHBondContact O-CG 3.46Å; S261-Q265 PolarHBondContact O-N 3.41Å; D262-Q265 PolarHBondContact O-N 3.3Å; Q265-G268 WeakPolarHBondContact O-CA 3.26Å; Q265-G268 PolarHBondContact O-N 2.77Å; Q265-G268 VanDerWaalsContact O-N 3.13Å; Q265-L269 PolarHBondContact O-N 3.37Å
266	C	90.8	Very high	86.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-49.1	174	-178.6	0	0	0	0	111.5	L251 L257 D262 G268 L269 M270	L251-C266 HydrophobicContact CD1-CB 4.41Å; L257-C266 HydrophobicContact CD1-CB 3.73Å; L257-C266 HydrophobicContact CD2-CB 3.95Å; D262-C266 WeakPolarHBondContact O-CB 3.19Å; D262-C266 PolarHBondContact O-N 3.33Å; C266-G268 PolarHBondContact O-N 2.98Å; C266-L269 PolarHBondContact O-N 3.3Å; C266-L269 VanDerWaalsContact O-N 3.07Å; C266-M270 VanDerWaalsContact O-CG 3.32Å; C266-M270 WeakPolarHBondContact O-CG 3.45Å; C266-M270 PolarHBondContact O-N 2.66Å
267	T	87.3	Confident	86.1	Confident	16 Å²	16	47.2 Å²	47.2	10%	0.098	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-34.6	175.3	-55.1	0	0	0	0	112.3	A263 V264 F297 I305	A263-T267 WeakPolarHBondContact O-CB 3.25Å; A263-T267 PolarHBondContact O-N 3.38Å; A263-T267 PolarHBondContact O-OG1 2.93Å; V264-T267 PolarHBondContact O-N 3.46Å; T267-F297 WeakPolarHBondContact OG1-CD2 3.24Å; T267-F297 WeakPolarHBondContact OG1-CE2 3.46Å; T267-I305 HydrophobicContact CG2-CD1 3.95Å
268	G	84.8	Confident	85.9	Confident	34 Å²	34	48.8 Å²	48.8	35%	0.351	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-46	173.4	0	0	0	0	0	113.1	V264 Q265 C266 R271	V264-G268 PolarHBondContact O-N 2.74Å; Q265-G268 WeakPolarHBondContact O-CA 3.26Å; Q265-G268 PolarHBondContact O-N 2.77Å; Q265-G268 VanDerWaalsContact O-N 3.13Å; C266-G268 PolarHBondContact O-N 2.98Å; G268-R271 WeakPolarHBondContact O-CB 3.36Å; G268-R271 PolarHBondContact O-N 3.09Å
269	L	88.9	Confident	85.9	Confident	2 Å²	2	43 Å²	43	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-44.3	176.3	-67.8	175.1	0	0	0	112.1	L240 D244 L247 L248 L251 Q265 C266 R271 H272 T273 L282	L240-L269 HydrophobicContact CD2-CD2 4.15Å; D244-L269 HydrophobicContact CB-CD2 3.67Å; D244-L269 WeakPolarHBondContact O-CD2 3.49Å; L247-L269 HydrophobicContact CB-CD2 4.4Å; L247-L269 HydrophobicContact CD2-CD1 4.47Å; L247-L269 HydrophobicContact CD2-CD2 4.16Å; L247-L269 HydrophobicContact CD2-CG 4.26Å; L247-L269 HydrophobicContact CG-CD1 4.19Å; L247-L269 HydrophobicContact CG-CD2 4.42Å; L247-L269 HydrophobicContact CG-CG 4.49Å; L248-L269 HydrophobicContact CB-CD1 3.98Å; L248-L269 HydrophobicContact CD1-CD1 4.3Å; L251-L269 HydrophobicContact CD1-CD1 3.78Å; Q265-L269 PolarHBondContact O-N 3.37Å; C266-L269 PolarHBondContact O-N 3.3Å; C266-L269 VanDerWaalsContact O-N 3.07Å; L269-R271 PolarHBondContact O-N 2.75Å; L269-R271 VanDerWaalsContact O-N 3.12Å; L269-H272 CarbonylContact O-C 3.47Å; L269-H272 WeakPolarHBondContact O-CA 3.13Å; L269-H272 PolarHBondContact O-N 3.08Å; L269-T273 PolarHBondContact O-N 3.28Å; L269-T273 PolarHBondContact O-OG1 3.46Å; L269-L282 HydrophobicContact CB-CD1 4.11Å; L269-L282 HydrophobicContact CB-CD2 4.06Å; L269-L282 HydrophobicContact CD1-CD2 4Å
270	M	88.9	Confident	85.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.5	-33.2	-178	-66.6	173	79.5	0	0	112.7	F237 C266 H272 T273 L282 I286 F297 I305 L306 W309	F237-M270 WeakPolarHBondContact CE1-O 3.31Å; C266-M270 VanDerWaalsContact O-CG 3.32Å; C266-M270 WeakPolarHBondContact O-CG 3.45Å; C266-M270 PolarHBondContact O-N 2.66Å; M270-H272 PolarHBondContact O-N 3.36Å; M270-T273 PolarHBondContact O-N 3.17Å; M270-L282 HydrophobicContact CG-CB 4.39Å; M270-L282 HydrophobicContact CG-CD1 4.04Å; M270-I286 HydrophobicContact CE-CD1 4.17Å; M270-I286 HydrophobicContact SD-CD1 3.85Å; M270-F297 HydrophobicContact CE-CZ 4.1Å; M270-F297 HydrophobicContact SD-CE2 3.61Å; M270-F297 HydrophobicContact SD-CZ 3.6Å; M270-F297 VanDerWaalsContact SD-CZ 3.6Å; M270-I305 HydrophobicContact CB-CG2 3.69Å; M270-I305 HydrophobicContact CE-CG2 4.34Å; M270-L306 HydrophobicContact CE-CD2 3.96Å; M270-W309 HydrophobicContact CB-CH2 4.1Å; M270-W309 HydrophobicContact CB-CZ2 3.63Å; M270-W309 HydrophobicContact CE-CD2 4.17Å; M270-W309 HydrophobicContact CE-CE3 3.79Å; M270-W309 HydrophobicContact CE-CH2 3.66Å; M270-W309 HydrophobicContact CE-CZ2 4.02Å; M270-W309 HydrophobicContact CE-CZ3 3.53Å; M270-W309 HydrophobicContact CG-CH2 3.66Å; M270-W309 HydrophobicContact CG-CZ2 3.74Å; M270-W309 HydrophobicContact CG-CZ3 4.48Å; M270-W309 PolarHBondContact O-NE1 3.4Å; M270-W309 HydrophobicContact SD-CH2 4.46Å
271	R	79.8	Confident	86.1	Confident	91 Å²	91	39 Å²	39	34%	0.343	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.9	174.4	178.6	177.7	-67.3	-166.8	-1.9	113.4	L234 F237 G268 L269 I305	L234-R271 HydrophobicContact CD2-CG 4.23Å; F237-R271 WeakPolarHBondContact CD1-O 3.5Å; G268-R271 WeakPolarHBondContact O-CB 3.36Å; G268-R271 PolarHBondContact O-N 3.09Å; L269-R271 PolarHBondContact O-N 2.75Å; L269-R271 VanDerWaalsContact O-N 3.12Å; R271-I305 HydrophobicContact CB-CD1 4.14Å
272	H	76.7	Confident	86.5	Confident	65 Å²	65	36 Å²	36	30%	0.301	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	27	-177.6	-49.7	152.7	0	0	0	111.7	R238 L240 D244 L269 M270	R238-H272 CarbonylContact O-C 3.32Å; L240-H272 HydrophobicContact CD2-CB 3.82Å; L240-H272 WeakPolarHBondContact CD2-O 3.33Å; D244-H272 IonicContact OD2-ND1 3.53Å; D244-H272 PolarHBondContact OD2-ND1 3.48Å; L269-H272 CarbonylContact O-C 3.47Å; L269-H272 WeakPolarHBondContact O-CA 3.13Å; L269-H272 PolarHBondContact O-N 3.08Å; M270-H272 PolarHBondContact O-N 3.36Å
273	T	80.1	Confident	86.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.			trans	-109.1	98.9	-177.6	-47.7	0	0	0	0	112	L269 M270 Q278 R279 L282	L269-T273 PolarHBondContact O-N 3.28Å; L269-T273 PolarHBondContact O-OG1 3.46Å; M270-T273 PolarHBondContact O-N 3.17Å; T273-Q278 HydrophobicContact CG2-CB 3.4Å; T273-Q278 VanDerWaalsContact CG2-CB 3.4Å; T273-R279 HydrophobicContact CG2-CB 4.35Å; T273-R279 HydrophobicContact CG2-CG 3.6Å; T273-R279 PolarHBondContact O-NE 3.32Å; T273-L282 HydrophobicContact CG2-CD1 4.17Å; T273-L282 VanDerWaalsContact OG1-CD1 3.28Å; T273-L282 WeakPolarHBondContact OG1-CD1 3.46Å
274	E	75.6	Confident	87	Confident	65 Å²	65	41 Å²	41	30%	0.304	21%	0.21	S	C	.	.			trans	-72.1	-53.4	165.7	-71.5	173.7	-158.2	0	0	111.3	F237 R238 R239	F237-E274 HydrophobicContact CB-CG 3.87Å; R238-E274 WeakPolarHBondContact CA-OE1 3.43Å; R239-E274 WeakPolarHBondContact CG-OE2 3.42Å; R239-E274 VanDerWaalsContact N-CD 3.26Å; R239-E274 PolarHBondContact N-OE1 3.3Å; R239-E274 IonicContact NE-OE2 3.41Å; R239-E274 PolarHBondContact NE-OE2 3.17Å
275	D	82.2	Confident	87.5	Confident	64 Å²	64	37.6 Å²	37.6	34%	0.342	19%	0.189	S	C	.	.			trans	-69.2	136.7	-165	172	80.1	0	0	0	114.4	N277 Q278 R279	D275-N277 PolarHBondContact O-N 3.44Å; D275-N277 PolarHBondContact OD1-ND2 3.15Å; D275-N277 WeakPolarHBondContact OD2-CA 3.49Å; D275-N277 VanDerWaalsContact OD2-CB 3.28Å; D275-N277 WeakPolarHBondContact OD2-CB 3.46Å; D275-N277 PolarHBondContact OD2-N 3.24Å; D275-Q278 HydrophobicContact CB-CB 4.19Å; D275-Q278 HydrophobicContact CB-CG 4.03Å; D275-Q278 PolarHBondContact O-N 3.45Å; D275-Q278 WeakPolarHBondContact OD2-CG 3.27Å; D275-Q278 PolarHBondContact OD2-N 2.99Å; D275-R279 WeakPolarHBondContact O-CG 3.45Å; D275-R279 PolarHBondContact O-N 3.01Å
276	L	84.4	Confident	87.9	Confident	22 Å²	22	34.5 Å²	34.5	12%	0.115	18%	0.175	C	C	.	.	H	α-helix	trans	-57	-46.8	-179.6	-179.5	56.5	0	0	0	113.2	Q278 R279 L280 C316 K319 Y323	L276-Q278 VanDerWaalsContact C-N 3.33Å; L276-Q278 PolarHBondContact O-N 2.87Å; L276-R279 PolarHBondContact O-N 2.92Å; L276-L280 HydrophobicContact CD1-CD1 3.97Å; L276-L280 HydrophobicContact CD1-CG 4.09Å; L276-L280 HydrophobicContact CG-CD1 3.94Å; L276-L280 HydrophobicContact CG-CG 4.45Å; L276-L280 WeakPolarHBondContact O-CB 3.05Å; L276-L280 VanDerWaalsContact O-CG 3.31Å; L276-L280 WeakPolarHBondContact O-CG 3.48Å; L276-L280 PolarHBondContact O-N 3.33Å; L276-C316 HydrophobicContact CD1-CB 4.44Å; L276-C316 HydrophobicContact CD2-CB 4.1Å; L276-K319 HydrophobicContact CD2-CB 4.16Å; L276-K319 HydrophobicContact CD2-CD 4.35Å; L276-Y323 HydrophobicContact CD1-CD2 3.42Å; L276-Y323 VanDerWaalsContact CD1-CD2 3.42Å; L276-Y323 HydrophobicContact CD1-CE2 4.01Å; L276-Y323 HydrophobicContact CD1-CG 3.96Å
277	N	86.5	Confident	88.1	Confident	95 Å²	95	36.7 Å²	36.7	51%	0.508	19%	0.186	S	C	.	.	H	α-helix	trans	-67.8	-39.2	-175.6	-54	-80.1	0	0	0	110.2	D275 L280 Q281	D275-N277 PolarHBondContact O-N 3.44Å; D275-N277 PolarHBondContact OD1-ND2 3.15Å; D275-N277 WeakPolarHBondContact OD2-CA 3.49Å; D275-N277 VanDerWaalsContact OD2-CB 3.28Å; D275-N277 WeakPolarHBondContact OD2-CB 3.46Å; D275-N277 PolarHBondContact OD2-N 3.24Å; N277-L280 PolarHBondContact O-N 3.33Å; N277-Q281 WeakPolarHBondContact O-CB 3.26Å; N277-Q281 WeakPolarHBondContact O-CG 3.46Å; N277-Q281 PolarHBondContact O-N 2.86Å
278	Q	89.4	Confident	88.5	Confident	37 Å²	37	40.2 Å²	40.2	17%	0.173	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-42.1	172.2	-63.7	176.3	1.2	0	0	111.6	L240 L248 T273 D275 L276 Q281 L282	L240-Q278 VanDerWaalsContact CD1-OE1 3.23Å; L248-Q278 HydrophobicContact CD2-CB 4.08Å; L248-Q278 HydrophobicContact CD2-CG 3.79Å; T273-Q278 HydrophobicContact CG2-CB 3.4Å; T273-Q278 VanDerWaalsContact CG2-CB 3.4Å; D275-Q278 HydrophobicContact CB-CB 4.19Å; D275-Q278 HydrophobicContact CB-CG 4.03Å; D275-Q278 PolarHBondContact O-N 3.45Å; D275-Q278 WeakPolarHBondContact OD2-CG 3.27Å; D275-Q278 PolarHBondContact OD2-N 2.99Å; L276-Q278 VanDerWaalsContact C-N 3.33Å; L276-Q278 PolarHBondContact O-N 2.87Å; Q278-Q281 PolarHBondContact O-N 2.98Å; Q278-L282 WeakPolarHBondContact O-CB 3.41Å; Q278-L282 WeakPolarHBondContact O-CG 3.44Å; Q278-L282 PolarHBondContact O-N 3.37Å
279	R	89.9	Confident	89	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-45.4	174.2	-70.3	-170.4	179.5	-171.6	2.2	111	T273 D275 L276 L282 A283 W309 D312 Y323	T273-R279 HydrophobicContact CG2-CB 4.35Å; T273-R279 HydrophobicContact CG2-CG 3.6Å; T273-R279 PolarHBondContact O-NE 3.32Å; D275-R279 WeakPolarHBondContact O-CG 3.45Å; D275-R279 PolarHBondContact O-N 3.01Å; L276-R279 PolarHBondContact O-N 2.92Å; R279-L282 PolarHBondContact O-N 2.67Å; R279-A283 WeakPolarHBondContact O-CB 3.27Å; R279-A283 PolarHBondContact O-N 3.43Å; R279-W309 HydrophobicContact CB-CE3 4.46Å; R279-W309 HydrophobicContact CB-CH2 3.91Å; R279-W309 HydrophobicContact CB-CZ2 4.14Å; R279-W309 HydrophobicContact CB-CZ3 4.07Å; R279-W309 HydrophobicContact CG-CD2 4.35Å; R279-W309 HydrophobicContact CG-CH2 4.03Å; R279-W309 HydrophobicContact CG-CZ2 3.72Å; R279-W309 HydrophobicContact CG-CZ3 4.46Å; R279-W309 WeakPolarHBondContact O-CZ3 3.16Å; R279-D312 IonicContact CZ-OD2 2.71Å; R279-D312 PolarHBondContact NH1-O 2.97Å; R279-D312 IonicContact NH1-OD2 3.26Å; R279-D312 IonicContact NH2-OD2 3.01Å; R279-D312 PolarHBondContact NH2-OD2 2.91Å; R279-Y323 HydrophobicContact CB-CE2 4.3Å; R279-Y323 WeakPolarHBondContact CD-OH 3.27Å; R279-Y323 PolarHBondContact NH1-OH 2.99Å
280	L	90.7	Very high	89.3	Confident	35 Å²	35	48.8 Å²	48.8	18%	0.183	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-42.8	178.3	-71.1	172.2	0	0	0	112.7	L276 N277 L282 A283 E284 Y323 K326	L276-L280 HydrophobicContact CD1-CD1 3.97Å; L276-L280 HydrophobicContact CD1-CG 4.09Å; L276-L280 HydrophobicContact CG-CD1 3.94Å; L276-L280 HydrophobicContact CG-CG 4.45Å; L276-L280 WeakPolarHBondContact O-CB 3.05Å; L276-L280 VanDerWaalsContact O-CG 3.31Å; L276-L280 WeakPolarHBondContact O-CG 3.48Å; L276-L280 PolarHBondContact O-N 3.33Å; N277-L280 PolarHBondContact O-N 3.33Å; L280-L282 VanDerWaalsContact C-N 3.35Å; L280-L282 PolarHBondContact O-N 2.99Å; L280-A283 WeakPolarHBondContact O-CB 3.15Å; L280-A283 PolarHBondContact O-N 3.42Å; L280-E284 WeakPolarHBondContact O-CB 3.12Å; L280-E284 PolarHBondContact O-N 2.94Å; L280-Y323 HydrophobicContact CD2-CD2 4.13Å; L280-K326 HydrophobicContact CD2-CB 3.89Å; L280-K326 HydrophobicContact CD2-CG 3.97Å
281	Q	93	Very high	89.4	Confident	75 Å²	75	52.9 Å²	52.9	35%	0.35	25%	0.248	S	C	.	.	H	α-helix	trans	-62.4	-39.8	175.7	-74.9	164.6	4.5	0	0	112.2	I252 N277 Q278 L285	I252-Q281 HydrophobicContact CD1-CB 4.15Å; I252-Q281 HydrophobicContact CD1-CG 4.25Å; I252-Q281 VanDerWaalsContact CD1-OE1 3.25Å; I252-Q281 HydrophobicContact CG1-CB 4.48Å; N277-Q281 WeakPolarHBondContact O-CB 3.26Å; N277-Q281 WeakPolarHBondContact O-CG 3.46Å; N277-Q281 PolarHBondContact O-N 2.86Å; Q278-Q281 PolarHBondContact O-N 2.98Å; Q281-L285 WeakPolarHBondContact O-CG 3.43Å; Q281-L285 PolarHBondContact O-N 2.94Å
282	L	94.2	Very high	89.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-41.2	174.2	-75.3	167.1	0	0	0	111.8	L248 L269 M270 T273 Q278 R279 L280 L285 I286 W309	L248-L282 HydrophobicContact CD1-CD2 3.79Å; L248-L282 HydrophobicContact CD1-CG 3.9Å; L269-L282 HydrophobicContact CB-CD1 4.11Å; L269-L282 HydrophobicContact CB-CD2 4.06Å; L269-L282 HydrophobicContact CD1-CD2 4Å; M270-L282 HydrophobicContact CG-CB 4.39Å; M270-L282 HydrophobicContact CG-CD1 4.04Å; T273-L282 HydrophobicContact CG2-CD1 4.17Å; T273-L282 VanDerWaalsContact OG1-CD1 3.28Å; T273-L282 WeakPolarHBondContact OG1-CD1 3.46Å; Q278-L282 WeakPolarHBondContact O-CB 3.41Å; Q278-L282 WeakPolarHBondContact O-CG 3.44Å; Q278-L282 PolarHBondContact O-N 3.37Å; R279-L282 PolarHBondContact O-N 2.67Å; L280-L282 VanDerWaalsContact C-N 3.35Å; L280-L282 PolarHBondContact O-N 2.99Å; L282-L285 PolarHBondContact O-N 3.1Å; L282-I286 WeakPolarHBondContact O-CD1 3.44Å; L282-I286 WeakPolarHBondContact O-CG1 3.42Å; L282-I286 PolarHBondContact O-N 3.28Å; L282-W309 HydrophobicContact CB-CH2 3.95Å; L282-W309 HydrophobicContact CD1-CH2 4.13Å; L282-W309 HydrophobicContact CD1-CZ2 4.43Å
283	A	94.3	Very high	90.6	Very high	3 Å²	3	50.5 Å²	50.5	3%	0.025	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-46	173.8	0	0	0	0	0	111.8	R279 L280 L285 I286 M287 L330	R279-A283 WeakPolarHBondContact O-CB 3.27Å; R279-A283 PolarHBondContact O-N 3.43Å; L280-A283 WeakPolarHBondContact O-CB 3.15Å; L280-A283 PolarHBondContact O-N 3.42Å; A283-L285 PolarHBondContact O-N 3.21Å; A283-I286 PolarHBondContact O-N 3.38Å; A283-M287 HydrophobicContact CB-CE 4.3Å; A283-M287 WeakPolarHBondContact O-CG 3.26Å; A283-M287 PolarHBondContact O-N 3.11Å; A283-L330 HydrophobicContact CB-CD1 4.41Å; A283-L330 HydrophobicContact CB-CD2 3.84Å
284	E	95.2	Very high	91.4	Very high	110 Å²	110	52.2 Å²	52.2	51%	0.514	25%	0.248	S	C	.	.	H	α-helix	trans	-60.6	-43	177.1	-179.8	170.4	-153.3	0	0	112.3	L280 I286 M287 N288	L280-E284 WeakPolarHBondContact O-CB 3.12Å; L280-E284 PolarHBondContact O-N 2.94Å; E284-I286 VanDerWaalsContact C-N 3.28Å; E284-I286 PolarHBondContact O-N 3.48Å; E284-M287 PolarHBondContact O-N 2.88Å; E284-N288 WeakPolarHBondContact CG-ND2 3.38Å; E284-N288 WeakPolarHBondContact O-CB 3.33Å; E284-N288 PolarHBondContact O-N 3.05Å; E284-N288 PolarHBondContact O-ND2 3.24Å
285	L	96.4	Very high	92.1	Very high	6 Å²	6	54.8 Å²	54.8	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-37.9	174.7	-78.3	168.2	0	0	0	112.9	L251 I252 L257 Q281 L282 A283 S289	L251-L285 HydrophobicContact CB-CD1 3.82Å; L251-L285 WeakPolarHBondContact O-CD2 3.48Å; I252-L285 HydrophobicContact CG1-CD1 4.05Å; L257-L285 HydrophobicContact CD2-CB 4.16Å; L257-L285 HydrophobicContact CG-CB 4.33Å; Q281-L285 WeakPolarHBondContact O-CG 3.43Å; Q281-L285 PolarHBondContact O-N 2.94Å; L282-L285 PolarHBondContact O-N 3.1Å; A283-L285 PolarHBondContact O-N 3.21Å; L285-S289 PolarHBondContact O-OG 3.13Å
286	I	96.2	Very high	92.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-71.4	-46.6	176.4	-62.5	158.7	0	0	0	110.5	L257 M270 L282 A283 E284 N288 S289 R294 F297 L330 L334	L257-I286 HydrophobicContact CD1-CG1 3.92Å; M270-I286 HydrophobicContact CE-CD1 4.17Å; M270-I286 HydrophobicContact SD-CD1 3.85Å; L282-I286 WeakPolarHBondContact O-CD1 3.44Å; L282-I286 WeakPolarHBondContact O-CG1 3.42Å; L282-I286 PolarHBondContact O-N 3.28Å; A283-I286 PolarHBondContact O-N 3.38Å; E284-I286 VanDerWaalsContact C-N 3.28Å; E284-I286 PolarHBondContact O-N 3.48Å; I286-N288 PolarHBondContact O-N 2.93Å; I286-S289 VanDerWaalsContact O-CB 3.26Å; I286-S289 WeakPolarHBondContact O-CB 3.05Å; I286-S289 PolarHBondContact O-N 2.75Å; I286-S289 VanDerWaalsContact O-N 3.14Å; I286-R294 HydrophobicContact CG2-CG 4.19Å; I286-R294 WeakPolarHBondContact O-CD 3.42Å; I286-R294 WeakPolarHBondContact O-CG 3.14Å; I286-F297 HydrophobicContact CD1-CD2 4.4Å; I286-F297 HydrophobicContact CD1-CE1 4.19Å; I286-F297 HydrophobicContact CD1-CE2 3.69Å; I286-F297 HydrophobicContact CD1-CZ 3.56Å; I286-F297 HydrophobicContact CG1-CD2 4.44Å; I286-F297 HydrophobicContact CG1-CE2 4.2Å; I286-F297 HydrophobicContact CG1-CZ 4.37Å; I286-F297 HydrophobicContact CG2-CD1 4.35Å; I286-F297 HydrophobicContact CG2-CE1 4.42Å; I286-L330 HydrophobicContact CB-CD1 3.75Å; I286-L330 HydrophobicContact CD1-CD1 4.15Å; I286-L330 HydrophobicContact CG2-CD1 3.64Å; I286-L334 HydrophobicContact CG2-CD2 3.96Å
287	M	95.9	Very high	92.8	Very high	46 Å²	46	53.1 Å²	53.1	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-44.6	178.8	-70.7	-173.9	-72.1	0	0	112.1	A283 E284 S289 D329 L330	A283-M287 HydrophobicContact CB-CE 4.3Å; A283-M287 WeakPolarHBondContact O-CG 3.26Å; A283-M287 PolarHBondContact O-N 3.11Å; E284-M287 PolarHBondContact O-N 2.88Å; M287-S289 PolarHBondContact O-N 2.94Å; M287-S289 VanDerWaalsContact O-N 3.11Å; M287-D329 HydrophobicContact SD-CB 3.77Å; M287-L330 HydrophobicContact CG-CD1 4.11Å; M287-L330 HydrophobicContact SD-CB 4.45Å
288	N	95.9	Very high	93	Very high	90 Å²	90	49.5 Å²	49.5	48%	0.481	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	0.2	178.9	-69	-19.4	0	0	0	114.1	G255 S256 E284 I286	G255-N288 WeakPolarHBondContact O-CB 3.16Å; S256-N288 WeakPolarHBondContact CB-O 3.36Å; E284-N288 WeakPolarHBondContact CG-ND2 3.38Å; E284-N288 WeakPolarHBondContact O-CB 3.33Å; E284-N288 PolarHBondContact O-N 3.05Å; E284-N288 PolarHBondContact O-ND2 3.24Å; I286-N288 PolarHBondContact O-N 2.93Å
289	S	95.1	Very high	92.7	Very high	5 Å²	5	49.4 Å²	49.4	4%	0.035	23%	0.23	C	C	.	.	S	Bend	trans	-86.1	152.9	-179	-64.4	0	0	0	0	113.2	L257 L285 I286 M287 R294	L257-S289 VanDerWaalsContact CB-OG 3.27Å; L257-S289 WeakPolarHBondContact CB-OG 3.34Å; L257-S289 PolarHBondContact N-OG 3.22Å; L257-S289 PolarHBondContact O-OG 3Å; L285-S289 PolarHBondContact O-OG 3.13Å; I286-S289 VanDerWaalsContact O-CB 3.26Å; I286-S289 WeakPolarHBondContact O-CB 3.05Å; I286-S289 PolarHBondContact O-N 2.75Å; I286-S289 VanDerWaalsContact O-N 3.14Å; M287-S289 PolarHBondContact O-N 2.94Å; M287-S289 VanDerWaalsContact O-N 3.11Å; S289-R294 VanDerWaalsContact O-CZ 3.31Å; S289-R294 PolarHBondContact O-NE 2.81Å; S289-R294 PolarHBondContact O-NH2 3.34Å
290	R	94.3	Very high	92.1	Very high	211 Å²	211	53.3 Å²	53.3	80%	0.796	26%	0.256	S	S	*	.			trans	-66.7	151.5	174.5	-63.5	178.9	178.9	174.9	-1.7	110.7	Q292 V293 R294	R290-Q292 PolarHBondContact O-N 2.63Å; R290-V293 PolarHBondContact O-N 3.46Å; R290-R294 PolarHBondContact O-N 3.17Å
291	D	92.4	Very high	91.5	Very high	85 Å²	85	54.2 Å²	54.2	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-55	-32.4	-174.5	-49.2	-45.7	0	0	0	113.8	R294 R295	D291-R294 PolarHBondContact O-N 3.43Å; D291-R294 IonicContact OD1-CZ 2.57Å; D291-R294 VanDerWaalsContact OD1-CZ 3.26Å; D291-R294 IonicContact OD1-NH1 3.73Å; D291-R294 PolarHBondContact OD1-NH1 2.89Å; D291-R294 IonicContact OD1-NH2 2.62Å; D291-R294 PolarHBondContact OD1-NH2 2.73Å; D291-R295 WeakPolarHBondContact O-CG 3.37Å; D291-R295 PolarHBondContact O-N 2.77Å
292	Q	90.2	Very high	91.2	Very high	96 Å²	96	50.7 Å²	50.7	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-42.8	175.8	-173.8	56.1	41.6	0	0	111.9	R290 R294 R295 D296	R290-Q292 PolarHBondContact O-N 2.63Å; Q292-R294 VanDerWaalsContact C-N 3.34Å; Q292-R295 WeakPolarHBondContact O-CB 3.39Å; Q292-R295 PolarHBondContact O-N 3.32Å; Q292-R295 VanDerWaalsContact OE1-NE 3.07Å; Q292-D296 PolarHBondContact NE2-OD1 2.73Å; Q292-D296 WeakPolarHBondContact O-CB 3.4Å; Q292-D296 PolarHBondContact O-N 2.98Å
293	V	91.7	Very high	90.9	Very high	11 Å²	11	50.7 Å²	50.7	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-73.2	-30.9	179	-169.9	0	0	0	0	110.8	L257 A263 R290 D296 F297	L257-V293 HydrophobicContact CB-CG1 3.68Å; A263-V293 HydrophobicContact CB-CG1 4.11Å; R290-V293 PolarHBondContact O-N 3.46Å; V293-D296 PolarHBondContact O-N 2.92Å; V293-F297 VanDerWaalsContact O-CB 3.31Å; V293-F297 WeakPolarHBondContact O-CB 3.41Å; V293-F297 PolarHBondContact O-N 2.75Å
294	R	95.1	Very high	90.4	Very high	35 Å²	35	50.8 Å²	50.8	13%	0.132	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-32.7	168.3	-81.5	-172.8	-87.2	106.4	9	112.9	I286 S289 R290 D291 Q292 L298 C333 L334 P335	I286-R294 HydrophobicContact CG2-CG 4.19Å; I286-R294 WeakPolarHBondContact O-CD 3.42Å; I286-R294 WeakPolarHBondContact O-CG 3.14Å; S289-R294 VanDerWaalsContact O-CZ 3.31Å; S289-R294 PolarHBondContact O-NE 2.81Å; S289-R294 PolarHBondContact O-NH2 3.34Å; R290-R294 PolarHBondContact O-N 3.17Å; D291-R294 PolarHBondContact O-N 3.43Å; D291-R294 IonicContact OD1-CZ 2.57Å; D291-R294 VanDerWaalsContact OD1-CZ 3.26Å; D291-R294 IonicContact OD1-NH1 3.73Å; D291-R294 PolarHBondContact OD1-NH1 2.89Å; D291-R294 IonicContact OD1-NH2 2.62Å; D291-R294 PolarHBondContact OD1-NH2 2.73Å; Q292-R294 VanDerWaalsContact C-N 3.34Å; R294-L298 WeakPolarHBondContact O-CG 3.36Å; R294-C333 WeakPolarHBondContact CD-O 3.48Å; R294-C333 VanDerWaalsContact CD-SG 3.51Å; R294-C333 PolarHBondContact NH1-O 3.22Å; R294-L334 HydrophobicContact CB-CD2 4.14Å; R294-L334 HydrophobicContact CG-CD2 4.13Å; R294-P335 HydrophobicContact CB-CG 4.45Å
295	R	92.1	Very high	89.9	Confident	120 Å²	120	45.6 Å²	45.6	45%	0.453	22%	0.224	S	C	.	.	H	α-helix	trans	-69.7	-44.6	167.8	-75.6	-175.8	-67.8	-90.8	5.6	112.3	D291 Q292 F297 L298 P335	D291-R295 WeakPolarHBondContact O-CG 3.37Å; D291-R295 PolarHBondContact O-N 2.77Å; Q292-R295 WeakPolarHBondContact O-CB 3.39Å; Q292-R295 PolarHBondContact O-N 3.32Å; Q292-R295 VanDerWaalsContact OE1-NE 3.07Å; R295-F297 PolarHBondContact O-N 3.17Å; R295-L298 PolarHBondContact O-N 3.01Å; R295-P335 HydrophobicContact CG-CB 4.36Å; R295-P335 HydrophobicContact CG-CG 3.54Å
296	D	88.2	Confident	89.7	Confident	49 Å²	49	45.3 Å²	45.3	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-61.8	-32.8	179.2	-66.7	-14.1	0	0	0	111.9	F260 A263 Q292 V293	F260-D296 HydrophobicContact CD2-CB 3.84Å; A263-D296 HydrophobicContact CB-CB 4.47Å; Q292-D296 PolarHBondContact NE2-OD1 2.73Å; Q292-D296 WeakPolarHBondContact O-CB 3.4Å; Q292-D296 PolarHBondContact O-N 2.98Å; V293-D296 PolarHBondContact O-N 2.92Å
297	F	91.8	Very high	89.3	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-32.1	173.2	173.3	-97.2	0	0	0	113.4	A263 T267 M270 I286 V293 R295 S299 S302 L306 L334	A263-F297 HydrophobicContact CB-CB 4.05Å; T267-F297 WeakPolarHBondContact OG1-CD2 3.24Å; T267-F297 WeakPolarHBondContact OG1-CE2 3.46Å; M270-F297 HydrophobicContact CE-CZ 4.1Å; M270-F297 HydrophobicContact SD-CE2 3.61Å; M270-F297 HydrophobicContact SD-CZ 3.6Å; M270-F297 VanDerWaalsContact SD-CZ 3.6Å; I286-F297 HydrophobicContact CD1-CD2 4.4Å; I286-F297 HydrophobicContact CD1-CE1 4.19Å; I286-F297 HydrophobicContact CD1-CE2 3.69Å; I286-F297 HydrophobicContact CD1-CZ 3.56Å; I286-F297 HydrophobicContact CG1-CD2 4.44Å; I286-F297 HydrophobicContact CG1-CE2 4.2Å; I286-F297 HydrophobicContact CG1-CZ 4.37Å; I286-F297 HydrophobicContact CG2-CD1 4.35Å; I286-F297 HydrophobicContact CG2-CE1 4.42Å; V293-F297 VanDerWaalsContact O-CB 3.31Å; V293-F297 WeakPolarHBondContact O-CB 3.41Å; V293-F297 PolarHBondContact O-N 2.75Å; R295-F297 PolarHBondContact O-N 3.17Å; F297-S299 PolarHBondContact O-N 3.42Å; F297-S302 WeakPolarHBondContact O-CB 3.38Å; F297-S302 PolarHBondContact O-OG 3.26Å; F297-L306 HydrophobicContact CE1-CD1 4.18Å; F297-L334 HydrophobicContact CD1-CD1 4.47Å; F297-L334 HydrophobicContact CD1-CD2 3.76Å; F297-L334 HydrophobicContact CE1-CD1 4.09Å; F297-L334 HydrophobicContact CE1-CD2 4.17Å
298	L	90.8	Very high	88.7	Confident	19 Å²	19	45.6 Å²	45.6	10%	0.099	22%	0.223	C	C	.	.			trans	-73.5	88.6	-175.8	-78	172.4	0	0	0	112.2	R294 R295 L334 P335 F336	R294-L298 WeakPolarHBondContact O-CG 3.36Å; R295-L298 PolarHBondContact O-N 3.01Å; L298-L334 HydrophobicContact CD1-CB 4.33Å; L298-L334 HydrophobicContact CD2-CB 4.31Å; L298-L334 HydrophobicContact CD2-CD1 4.33Å; L298-L334 HydrophobicContact CD2-CD2 4.32Å; L298-L334 HydrophobicContact CG-CD2 4.23Å; L298-P335 VanDerWaalsContact CD1-C 3.45Å; L298-P335 HydrophobicContact CD1-CG 4.17Å; L298-P335 WeakPolarHBondContact CD1-O 3.18Å; L298-F336 HydrophobicContact CD1-CD1 4.39Å; L298-F336 HydrophobicContact CD2-CD1 3.79Å; L298-F336 HydrophobicContact CD2-CE1 3.44Å; L298-F336 VanDerWaalsContact CD2-CE1 3.44Å; L298-F336 HydrophobicContact CD2-CZ 3.92Å
299	S	82.6	Confident	88.3	Confident	35 Å²	35	41.3 Å²	41.3	25%	0.245	20%	0.2	C	C	.	.			trans	-118	158.7	177	68.3	0	0	0	0	109.7	F297 S301 S302 C303	F297-S299 PolarHBondContact O-N 3.42Å; S299-S301 PolarHBondContact O-N 3.17Å; S299-S301 VanDerWaalsContact O-N 3.15Å; S299-S302 PolarHBondContact N-OG 2.93Å; S299-S302 PolarHBondContact O-N 3.04Å; S299-S302 VanDerWaalsContact O-N 3.13Å; S299-S302 PolarHBondContact O-OG 3.13Å; S299-S302 PolarHBondContact OG-N 3.24Å; S299-S302 VanDerWaalsContact OG-N 3.15Å; S299-S302 PolarHBondContact OG-OG 3.3Å; S299-S302 VanDerWaalsContact OG-OG 3.11Å; S299-C303 PolarHBondContact O-N 3.35Å; S299-C303 VanDerWaalsContact O-N 3.1Å; S299-C303 PolarHBondContact O-SG 3.36Å
300	P	78.9	Confident	88	Confident	86 Å²	86	41.2 Å²	41.2	56%	0.558	20%	0.199	S	C	*	.	H	α-helix	trans	-52.4	-38.6	173.2	-27.1	35.5	0	0	0	112.4	I304	P300-I304 WeakPolarHBondContact O-CD1 3.42Å; P300-I304 WeakPolarHBondContact O-CG1 3.39Å; P300-I304 PolarHBondContact O-N 2.93Å
301	S	78.3	Confident	87.4	Confident	54 Å²	54	34.8 Å²	34.8	38%	0.378	18%	0.183	S	C	.	.	H	α-helix	trans	-61	-48.6	176.8	-61.4	0	0	0	0	113.3	S299 I304 I305	S299-S301 PolarHBondContact O-N 3.17Å; S299-S301 VanDerWaalsContact O-N 3.15Å; S301-I304 PolarHBondContact O-N 3.4Å; S301-I305 WeakPolarHBondContact O-CD1 3.38Å; S301-I305 WeakPolarHBondContact O-CG1 3.45Å; S301-I305 PolarHBondContact O-N 3.44Å
302	S	85.7	Confident	86.6	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-69.6	-39	-178	54.2	0	0	0	0	112.1	F297 S299 I304 I305 L306	F297-S302 WeakPolarHBondContact O-CB 3.38Å; F297-S302 PolarHBondContact O-OG 3.26Å; S299-S302 PolarHBondContact N-OG 2.93Å; S299-S302 PolarHBondContact O-N 3.04Å; S299-S302 VanDerWaalsContact O-N 3.13Å; S299-S302 PolarHBondContact O-OG 3.13Å; S299-S302 PolarHBondContact OG-N 3.24Å; S299-S302 VanDerWaalsContact OG-N 3.15Å; S299-S302 PolarHBondContact OG-OG 3.3Å; S299-S302 VanDerWaalsContact OG-OG 3.11Å; S302-I304 VanDerWaalsContact C-N 3.25Å; S302-I304 PolarHBondContact O-N 2.99Å; S302-I305 PolarHBondContact O-N 2.83Å; S302-I305 VanDerWaalsContact O-N 3.1Å; S302-L306 WeakPolarHBondContact O-CG 3.45Å; S302-L306 PolarHBondContact O-N 2.95Å
303	C	87.1	Confident	85.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.7	-37.7	175.5	-61.9	0	0	0	0	112.6	S299 R307 L347	S299-C303 PolarHBondContact O-N 3.35Å; S299-C303 VanDerWaalsContact O-N 3.1Å; S299-C303 PolarHBondContact O-SG 3.36Å; C303-R307 PolarHBondContact O-N 3.08Å; C303-R307 VanDerWaalsContact O-N 3.1Å; C303-L347 HydrophobicContact CB-CD1 3.8Å
304	I	84.3	Confident	83.9	Confident	6 Å²	6	32 Å²	32	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-72.4	-38.6	176.9	-57.7	151.6	0	0	0	111.3	V230 A232 P300 S301 S302 R307 H308	V230-I304 HydrophobicContact CB-CD1 3.8Å; V230-I304 HydrophobicContact CG1-CD1 3.51Å; V230-I304 HydrophobicContact CG1-CG1 4.05Å; V230-I304 HydrophobicContact CG2-CD1 3.4Å; A232-I304 HydrophobicContact CB-CG2 3.61Å; P300-I304 WeakPolarHBondContact O-CD1 3.42Å; P300-I304 WeakPolarHBondContact O-CG1 3.39Å; P300-I304 PolarHBondContact O-N 2.93Å; S301-I304 PolarHBondContact O-N 3.4Å; S302-I304 VanDerWaalsContact C-N 3.25Å; S302-I304 PolarHBondContact O-N 2.99Å; I304-R307 PolarHBondContact O-N 3.38Å; I304-H308 PolarHBondContact O-N 2.89Å; I304-H308 PolarHBondContact O-ND1 2.84Å
305	I	85.7	Confident	81.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-40.6	177.6	-63.3	160.4	0	0	0	110.3	L234 T267 M270 R271 S301 S302 R307 H308 W309	L234-I305 HydrophobicContact CD1-CB 4.42Å; L234-I305 HydrophobicContact CD1-CG1 3.84Å; L234-I305 HydrophobicContact CD1-CG2 4.49Å; L234-I305 HydrophobicContact CD2-CG1 3.9Å; T267-I305 HydrophobicContact CG2-CD1 3.95Å; M270-I305 HydrophobicContact CB-CG2 3.69Å; M270-I305 HydrophobicContact CE-CG2 4.34Å; R271-I305 HydrophobicContact CB-CD1 4.14Å; S301-I305 WeakPolarHBondContact O-CD1 3.38Å; S301-I305 WeakPolarHBondContact O-CG1 3.45Å; S301-I305 PolarHBondContact O-N 3.44Å; S302-I305 PolarHBondContact O-N 2.83Å; S302-I305 VanDerWaalsContact O-N 3.1Å; I305-R307 PolarHBondContact O-N 2.93Å; I305-H308 WeakPolarHBondContact O-CB 3.3Å; I305-H308 PolarHBondContact O-N 2.71Å; I305-W309 PolarHBondContact O-N 3.05Å
306	L	91.3	Very high	80	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.2	-46.7	171.1	-72.5	170.2	0	0	0	111.7	M270 F297 S302 H308 W309 M310 M327 L330 L331 L334 F336 L347	M270-L306 HydrophobicContact CE-CD2 3.96Å; F297-L306 HydrophobicContact CE1-CD1 4.18Å; S302-L306 WeakPolarHBondContact O-CG 3.45Å; S302-L306 PolarHBondContact O-N 2.95Å; L306-H308 VanDerWaalsContact C-N 3.32Å; L306-H308 PolarHBondContact O-N 2.9Å; L306-W309 PolarHBondContact O-N 2.91Å; L306-M310 WeakPolarHBondContact O-CG 3.45Å; L306-M310 PolarHBondContact O-N 3.11Å; L306-M327 HydrophobicContact CD2-CE 4.48Å; L306-L330 HydrophobicContact CD2-CD2 3.6Å; L306-L330 HydrophobicContact CD2-CG 4.2Å; L306-L331 HydrophobicContact CB-CD2 4.31Å; L306-L331 HydrophobicContact CD1-CD2 4.16Å; L306-L331 HydrophobicContact CD2-CD2 4.44Å; L306-L334 HydrophobicContact CD1-CD1 3.61Å; L306-F336 HydrophobicContact CD1-CZ 4.49Å; L306-L347 HydrophobicContact CB-CD2 4.09Å
307	R	88.7	Confident	78.4	Confident	26 Å²	26	34.6 Å²	34.6	10%	0.098	19%	0.19	C	C	.	.	H	α-helix	trans	-63.3	-38.6	175.9	-161.9	-151.9	64.1	-134.5	8.1	111.9	C303 I304 I305 M310 T311 S345 C346 L347 E350	C303-R307 PolarHBondContact O-N 3.08Å; C303-R307 VanDerWaalsContact O-N 3.1Å; I304-R307 PolarHBondContact O-N 3.38Å; I305-R307 PolarHBondContact O-N 2.93Å; R307-M310 WeakPolarHBondContact O-CB 3.25Å; R307-M310 PolarHBondContact O-N 3.12Å; R307-M310 VanDerWaalsContact O-N 3.15Å; R307-T311 PolarHBondContact O-N 2.8Å; R307-T311 PolarHBondContact O-OG1 3.5Å; R307-S345 WeakPolarHBondContact CD-O 3.42Å; R307-S345 PolarHBondContact NH1-O 3.4Å; R307-C346 WeakPolarHBondContact CD-O 3.45Å; R307-L347 HydrophobicContact CB-CD2 3.73Å; R307-L347 HydrophobicContact CB-CG 4.21Å; R307-L347 HydrophobicContact CG-CD2 4.3Å; R307-E350 HydrophobicContact CG-CB 3.71Å; R307-E350 HydrophobicContact CG-CG 3.9Å
308	H	83.1	Confident	77.1	Confident	28 Å²	28	41.2 Å²	41.2	13%	0.13	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-52.2	172.8	-76.7	67	0	0	0	109.7	A232 L234 F237 I304 I305 L306 M310 T311 D312	A232-H308 PolarHBondContact O-CE1 2.79Å; A232-H308 PolarHBondContact O-NE2 3.31Å; A232-H308 VanDerWaalsContact O-NE2 3.16Å; L234-H308 HydrophobicContact CD1-CB 4.01Å; F237-H308 HydrophobicContact CE2-CB 4.31Å; F237-H308 HydrophobicContact CZ-CB 4.03Å; I304-H308 PolarHBondContact O-N 2.89Å; I304-H308 PolarHBondContact O-ND1 2.84Å; I305-H308 WeakPolarHBondContact O-CB 3.3Å; I305-H308 PolarHBondContact O-N 2.71Å; L306-H308 VanDerWaalsContact C-N 3.32Å; L306-H308 PolarHBondContact O-N 2.9Å; H308-M310 PolarHBondContact O-N 2.92Å; H308-T311 PolarHBondContact O-N 3.37Å; H308-D312 WeakPolarHBondContact O-CA 3.48Å; H308-D312 WeakPolarHBondContact O-CB 3.26Å; H308-D312 PolarHBondContact O-N 2.68Å
309	W	87.1	Confident	76.3	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.6	-23.9	176.4	-74.1	10.1	0	0	0	114.8	F237 M270 R279 L282 I305 L306 Y323 M327	F237-W309 AromaticContact CE1-NE1 3.76Å; F237-W309 AromaticContact CZ-CD1 3.73Å; F237-W309 AromaticContact CZ-NE1 3.84Å; M270-W309 HydrophobicContact CB-CH2 4.1Å; M270-W309 HydrophobicContact CB-CZ2 3.63Å; M270-W309 HydrophobicContact CE-CD2 4.17Å; M270-W309 HydrophobicContact CE-CE3 3.79Å; M270-W309 HydrophobicContact CE-CH2 3.66Å; M270-W309 HydrophobicContact CE-CZ2 4.02Å; M270-W309 HydrophobicContact CE-CZ3 3.53Å; M270-W309 HydrophobicContact CG-CH2 3.66Å; M270-W309 HydrophobicContact CG-CZ2 3.74Å; M270-W309 HydrophobicContact CG-CZ3 4.48Å; M270-W309 PolarHBondContact O-NE1 3.4Å; M270-W309 HydrophobicContact SD-CH2 4.46Å; R279-W309 HydrophobicContact CB-CE3 4.46Å; R279-W309 HydrophobicContact CB-CH2 3.91Å; R279-W309 HydrophobicContact CB-CZ2 4.14Å; R279-W309 HydrophobicContact CB-CZ3 4.07Å; R279-W309 HydrophobicContact CG-CD2 4.35Å; R279-W309 HydrophobicContact CG-CH2 4.03Å; R279-W309 HydrophobicContact CG-CZ2 3.72Å; R279-W309 HydrophobicContact CG-CZ3 4.46Å; R279-W309 WeakPolarHBondContact O-CZ3 3.16Å; L282-W309 HydrophobicContact CB-CH2 3.95Å; L282-W309 HydrophobicContact CD1-CH2 4.13Å; L282-W309 HydrophobicContact CD1-CZ2 4.43Å; I305-W309 PolarHBondContact O-N 3.05Å; L306-W309 PolarHBondContact O-N 2.91Å; W309-Y323 WeakPolarHBondContact CB-OH 3.36Å; W309-Y323 PolarHBondContact O-OH 2.65Å; W309-M327 HydrophobicContact CB-CE 3.6Å; W309-M327 HydrophobicContact CB-SD 4.19Å; W309-M327 HydrophobicContact CE3-CE 4.38Å; W309-M327 HydrophobicContact CE3-SD 3.95Å
310	M	88.6	Confident	76.1	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-78.8	-41.3	171.4	-64.5	173.5	74.7	0	0	113.8	L306 R307 H308 V313 M327 L331 L347 E350 L351 W354	L306-M310 WeakPolarHBondContact O-CG 3.45Å; L306-M310 PolarHBondContact O-N 3.11Å; R307-M310 WeakPolarHBondContact O-CB 3.25Å; R307-M310 PolarHBondContact O-N 3.12Å; R307-M310 VanDerWaalsContact O-N 3.15Å; H308-M310 PolarHBondContact O-N 2.92Å; M310-V313 VanDerWaalsContact O-CG2 3.31Å; M310-V313 WeakPolarHBondContact O-CG2 3.45Å; M310-M327 HydrophobicContact CG-CE 4Å; M310-L331 HydrophobicContact CE-CD1 3.85Å; M310-L331 HydrophobicContact CG-CD1 4.21Å; M310-L331 HydrophobicContact SD-CD1 3.54Å; M310-L331 VanDerWaalsContact SD-CD1 3.54Å; M310-L347 HydrophobicContact SD-CD2 3.77Å; M310-E350 HydrophobicContact CB-CG 3.79Å; M310-E350 HydrophobicContact CE-CB 4.12Å; M310-E350 HydrophobicContact CE-CG 4.19Å; M310-E350 HydrophobicContact SD-CB 4.31Å; M310-E350 HydrophobicContact SD-CG 4.37Å; M310-L351 HydrophobicContact CE-CB 4.15Å; M310-L351 HydrophobicContact CE-CD1 4.38Å; M310-W354 HydrophobicContact CB-CH2 4.08Å; M310-W354 HydrophobicContact CB-CZ2 3.73Å; M310-W354 HydrophobicContact CE-CD2 3.97Å; M310-W354 HydrophobicContact CE-CE3 3.93Å; M310-W354 HydrophobicContact CE-CH2 4.35Å; M310-W354 HydrophobicContact CE-CZ2 4.38Å; M310-W354 HydrophobicContact CE-CZ3 4.12Å; M310-W354 HydrophobicContact CG-CH2 3.9Å; M310-W354 HydrophobicContact CG-CZ2 4.06Å; M310-W354 HydrophobicContact CG-CZ3 4.41Å; M310-W354 WeakPolarHBondContact O-CZ2 3.46Å
311	T	81.8	Confident	76.3	Confident	76 Å²	76	42.5 Å²	42.5	47%	0.466	22%	0.221	S	C	.	.	H	α-helix	trans	-78	-37.3	178.6	-49.8	0	0	0	0	112.1	R307 H308 V313 E350	R307-T311 PolarHBondContact O-N 2.8Å; R307-T311 PolarHBondContact O-OG1 3.5Å; H308-T311 PolarHBondContact O-N 3.37Å; T311-V313 PolarHBondContact O-N 3.23Å; T311-E350 WeakPolarHBondContact CB-OE1 3.4Å; T311-E350 PolarHBondContact OG1-OE1 3.21Å
312	D	74.8	Confident	76.6	Confident	48 Å²	48	43.5 Å²	43.5	26%	0.257	22%	0.22	S	C	.	.			trans	-95.9	61.9	-168.4	-170.5	72.5	0	0	0	109.6	F237 R279 H308 I314	F237-D312 WeakPolarHBondContact CD2-OD2 3.19Å; F237-D312 HydrophobicContact CE2-CB 4.35Å; F237-D312 WeakPolarHBondContact CE2-OD2 3.29Å; R279-D312 IonicContact CZ-OD2 2.71Å; R279-D312 PolarHBondContact NH1-O 2.97Å; R279-D312 IonicContact NH1-OD2 3.26Å; R279-D312 IonicContact NH2-OD2 3.01Å; R279-D312 PolarHBondContact NH2-OD2 2.91Å; H308-D312 WeakPolarHBondContact O-CA 3.48Å; H308-D312 WeakPolarHBondContact O-CB 3.26Å; H308-D312 PolarHBondContact O-N 2.68Å; D312-I314 PolarHBondContact O-N 3.03Å; D312-I314 WeakPolarHBondContact OD1-CD1 3.42Å; D312-I314 WeakPolarHBondContact OD1-CG1 3.45Å; D312-I314 WeakPolarHBondContact OD2-CD1 3.41Å; D312-I314 WeakPolarHBondContact OD2-CG1 3.35Å
313	V	68.2	Low	76.7	Confident	29 Å²	29	43.8 Å²	43.8	18%	0.176	22%	0.221	C	C	.	.			trans	-78.1	50.1	177.9	-164.5	0	0	0	0	109.8	M310 T311 D315 V320 Y323 L363	M310-V313 VanDerWaalsContact O-CG2 3.31Å; M310-V313 WeakPolarHBondContact O-CG2 3.45Å; T311-V313 PolarHBondContact O-N 3.23Å; V313-D315 PolarHBondContact O-N 3.19Å; V313-V320 HydrophobicContact CG1-CG1 3.89Å; V313-Y323 HydrophobicContact CG1-CD1 4.14Å; V313-Y323 HydrophobicContact CG1-CE1 4.47Å; V313-L363 HydrophobicContact CB-CD1 4.46Å; V313-L363 HydrophobicContact CG2-CD1 4.34Å
314	I	57.1	Low	76.9	Confident	56 Å²	56	43.8 Å²	43.8	29%	0.287	22%	0.221	S	C	.	.			trans	-50.2	122.8	-175.3	-75.6	-179.4	0	0	0	110.8	F237 D312 C316	F237-I314 HydrophobicContact CD2-CD1 4.38Å; D312-I314 PolarHBondContact O-N 3.03Å; D312-I314 WeakPolarHBondContact OD1-CD1 3.42Å; D312-I314 WeakPolarHBondContact OD1-CG1 3.45Å; D312-I314 WeakPolarHBondContact OD2-CD1 3.41Å; D312-I314 WeakPolarHBondContact OD2-CG1 3.35Å; I314-C316 PolarHBondContact O-N 3.2Å; I314-C316 PolarHBondContact O-SG 3.34Å
315	D	53.2	Low	77.2	Confident	114 Å²	114	45.3 Å²	45.3	61%	0.61	23%	0.229	S	C	*	.	S	Bend	trans	46.5	12.8	155.1	-49.2	-26.1	0	0	0	118.5	V313 Y317	V313-D315 PolarHBondContact O-N 3.19Å; D315-Y317 HydrophobicContact CB-CE2 4.02Å; D315-Y317 WeakPolarHBondContact O-CD2 3.42Å; D315-Y317 WeakPolarHBondContact O-CE2 3.46Å; D315-Y317 PolarHBondContact O-N 3.48Å; D315-Y317 VanDerWaalsContact O-N 3.13Å
316	C	52.7	Low	77.4	Confident	24 Å²	24	49.4 Å²	49.4	16%	0.162	25%	0.247	C	C	.	.			trans	-86.1	29.4	-176.1	-70.4	0	0	0	0	112.8	L276 I314 D318 K319 V320	L276-C316 HydrophobicContact CD1-CB 4.44Å; L276-C316 HydrophobicContact CD2-CB 4.1Å; I314-C316 PolarHBondContact O-N 3.2Å; I314-C316 PolarHBondContact O-SG 3.34Å; C316-D318 PolarHBondContact O-N 3.23Å; C316-K319 PolarHBondContact O-N 3.1Å; C316-V320 WeakPolarHBondContact O-CG2 3.5Å
317	Y	55.3	Low	77.5	Confident	121 Å²	121	49.5 Å²	49.5	48%	0.475	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	22.1	-162.5	18.7	-150.6	0	0	0	117.6	D315 K367	D315-Y317 HydrophobicContact CB-CE2 4.02Å; D315-Y317 WeakPolarHBondContact O-CD2 3.42Å; D315-Y317 WeakPolarHBondContact O-CE2 3.46Å; D315-Y317 PolarHBondContact O-N 3.48Å; D315-Y317 VanDerWaalsContact O-N 3.13Å; Y317-K367 VanDerWaalsContact C-NZ 3.32Å; Y317-K367 HydrophobicContact CD1-CB 4.38Å; Y317-K367 HydrophobicContact CD1-CG 4.47Å; Y317-K367 HydrophobicContact CG-CD 4.37Å; Y317-K367 HydrophobicContact CG-CG 4.48Å; Y317-K367 VanDerWaalsContact O-CD 3.31Å; Y317-K367 WeakPolarHBondContact O-CD 3.3Å; Y317-K367 WeakPolarHBondContact O-CE 3.26Å; Y317-K367 PolarHBondContact O-NZ 2.87Å
318	D	63.7	Low	77.8	Confident	142 Å²	142	48.3 Å²	48.3	76%	0.759	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-6.5	165.8	-59.2	-60	0	0	0	113.1	C316 K367	C316-D318 PolarHBondContact O-N 3.23Å; D318-K367 IonicContact OD1-NZ 2.65Å; D318-K367 PolarHBondContact OD1-NZ 3Å; D318-K367 IonicContact OD2-NZ 3.24Å; D318-K367 PolarHBondContact OD2-NZ 2.73Å
319	K	74.2	Confident	78.4	Confident	98 Å²	98	49.9 Å²	49.9	43%	0.426	25%	0.252	S	S	.	.	S	Bend	trans	-144.6	30.9	-173.2	-75	178.5	164	-80.8	0	113.4	L276 C316 D321 E322 Y323	L276-K319 HydrophobicContact CD2-CB 4.16Å; L276-K319 HydrophobicContact CD2-CD 4.35Å; C316-K319 PolarHBondContact O-N 3.1Å; K319-D321 PolarHBondContact O-N 3.35Å; K319-E322 HydrophobicContact CB-CB 4.47Å; K319-E322 IonicContact NZ-OE1 3.79Å; K319-E322 IonicContact NZ-OE2 3.35Å; K319-E322 PolarHBondContact NZ-OE2 2.91Å; K319-E322 PolarHBondContact O-N 3.11Å; K319-Y323 WeakPolarHBondContact O-CB 3.27Å; K319-Y323 PolarHBondContact O-N 3Å
320	V	78.5	Confident	78.8	Confident	20 Å²	20	49.9 Å²	49.9	12%	0.121	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-41.7	-171.8	-174.5	0	0	0	0	112.1	V313 C316 Y323 V324 L364	V313-V320 HydrophobicContact CG1-CG1 3.89Å; C316-V320 WeakPolarHBondContact O-CG2 3.5Å; V320-Y323 PolarHBondContact O-N 3.29Å; V320-V324 HydrophobicContact CG1-CG2 4.5Å; V320-V324 WeakPolarHBondContact O-CB 3.45Å; V320-V324 VanDerWaalsContact O-CG2 3.28Å; V320-V324 WeakPolarHBondContact O-CG2 3.35Å; V320-V324 PolarHBondContact O-N 3.08Å; V320-L364 HydrophobicContact CB-CD2 3.79Å; V320-L364 HydrophobicContact CG1-CD2 3.64Å
321	D	83.2	Confident	79.2	Confident	48 Å²	48	49.8 Å²	49.8	26%	0.257	25%	0.252	S	S	.	.	H	α-helix	trans	-68.6	-43.4	178.2	66.5	-36.8	0	0	0	112.2	K319 Y323 V324 L325 L364 N385 I389	K319-D321 PolarHBondContact O-N 3.35Å; D321-Y323 VanDerWaalsContact C-N 3.32Å; D321-Y323 PolarHBondContact O-N 2.91Å; D321-V324 PolarHBondContact O-N 3.3Å; D321-L325 WeakPolarHBondContact O-CB 3.37Å; D321-L325 VanDerWaalsContact O-CG 3.31Å; D321-L325 WeakPolarHBondContact O-CG 3.36Å; D321-L325 PolarHBondContact O-N 3Å; D321-L364 HydrophobicContact CB-CD2 4.1Å; D321-N385 HydrophobicContact CB-CB 4.32Å; D321-N385 PolarHBondContact OD2-ND2 2.89Å; D321-I389 HydrophobicContact CB-CD1 4.2Å
322	E	84.5	Confident	79.8	Confident	76 Å²	76	51.4 Å²	51.4	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-57.4	-45.1	172.1	-174.6	-176.7	176.7	0	0	111	K319 K326	K319-E322 HydrophobicContact CB-CB 4.47Å; K319-E322 IonicContact NZ-OE1 3.79Å; K319-E322 IonicContact NZ-OE2 3.35Å; K319-E322 PolarHBondContact NZ-OE2 2.91Å; K319-E322 PolarHBondContact O-N 3.11Å; E322-K326 WeakPolarHBondContact O-CB 3.32Å; E322-K326 VanDerWaalsContact O-CG 3.23Å; E322-K326 WeakPolarHBondContact O-CG 3.49Å; E322-K326 PolarHBondContact O-N 3.46Å
323	Y	88	Confident	80.7	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.02	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-47.2	177.1	-178.2	-112.7	0	0	0	112.4	L276 R279 L280 W309 V313 K319 V320 D321 L325 K326 M327	L276-Y323 HydrophobicContact CD1-CD2 3.42Å; L276-Y323 VanDerWaalsContact CD1-CD2 3.42Å; L276-Y323 HydrophobicContact CD1-CE2 4.01Å; L276-Y323 HydrophobicContact CD1-CG 3.96Å; R279-Y323 HydrophobicContact CB-CE2 4.3Å; R279-Y323 WeakPolarHBondContact CD-OH 3.27Å; R279-Y323 PolarHBondContact NH1-OH 2.99Å; L280-Y323 HydrophobicContact CD2-CD2 4.13Å; W309-Y323 WeakPolarHBondContact CB-OH 3.36Å; W309-Y323 PolarHBondContact O-OH 2.65Å; V313-Y323 HydrophobicContact CG1-CD1 4.14Å; V313-Y323 HydrophobicContact CG1-CE1 4.47Å; K319-Y323 WeakPolarHBondContact O-CB 3.27Å; K319-Y323 PolarHBondContact O-N 3Å; V320-Y323 PolarHBondContact O-N 3.29Å; D321-Y323 VanDerWaalsContact C-N 3.32Å; D321-Y323 PolarHBondContact O-N 2.91Å; Y323-L325 PolarHBondContact O-N 3.47Å; Y323-K326 PolarHBondContact O-N 3.27Å; Y323-M327 HydrophobicContact CD1-CG 4.35Å; Y323-M327 HydrophobicContact CD2-CG 4.41Å; Y323-M327 HydrophobicContact CE1-CG 3.98Å; Y323-M327 HydrophobicContact CE2-CG 4.02Å; Y323-M327 HydrophobicContact CE2-SD 4.26Å; Y323-M327 WeakPolarHBondContact O-CB 3.26Å; Y323-M327 WeakPolarHBondContact O-CG 3.32Å; Y323-M327 PolarHBondContact O-N 3.2Å
324	V	89.9	Confident	82.1	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-63.1	-42.4	178.5	168	0	0	0	0	111.2	V320 D321 K326 M327 L328 W354 I389	V320-V324 HydrophobicContact CG1-CG2 4.5Å; V320-V324 WeakPolarHBondContact O-CB 3.45Å; V320-V324 VanDerWaalsContact O-CG2 3.28Å; V320-V324 WeakPolarHBondContact O-CG2 3.35Å; V320-V324 PolarHBondContact O-N 3.08Å; D321-V324 PolarHBondContact O-N 3.3Å; V324-K326 PolarHBondContact O-N 3.01Å; V324-M327 PolarHBondContact O-N 3.13Å; V324-L328 WeakPolarHBondContact O-CG 3.42Å; V324-L328 PolarHBondContact O-N 3Å; V324-W354 HydrophobicContact CB-CH2 4.41Å; V324-W354 HydrophobicContact CG1-CD2 4.41Å; V324-W354 HydrophobicContact CG1-CE3 3.96Å; V324-W354 HydrophobicContact CG1-CH2 4.12Å; V324-W354 HydrophobicContact CG1-CZ3 3.82Å; V324-W354 HydrophobicContact CG2-CH2 4.15Å; V324-W354 HydrophobicContact CG2-CZ2 4.21Å; V324-I389 HydrophobicContact CB-CD1 4.4Å; V324-I389 HydrophobicContact CG1-CD1 4.03Å; V324-I389 HydrophobicContact CG1-CG1 4.25Å; V324-I389 HydrophobicContact CG1-CG2 3.48Å; V324-I389 VanDerWaalsContact CG1-CG2 3.48Å
325	L	90.6	Very high	83.8	Confident	37 Å²	37	49.3 Å²	49.3	19%	0.194	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-40.7	175.5	-76.2	169.3	0	0	0	112.4	D321 Y323 L328 D329 I389 K392	D321-L325 WeakPolarHBondContact O-CB 3.37Å; D321-L325 VanDerWaalsContact O-CG 3.31Å; D321-L325 WeakPolarHBondContact O-CG 3.36Å; D321-L325 PolarHBondContact O-N 3Å; Y323-L325 PolarHBondContact O-N 3.47Å; L325-L328 PolarHBondContact O-N 3.09Å; L325-D329 PolarHBondContact O-N 3.04Å; L325-I389 HydrophobicContact CD2-CG1 3.64Å; L325-I389 HydrophobicContact CG-CD1 4.26Å; L325-I389 HydrophobicContact CG-CG1 3.83Å; L325-K392 HydrophobicContact CD2-CD 4.28Å; L325-K392 PolarHBondContact O-NZ 2.89Å
326	K	91.5	Very high	85.7	Confident	86 Å²	86	44.6 Å²	44.6	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-69.3	-36	175.1	-73.2	-69.2	-178.6	-170.5	0	113.2	L280 E322 Y323 V324 L328 D329 L330	L280-K326 HydrophobicContact CD2-CB 3.89Å; L280-K326 HydrophobicContact CD2-CG 3.97Å; E322-K326 WeakPolarHBondContact O-CB 3.32Å; E322-K326 VanDerWaalsContact O-CG 3.23Å; E322-K326 WeakPolarHBondContact O-CG 3.49Å; E322-K326 PolarHBondContact O-N 3.46Å; Y323-K326 PolarHBondContact O-N 3.27Å; V324-K326 PolarHBondContact O-N 3.01Å; K326-L328 VanDerWaalsContact C-N 3.35Å; K326-D329 PolarHBondContact O-N 3.08Å; K326-L330 WeakPolarHBondContact O-CB 3.19Å; K326-L330 PolarHBondContact O-N 3.32Å
327	M	93.1	Very high	87.2	Confident	3 Å²	3	47 Å²	47	2%	0.015	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-39.5	171.8	-75.8	-61	-63.1	0	0	111.2	L306 W309 M310 Y323 V324 L330 L331 W354	L306-M327 HydrophobicContact CD2-CE 4.48Å; W309-M327 HydrophobicContact CB-CE 3.6Å; W309-M327 HydrophobicContact CB-SD 4.19Å; W309-M327 HydrophobicContact CE3-CE 4.38Å; W309-M327 HydrophobicContact CE3-SD 3.95Å; M310-M327 HydrophobicContact CG-CE 4Å; Y323-M327 HydrophobicContact CD1-CG 4.35Å; Y323-M327 HydrophobicContact CD2-CG 4.41Å; Y323-M327 HydrophobicContact CE1-CG 3.98Å; Y323-M327 HydrophobicContact CE2-CG 4.02Å; Y323-M327 HydrophobicContact CE2-SD 4.26Å; Y323-M327 WeakPolarHBondContact O-CB 3.26Å; Y323-M327 WeakPolarHBondContact O-CG 3.32Å; Y323-M327 PolarHBondContact O-N 3.2Å; V324-M327 PolarHBondContact O-N 3.13Å; M327-L330 PolarHBondContact O-N 3.28Å; M327-L330 HydrophobicContact SD-CD2 4.16Å; M327-L331 WeakPolarHBondContact O-CB 3.4Å; M327-L331 VanDerWaalsContact O-CG 3.23Å; M327-L331 WeakPolarHBondContact O-CG 3.31Å; M327-L331 PolarHBondContact O-N 3.06Å; M327-W354 HydrophobicContact CB-CH2 3.77Å; M327-W354 HydrophobicContact CB-CZ3 3.92Å; M327-W354 HydrophobicContact CG-CH2 4.41Å
328	L	94.9	Very high	88.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-38.5	172.1	-72.1	173.5	0	0	0	112.6	V324 L325 K326 N332 L351 W354 I389 K392 A393 M396	V324-L328 WeakPolarHBondContact O-CG 3.42Å; V324-L328 PolarHBondContact O-N 3Å; L325-L328 PolarHBondContact O-N 3.09Å; K326-L328 VanDerWaalsContact C-N 3.35Å; L328-N332 VanDerWaalsContact O-CB 3.27Å; L328-N332 WeakPolarHBondContact O-CB 3.49Å; L328-N332 PolarHBondContact O-N 3.39Å; L328-L351 HydrophobicContact CD2-CD1 3.78Å; L328-W354 HydrophobicContact CD2-CE3 3.83Å; L328-W354 HydrophobicContact CD2-CZ3 4.17Å; L328-W354 HydrophobicContact CG-CE3 4Å; L328-W354 HydrophobicContact CG-CZ3 4.02Å; L328-I389 HydrophobicContact CD1-CG2 4Å; L328-K392 HydrophobicContact CB-CD 3.85Å; L328-K392 HydrophobicContact CB-CG 4.27Å; L328-K392 HydrophobicContact CD1-CB 4.1Å; L328-K392 HydrophobicContact CD1-CD 3.87Å; L328-K392 HydrophobicContact CD1-CG 4.02Å; L328-K392 HydrophobicContact CG-CD 4.5Å; L328-A393 HydrophobicContact CD2-CB 4.13Å; L328-M396 HydrophobicContact CD2-CE 3.48Å; L328-M396 VanDerWaalsContact CD2-CE 3.48Å
329	D	95.1	Very high	90.1	Very high	60 Å²	60	37.3 Å²	37.3	32%	0.321	19%	0.194	S	C	.	.	H	α-helix	trans	-62.9	-45.9	173.2	-71.2	-34.1	0	0	0	112.1	M287 L325 K326 L331 N332 C333 K392	M287-D329 HydrophobicContact SD-CB 3.77Å; L325-D329 PolarHBondContact O-N 3.04Å; K326-D329 PolarHBondContact O-N 3.08Å; D329-L331 PolarHBondContact O-N 3.31Å; D329-N332 PolarHBondContact O-N 3.07Å; D329-C333 PolarHBondContact O-N 2.69Å; D329-K392 VanDerWaalsContact CG-NZ 3.29Å; D329-K392 WeakPolarHBondContact OD1-CE 3.25Å; D329-K392 IonicContact OD1-NZ 2.72Å; D329-K392 PolarHBondContact OD1-NZ 3.3Å; D329-K392 IonicContact OD2-NZ 3.78Å
330	L	96.1	Very high	90.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-44	178.4	176.2	63.3	0	0	0	111.9	A283 I286 M287 L306 K326 M327 C333 L334	A283-L330 HydrophobicContact CB-CD1 4.41Å; A283-L330 HydrophobicContact CB-CD2 3.84Å; I286-L330 HydrophobicContact CB-CD1 3.75Å; I286-L330 HydrophobicContact CD1-CD1 4.15Å; I286-L330 HydrophobicContact CG2-CD1 3.64Å; M287-L330 HydrophobicContact CG-CD1 4.11Å; M287-L330 HydrophobicContact SD-CB 4.45Å; L306-L330 HydrophobicContact CD2-CD2 3.6Å; L306-L330 HydrophobicContact CD2-CG 4.2Å; K326-L330 WeakPolarHBondContact O-CB 3.19Å; K326-L330 PolarHBondContact O-N 3.32Å; M327-L330 PolarHBondContact O-N 3.28Å; M327-L330 HydrophobicContact SD-CD2 4.16Å; L330-C333 PolarHBondContact O-SG 3.19Å; L330-L334 WeakPolarHBondContact O-CD1 3.31Å; L330-L334 VanDerWaalsContact O-CG 3.31Å; L330-L334 WeakPolarHBondContact O-CG 3.38Å
331	L	96.4	Very high	91	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.8	-38.8	179	-67.9	169.8	0	0	0	111.9	L306 M310 M327 D329 C333 L334 F336 L347 M396 W400	L306-L331 HydrophobicContact CB-CD2 4.31Å; L306-L331 HydrophobicContact CD1-CD2 4.16Å; L306-L331 HydrophobicContact CD2-CD2 4.44Å; M310-L331 HydrophobicContact CE-CD1 3.85Å; M310-L331 HydrophobicContact CG-CD1 4.21Å; M310-L331 HydrophobicContact SD-CD1 3.54Å; M310-L331 VanDerWaalsContact SD-CD1 3.54Å; M327-L331 WeakPolarHBondContact O-CB 3.4Å; M327-L331 VanDerWaalsContact O-CG 3.23Å; M327-L331 WeakPolarHBondContact O-CG 3.31Å; M327-L331 PolarHBondContact O-N 3.06Å; D329-L331 PolarHBondContact O-N 3.31Å; L331-C333 VanDerWaalsContact C-N 3.34Å; L331-C333 PolarHBondContact O-N 2.97Å; L331-L334 PolarHBondContact O-N 2.92Å; L331-F336 HydrophobicContact CD2-CZ 4.45Å; L331-L347 HydrophobicContact CD2-CD2 4.33Å; L331-M396 HydrophobicContact CB-CE 3.68Å; L331-M396 HydrophobicContact CB-SD 3.85Å; L331-M396 HydrophobicContact CD1-CE 4.12Å; L331-W400 HydrophobicContact CB-CH2 4.11Å; L331-W400 HydrophobicContact CB-CZ2 4.1Å; L331-W400 HydrophobicContact CD1-CH2 4.47Å; L331-W400 HydrophobicContact CD2-CH2 4.22Å; L331-W400 HydrophobicContact CG-CH2 4.49Å
332	N	94.8	Very high	91.4	Very high	111 Å²	111	31.2 Å²	31.2	59%	0.594	17%	0.165	S	C	*	.	H	α-helix	trans	-71.3	-26.6	179.8	-167.3	38.3	0	0	0	112.9	L328 D329 L334 M396	L328-N332 VanDerWaalsContact O-CB 3.27Å; L328-N332 WeakPolarHBondContact O-CB 3.49Å; L328-N332 PolarHBondContact O-N 3.39Å; D329-N332 PolarHBondContact O-N 3.07Å; N332-L334 VanDerWaalsContact C-N 3.3Å; N332-L334 PolarHBondContact O-N 3.11Å; N332-M396 HydrophobicContact CB-SD 3.8Å
333	C	94.6	Very high	91.4	Very high	33 Å²	33	30.3 Å²	30.3	22%	0.223	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.2	176.8	91.2	0	0	0	0	113.9	R294 D329 L330 L331	R294-C333 WeakPolarHBondContact CD-O 3.48Å; R294-C333 VanDerWaalsContact CD-SG 3.51Å; R294-C333 PolarHBondContact NH1-O 3.22Å; D329-C333 PolarHBondContact O-N 2.69Å; L330-C333 PolarHBondContact O-SG 3.19Å; L331-C333 VanDerWaalsContact C-N 3.34Å; L331-C333 PolarHBondContact O-N 2.97Å
334	L	95.8	Very high	91	Very high	8 Å²	8	36.9 Å²	36.9	4%	0.042	19%	0.19	C	C	.	.	S	Bend	trans	-90.1	121.8	-172.5	-77	171.5	0	0	0	112	I286 R294 F297 L298 L306 L330 L331 N332 F336	I286-L334 HydrophobicContact CG2-CD2 3.96Å; R294-L334 HydrophobicContact CB-CD2 4.14Å; R294-L334 HydrophobicContact CG-CD2 4.13Å; F297-L334 HydrophobicContact CD1-CD1 4.47Å; F297-L334 HydrophobicContact CD1-CD2 3.76Å; F297-L334 HydrophobicContact CE1-CD1 4.09Å; F297-L334 HydrophobicContact CE1-CD2 4.17Å; L298-L334 HydrophobicContact CD1-CB 4.33Å; L298-L334 HydrophobicContact CD2-CB 4.31Å; L298-L334 HydrophobicContact CD2-CD1 4.33Å; L298-L334 HydrophobicContact CD2-CD2 4.32Å; L298-L334 HydrophobicContact CG-CD2 4.23Å; L306-L334 HydrophobicContact CD1-CD1 3.61Å; L330-L334 WeakPolarHBondContact O-CD1 3.31Å; L330-L334 VanDerWaalsContact O-CG 3.31Å; L330-L334 WeakPolarHBondContact O-CG 3.38Å; L331-L334 PolarHBondContact O-N 2.92Å; N332-L334 VanDerWaalsContact C-N 3.3Å; N332-L334 PolarHBondContact O-N 3.11Å; L334-F336 VanDerWaalsContact C-N 3.32Å; L334-F336 HydrophobicContact CB-CD2 4.16Å; L334-F336 HydrophobicContact CB-CE2 3.69Å; L334-F336 HydrophobicContact CB-CZ 4.17Å; L334-F336 HydrophobicContact CD1-CZ 4.31Å; L334-F336 VanDerWaalsContact O-CD2 3.24Å; L334-F336 WeakPolarHBondContact O-CD2 3.39Å; L334-F336 PolarHBondContact O-N 3.28Å
335	P	93.2	Very high	90.7	Very high	48 Å²	48	37 Å²	37	31%	0.312	19%	0.19	S	C	.	.			trans	-80.9	72.9	-174.8	33.3	-36.1	0	0	0	112.1	R294 R295 L298	R294-P335 HydrophobicContact CB-CG 4.45Å; R295-P335 HydrophobicContact CG-CB 4.36Å; R295-P335 HydrophobicContact CG-CG 3.54Å; L298-P335 VanDerWaalsContact CD1-C 3.45Å; L298-P335 HydrophobicContact CD1-CG 4.17Å; L298-P335 WeakPolarHBondContact CD1-O 3.18Å
336	F	92.7	Very high	90.6	Very high	14 Å²	14	36.5 Å²	36.5	6%	0.061	19%	0.19	C	C	.	.			trans	-59.4	123.1	177.6	-69.6	-80.4	0	0	0	111.6	L298 L306 L331 L334 M341 L342 L347 W400 L403	L298-F336 HydrophobicContact CD1-CD1 4.39Å; L298-F336 HydrophobicContact CD2-CD1 3.79Å; L298-F336 HydrophobicContact CD2-CE1 3.44Å; L298-F336 VanDerWaalsContact CD2-CE1 3.44Å; L298-F336 HydrophobicContact CD2-CZ 3.92Å; L306-F336 HydrophobicContact CD1-CZ 4.49Å; L331-F336 HydrophobicContact CD2-CZ 4.45Å; L334-F336 VanDerWaalsContact C-N 3.32Å; L334-F336 HydrophobicContact CB-CD2 4.16Å; L334-F336 HydrophobicContact CB-CE2 3.69Å; L334-F336 HydrophobicContact CB-CZ 4.17Å; L334-F336 HydrophobicContact CD1-CZ 4.31Å; L334-F336 VanDerWaalsContact O-CD2 3.24Å; L334-F336 WeakPolarHBondContact O-CD2 3.39Å; L334-F336 PolarHBondContact O-N 3.28Å; F336-M341 HydrophobicContact CD1-SD 4.15Å; F336-L342 HydrophobicContact CB-CD2 4.32Å; F336-L342 HydrophobicContact CD1-CD2 3.45Å; F336-L342 VanDerWaalsContact CD1-CD2 3.45Å; F336-L342 HydrophobicContact CD1-CG 4.27Å; F336-L342 HydrophobicContact CD2-CD2 4.09Å; F336-L342 HydrophobicContact CE1-CD2 3.62Å; F336-L342 HydrophobicContact CE2-CD2 4.25Å; F336-L342 HydrophobicContact CG-CD2 3.69Å; F336-L342 HydrophobicContact CG-CG 4.39Å; F336-L342 HydrophobicContact CZ-CD2 4.03Å; F336-L347 HydrophobicContact CE1-CD1 3.77Å; F336-L347 HydrophobicContact CZ-CD1 3.9Å; F336-W400 HydrophobicContact CD2-CH2 4.48Å; F336-W400 AromaticContact CD2-CZ2 3.75Å; F336-W400 HydrophobicContact CD2-CZ2 3.75Å; F336-W400 AromaticContact CE2-CH2 3.93Å; F336-W400 HydrophobicContact CE2-CH2 3.93Å; F336-W400 AromaticContact CE2-CZ2 3.47Å; F336-W400 HydrophobicContact CE2-CZ2 3.47Å; F336-W400 VanDerWaalsContact CE2-CZ2 3.47Å; F336-W400 HydrophobicContact CZ-CH2 4.36Å; F336-W400 HydrophobicContact CZ-CZ2 4.33Å; F336-L403 HydrophobicContact CB-CD1 4.29Å
337	P	85.7	Confident	90.5	Very high	75 Å²	75	32.4 Å²	32.4	49%	0.487	17%	0.172	S	C	.	.			trans	-80.5	-30.8	-166.6	29.5	-35.8	0	0	0	114.6	M341	P337-M341 HydrophobicContact CG-CE 3.75Å; P337-M341 HydrophobicContact CG-SD 4.2Å
338	H	88.6	Confident	90.4	Very high	28 Å²	28	33 Å²	33	13%	0.13	18%	0.175	C	C	.	.			trans	-159.8	143.4	-173.9	52.1	58.6	0	0	0	111	T340 M341 K404 E406	H338-T340 PolarHBondContact O-N 2.71Å; H338-T340 VanDerWaalsContact O-N 3.11Å; H338-M341 PolarHBondContact ND1-N 2.7Å; H338-M341 WeakPolarHBondContact O-CB 2.74Å; H338-M341 PolarHBondContact O-N 2.87Å; H338-K404 CarbonylContact C-O 3.59Å; H338-K404 VanDerWaalsContact CA-O 3.27Å; H338-K404 WeakPolarHBondContact CA-O 3.48Å; H338-K404 VanDerWaalsContact CB-O 3.27Å; H338-K404 WeakPolarHBondContact CB-O 3.38Å; H338-E406 HydrophobicContact CB-CB 3.9Å; H338-E406 IonicContact CD2-OE2 3.64Å; H338-E406 PolarHBondContact CD2-OE2 3.07Å; H338-E406 VanDerWaalsContact CD2-OE2 3.27Å
339	K	90.5	Very high	90.1	Very high	31 Å²	31	38.8 Å²	38.8	14%	0.135	20%	0.202	C	C	.	.	H	α-helix	trans	-55.8	-34.2	-174.4	-173.1	176	-172.2	-95	0	113	M341 L342 E343 L348 M401 L403 K404 N405	K339-M341 PolarHBondContact O-N 2.86Å; K339-L342 WeakPolarHBondContact O-CB 3.5Å; K339-L342 PolarHBondContact O-N 3.47Å; K339-E343 HydrophobicContact CG-CG 4.15Å; K339-E343 IonicContact NZ-OE1 3.73Å; K339-E343 PolarHBondContact NZ-OE1 2.99Å; K339-E343 PolarHBondContact O-N 3.37Å; K339-L348 HydrophobicContact CG-CD2 4.39Å; K339-M401 WeakPolarHBondContact CE-SD 3.3Å; K339-L403 HydrophobicContact CB-CB 3.94Å; K339-L403 WeakPolarHBondContact CB-O 3.31Å; K339-K404 PolarHBondContact N-O 3.1Å; K339-N405 WeakPolarHBondContact CB-OD1 3.46Å
340	T	84.5	Confident	89.8	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.025	19%	0.19	C	C	.	.	H	α-helix	trans	-57.4	-18.4	175.6	-40	0	0	0	0	114.3	H338 K344 N405 E406 Y407	H338-T340 PolarHBondContact O-N 2.71Å; H338-T340 VanDerWaalsContact O-N 3.11Å; T340-K344 HydrophobicContact CG2-CD 4.18Å; T340-K344 HydrophobicContact CG2-CG 4.49Å; T340-K344 VanDerWaalsContact O-CB 3.32Å; T340-K344 WeakPolarHBondContact O-CB 3.26Å; T340-K344 VanDerWaalsContact O-CG 3.26Å; T340-K344 WeakPolarHBondContact O-CG 3.1Å; T340-K344 PolarHBondContact O-N 3.44Å; T340-N405 PolarHBondContact N-OD1 2.91Å; T340-N405 VanDerWaalsContact N-OD1 3.1Å; T340-N405 WeakPolarHBondContact OG1-CA 2.95Å; T340-N405 PolarHBondContact OG1-OD1 2.79Å; T340-E406 PolarHBondContact OG1-N 3.43Å; T340-Y407 HydrophobicContact CG2-CD1 3.8Å; T340-Y407 HydrophobicContact CG2-CE1 3.47Å; T340-Y407 VanDerWaalsContact CG2-CE1 3.47Å
341	M	87.3	Confident	89.7	Confident	35 Å²	35	36.5 Å²	36.5	17%	0.172	19%	0.19	C	C	.	.	H	α-helix	trans	-78.7	-39.5	172.7	-177.4	176.1	-75.5	0	0	111.6	F336 P337 H338 K339 S345	F336-M341 HydrophobicContact CD1-SD 4.15Å; P337-M341 HydrophobicContact CG-CE 3.75Å; P337-M341 HydrophobicContact CG-SD 4.2Å; H338-M341 PolarHBondContact ND1-N 2.7Å; H338-M341 WeakPolarHBondContact O-CB 2.74Å; H338-M341 PolarHBondContact O-N 2.87Å; K339-M341 PolarHBondContact O-N 2.86Å; M341-S345 WeakPolarHBondContact O-CB 3.39Å; M341-S345 PolarHBondContact O-N 2.68Å; M341-S345 PolarHBondContact O-OG 3.45Å
342	L	90.7	Very high	89.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-72.5	-41	179.3	-59.9	169.3	0	0	0	111	F336 K339 S345 C346 L347 L348 W400 L403	F336-L342 HydrophobicContact CB-CD2 4.32Å; F336-L342 HydrophobicContact CD1-CD2 3.45Å; F336-L342 VanDerWaalsContact CD1-CD2 3.45Å; F336-L342 HydrophobicContact CD1-CG 4.27Å; F336-L342 HydrophobicContact CD2-CD2 4.09Å; F336-L342 HydrophobicContact CE1-CD2 3.62Å; F336-L342 HydrophobicContact CE2-CD2 4.25Å; F336-L342 HydrophobicContact CG-CD2 3.69Å; F336-L342 HydrophobicContact CG-CG 4.39Å; F336-L342 HydrophobicContact CZ-CD2 4.03Å; K339-L342 WeakPolarHBondContact O-CB 3.5Å; K339-L342 PolarHBondContact O-N 3.47Å; L342-S345 PolarHBondContact O-N 2.68Å; L342-S345 PolarHBondContact O-OG 3.33Å; L342-C346 PolarHBondContact O-N 3.22Å; L342-C346 VanDerWaalsContact O-N 3.13Å; L342-L347 HydrophobicContact CD2-CB 4.01Å; L342-L347 HydrophobicContact CD2-CD1 4.01Å; L342-L347 PolarHBondContact O-N 3.31Å; L342-L348 HydrophobicContact CB-CB 4.08Å; L342-W400 HydrophobicContact CD1-CB 3.7Å; L342-W400 HydrophobicContact CD1-CD2 3.56Å; L342-W400 HydrophobicContact CD1-CE3 3.62Å; L342-W400 HydrophobicContact CD1-CG 3.62Å; L342-W400 HydrophobicContact CD1-CZ3 4.44Å; L342-W400 HydrophobicContact CD2-CD2 4.14Å; L342-W400 HydrophobicContact CD2-CE3 3.77Å; L342-W400 HydrophobicContact CD2-CH2 4.06Å; L342-W400 HydrophobicContact CD2-CZ2 4.41Å; L342-W400 HydrophobicContact CD2-CZ3 3.72Å; L342-W400 HydrophobicContact CG-CD2 4.49Å; L342-W400 HydrophobicContact CG-CE3 4.23Å; L342-L403 HydrophobicContact CD1-CD1 3.86Å
343	E	85	Confident	89.3	Confident	57 Å²	57	36.4 Å²	36.4	27%	0.266	19%	0.191	S	C	.	.	H	α-helix	trans	-60.4	-54.4	173	-67.5	171.8	165.6	0	0	110.8	K339 S345 C346 L348 N405	K339-E343 HydrophobicContact CG-CG 4.15Å; K339-E343 IonicContact NZ-OE1 3.73Å; K339-E343 PolarHBondContact NZ-OE1 2.99Å; K339-E343 PolarHBondContact O-N 3.37Å; E343-S345 PolarHBondContact O-N 3.27Å; E343-S345 VanDerWaalsContact O-N 3.09Å; E343-C346 PolarHBondContact O-N 2.92Å; E343-L348 HydrophobicContact CG-CD2 4.27Å; E343-N405 PolarHBondContact OE2-OD1 3.27Å
344	K	79.5	Confident	89.1	Confident	143 Å²	143	34.9 Å²	34.9	62%	0.622	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-9.7	-178.4	-72.4	-177.5	176.2	-176.2	0	115.5	T340	T340-K344 HydrophobicContact CG2-CD 4.18Å; T340-K344 HydrophobicContact CG2-CG 4.49Å; T340-K344 VanDerWaalsContact O-CB 3.32Å; T340-K344 WeakPolarHBondContact O-CB 3.26Å; T340-K344 VanDerWaalsContact O-CG 3.26Å; T340-K344 WeakPolarHBondContact O-CG 3.1Å; T340-K344 PolarHBondContact O-N 3.44Å
345	S	84.3	Confident	88.9	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.021	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-6.2	173.1	52.3	0	0	0	0	113.1	R307 M341 L342 E343 L347	R307-S345 WeakPolarHBondContact CD-O 3.42Å; R307-S345 PolarHBondContact NH1-O 3.4Å; M341-S345 WeakPolarHBondContact O-CB 3.39Å; M341-S345 PolarHBondContact O-N 2.68Å; M341-S345 PolarHBondContact O-OG 3.45Å; L342-S345 PolarHBondContact O-N 2.68Å; L342-S345 PolarHBondContact O-OG 3.33Å; E343-S345 PolarHBondContact O-N 3.27Å; E343-S345 VanDerWaalsContact O-N 3.09Å; S345-L347 PolarHBondContact O-N 3.31Å
346	C	88.5	Confident	88.8	Confident	27 Å²	27	38.4 Å²	38.4	18%	0.182	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	19.7	-168.5	-54	0	0	0	0	114.1	R307 L342 E343 L348 E349 E350	R307-C346 WeakPolarHBondContact CD-O 3.45Å; L342-C346 PolarHBondContact O-N 3.22Å; L342-C346 VanDerWaalsContact O-N 3.13Å; E343-C346 PolarHBondContact O-N 2.92Å; C346-L348 VanDerWaalsContact C-N 3.34Å; C346-E349 HydrophobicContact CB-CB 4.47Å; C346-E349 WeakPolarHBondContact CB-OE2 3.37Å; C346-E349 PolarHBondContact O-N 2.88Å; C346-E349 PolarHBondContact SG-OE2 3.48Å; C346-E350 PolarHBondContact O-N 3.33Å; C346-E350 VanDerWaalsContact O-N 3.07Å
347	L	90.4	Very high	88.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-36.4	175.6	-84.1	173.9	0	0	0	112.2	C303 L306 R307 M310 L331 F336 L342 S345 L351 W400	C303-L347 HydrophobicContact CB-CD1 3.8Å; L306-L347 HydrophobicContact CB-CD2 4.09Å; R307-L347 HydrophobicContact CB-CD2 3.73Å; R307-L347 HydrophobicContact CB-CG 4.21Å; R307-L347 HydrophobicContact CG-CD2 4.3Å; M310-L347 HydrophobicContact SD-CD2 3.77Å; L331-L347 HydrophobicContact CD2-CD2 4.33Å; F336-L347 HydrophobicContact CE1-CD1 3.77Å; F336-L347 HydrophobicContact CZ-CD1 3.9Å; L342-L347 HydrophobicContact CD2-CB 4.01Å; L342-L347 HydrophobicContact CD2-CD1 4.01Å; L342-L347 PolarHBondContact O-N 3.31Å; S345-L347 PolarHBondContact O-N 3.31Å; L347-L351 WeakPolarHBondContact O-CB 3.49Å; L347-L351 PolarHBondContact O-N 3.1Å; L347-W400 HydrophobicContact CB-CZ3 4.26Å
348	L	90	Very high	88.6	Confident	14 Å²	14	40.5 Å²	40.5	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-40	178.4	-172.4	65.6	0	0	0	111.5	K339 L342 E343 C346 G352 W400 M401	K339-L348 HydrophobicContact CG-CD2 4.39Å; L342-L348 HydrophobicContact CB-CB 4.08Å; E343-L348 HydrophobicContact CG-CD2 4.27Å; C346-L348 VanDerWaalsContact C-N 3.34Å; L348-G352 PolarHBondContact O-N 3.31Å; L348-W400 HydrophobicContact CD1-CB 3.98Å; L348-W400 HydrophobicContact CD1-CE3 4.27Å; L348-M401 HydrophobicContact CD1-CG 4.33Å; L348-M401 HydrophobicContact CD1-SD 4.49Å; L348-M401 HydrophobicContact CD2-SD 3.92Å
349	E	87.9	Confident	88.5	Confident	124 Å²	124	42.3 Å²	42.3	58%	0.579	22%	0.215	S	C	*	.	H	α-helix	trans	-67.8	-41.4	177.9	-61.1	173	162.2	0	0	111.2	C346 G352 K353	C346-E349 HydrophobicContact CB-CB 4.47Å; C346-E349 WeakPolarHBondContact CB-OE2 3.37Å; C346-E349 PolarHBondContact O-N 2.88Å; C346-E349 PolarHBondContact SG-OE2 3.48Å; E349-G352 PolarHBondContact O-N 3.29Å; E349-K353 PolarHBondContact O-N 2.94Å
350	E	89.8	Confident	88.2	Confident	12 Å²	12	40.9 Å²	40.9	6%	0.056	21%	0.209	C	C	.	.	H	α-helix	trans	-68.5	-43	178.2	-152.9	66.3	-164.1	0	0	112.2	R307 M310 T311 C346 G352 K353 W354	R307-E350 HydrophobicContact CG-CB 3.71Å; R307-E350 HydrophobicContact CG-CG 3.9Å; M310-E350 HydrophobicContact CB-CG 3.79Å; M310-E350 HydrophobicContact CE-CB 4.12Å; M310-E350 HydrophobicContact CE-CG 4.19Å; M310-E350 HydrophobicContact SD-CB 4.31Å; M310-E350 HydrophobicContact SD-CG 4.37Å; T311-E350 WeakPolarHBondContact CB-OE1 3.4Å; T311-E350 PolarHBondContact OG1-OE1 3.21Å; C346-E350 PolarHBondContact O-N 3.33Å; C346-E350 VanDerWaalsContact O-N 3.07Å; E350-G352 VanDerWaalsContact C-N 3.25Å; E350-G352 PolarHBondContact O-N 2.9Å; E350-K353 WeakPolarHBondContact O-CB 3.46Å; E350-K353 PolarHBondContact O-N 2.85Å; E350-K353 IonicContact OE1-NZ 2.74Å; E350-K353 PolarHBondContact OE1-NZ 3.19Å; E350-K353 VanDerWaalsContact OE2-CE 3.31Å; E350-K353 WeakPolarHBondContact OE2-CE 3.26Å; E350-K353 IonicContact OE2-NZ 3.21Å; E350-K353 PolarHBondContact OE2-NZ 2.9Å; E350-W354 PolarHBondContact O-N 3Å
351	L	93.8	Very high	88.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-35.7	173.1	-176.2	63.4	0	0	0	111.6	M310 L328 L347 K353 W354 T355 A393 M396 H397 W400	M310-L351 HydrophobicContact CE-CB 4.15Å; M310-L351 HydrophobicContact CE-CD1 4.38Å; L328-L351 HydrophobicContact CD2-CD1 3.78Å; L347-L351 WeakPolarHBondContact O-CB 3.49Å; L347-L351 PolarHBondContact O-N 3.1Å; L351-K353 PolarHBondContact O-N 2.94Å; L351-W354 PolarHBondContact O-N 3.35Å; L351-T355 PolarHBondContact O-N 2.7Å; L351-A393 HydrophobicContact CD1-CB 3.87Å; L351-M396 HydrophobicContact CD1-CE 3.52Å; L351-M396 HydrophobicContact CD2-CB 4.16Å; L351-M396 HydrophobicContact CD2-CE 3.75Å; L351-M396 HydrophobicContact CD2-CG 3.91Å; L351-M396 HydrophobicContact CG-CE 4.3Å; L351-H397 HydrophobicContact CD2-CB 3.93Å; L351-H397 HydrophobicContact CG-CB 4.17Å; L351-W400 HydrophobicContact CB-CZ3 4.27Å; L351-W400 HydrophobicContact CD2-CD2 4.09Å; L351-W400 HydrophobicContact CD2-CE3 3.55Å; L351-W400 HydrophobicContact CD2-CH2 4.14Å; L351-W400 HydrophobicContact CD2-CZ3 3.59Å
352	G	91.4	Very high	87.9	Confident	26 Å²	26	48.4 Å²	48.4	27%	0.268	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-21	173.4	0	0	0	0	0	114.5	L348 E349 E350 T355	L348-G352 PolarHBondContact O-N 3.31Å; E349-G352 PolarHBondContact O-N 3.29Å; E350-G352 VanDerWaalsContact C-N 3.25Å; E350-G352 PolarHBondContact O-N 2.9Å; G352-T355 PolarHBondContact O-OG1 3.32Å; G352-T355 VanDerWaalsContact O-OG1 3.08Å
353	K	90.5	Very high	87.3	Confident	82 Å²	82	50 Å²	50	36%	0.357	25%	0.251	S	S	.	.	H	α-helix	trans	-74.4	-38.6	168.6	-57.9	172.8	-175.7	169.3	0	111.3	E349 E350 L351 T355 N356 F359	E349-K353 PolarHBondContact O-N 2.94Å; E350-K353 WeakPolarHBondContact O-CB 3.46Å; E350-K353 PolarHBondContact O-N 2.85Å; E350-K353 IonicContact OE1-NZ 2.74Å; E350-K353 PolarHBondContact OE1-NZ 3.19Å; E350-K353 VanDerWaalsContact OE2-CE 3.31Å; E350-K353 WeakPolarHBondContact OE2-CE 3.26Å; E350-K353 IonicContact OE2-NZ 3.21Å; E350-K353 PolarHBondContact OE2-NZ 2.9Å; L351-K353 PolarHBondContact O-N 2.94Å; K353-T355 PolarHBondContact O-N 3.41Å; K353-N356 WeakPolarHBondContact O-CB 3.39Å; K353-N356 PolarHBondContact O-N 3Å; K353-F359 HydrophobicContact CB-CD1 3.96Å; K353-F359 HydrophobicContact CB-CE1 3.88Å; K353-F359 HydrophobicContact CB-CE2 4.47Å; K353-F359 HydrophobicContact CB-CG 4.32Å; K353-F359 HydrophobicContact CB-CZ 4.14Å; K353-F359 HydrophobicContact CD-CE2 4.39Å; K353-F359 HydrophobicContact CD-CZ 4.2Å; K353-F359 WeakPolarHBondContact O-CD1 3.35Å
354	W	91.2	Very high	86.9	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-73.6	-7.9	-177.7	-69.6	13.4	0	0	0	113.5	M310 V324 M327 L328 E350 L351 N356 F359 L360 A393	M310-W354 HydrophobicContact CB-CH2 4.08Å; M310-W354 HydrophobicContact CB-CZ2 3.73Å; M310-W354 HydrophobicContact CE-CD2 3.97Å; M310-W354 HydrophobicContact CE-CE3 3.93Å; M310-W354 HydrophobicContact CE-CH2 4.35Å; M310-W354 HydrophobicContact CE-CZ2 4.38Å; M310-W354 HydrophobicContact CE-CZ3 4.12Å; M310-W354 HydrophobicContact CG-CH2 3.9Å; M310-W354 HydrophobicContact CG-CZ2 4.06Å; M310-W354 HydrophobicContact CG-CZ3 4.41Å; M310-W354 WeakPolarHBondContact O-CZ2 3.46Å; V324-W354 HydrophobicContact CB-CH2 4.41Å; V324-W354 HydrophobicContact CG1-CD2 4.41Å; V324-W354 HydrophobicContact CG1-CE3 3.96Å; V324-W354 HydrophobicContact CG1-CH2 4.12Å; V324-W354 HydrophobicContact CG1-CZ3 3.82Å; V324-W354 HydrophobicContact CG2-CH2 4.15Å; V324-W354 HydrophobicContact CG2-CZ2 4.21Å; M327-W354 HydrophobicContact CB-CH2 3.77Å; M327-W354 HydrophobicContact CB-CZ3 3.92Å; M327-W354 HydrophobicContact CG-CH2 4.41Å; L328-W354 HydrophobicContact CD2-CE3 3.83Å; L328-W354 HydrophobicContact CD2-CZ3 4.17Å; L328-W354 HydrophobicContact CG-CE3 4Å; L328-W354 HydrophobicContact CG-CZ3 4.02Å; E350-W354 PolarHBondContact O-N 3Å; L351-W354 PolarHBondContact O-N 3.35Å; W354-N356 VanDerWaalsContact C-N 3.34Å; W354-F359 AromaticContact CD1-CE1 3.74Å; W354-L360 HydrophobicContact CB-CD2 4.4Å; W354-L360 HydrophobicContact CG-CD2 4.44Å; W354-L360 WeakPolarHBondContact O-CD1 3.36Å; W354-A393 HydrophobicContact CB-CB 3.92Å; W354-A393 WeakPolarHBondContact O-CB 3.29Å
355	T	91.8	Very high	86.3	Confident	48 Å²	48	46.8 Å²	46.8	29%	0.294	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-17	166.4	70	0	0	0	0	112.7	L351 G352 K353 V357 A393 E394 H397	L351-T355 PolarHBondContact O-N 2.7Å; G352-T355 PolarHBondContact O-OG1 3.32Å; G352-T355 VanDerWaalsContact O-OG1 3.08Å; K353-T355 PolarHBondContact O-N 3.41Å; T355-V357 PolarHBondContact O-N 3.3Å; T355-A393 HydrophobicContact CG2-CB 4.14Å; T355-E394 HydrophobicContact CG2-CB 4.12Å; T355-H397 HydrophobicContact CG2-CB 4.18Å
356	N	90.3	Very high	85	Confident	82 Å²	82	53.5 Å²	53.5	44%	0.439	28%	0.28	S	S	.	.			trans	-86	110.2	-177.9	-175.8	-46.3	0	0	0	110.6	K353 W354 D358 F359 L360	K353-N356 WeakPolarHBondContact O-CB 3.39Å; K353-N356 PolarHBondContact O-N 3Å; W354-N356 VanDerWaalsContact C-N 3.34Å; N356-D358 VanDerWaalsContact C-N 3.27Å; N356-D358 PolarHBondContact O-N 3.47Å; N356-D358 WeakPolarHBondContact OD1-CA 3.41Å; N356-D358 PolarHBondContact OD1-N 2.96Å; N356-F359 HydrophobicContact CB-CB 3.94Å; N356-F359 WeakPolarHBondContact O-CB 3.28Å; N356-F359 PolarHBondContact O-N 3.16Å; N356-F359 PolarHBondContact OD1-N 3.04Å; N356-L360 PolarHBondContact O-N 3.49Å
357	V	89	Confident	83	Confident	41 Å²	41	56.6 Å²	56.6	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-36.6	179.9	170.7	0	0	0	0	112.8	T355 L360 K361 V386 A390	T355-V357 PolarHBondContact O-N 3.3Å; V357-L360 PolarHBondContact O-N 2.88Å; V357-K361 HydrophobicContact CG1-CD 4.31Å; V357-K361 VanDerWaalsContact CG1-CE 3.45Å; V357-K361 VanDerWaalsContact O-CG 3.28Å; V357-K361 WeakPolarHBondContact O-CG 3.4Å; V357-K361 PolarHBondContact O-N 2.88Å; V357-V386 HydrophobicContact CG1-CG1 4Å; V357-A390 HydrophobicContact CG2-CB 3.71Å
358	D	85.1	Confident	80.6	Confident	92 Å²	92	65.8 Å²	65.8	49%	0.492	33%	0.33	S	S	.	.	H	α-helix	trans	-79.5	-29.5	-179.2	-61.7	-35.1	0	0	0	112.6	N356 K361 Q362	N356-D358 VanDerWaalsContact C-N 3.27Å; N356-D358 PolarHBondContact O-N 3.47Å; N356-D358 WeakPolarHBondContact OD1-CA 3.41Å; N356-D358 PolarHBondContact OD1-N 2.96Å; D358-K361 IonicContact OD1-NZ 3.75Å; D358-K361 PolarHBondContact OD1-NZ 3.2Å; D358-Q362 WeakPolarHBondContact O-CB 3.35Å; D358-Q362 VanDerWaalsContact O-CG 3.26Å; D358-Q362 WeakPolarHBondContact O-CG 3.38Å; D358-Q362 PolarHBondContact O-N 2.68Å
359	F	86.9	Confident	78	Confident	66 Å²	66	71.3 Å²	71.3	29%	0.289	37%	0.365	S	S	.	.	H	α-helix	trans	-64.6	-45.8	166.7	175.4	-92.7	0	0	0	111.1	K353 W354 N356 Q362 L363	K353-F359 HydrophobicContact CB-CD1 3.96Å; K353-F359 HydrophobicContact CB-CE1 3.88Å; K353-F359 HydrophobicContact CB-CE2 4.47Å; K353-F359 HydrophobicContact CB-CG 4.32Å; K353-F359 HydrophobicContact CB-CZ 4.14Å; K353-F359 HydrophobicContact CD-CE2 4.39Å; K353-F359 HydrophobicContact CD-CZ 4.2Å; K353-F359 WeakPolarHBondContact O-CD1 3.35Å; W354-F359 AromaticContact CD1-CE1 3.74Å; N356-F359 HydrophobicContact CB-CB 3.94Å; N356-F359 WeakPolarHBondContact O-CB 3.28Å; N356-F359 PolarHBondContact O-N 3.16Å; N356-F359 PolarHBondContact OD1-N 3.04Å; F359-Q362 PolarHBondContact O-N 2.83Å; F359-L363 HydrophobicContact CE1-CD2 4.18Å; F359-L363 WeakPolarHBondContact O-CB 3.48Å; F359-L363 PolarHBondContact O-N 3.17Å
360	L	85.1	Confident	75.6	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-62.3	-42.9	175.6	-70.8	178	0	0	0	112	W354 N356 V357 Q362 L363 L364 V386 I389 A390	W354-L360 HydrophobicContact CB-CD2 4.4Å; W354-L360 HydrophobicContact CG-CD2 4.44Å; W354-L360 WeakPolarHBondContact O-CD1 3.36Å; N356-L360 PolarHBondContact O-N 3.49Å; V357-L360 PolarHBondContact O-N 2.88Å; L360-Q362 PolarHBondContact O-N 3.26Å; L360-L363 PolarHBondContact O-N 3.31Å; L360-L364 WeakPolarHBondContact O-CB 3.42Å; L360-L364 WeakPolarHBondContact O-CG 3.44Å; L360-L364 PolarHBondContact O-N 3.06Å; L360-V386 HydrophobicContact CB-CG1 3.96Å; L360-V386 HydrophobicContact CD1-CG1 4.34Å; L360-I389 HydrophobicContact CD1-CB 4.03Å; L360-I389 HydrophobicContact CD1-CG2 3.58Å; L360-I389 HydrophobicContact CD2-CG2 3.79Å; L360-I389 HydrophobicContact CG-CG2 4.35Å; L360-A390 HydrophobicContact CD1-CB 3.81Å
361	K	83.7	Confident	73	Confident	79 Å²	79	82.7 Å²	82.7	34%	0.343	42%	0.418	S	S	.	.	H	α-helix	trans	-56.3	-49	172.3	-75.6	169.2	-166.5	154.9	0	110.9	V357 D358 L363 L364 S365 V386	V357-K361 HydrophobicContact CG1-CD 4.31Å; V357-K361 VanDerWaalsContact CG1-CE 3.45Å; V357-K361 VanDerWaalsContact O-CG 3.28Å; V357-K361 WeakPolarHBondContact O-CG 3.4Å; V357-K361 PolarHBondContact O-N 2.88Å; D358-K361 IonicContact OD1-NZ 3.75Å; D358-K361 PolarHBondContact OD1-NZ 3.2Å; K361-L363 VanDerWaalsContact C-N 3.33Å; K361-L363 PolarHBondContact O-N 3.1Å; K361-L364 PolarHBondContact O-N 3.22Å; K361-S365 WeakPolarHBondContact O-CA 3.13Å; K361-S365 WeakPolarHBondContact O-CB 3.39Å; K361-S365 PolarHBondContact O-N 2.85Å; K361-S365 PolarHBondContact O-OG 3.11Å; K361-V386 HydrophobicContact CG-CG1 4.25Å
362	Q	81.8	Confident	70.5	Confident	119 Å²	119	91 Å²	91	56%	0.556	46%	0.457	S	S	*	.	H	α-helix	trans	-62.6	-36.9	178.4	-73	169.9	30.7	0	0	113.1	D358 F359 L360 Q366	D358-Q362 WeakPolarHBondContact O-CB 3.35Å; D358-Q362 VanDerWaalsContact O-CG 3.26Å; D358-Q362 WeakPolarHBondContact O-CG 3.38Å; D358-Q362 PolarHBondContact O-N 2.68Å; F359-Q362 PolarHBondContact O-N 2.83Å; L360-Q362 PolarHBondContact O-N 3.26Å; Q362-Q366 VanDerWaalsContact O-CG 3.28Å; Q362-Q366 WeakPolarHBondContact O-CG 3.1Å; Q362-Q366 PolarHBondContact O-NE2 3.24Å
363	L	77.9	Confident	67.6	Low	33 Å²	33	96.5 Å²	96.5	17%	0.173	48%	0.479	C	S	.	.	H	α-helix	trans	-68.8	-40.6	177.4	-178.1	64.8	0	0	0	111.8	V313 F359 L360 K361	V313-L363 HydrophobicContact CB-CD1 4.46Å; V313-L363 HydrophobicContact CG2-CD1 4.34Å; F359-L363 HydrophobicContact CE1-CD2 4.18Å; F359-L363 WeakPolarHBondContact O-CB 3.48Å; F359-L363 PolarHBondContact O-N 3.17Å; L360-L363 PolarHBondContact O-N 3.31Å; K361-L363 VanDerWaalsContact C-N 3.33Å; K361-L363 PolarHBondContact O-N 3.1Å
364	L	75.7	Confident	65	Low	47 Å²	47	99.6 Å²	99.6	25%	0.246	50%	0.5	C	S	.	.	H	α-helix	trans	-83.8	-26.8	-178.7	-67.5	163.9	0	0	0	112.8	V320 D321 L360 K361 Q366 V386 I389	V320-L364 HydrophobicContact CB-CD2 3.79Å; V320-L364 HydrophobicContact CG1-CD2 3.64Å; D321-L364 HydrophobicContact CB-CD2 4.1Å; L360-L364 WeakPolarHBondContact O-CB 3.42Å; L360-L364 WeakPolarHBondContact O-CG 3.44Å; L360-L364 PolarHBondContact O-N 3.06Å; K361-L364 PolarHBondContact O-N 3.22Å; L364-Q366 VanDerWaalsContact C-N 3.34Å; L364-V386 HydrophobicContact CD1-CG2 3.79Å; L364-I389 HydrophobicContact CD1-CD1 4.47Å
365	S	68.1	Low	62.5	Low	86 Å²	86	104.9 Å²	104.9	60%	0.601	54%	0.537	S	S	*	.	S	Bend	trans	-86.8	3.3	179.7	80.3	0	0	0	0	114.2	K361 K367	K361-S365 WeakPolarHBondContact O-CA 3.13Å; K361-S365 WeakPolarHBondContact O-CB 3.39Å; K361-S365 PolarHBondContact O-N 2.85Å; K361-S365 PolarHBondContact O-OG 3.11Å; S365-K367 PolarHBondContact O-N 3.47Å
366	Q	55.6	Low	59.6	Low	143 Å²	143	107.7 Å²	107.7	67%	0.668	57%	0.565	S	S	*	*	S	Bend	trans	-73	14.2	-178.1	-98.5	168	56.4	0	0	114.7	Q362 L364	Q362-Q366 VanDerWaalsContact O-CG 3.28Å; Q362-Q366 WeakPolarHBondContact O-CG 3.1Å; Q362-Q366 PolarHBondContact O-NE2 3.24Å; L364-Q366 VanDerWaalsContact C-N 3.34Å
367	K	48.3	Very low	57.1	Low	93 Å²	93	112.7 Å²	112.7	40%	0.404	59%	0.586	S	S	.	*			trans	-140.1	90.4	173.1	-164.5	-153.7	-129.5	170.6	0	112.5	Y317 D318 S365	Y317-K367 VanDerWaalsContact C-NZ 3.32Å; Y317-K367 HydrophobicContact CD1-CB 4.38Å; Y317-K367 HydrophobicContact CD1-CG 4.47Å; Y317-K367 HydrophobicContact CG-CD 4.37Å; Y317-K367 HydrophobicContact CG-CG 4.48Å; Y317-K367 VanDerWaalsContact O-CD 3.31Å; Y317-K367 WeakPolarHBondContact O-CD 3.3Å; Y317-K367 WeakPolarHBondContact O-CE 3.26Å; Y317-K367 PolarHBondContact O-NZ 2.87Å; D318-K367 IonicContact OD1-NZ 2.65Å; D318-K367 PolarHBondContact OD1-NZ 3Å; D318-K367 IonicContact OD2-NZ 3.24Å; D318-K367 PolarHBondContact OD2-NZ 2.73Å; S365-K367 PolarHBondContact O-N 3.47Å
368	K	39.7	Very low	54.4	Low	193 Å²	193	120.7 Å²	120.7	84%	0.839	62%	0.621	S	S	*	*	S	Bend	trans	-163.3	10.7	155.4	-121.6	172.7	-173.5	175.5	0	115.6
369	T	35.5	Very low	51.8	Low	130 Å²	130	119.6 Å²	119.6	80%	0.798	63%	0.631	S	S	*	*	S	Bend	trans	-108.8	135.6	167.4	46.7	0	0	0	0	108.4
370	E	36.4	Very low	49.6	Very low	186 Å²	186	124 Å²	124	87%	0.869	66%	0.658	S	S	*	*	S	Bend	trans	78.9	128.7	-166	-54.9	178.3	-155.9	0	0	113.1
371	E	35.8	Very low	47.8	Very low	189 Å²	189	128.6 Å²	128.6	88%	0.883	68%	0.682	S	S	*	*	S	Bend	trans	71.2	139.2	-172.6	-53	-161.8	161.8	0	0	119.1
372	H	40.1	Very low	46.3	Very low	175 Å²	175	129.5 Å²	129.5	81%	0.81	70%	0.696	S	S	*	*			trans	58.2	97.1	178.4	-89	-73.4	0	0	0	121.6
373	N	31.3	Very low	45.1	Very low	140 Å²	140	128 Å²	128	75%	0.749	69%	0.692	S	S	*	*			trans	-65.6	168.3	135.9	-77.3	-32	0	0	0	111.1
374	D	35.5	Very low	44.4	Very low	147 Å²	147	131 Å²	131	79%	0.786	71%	0.712	S	S	*	*	S	Bend	trans	76.8	147.8	168.5	-57.1	-38.1	0	0	0	118
375	S	38.5	Very low	44.5	Very low	112 Å²	112	131.3 Å²	131.3	78%	0.783	71%	0.713	S	S	*	*			trans	57	85.4	-176.1	52.4	0	0	0	0	116.7
376	A	30.8	Very low	45.3	Very low	107 Å²	107	127.4 Å²	127.4	88%	0.884	69%	0.686	S	S	*	*			trans	-71.1	126.7	156.5	0	0	0	0	0	110.2
377	Q	38.5	Very low	46.9	Very low	188 Å²	188	125.8 Å²	125.8	88%	0.879	68%	0.682	S	S	*	*			trans	-128.6	140.2	159.2	-65.3	-161.1	-77.5	0	0	108.8
378	E	32.3	Very low	48.8	Very low	208 Å²	208	125.2 Å²	125.2	97%	0.972	69%	0.686	S	S	*	*			trans	-80.6	120.3	179.6	-62	170.6	129.1	0	0	109.3
379	G	30.6	Very low	51.3	Low	69 Å²	69	116 Å²	116	71%	0.711	65%	0.646	S	S	*	*			trans	-173.7	126.1	178.5	0	0	0	0	0	111.8
380	D	40.4	Very low	54	Low	159 Å²	159	110.1 Å²	110.1	85%	0.85	61%	0.61	S	S	*	*			trans	38.7	115.1	173.5	-60.8	-19.1	0	0	0	118.9	P382	D380-P382 VanDerWaalsContact O-CD 3.29Å; D380-P382 WeakPolarHBondContact O-CD 3.34Å
381	D	48.3	Very low	56.7	Low	97 Å²	97	107.2 Å²	107.2	52%	0.519	60%	0.595	S	S	.	*			trans	-69.1	117.5	174.5	-179.2	2.9	0	0	0	111.6	L383 T384	D381-L383 PolarHBondContact O-N 2.75Å; D381-L383 WeakPolarHBondContact OD1-CD1 3.28Å; D381-L383 PolarHBondContact OD1-N 3.03Å; D381-T384 HydrophobicContact CB-CG2 4.34Å; D381-T384 WeakPolarHBondContact O-CG2 3.33Å; D381-T384 PolarHBondContact O-N 2.89Å; D381-T384 PolarHBondContact O-OG1 3.25Å
382	P	50.8	Low	59.5	Low	98 Å²	98	100.7 Å²	100.7	64%	0.636	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-12.5	178.9	-22.9	35.2	0	0	0	115.1	D380 T384	D380-P382 VanDerWaalsContact O-CD 3.29Å; D380-P382 WeakPolarHBondContact O-CD 3.34Å; P382-T384 VanDerWaalsContact C-N 3.35Å
383	L	57.5	Low	62.1	Low	89 Å²	89	92.3 Å²	92.3	47%	0.466	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.1	179.9	-78	81.5	0	0	0	113.9	D381 N385 V386	D381-L383 PolarHBondContact O-N 2.75Å; D381-L383 WeakPolarHBondContact OD1-CD1 3.28Å; D381-L383 PolarHBondContact OD1-N 3.03Å; L383-N385 PolarHBondContact O-N 3.32Å; L383-N385 VanDerWaalsContact O-N 3.07Å; L383-V386 HydrophobicContact CB-CG2 4.34Å; L383-V386 HydrophobicContact CG-CG2 4.48Å; L383-V386 WeakPolarHBondContact O-CB 3.33Å; L383-V386 VanDerWaalsContact O-CG2 3.31Å; L383-V386 WeakPolarHBondContact O-CG2 3.4Å; L383-V386 PolarHBondContact O-N 3.41Å
384	T	63.1	Low	65.1	Low	96 Å²	96	90.5 Å²	90.5	59%	0.589	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.6	-174.2	45.5	0	0	0	0	115.2	D381 P382	D381-T384 HydrophobicContact CB-CG2 4.34Å; D381-T384 WeakPolarHBondContact O-CG2 3.33Å; D381-T384 PolarHBondContact O-N 2.89Å; D381-T384 PolarHBondContact O-OG1 3.25Å; P382-T384 VanDerWaalsContact C-N 3.35Å
385	N	78	Confident	67.8	Low	53 Å²	53	89 Å²	89	28%	0.283	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.1	179.7	-76	-30.2	0	0	0	114.8	D321 L383 V388 I389	D321-N385 HydrophobicContact CB-CB 4.32Å; D321-N385 PolarHBondContact OD2-ND2 2.89Å; L383-N385 PolarHBondContact O-N 3.32Å; L383-N385 VanDerWaalsContact O-N 3.07Å; N385-V388 PolarHBondContact O-N 2.94Å; N385-I389 HydrophobicContact CB-CD1 4.4Å; N385-I389 VanDerWaalsContact O-CG1 3.3Å; N385-I389 WeakPolarHBondContact O-CG1 2.88Å; N385-I389 PolarHBondContact O-N 3.45Å
386	V	85.7	Confident	70.5	Confident	4 Å²	4	84.1 Å²	84.1	2%	0.024	47%	0.465	C	S	.	.	H	α-helix	trans	-61.3	-51.7	-173.4	178.9	0	0	0	0	111.8	V357 L360 K361 L364 L383 V388 I389 A390	V357-V386 HydrophobicContact CG1-CG1 4Å; L360-V386 HydrophobicContact CB-CG1 3.96Å; L360-V386 HydrophobicContact CD1-CG1 4.34Å; K361-V386 HydrophobicContact CG-CG1 4.25Å; L364-V386 HydrophobicContact CD1-CG2 3.79Å; L383-V386 HydrophobicContact CB-CG2 4.34Å; L383-V386 HydrophobicContact CG-CG2 4.48Å; L383-V386 WeakPolarHBondContact O-CB 3.33Å; L383-V386 VanDerWaalsContact O-CG2 3.31Å; L383-V386 WeakPolarHBondContact O-CG2 3.4Å; L383-V386 PolarHBondContact O-N 3.41Å; V386-V388 VanDerWaalsContact C-N 3.28Å; V386-V388 PolarHBondContact O-N 3.38Å; V386-I389 PolarHBondContact O-N 2.9Å; V386-A390 PolarHBondContact O-N 2.99Å
387	D	87.2	Confident	73.5	Confident	109 Å²	109	80.9 Å²	80.9	58%	0.583	43%	0.432	S	S	*	.	H	α-helix	trans	-69.6	-29.5	-176.6	-60.8	-40.2	0	0	0	111.9	K391	D387-K391 VanDerWaalsContact O-CB 3.29Å; D387-K391 WeakPolarHBondContact O-CB 3.43Å; D387-K391 PolarHBondContact O-N 3.25Å
388	V	89.6	Confident	76.1	Confident	80 Å²	80	75.8 Å²	75.8	49%	0.485	41%	0.41	S	S	.	.	H	α-helix	trans	-66.7	-44.1	174.2	-176.2	0	0	0	0	110.6	N385 V386 K392	N385-V388 PolarHBondContact O-N 2.94Å; V386-V388 VanDerWaalsContact C-N 3.28Å; V386-V388 PolarHBondContact O-N 3.38Å; V388-K392 VanDerWaalsContact O-CB 3.25Å; V388-K392 WeakPolarHBondContact O-CB 3.24Å; V388-K392 PolarHBondContact O-N 3.1Å; V388-K392 VanDerWaalsContact O-N 3.1Å
389	I	91.2	Very high	79	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-64	-49.5	175	-69.4	166	0	0	0	110.3	D321 V324 L325 L328 L360 L364 N385 V386 K391 K392 A393	D321-I389 HydrophobicContact CB-CD1 4.2Å; V324-I389 HydrophobicContact CB-CD1 4.4Å; V324-I389 HydrophobicContact CG1-CD1 4.03Å; V324-I389 HydrophobicContact CG1-CG1 4.25Å; V324-I389 HydrophobicContact CG1-CG2 3.48Å; V324-I389 VanDerWaalsContact CG1-CG2 3.48Å; L325-I389 HydrophobicContact CD2-CG1 3.64Å; L325-I389 HydrophobicContact CG-CD1 4.26Å; L325-I389 HydrophobicContact CG-CG1 3.83Å; L328-I389 HydrophobicContact CD1-CG2 4Å; L360-I389 HydrophobicContact CD1-CB 4.03Å; L360-I389 HydrophobicContact CD1-CG2 3.58Å; L360-I389 HydrophobicContact CD2-CG2 3.79Å; L360-I389 HydrophobicContact CG-CG2 4.35Å; L364-I389 HydrophobicContact CD1-CD1 4.47Å; N385-I389 HydrophobicContact CB-CD1 4.4Å; N385-I389 VanDerWaalsContact O-CG1 3.3Å; N385-I389 WeakPolarHBondContact O-CG1 2.88Å; N385-I389 PolarHBondContact O-N 3.45Å; V386-I389 PolarHBondContact O-N 2.9Å; I389-K391 PolarHBondContact O-N 2.91Å; I389-K392 PolarHBondContact O-N 3.42Å; I389-A393 WeakPolarHBondContact O-CB 3.48Å; I389-A393 PolarHBondContact O-N 3.27Å
390	A	92.7	Very high	82	Confident	7 Å²	7	66.6 Å²	66.6	6%	0.058	36%	0.356	C	S	.	.	H	α-helix	trans	-57.3	-49.3	-178.4	0	0	0	0	0	111.9	V357 L360 V386 A393 E394	V357-A390 HydrophobicContact CG2-CB 3.71Å; L360-A390 HydrophobicContact CD1-CB 3.81Å; V386-A390 PolarHBondContact O-N 2.99Å; A390-A393 PolarHBondContact O-N 3.1Å; A390-E394 WeakPolarHBondContact O-CB 3.23Å; A390-E394 PolarHBondContact O-N 3.15Å
391	K	93	Very high	84.3	Confident	124 Å²	124	63.5 Å²	63.5	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-62.8	-44.7	178.1	179.5	174.9	171.9	176.8	0	112.4	D387 I389 A393 E394 E395	D387-K391 VanDerWaalsContact O-CB 3.29Å; D387-K391 WeakPolarHBondContact O-CB 3.43Å; D387-K391 PolarHBondContact O-N 3.25Å; I389-K391 PolarHBondContact O-N 2.91Å; K391-A393 VanDerWaalsContact C-N 3.29Å; K391-A393 PolarHBondContact O-N 3.28Å; K391-E394 PolarHBondContact O-N 3.13Å; K391-E395 WeakPolarHBondContact CE-OE1 3.17Å; K391-E395 IonicContact NZ-OE1 2.68Å; K391-E395 WeakPolarHBondContact O-CG 3.05Å; K391-E395 PolarHBondContact O-N 3.11Å
392	K	94.4	Very high	86.3	Confident	52 Å²	52	66.1 Å²	66.1	23%	0.226	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-36	177.7	-174.6	-178.5	-177	-173.6	0	111.7	L325 L328 D329 V388 I389 M396	L325-K392 HydrophobicContact CD2-CD 4.28Å; L325-K392 PolarHBondContact O-NZ 2.89Å; L328-K392 HydrophobicContact CB-CD 3.85Å; L328-K392 HydrophobicContact CB-CG 4.27Å; L328-K392 HydrophobicContact CD1-CB 4.1Å; L328-K392 HydrophobicContact CD1-CD 3.87Å; L328-K392 HydrophobicContact CD1-CG 4.02Å; L328-K392 HydrophobicContact CG-CD 4.5Å; D329-K392 VanDerWaalsContact CG-NZ 3.29Å; D329-K392 WeakPolarHBondContact OD1-CE 3.25Å; D329-K392 IonicContact OD1-NZ 2.72Å; D329-K392 PolarHBondContact OD1-NZ 3.3Å; D329-K392 IonicContact OD2-NZ 3.78Å; V388-K392 VanDerWaalsContact O-CB 3.25Å; V388-K392 WeakPolarHBondContact O-CB 3.24Å; V388-K392 PolarHBondContact O-N 3.1Å; V388-K392 VanDerWaalsContact O-N 3.1Å; I389-K392 PolarHBondContact O-N 3.42Å; K392-M396 PolarHBondContact O-N 3Å
393	A	94.4	Very high	88.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-41.3	172.9	0	0	0	0	0	112.1	L328 L351 W354 T355 I389 A390 K391 M396 H397	L328-A393 HydrophobicContact CD2-CB 4.13Å; L351-A393 HydrophobicContact CD1-CB 3.87Å; W354-A393 HydrophobicContact CB-CB 3.92Å; W354-A393 WeakPolarHBondContact O-CB 3.29Å; T355-A393 HydrophobicContact CG2-CB 4.14Å; I389-A393 WeakPolarHBondContact O-CB 3.48Å; I389-A393 PolarHBondContact O-N 3.27Å; A390-A393 PolarHBondContact O-N 3.1Å; K391-A393 VanDerWaalsContact C-N 3.29Å; K391-A393 PolarHBondContact O-N 3.28Å; A393-M396 PolarHBondContact O-N 3.4Å; A393-H397 VanDerWaalsContact O-CB 3.26Å; A393-H397 WeakPolarHBondContact O-CB 3.46Å; A393-H397 PolarHBondContact O-N 3.35Å
394	E	94	Very high	89.5	Confident	102 Å²	102	68.1 Å²	68.1	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-64.7	-48	178.8	178.6	176.1	-157.9	0	0	112.3	T355 A390 K391 M396 H397 N398	T355-E394 HydrophobicContact CG2-CB 4.12Å; A390-E394 WeakPolarHBondContact O-CB 3.23Å; A390-E394 PolarHBondContact O-N 3.15Å; K391-E394 PolarHBondContact O-N 3.13Å; E394-M396 VanDerWaalsContact C-N 3.27Å; E394-M396 PolarHBondContact O-N 3.15Å; E394-H397 PolarHBondContact O-N 3.34Å; E394-N398 WeakPolarHBondContact CG-ND2 3.41Å; E394-N398 WeakPolarHBondContact O-CB 3.44Å; E394-N398 VanDerWaalsContact O-CG 3.31Å; E394-N398 PolarHBondContact O-N 3.01Å; E394-N398 PolarHBondContact O-ND2 3.26Å
395	E	93.7	Very high	90.3	Very high	116 Å²	116	66.9 Å²	66.9	54%	0.542	34%	0.338	S	S	.	.	H	α-helix	trans	-56.2	-43.3	176.9	-73	176	-177.9	0	0	111.2	K391 S399	K391-E395 WeakPolarHBondContact CE-OE1 3.17Å; K391-E395 IonicContact NZ-OE1 2.68Å; K391-E395 WeakPolarHBondContact O-CG 3.05Å; K391-E395 PolarHBondContact O-N 3.11Å; E395-S399 WeakPolarHBondContact O-CB 3.47Å; E395-S399 PolarHBondContact O-N 3Å; E395-S399 VanDerWaalsContact O-N 3.1Å
396	M	94.6	Very high	90	Very high	9 Å²	9	68.6 Å²	68.6	4%	0.044	34%	0.344	C	S	.	.	H	α-helix	trans	-71	-41.5	176.8	-174.4	164.8	63.6	0	0	112.8	L328 L331 N332 L351 K392 A393 E394 N398 S399 W400	L328-M396 HydrophobicContact CD2-CE 3.48Å; L328-M396 VanDerWaalsContact CD2-CE 3.48Å; L331-M396 HydrophobicContact CB-CE 3.68Å; L331-M396 HydrophobicContact CB-SD 3.85Å; L331-M396 HydrophobicContact CD1-CE 4.12Å; N332-M396 HydrophobicContact CB-SD 3.8Å; L351-M396 HydrophobicContact CD1-CE 3.52Å; L351-M396 HydrophobicContact CD2-CB 4.16Å; L351-M396 HydrophobicContact CD2-CE 3.75Å; L351-M396 HydrophobicContact CD2-CG 3.91Å; L351-M396 HydrophobicContact CG-CE 4.3Å; K392-M396 PolarHBondContact O-N 3Å; A393-M396 PolarHBondContact O-N 3.4Å; E394-M396 VanDerWaalsContact C-N 3.27Å; E394-M396 PolarHBondContact O-N 3.15Å; M396-N398 PolarHBondContact O-N 3.44Å; M396-S399 WeakPolarHBondContact O-CB 3.33Å; M396-S399 PolarHBondContact O-N 3.06Å; M396-W400 HydrophobicContact CE-CH2 4.37Å; M396-W400 HydrophobicContact CE-CZ2 4.26Å; M396-W400 HydrophobicContact CG-CD2 4.19Å; M396-W400 HydrophobicContact CG-CG 4.48Å; M396-W400 HydrophobicContact CG-CZ2 3.95Å; M396-W400 WeakPolarHBondContact O-CB 3.47Å; M396-W400 PolarHBondContact O-N 3.43Å; M396-W400 HydrophobicContact SD-CH2 4.37Å; M396-W400 HydrophobicContact SD-CZ2 3.68Å
397	H	93.7	Very high	88.9	Confident	39 Å²	39	75.4 Å²	75.4	18%	0.181	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-44	177.6	177.1	-91.4	0	0	0	111.5	L351 T355 A393 E394 W400 M401	L351-H397 HydrophobicContact CD2-CB 3.93Å; L351-H397 HydrophobicContact CG-CB 4.17Å; T355-H397 HydrophobicContact CG2-CB 4.18Å; A393-H397 VanDerWaalsContact O-CB 3.26Å; A393-H397 WeakPolarHBondContact O-CB 3.46Å; A393-H397 PolarHBondContact O-N 3.35Å; E394-H397 PolarHBondContact O-N 3.34Å; H397-W400 PolarHBondContact O-N 3.48Å; H397-M401 WeakPolarHBondContact O-CB 3.31Å; H397-M401 VanDerWaalsContact O-CG 3.32Å; H397-M401 WeakPolarHBondContact O-CG 3.43Å; H397-M401 PolarHBondContact O-N 3.3Å
398	N	92.8	Very high	87.1	Confident	81 Å²	81	77.6 Å²	77.6	43%	0.433	38%	0.375	S	S	.	.	H	α-helix	trans	-66.2	-39.9	177.4	-70.5	-24.1	0	0	0	111.7	E394 M396 M401 L402	E394-N398 WeakPolarHBondContact CG-ND2 3.41Å; E394-N398 WeakPolarHBondContact O-CB 3.44Å; E394-N398 VanDerWaalsContact O-CG 3.31Å; E394-N398 PolarHBondContact O-N 3.01Å; E394-N398 PolarHBondContact O-ND2 3.26Å; M396-N398 PolarHBondContact O-N 3.44Å; N398-M401 PolarHBondContact O-N 2.92Å; N398-L402 WeakPolarHBondContact O-CG 3.28Å; N398-L402 PolarHBondContact O-N 3.1Å
399	S	93.3	Very high	84.5	Confident	70 Å²	70	81.1 Å²	81.1	49%	0.49	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-46.4	170.9	-177.8	0	0	0	0	112.3	E395 M396 M401 L402	E395-S399 WeakPolarHBondContact O-CB 3.47Å; E395-S399 PolarHBondContact O-N 3Å; E395-S399 VanDerWaalsContact O-N 3.1Å; M396-S399 WeakPolarHBondContact O-CB 3.33Å; M396-S399 PolarHBondContact O-N 3.06Å; S399-M401 PolarHBondContact O-N 3.2Å; S399-L402 PolarHBondContact O-N 2.87Å
400	W	94	Very high	81.6	Confident	13 Å²	13	86.3 Å²	86.3	5%	0.049	42%	0.423	C	S	.	.	H	α-helix	trans	-67.7	-31.7	179.1	-73.6	9.3	0	0	0	113.7	L331 F336 L342 L347 L348 L351 M396 H397 L402 L403	L331-W400 HydrophobicContact CB-CH2 4.11Å; L331-W400 HydrophobicContact CB-CZ2 4.1Å; L331-W400 HydrophobicContact CD1-CH2 4.47Å; L331-W400 HydrophobicContact CD2-CH2 4.22Å; L331-W400 HydrophobicContact CG-CH2 4.49Å; F336-W400 HydrophobicContact CD2-CH2 4.48Å; F336-W400 AromaticContact CD2-CZ2 3.75Å; F336-W400 HydrophobicContact CD2-CZ2 3.75Å; F336-W400 AromaticContact CE2-CH2 3.93Å; F336-W400 HydrophobicContact CE2-CH2 3.93Å; F336-W400 AromaticContact CE2-CZ2 3.47Å; F336-W400 HydrophobicContact CE2-CZ2 3.47Å; F336-W400 VanDerWaalsContact CE2-CZ2 3.47Å; F336-W400 HydrophobicContact CZ-CH2 4.36Å; F336-W400 HydrophobicContact CZ-CZ2 4.33Å; L342-W400 HydrophobicContact CD1-CB 3.7Å; L342-W400 HydrophobicContact CD1-CD2 3.56Å; L342-W400 HydrophobicContact CD1-CE3 3.62Å; L342-W400 HydrophobicContact CD1-CG 3.62Å; L342-W400 HydrophobicContact CD1-CZ3 4.44Å; L342-W400 HydrophobicContact CD2-CD2 4.14Å; L342-W400 HydrophobicContact CD2-CE3 3.77Å; L342-W400 HydrophobicContact CD2-CH2 4.06Å; L342-W400 HydrophobicContact CD2-CZ2 4.41Å; L342-W400 HydrophobicContact CD2-CZ3 3.72Å; L342-W400 HydrophobicContact CG-CD2 4.49Å; L342-W400 HydrophobicContact CG-CE3 4.23Å; L347-W400 HydrophobicContact CB-CZ3 4.26Å; L348-W400 HydrophobicContact CD1-CB 3.98Å; L348-W400 HydrophobicContact CD1-CE3 4.27Å; L351-W400 HydrophobicContact CB-CZ3 4.27Å; L351-W400 HydrophobicContact CD2-CD2 4.09Å; L351-W400 HydrophobicContact CD2-CE3 3.55Å; L351-W400 HydrophobicContact CD2-CH2 4.14Å; L351-W400 HydrophobicContact CD2-CZ3 3.59Å; M396-W400 HydrophobicContact CE-CH2 4.37Å; M396-W400 HydrophobicContact CE-CZ2 4.26Å; M396-W400 HydrophobicContact CG-CD2 4.19Å; M396-W400 HydrophobicContact CG-CG 4.48Å; M396-W400 HydrophobicContact CG-CZ2 3.95Å; M396-W400 WeakPolarHBondContact O-CB 3.47Å; M396-W400 PolarHBondContact O-N 3.43Å; M396-W400 HydrophobicContact SD-CH2 4.37Å; M396-W400 HydrophobicContact SD-CZ2 3.68Å; H397-W400 PolarHBondContact O-N 3.48Å; W400-L402 PolarHBondContact O-N 2.91Å; W400-L403 WeakPolarHBondContact O-CB 3.38Å; W400-L403 PolarHBondContact O-N 3.17Å
401	M	88.7	Confident	78.6	Confident	94 Å²	94	97.5 Å²	97.5	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-65.6	-23.3	174.9	-79	-75	-86.3	0	0	113.2	K339 L348 H397 N398 S399	K339-M401 WeakPolarHBondContact CE-SD 3.3Å; L348-M401 HydrophobicContact CD1-CG 4.33Å; L348-M401 HydrophobicContact CD1-SD 4.49Å; L348-M401 HydrophobicContact CD2-SD 3.92Å; H397-M401 WeakPolarHBondContact O-CB 3.31Å; H397-M401 VanDerWaalsContact O-CG 3.32Å; H397-M401 WeakPolarHBondContact O-CG 3.43Å; H397-M401 PolarHBondContact O-N 3.3Å; N398-M401 PolarHBondContact O-N 2.92Å; S399-M401 PolarHBondContact O-N 3.2Å
402	L	90.6	Very high	75.7	Confident	152 Å²	152	99.1 Å²	99.1	80%	0.796	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-8.3	176	-63.8	170.8	0	0	0	113.8	N398 S399 W400	N398-L402 WeakPolarHBondContact O-CG 3.28Å; N398-L402 PolarHBondContact O-N 3.1Å; S399-L402 PolarHBondContact O-N 2.87Å; W400-L402 PolarHBondContact O-N 2.91Å
403	L	89.9	Confident	72.7	Confident	51 Å²	51	107.2 Å²	107.2	27%	0.267	51%	0.507	S	S	.	.	S	Bend	trans	-65.3	140.8	176.1	-68.7	173.1	0	0	0	110.9	F336 K339 L342 W400	F336-L403 HydrophobicContact CB-CD1 4.29Å; K339-L403 HydrophobicContact CB-CB 3.94Å; K339-L403 WeakPolarHBondContact CB-O 3.31Å; L342-L403 HydrophobicContact CD1-CD1 3.86Å; W400-L403 WeakPolarHBondContact O-CB 3.38Å; W400-L403 PolarHBondContact O-N 3.17Å
404	K	85.3	Confident	69.9	Low	178 Å²	178	114.5 Å²	114.5	77%	0.774	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-66.2	147.1	176.8	-65.9	-178.1	179.9	179.2	0	110.9	H338 K339	H338-K404 CarbonylContact C-O 3.59Å; H338-K404 VanDerWaalsContact CA-O 3.27Å; H338-K404 WeakPolarHBondContact CA-O 3.48Å; H338-K404 VanDerWaalsContact CB-O 3.27Å; H338-K404 WeakPolarHBondContact CB-O 3.38Å; K339-K404 PolarHBondContact N-O 3.1Å
405	N	80	Confident	67	Low	71 Å²	71	117 Å²	117	38%	0.38	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-81.8	139.6	166.4	-89.8	-29.4	0	0	0	110.6	K339 T340 E343 Y407	K339-N405 WeakPolarHBondContact CB-OD1 3.46Å; T340-N405 PolarHBondContact N-OD1 2.91Å; T340-N405 VanDerWaalsContact N-OD1 3.1Å; T340-N405 WeakPolarHBondContact OG1-CA 2.95Å; T340-N405 PolarHBondContact OG1-OD1 2.79Å; E343-N405 PolarHBondContact OE2-OD1 3.27Å; N405-Y407 HydrophobicContact CB-CE2 3.82Å; N405-Y407 PolarHBondContact ND2-OH 3.2Å
406	E	71.1	Confident	64.4	Low	89 Å²	89	120.6 Å²	120.6	42%	0.416	57%	0.569	S	S	.	*			trans	-135.7	111.5	177.6	-164.3	-169.6	158.4	0	0	110.4	H338 T340 K408	H338-E406 HydrophobicContact CB-CB 3.9Å; H338-E406 IonicContact CD2-OE2 3.64Å; H338-E406 PolarHBondContact CD2-OE2 3.07Å; H338-E406 VanDerWaalsContact CD2-OE2 3.27Å; T340-E406 PolarHBondContact OG1-N 3.43Å; E406-K408 WeakPolarHBondContact OE1-CE 3.35Å; E406-K408 IonicContact OE1-NZ 2.74Å
407	Y	63.2	Low	61.7	Low	147 Å²	147	128.9 Å²	128.9	58%	0.576	61%	0.608	S	S	*	*			trans	-106.4	94.5	178.5	-57.4	-77	0	0	0	110.2	T340 N405 I409	T340-Y407 HydrophobicContact CG2-CD1 3.8Å; T340-Y407 HydrophobicContact CG2-CE1 3.47Å; T340-Y407 VanDerWaalsContact CG2-CE1 3.47Å; N405-Y407 HydrophobicContact CB-CE2 3.82Å; N405-Y407 PolarHBondContact ND2-OH 3.2Å; Y407-I409 PolarHBondContact O-N 3.02Å
408	K	48.6	Very low	58.9	Low	155 Å²	155	136.5 Å²	136.5	67%	0.674	64%	0.64	S	S	*	*			trans	-69.2	102.9	172.4	-69.1	177.9	-174.1	170	0	109.6	E406 P410	E406-K408 WeakPolarHBondContact OE1-CE 3.35Å; E406-K408 IonicContact OE1-NZ 2.74Å; K408-P410 WeakPolarHBondContact O-CD 3.04Å
409	I	34.9	Very low	56	Low	153 Å²	153	137 Å²	137	79%	0.785	65%	0.649	S	S	*	*			trans	-56.5	122.6	170.5	-58.7	175.4	0	0	0	107.8	Y407 R411	Y407-I409 PolarHBondContact O-N 3.02Å; I409-R411 PolarHBondContact O-N 3.02Å
410	P	31.1	Very low	53.5	Low	110 Å²	110	137.6 Å²	137.6	71%	0.714	65%	0.652	S	S	*	*			trans	-59.1	123.8	175.9	-23.8	34.4	0	0	0	109.9	K408 L412	K408-P410 WeakPolarHBondContact O-CD 3.04Å; P410-L412 PolarHBondContact O-N 3.01Å
411	R	29.2	Very low	51	Low	241 Å²	241	141.3 Å²	141.3	91%	0.909	68%	0.681	S	S	*	*			trans	-64.3	103.4	168.6	-73.8	-175	178.2	178.7	-0.5	107.7	I409 R413	I409-R411 PolarHBondContact O-N 3.02Å; R411-R413 PolarHBondContact O-N 3.15Å; R411-R413 VanDerWaalsContact O-N 3.08Å
412	L	32.3	Very low	48.7	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	69%	0.69	S	S	*	*			trans	-50.9	118.2	165.8	-75.5	167.6	0	0	0	107.7	P410 I414	P410-L412 PolarHBondContact O-N 3.01Å; L412-I414 VanDerWaalsContact C-N 3.27Å; L412-I414 PolarHBondContact O-N 3.05Å
413	R	32.3	Very low	46.6	Very low	223 Å²	223	136 Å²	136	84%	0.842	66%	0.664	S	S	*	*			trans	-66.9	98.9	161.6	-76.4	-175.8	178.6	170.5	0.3	105.8	R411 E415	R411-R413 PolarHBondContact O-N 3.15Å; R411-R413 VanDerWaalsContact O-N 3.08Å; R413-E415 HydrophobicContact CB-CG 4.39Å; R413-E415 PolarHBondContact O-N 2.72Å
414	I	33.8	Very low	44.4	Very low	152 Å²	152	138.5 Å²	138.5	78%	0.779	67%	0.674	S	S	*	*			trans	-65.5	92	156.3	-57.6	175	0	0	0	104.4	L412 K416	L412-I414 VanDerWaalsContact C-N 3.27Å; L412-I414 PolarHBondContact O-N 3.05Å; I414-K416 PolarHBondContact O-N 3.24Å
415	E	34.7	Very low	42.8	Very low	154 Å²	154	135.7 Å²	135.7	72%	0.72	66%	0.664	S	S	*	*			trans	-61.9	108.8	165.9	-63.9	-165.7	162.3	0	0	105.6	R413 E417	R413-E415 HydrophobicContact CB-CG 4.39Å; R413-E415 PolarHBondContact O-N 2.72Å; E415-E417 PolarHBondContact O-N 3.3Å
416	K	38.6	Very low	41.4	Very low	193 Å²	193	134.7 Å²	134.7	84%	0.839	67%	0.665	S	S	*	*			trans	-63.4	103.9	172.8	-72.7	-173.1	174.8	-172.2	0	106.4	I414 K418	I414-K416 PolarHBondContact O-N 3.24Å; K416-K418 PolarHBondContact O-N 2.88Å; K416-K418 VanDerWaalsContact O-N 3.08Å
417	E	37.8	Very low	40.5	Very low	183 Å²	183	136.6 Å²	136.6	86%	0.855	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-48.3	119.8	169.4	-64.4	-173.7	154	0	0	107.6	E415 P419	E415-E417 PolarHBondContact O-N 3.3Å; E417-P419 WeakPolarHBondContact O-CD 3.04Å
418	K	34.1	Very low	39.9	Very low	198 Å²	198	137 Å²	137	86%	0.861	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-64.1	123.5	170.5	-78.9	-178.5	174.8	177.7	0	106.2	K416 S420	K416-K418 PolarHBondContact O-N 2.88Å; K416-K418 VanDerWaalsContact O-N 3.08Å; K418-S420 PolarHBondContact O-N 2.8Å; K418-S420 VanDerWaalsContact O-N 3.11Å
419	P	33.2	Very low	40.1	Very low	93 Å²	93	137.7 Å²	137.7	60%	0.604	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-52.8	123.4	176.7	-25.5	34.4	0	0	0	109.2	E417 S423	E417-P419 WeakPolarHBondContact O-CD 3.04Å; P419-S423 VanDerWaalsContact CB-OG 3.29Å; P419-S423 WeakPolarHBondContact CB-OG 3.16Å
420	S	40.3	Very low	41	Very low	81 Å²	81	139.3 Å²	139.3	57%	0.566	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-63.8	145.7	176.2	67.4	0	0	0	0	108.5	K418 C422 S423	K418-S420 PolarHBondContact O-N 2.8Å; K418-S420 VanDerWaalsContact O-N 3.11Å; S420-C422 PolarHBondContact O-N 2.79Å; S420-S423 PolarHBondContact N-OG 3.39Å; S420-S423 WeakPolarHBondContact O-CB 3.36Å; S420-S423 PolarHBondContact O-N 3.32Å; S420-S423 PolarHBondContact O-OG 3.21Å
421	S	40.8	Very low	42.1	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	66%	0.664	S	S	*	*	H	α-helix	trans	-61.8	-11.6	-169.8	50.9	0	0	0	0	115.2
422	C	40.2	Very low	43.1	Very low	97 Å²	97	132.7 Å²	132.7	66%	0.655	65%	0.649	S	S	*	*	H	α-helix	trans	-76.7	-30.8	169.3	-70.4	0	0	0	0	113.5	S420 Q425 A426	S420-C422 PolarHBondContact O-N 2.79Å; C422-Q425 PolarHBondContact O-N 3.02Å; C422-A426 PolarHBondContact O-N 3.19Å; C422-A426 VanDerWaalsContact O-N 3.13Å
423	S	46.4	Very low	43.9	Very low	37 Å²	37	132.5 Å²	132.5	26%	0.259	64%	0.644	S	S	.	*	H	α-helix	trans	-68	-48.8	-177.8	60.7	0	0	0	0	112.4	P419 S420 Q425 A426 E427	P419-S423 VanDerWaalsContact CB-OG 3.29Å; P419-S423 WeakPolarHBondContact CB-OG 3.16Å; S420-S423 PolarHBondContact N-OG 3.39Å; S420-S423 WeakPolarHBondContact O-CB 3.36Å; S420-S423 PolarHBondContact O-N 3.32Å; S420-S423 PolarHBondContact O-OG 3.21Å; S423-Q425 PolarHBondContact O-N 2.87Å; S423-Q425 VanDerWaalsContact O-N 3.17Å; S423-A426 WeakPolarHBondContact O-CB 3.44Å; S423-A426 PolarHBondContact O-N 2.82Å; S423-E427 PolarHBondContact O-N 3.04Å
424	E	44	Very low	44.7	Very low	103 Å²	103	130.1 Å²	130.1	48%	0.481	64%	0.642	S	S	.	*	H	α-helix	trans	-57.2	-33.1	175.5	-68.6	-166.1	118.7	0	0	112.8	R428	E424-R428 WeakPolarHBondContact O-CB 3.45Å; E424-R428 WeakPolarHBondContact O-CD 3.43Å; E424-R428 WeakPolarHBondContact O-CG 3.31Å; E424-R428 PolarHBondContact O-N 3.48Å
425	Q	52.9	Low	45	Very low	120 Å²	120	127.8 Å²	127.8	56%	0.561	64%	0.639	S	S	*	*	H	α-helix	trans	-74.9	-33.5	176.8	-66.4	-169	12.7	0	0	112.5	C422 S423 R429	C422-Q425 PolarHBondContact O-N 3.02Å; S423-Q425 PolarHBondContact O-N 2.87Å; S423-Q425 VanDerWaalsContact O-N 3.17Å; Q425-R429 VanDerWaalsContact O-CG 3.3Å; Q425-R429 WeakPolarHBondContact O-CG 3.42Å; Q425-R429 PolarHBondContact O-N 3.48Å
426	A	50.8	Low	45.2	Very low	49 Å²	49	124.6 Å²	124.6	41%	0.405	63%	0.634	S	S	.	*	H	α-helix	trans	-69	-41.9	173.5	0	0	0	0	0	111.8	C422 S423 R429 R430	C422-A426 PolarHBondContact O-N 3.19Å; C422-A426 VanDerWaalsContact O-N 3.13Å; S423-A426 WeakPolarHBondContact O-CB 3.44Å; S423-A426 PolarHBondContact O-N 2.82Å; A426-R429 PolarHBondContact O-N 3.36Å; A426-R430 WeakPolarHBondContact O-CG 3.27Å; A426-R430 PolarHBondContact O-N 3.35Å; A426-R430 VanDerWaalsContact O-N 3.07Å
427	E	50.9	Low	45.2	Very low	129 Å²	129	123.4 Å²	123.4	60%	0.603	64%	0.637	S	S	*	*	H	α-helix	trans	-70.4	-38.6	179.1	-68.8	-174	137.6	0	0	112.6	S423 R430 S431	S423-E427 PolarHBondContact O-N 3.04Å; E427-R430 PolarHBondContact O-N 3.06Å; E427-S431 WeakPolarHBondContact O-CB 3.31Å; E427-S431 PolarHBondContact O-N 2.91Å; E427-S431 PolarHBondContact O-OG 3.03Å
428	R	51	Low	44.8	Very low	156 Å²	156	126 Å²	126	59%	0.589	64%	0.638	S	S	*	*	H	α-helix	trans	-60.1	-46.5	172	-75.3	168.8	-172.4	-107.2	1.1	111.7	E424 R430 S431 E432	E424-R428 WeakPolarHBondContact O-CB 3.45Å; E424-R428 WeakPolarHBondContact O-CD 3.43Å; E424-R428 WeakPolarHBondContact O-CG 3.31Å; E424-R428 PolarHBondContact O-N 3.48Å; R428-R430 VanDerWaalsContact C-N 3.33Å; R428-R430 PolarHBondContact O-N 3.34Å; R428-S431 WeakPolarHBondContact O-CB 3.47Å; R428-S431 PolarHBondContact O-N 2.68Å; R428-S431 VanDerWaalsContact O-N 3.11Å; R428-E432 WeakPolarHBondContact O-CG 3.31Å; R428-E432 PolarHBondContact O-N 3.36Å
429	R	53	Low	44.8	Very low	169 Å²	169	124.4 Å²	124.4	64%	0.638	64%	0.638	S	S	*	*	H	α-helix	trans	-61.2	-38	176.8	-73.9	175.5	179	-170.2	1.3	112.9	Q425 A426 Q433	Q425-R429 VanDerWaalsContact O-CG 3.3Å; Q425-R429 WeakPolarHBondContact O-CG 3.42Å; Q425-R429 PolarHBondContact O-N 3.48Å; A426-R429 PolarHBondContact O-N 3.36Å; R429-Q433 WeakPolarHBondContact O-CG 3.46Å; R429-Q433 PolarHBondContact O-N 3.49Å
430	R	53	Low	44.8	Very low	188 Å²	188	125.4 Å²	125.4	71%	0.709	64%	0.642	S	S	*	*	H	α-helix	trans	-68.8	-37	173.1	-71.5	-179.3	-177.9	-162.9	1.1	112.8	A426 E427 R428	A426-R430 WeakPolarHBondContact O-CG 3.27Å; A426-R430 PolarHBondContact O-N 3.35Å; A426-R430 VanDerWaalsContact O-N 3.07Å; E427-R430 PolarHBondContact O-N 3.06Å; R428-R430 VanDerWaalsContact C-N 3.33Å; R428-R430 PolarHBondContact O-N 3.34Å
431	S	55.6	Low	44.5	Very low	86 Å²	86	129.1 Å²	129.1	60%	0.601	66%	0.655	S	S	*	*	H	α-helix	trans	-65.1	-43.9	177.2	-57.2	0	0	0	0	111.9	E427 R428 H434	E427-S431 WeakPolarHBondContact O-CB 3.31Å; E427-S431 PolarHBondContact O-N 2.91Å; E427-S431 PolarHBondContact O-OG 3.03Å; R428-S431 WeakPolarHBondContact O-CB 3.47Å; R428-S431 PolarHBondContact O-N 2.68Å; R428-S431 VanDerWaalsContact O-N 3.11Å; S431-H434 PolarHBondContact O-N 2.97Å
432	E	49.2	Very low	44.1	Very low	126 Å²	126	131.7 Å²	131.7	59%	0.589	66%	0.662	S	S	*	*	H	α-helix	trans	-67.1	-39.1	-178.4	-72.5	162.7	-178.7	0	0	111.8	R428 H434 S435	R428-E432 WeakPolarHBondContact O-CG 3.31Å; R428-E432 PolarHBondContact O-N 3.36Å; E432-H434 VanDerWaalsContact C-N 3.3Å; E432-H434 PolarHBondContact O-N 3.37Å; E432-S435 WeakPolarHBondContact O-CB 3.45Å; E432-S435 PolarHBondContact O-N 3.31Å; E432-S435 PolarHBondContact O-OG 3.04Å
433	Q	50.2	Low	43.9	Very low	154 Å²	154	132.3 Å²	132.3	72%	0.72	67%	0.667	S	S	*	*	H	α-helix	trans	-70.9	-16	180	-73.9	-176	-38.6	0	0	115.2	R429	R429-Q433 WeakPolarHBondContact O-CG 3.46Å; R429-Q433 PolarHBondContact O-N 3.49Å
434	H	49.4	Very low	43.3	Very low	173 Å²	173	138.1 Å²	138.1	80%	0.801	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	2.3	174.7	-94.3	-61.5	0	0	0	114.5	S431 E432 S436	S431-H434 PolarHBondContact O-N 2.97Å; E432-H434 VanDerWaalsContact C-N 3.3Å; E432-H434 PolarHBondContact O-N 3.37Å; H434-S436 VanDerWaalsContact C-N 3.26Å; H434-S436 PolarHBondContact O-N 2.96Å
435	S	39.2	Very low	42.6	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	70%	0.699	S	S	*	*	S	Bend	trans	-74.4	-9.9	-179.1	65.2	0	0	0	0	114.9	E432	E432-S435 WeakPolarHBondContact O-CB 3.45Å; E432-S435 PolarHBondContact O-N 3.31Å; E432-S435 PolarHBondContact O-OG 3.04Å
436	S	38.9	Very low	41.7	Very low	88 Å²	88	137.7 Å²	137.7	62%	0.615	71%	0.705	S	S	*	*			trans	-111.1	71.8	-172.5	61.6	0	0	0	0	113.8	H434	H434-S436 VanDerWaalsContact C-N 3.26Å; H434-S436 PolarHBondContact O-N 2.96Å
437	N	37.7	Very low	40.7	Very low	168 Å²	168	144.2 Å²	144.2	90%	0.898	73%	0.725	S	S	*	*			trans	-163.1	123.8	151.3	-98.8	-29.8	0	0	0	110.9
438	R	29.6	Very low	39.8	Very low	236 Å²	236	143 Å²	143	89%	0.891	73%	0.731	S	S	*	*			trans	-126.6	111.4	177.6	-81.9	-174.2	175.7	-174.3	-0.2	111.1
439	I	34.9	Very low	38.9	Very low	165 Å²	165	141.5 Å²	141.5	85%	0.846	74%	0.739	S	S	*	*			trans	-148	100.9	156.6	-54.9	-178.9	0	0	0	103.4
440	V	32.2	Very low	37.9	Very low	114 Å²	114	139.6 Å²	139.6	69%	0.691	74%	0.74	S	S	*	*				62.2	94.3	64.8	-173.4	0	0	0	0	112.3
441	D	35.1	Very low	36.9	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	74%	0.744	S	S	*	*				-157.2	171.4	127.4	-120.9	-36.7	0	0	0	112.5
442	N	32.7	Very low	35.5	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	76%	0.758	S	S	*	*			trans	-120.9	178	-160	-100.5	-43.2	0	0	0	115.2
443	S	36.2	Very low	35.1	Very low	110 Å²	110	146 Å²	146	77%	0.769	77%	0.766	S	S	*	*			trans	83	147.4	168.9	83.3	0	0	0	0	116.5
444	I	32.2	Very low	34.2	Very low	160 Å²	160	144 Å²	144	82%	0.821	77%	0.769	S	S	*	*			cis	-140.2	-179.4	-0.7	-136.3	158.2	0	0	0	111.6
445	S	31.2	Very low	33.5	Very low	83 Å²	83	141.5 Å²	141.5	58%	0.58	77%	0.766	S	S	*	*			trans	-74.4	-177.1	-174.1	60	0	0	0	0	113.1
446	D	32.9	Very low	33.4	Very low	131 Å²	131	141.7 Å²	141.7	70%	0.701	77%	0.767	S	S	*	*			cis	-166.7	178.3	31.4	-136.8	-46.1	0	0	0	116.5
447	F	30.4	Very low	33.2	Very low	185 Å²	185	142.9 Å²	142.9	81%	0.811	78%	0.775	S	S	*	*			trans	81	130.7	165.6	-95.8	-92.2	0	0	0	121.1
448	S	30.8	Very low	33.4	Very low	104 Å²	104	141 Å²	141	73%	0.727	77%	0.772	S	S	*	*			trans	-147.2	160.9	-178.4	66.6	0	0	0	0	109.2
449	V	32.3	Very low	33.7	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	77%	0.765	S	S	*	*			trans	179.5	135	165.6	139.6	0	0	0	0	107.6
450	L	31.5	Very low	33.4	Very low	128 Å²	128	131.4 Å²	131.4	67%	0.67	77%	0.766	S	S	*	*			cis	-153	152.6	-14.1	-93.7	171.2	0	0	0	110.3
451	K	32.2	Very low	33.6	Very low	182 Å²	182	130.4 Å²	130.4	79%	0.791	76%	0.764	S	S	*	*			trans	27.5	153	142.4	-62.2	171	-175.3	169.9	0	122.3
452	R	27.6	Very low	33.5	Very low	237 Å²	237	130.5 Å²	130.5	89%	0.894	76%	0.763	S	S	*	*			cis	-175.8	165.9	-35	-115.5	-165.2	-176.9	-159.9	2.4	108.4
453	P	40.1	Very low	33.3	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	76%	0.763	S	S	*	*			trans	-113.8	-154.1	-164.6	44.8	-38	0	0	0	115.1
454	S	30.9	Very low	33.6	Very low	111 Å²	111	129.3 Å²	129.3	78%	0.776	76%	0.764	S	S	*	*			trans	110.1	156.2	177.2	71.9	0	0	0	0	113.7
455	V	35.9	Very low	34	Very low	122 Å²	122	126.8 Å²	126.8	74%	0.739	76%	0.758	S	S	*	*			cis	-147.8	148.3	27.4	-171	0	0	0	0	113.2
456	S	36.1	Very low	34.2	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	77%	0.767	S	S	*	*			trans	62	157.1	157.8	53.9	0	0	0	0	121.5
457	S	35.3	Very low	34	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	77%	0.77	S	S	*	*			cis	140.9	167.5	-20.3	-80.4	0	0	0	0	110.5
458	P	41.6	Very low	34	Very low	129 Å²	129	135.1 Å²	135.1	84%	0.838	77%	0.772	S	S	*	*				-134.3	-176.5	-50.8	40.8	-25	0	0	0	112.8
459	G	35.2	Very low	33.9	Very low	72 Å²	72	135 Å²	135	74%	0.742	77%	0.77	S	S	*	*			trans	168	106.8	162.2	0	0	0	0	0	118.4
460	C	30.1	Very low	34.2	Very low	128 Å²	128	134.5 Å²	134.5	87%	0.865	77%	0.77	S	S	*	*			trans	10	150.2	149.7	-70.4	0	0	0	0	122.7
461	S	34.6	Very low	34.2	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	77%	0.768	S	S	*	*			cis	-173.7	145.7	1.1	43.4	0	0	0	0	113.4
462	L	34.3	Very low	34.3	Very low	161 Å²	161	132 Å²	132	84%	0.843	77%	0.767	S	S	*	*			trans	60	132.5	153.5	-58.6	162.7	0	0	0	118.4
463	S	28.5	Very low	34.4	Very low	111 Å²	111	126.8 Å²	126.8	78%	0.776	76%	0.757	S	S	*	*			cis	124.3	145.2	-5.4	-62	0	0	0	0	114.6
464	P	42.8	Very low	33.8	Very low	121 Å²	121	126.8 Å²	126.8	79%	0.786	76%	0.755	S	S	*	*			trans	-113.9	-158	-165.9	42.7	-25.5	0	0	0	111.2
465	P	40.4	Very low	33.8	Very low	107 Å²	107	133 Å²	133	70%	0.695	76%	0.761	S	S	*	*			cis	-140.9	-146.9	3.7	45.1	-23.5	0	0	0	114.7
466	L	34.9	Very low	33.4	Very low	148 Å²	148	131.4 Å²	131.4	78%	0.775	76%	0.761	S	S	*	*			trans	119.4	157.4	159.2	-64.3	166.8	0	0	0	114.8
467	R	28.2	Very low	33.2	Very low	200 Å²	200	136.7 Å²	136.7	76%	0.755	76%	0.764	S	S	*	*			cis	174.7	170.1	-40.2	173.9	178.1	-96.6	-93.4	3.5	106.9
468	W	30.2	Very low	32.9	Very low	226 Å²	226	139 Å²	139	86%	0.856	76%	0.762	S	S	*	*			trans	86.2	150.2	169.3	-58.6	73.8	0	0	0	114.9
469	S	29.7	Very low	32.4	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	76%	0.764	S	S	*	*			cis	170	163.9	-36.4	-95.4	0	0	0	0	107.8
470	P	38.7	Very low	32.2	Very low	115 Å²	115	142.7 Å²	142.7	75%	0.747	76%	0.761	S	S	*	*			trans	-117.1	-172.7	-144.7	42.2	-34.1	0	0	0	116.9
471	S	30.1	Very low	32.3	Very low	90 Å²	90	144.5 Å²	144.5	63%	0.629	76%	0.757	S	S	*	*			trans	125	153.9	142.5	-60.1	0	0	0	0	117.4
472	H	34.4	Very low	32.1	Very low	168 Å²	168	146.4 Å²	146.4	78%	0.778	76%	0.76	S	S	*	*			trans	69.4	149.3	159.6	-64.6	-60.2	0	0	0	119.2
473	D	30.2	Very low	32	Very low	128 Å²	128	145.5 Å²	145.5	68%	0.684	76%	0.755	S	S	*	*			cis	-163.8	175	-28.4	-133.6	-33	0	0	0	113.4
474	V	28.4	Very low	32.2	Very low	116 Å²	116	144.7 Å²	144.7	70%	0.703	75%	0.75	S	S	*	*			trans	12.8	122.9	155.7	174.4	0	0	0	0	119.8
475	R	30.9	Very low	31.6	Very low	242 Å²	242	143.2 Å²	143.2	91%	0.913	74%	0.743	S	S	*	*				-169.6	163.5	107.1	-134.3	150.6	-169.9	149.5	3.2	115
476	A	27.3	Very low	31.2	Very low	87 Å²	87	148.9 Å²	148.9	72%	0.719	75%	0.75	S	S	*	*			trans	-133.6	153.6	178.9	0	0	0	0	0	112.6
477	R	32.3	Very low	30.9	Very low	218 Å²	218	147 Å²	147	82%	0.823	75%	0.749	S	S	*	*			trans	171.3	126.3	158.5	-97.5	153.7	179	-172.8	0.1	107.5
478	E	27.4	Very low	31.1	Very low	159 Å²	159	141.5 Å²	141.5	74%	0.743	74%	0.742	S	S	*	*				84	152.9	63.9	-73.8	-177.4	127.6	0	0	114
479	F	32.4	Very low	31.2	Very low	198 Å²	198	139.5 Å²	139.5	87%	0.868	74%	0.742	S	S	*	*			trans	71.7	117.4	-167.9	-57.7	-85.7	0	0	0	114.6
480	A	30.2	Very low	31.4	Very low	82 Å²	82	140.3 Å²	140.3	68%	0.678	74%	0.738	S	S	*	*			cis	105.5	141.4	10.3	0	0	0	0	0	116
481	Q	31.5	Very low	31.2	Very low	166 Å²	166	142.7 Å²	142.7	78%	0.776	74%	0.741	S	S	*	*			trans	69.5	158.5	170.4	-58.4	-170.8	-96.1	0	0	116.6
482	D	31.6	Very low	31.3	Very low	132 Å²	132	142.1 Å²	142.1	71%	0.706	74%	0.737	S	S	*	*			cis	-172.5	164.8	-22.4	-94.2	-12.3	0	0	0	106.5
483	D	31.2	Very low	31.3	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	75%	0.745	S	S	*	*			cis	-158.2	175.3	-8.4	169.7	46	0	0	0	107.9
484	S	34.4	Very low	31.4	Very low	94 Å²	94	144.9 Å²	144.9	66%	0.657	75%	0.748	S	S	*	*			trans	81.9	163.3	152.8	89.4	0	0	0	0	118.6
485	S	29.2	Very low	31.7	Very low	91 Å²	91	148 Å²	148	64%	0.636	76%	0.756	S	S	*	*			cis	-171.6	172.7	-37.1	62.3	0	0	0	0	110.4
486	R	31.2	Very low	31.7	Very low	226 Å²	226	145.9 Å²	145.9	85%	0.853	75%	0.754	S	S	*	*			trans	69.9	121.4	163.5	-78.4	173.5	167.8	155.2	-3.1	117.3
487	S	29.9	Very low	32	Very low	107 Å²	107	150.5 Å²	150.5	75%	0.748	76%	0.758	S	S	*	*				91.6	143.9	61.4	78	0	0	0	0	112.9
488	S	31.8	Very low	32.2	Very low	86 Å²	86	147.8 Å²	147.8	60%	0.601	75%	0.754	S	S	*	*			cis	-159	172.8	6.7	59.4	0	0	0	0	113.9
489	E	32.7	Very low	32.4	Very low	183 Å²	183	147.8 Å²	147.8	86%	0.855	76%	0.758	S	S	*	*			trans	45.1	147.9	144.2	-64.8	146.5	159.9	0	0	123.4
490	D	33.2	Very low	32.3	Very low	118 Å²	118	141.4 Å²	141.4	63%	0.631	75%	0.749	S	S	*	*			cis	-134.2	-115.6	-26.7	178.8	22.7	0	0	0	108.2	S492	D490-S492 PolarHBondContact OD1-N 3.02Å; D490-S492 PolarHBondContact OD2-N 2.6Å; D490-S492 VanDerWaalsContact OD2-N 3.12Å; D490-S492 PolarHBondContact OD2-OG 2.78Å
491	M	34.2	Very low	32.4	Very low	165 Å²	165	147 Å²	147	81%	0.813	76%	0.758	S	S	*	*			cis	-127.5	103.9	-4.8	-80.6	-126.8	81.6	0	0	112.3
492	S	32.1	Very low	32.1	Very low	77 Å²	77	150.7 Å²	150.7	54%	0.538	77%	0.765	S	S	.	*			trans	36.2	143.3	131.5	-72.3	0	0	0	0	124.3	D490	D490-S492 PolarHBondContact OD1-N 3.02Å; D490-S492 PolarHBondContact OD2-N 2.6Å; D490-S492 VanDerWaalsContact OD2-N 3.12Å; D490-S492 PolarHBondContact OD2-OG 2.78Å
493	R	35.6	Very low	32	Very low	248 Å²	248	149.6 Å²	149.6	94%	0.936	77%	0.768	S	S	*	*			trans	87.6	143.2	162.5	-62.1	172.9	-176.6	177.8	2	117.6
494	S	31.6	Very low	31.8	Very low	107 Å²	107	149 Å²	149	75%	0.748	77%	0.769	S	S	*	*			cis	-165.4	141.9	-12.9	177.4	0	0	0	0	111.8
495	M	34.7	Very low	31.3	Very low	180 Å²	180	152 Å²	152	89%	0.887	78%	0.777	S	S	*	*				161.6	148	129.5	-84.1	-160.3	88.1	0	0	111.6
496	K	30.4	Very low	31.4	Very low	198 Å²	198	155 Å²	155	86%	0.861	79%	0.785	S	S	*	*			trans	-137.8	146.7	-178.7	-76.2	179.7	176.6	173.9	0	111.6
497	K	34.8	Very low	31.1	Very low	184 Å²	184	152.1 Å²	152.1	80%	0.8	79%	0.786	S	S	*	*			trans	-175.5	114.3	140.2	-100	159.6	-178.1	-176	0	107.9
498	H	35.7	Very low	31.2	Very low	162 Å²	162	151.5 Å²	151.5	75%	0.75	79%	0.787	S	S	*	*				78.5	132.3	105.3	-73.2	-16.8	0	0	0	113.9
499	L	33	Very low	30.8	Very low	158 Å²	158	154.9 Å²	154.9	83%	0.827	80%	0.799	S	S	*	*			cis	-159.1	155.3	9.2	-108.7	157.8	0	0	0	112.8
500	G	30.4	Very low	30.7	Very low	65 Å²	65	154.3 Å²	154.3	67%	0.67	80%	0.8	S	S	*	*			trans	86.3	91.6	152.1	0	0	0	0	0	119
501	K	31	Very low	30.4	Very low	200 Å²	200	152.8 Å²	152.8	87%	0.87	80%	0.799	S	S	*	*				70.5	102.2	69.2	-72.6	-170.4	169.9	-179.4	0	117.6
502	R	26.1	Very low	30.3	Very low	242 Å²	242	152.3 Å²	152.3	91%	0.913	80%	0.799	S	S	*	*				165.5	134.5	108.5	-93.5	176.6	176.2	174	-0.2	114.7
503	S	28	Very low	30	Very low	110 Å²	110	160.2 Å²	160.2	77%	0.769	82%	0.817	S	S	*	*			trans	127.7	82.7	157.4	72.4	0	0	0	0	111.6
504	V	28.3	Very low	29.8	Very low	128 Å²	128	157.3 Å²	157.3	78%	0.776	81%	0.814	S	S	*	*				75.9	91.3	79.4	176.9	0	0	0	0	112.3	I506	V504-I506 HydrophobicContact CG1-CG1 4.38Å
505	D	23.3	Very low	29.6	Very low	156 Å²	156	161.5 Å²	161.5	83%	0.834	82%	0.822	S	S	*	*			trans	-79.2	148.5	162.2	-55.8	-81.6	0	0	0	111.2
506	I	31.4	Very low	29.3	Very low	155 Å²	155	159 Å²	159	80%	0.795	82%	0.816	S	S	*	*			trans	-137.3	104.8	161.1	-59	-178	0	0	0	108.8	V504	V504-I506 HydrophobicContact CG1-CG1 4.38Å
507	N	24.6	Very low	29.3	Very low	165 Å²	165	154.4 Å²	154.4	88%	0.882	81%	0.807	S	S	*	*			trans	-84.4	140.9	162.3	-88.4	-33.8	0	0	0	110
508	A	31.4	Very low	29	Very low	94 Å²	94	151.9 Å²	151.9	78%	0.777	81%	0.81	S	S	*	*			trans	-157.7	126.1	152.2	0	0	0	0	0	109.9
509	N	25.2	Very low	28.6	Very low	157 Å²	157	153.6 Å²	153.6	84%	0.84	82%	0.815	S	S	*	*			trans	-79.3	160	164.4	-65.3	-40.3	0	0	0	109.7
510	I	30	Very low	28.4	Very low	171 Å²	171	155.9 Å²	155.9	88%	0.877	82%	0.818	S	S	*	*				-172.3	145.6	124	-96.6	154.3	0	0	0	108
511	S	26.7	Very low	28.2	Very low	87 Å²	87	159.3 Å²	159.3	61%	0.608	83%	0.826	S	S	*	*			trans	-86.8	157	174.5	53.8	0	0	0	0	111
512	D	31.5	Very low	28	Very low	155 Å²	155	155.6 Å²	155.6	83%	0.829	82%	0.822	S	S	*	*				-179.6	170.7	108.8	-85	-11.9	0	0	0	110.8
513	R	27	Very low	28.1	Very low	243 Å²	243	148.8 Å²	148.8	92%	0.917	82%	0.818	S	S	*	*			trans	-97.7	138.8	-176	-64.4	172.3	171.8	174.4	-4.4	110.7
514	E	31.1	Very low	28	Very low	187 Å²	187	148 Å²	148	87%	0.874	82%	0.818	S	S	*	*			trans	-156	138	144	-121.9	171.4	-159.4	0	0	110.8
515	E	26.1	Very low	27.9	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	81%	0.814	S	S	*	*			trans	-98.1	130.1	177.6	-66.7	-177.2	120	0	0	110.2
516	V	30.1	Very low	28.2	Very low	126 Å²	126	145.8 Å²	145.8	76%	0.764	80%	0.801	S	S	*	*			trans	-135.5	127.9	175.3	-176.1	0	0	0	0	109.6
517	P	29	Very low	28.2	Very low	103 Å²	103	145.1 Å²	145.1	67%	0.669	79%	0.79	S	S	*	*			trans	-74.1	155.2	-172.2	28.9	-35.9	0	0	0	113.8
518	P	29	Very low	28.6	Very low	131 Å²	131	140.9 Å²	140.9	85%	0.851	77%	0.767	S	S	*	*			trans	-70.5	139.6	-170.1	28.3	-36	0	0	0	113.5
519	K	27.6	Very low	28.4	Very low	198 Å²	198	142.4 Å²	142.4	86%	0.861	76%	0.762	S	S	*	*			trans	-126.2	111	172.8	-75.4	-178.5	178.9	172.8	0	112
520	K	29.5	Very low	28.6	Very low	205 Å²	205	140.6 Å²	140.6	89%	0.891	76%	0.757	S	S	*	*			trans	45	106.9	153.9	-62.1	-173.5	177	-174.7	0	117.9
521	T	24.8	Very low	28.5	Very low	138 Å²	138	136.6 Å²	136.6	85%	0.847	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-65.2	139.4	168.6	41.4	0	0	0	0	113.5
522	P	26.6	Very low	28.4	Very low	121 Å²	121	140 Å²	140	79%	0.786	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-66.4	168	154.5	-18.4	33.4	0	0	0	112
523	A	28.2	Very low	28.2	Very low	99 Å²	99	141.5 Å²	141.5	82%	0.818	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-56.8	147.5	-168.7	0	0	0	0	0	115.8
524	A	26.5	Very low	28.1	Very low	94 Å²	94	137.9 Å²	137.9	78%	0.777	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-71.9	128	176.7	0	0	0	0	0	112.3	N526	A524-N526 PolarHBondContact O-N 3.37Å
525	L	26.1	Very low	27.8	Very low	132 Å²	132	132.4 Å²	132.4	69%	0.691	75%	0.746	S	S	*	*			trans	-86.8	88	172.7	-84.2	162.9	0	0	0	110.3	Y527	L525-Y527 HydrophobicContact CB-CD2 3.94Å; L525-Y527 HydrophobicContact CB-CE2 3.73Å; L525-Y527 HydrophobicContact CD1-CE2 4.18Å; L525-Y527 HydrophobicContact CD2-CE2 4.32Å; L525-Y527 HydrophobicContact CG-CE2 4.3Å; L525-Y527 WeakPolarHBondContact O-CD2 3.47Å; L525-Y527 PolarHBondContact O-N 2.86Å
526	N	30.7	Very low	27.9	Very low	106 Å²	106	129.4 Å²	129.4	57%	0.567	75%	0.747	S	S	*	*			trans	-73.1	87.4	176	-179.1	10	0	0	0	111.3	A524 N528	A524-N526 PolarHBondContact O-N 3.37Å; N526-N528 PolarHBondContact O-N 3.49Å; N526-N528 VanDerWaalsContact O-N 3.15Å; N526-N528 PolarHBondContact OD1-N 2.93Å
527	Y	31.6	Very low	27.5	Very low	141 Å²	141	135.2 Å²	135.2	55%	0.553	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	1.4	-175.6	-92.1	-77.8	0	0	0	116	L525	L525-Y527 HydrophobicContact CB-CD2 3.94Å; L525-Y527 HydrophobicContact CB-CE2 3.73Å; L525-Y527 HydrophobicContact CD1-CE2 4.18Å; L525-Y527 HydrophobicContact CD2-CE2 4.32Å; L525-Y527 HydrophobicContact CG-CE2 4.3Å; L525-Y527 WeakPolarHBondContact O-CD2 3.47Å; L525-Y527 PolarHBondContact O-N 2.86Å
528	N	32.2	Very low	27.3	Very low	76 Å²	76	135.6 Å²	135.6	41%	0.406	76%	0.759	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.5	-2	-178.9	-74	-2.7	0	0	0	114.4	N526	N526-N528 PolarHBondContact O-N 3.49Å; N526-N528 VanDerWaalsContact O-N 3.15Å; N526-N528 PolarHBondContact OD1-N 2.93Å
529	N	27.9	Very low	27.1	Very low	126 Å²	126	138.2 Å²	138.2	67%	0.674	76%	0.759	S	S	*	*			trans	-112.4	97	175.9	-74.4	-6.6	0	0	0	111.5
530	V	28.9	Very low	26.8	Very low	119 Å²	119	135.6 Å²	135.6	72%	0.721	75%	0.748	S	S	*	*			trans	-101.5	90.2	175.2	-176	0	0	0	0	110.6
531	T	26.7	Very low	26.5	Very low	87 Å²	87	134.2 Å²	134.2	53%	0.534	75%	0.75	S	S	.	*			trans	-116.3	124	169.4	40.9	0	0	0	0	111.2
532	Q	26.3	Very low	26.3	Very low	158 Å²	158	134.3 Å²	134.3	74%	0.738	74%	0.74	S	S	*	*			trans	53.8	102.2	161.4	-56.6	-174.8	11.7	0	0	118.4
533	L	27.1	Very low	26.2	Very low	187 Å²	187	137 Å²	137	98%	0.979	75%	0.747	S	S	*	*			trans	-124.8	115.7	137.6	-81	176.9	0	0	0	108.3
534	N	24.7	Very low	26	Very low	167 Å²	167	139.7 Å²	139.7	89%	0.893	75%	0.747	S	S	*	*			trans	-129.7	130.6	-176.5	-155.7	4.8	0	0	0	108.2
535	G	24.6	Very low	25.9	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	75%	0.752	S	S	*	*			trans	109.8	70.5	172.1	0	0	0	0	0	117.6
536	S	28	Very low	26	Very low	131 Å²	131	137.8 Å²	137.8	92%	0.916	75%	0.75	S	S	*	*			trans	-134.2	133.6	151.5	-74.8	0	0	0	0	108.8
537	R	22.7	Very low	25.7	Very low	248 Å²	248	139.3 Å²	139.3	94%	0.936	76%	0.758	S	S	*	*			trans	-116.3	115.8	-163.2	162.9	-170.7	167.2	-171.3	-2.3	111.3
538	C	23.5	Very low	25.6	Very low	111 Å²	111	141.8 Å²	141.8	75%	0.75	78%	0.775	S	S	*	*			trans	-179.4	149.4	158	-98.8	0	0	0	0	108.3
539	E	24.6	Very low	25.3	Very low	186 Å²	186	141.4 Å²	141.4	87%	0.869	79%	0.789	S	S	*	*			cis	-153.3	175.2	-21.8	-150.8	157.5	-155.4	0	0	109.4
540	K	21.3	Very low	25.3	Very low	143 Å²	143	143.4 Å²	143.4	62%	0.622	80%	0.799	S	S	*	*			trans	-105.2	125.7	-164	-164.2	-165.8	-165.7	-150.9	0	113	E542	K540-E542 WeakPolarHBondContact CE-OE1 3.46Å; K540-E542 VanDerWaalsContact CE-OE2 3.31Å; K540-E542 WeakPolarHBondContact CE-OE2 3.43Å; K540-E542 IonicContact NZ-OE1 2.72Å; K540-E542 PolarHBondContact NZ-OE1 3.3Å; K540-E542 IonicContact NZ-OE2 3.49Å; K540-E542 PolarHBondContact NZ-OE2 2.84Å
541	L	24.4	Very low	25	Very low	176 Å²	176	145.5 Å²	145.5	92%	0.921	80%	0.799	S	S	*	*			trans	-133.1	118.2	162.1	-80.5	172.9	0	0	0	110.6
542	E	19.8	Very low	24.9	Very low	140 Å²	140	148.3 Å²	148.3	65%	0.654	82%	0.816	S	S	*	*			trans	-110.1	141.1	167.3	-67.7	158.2	152.3	0	0	107.7	K540	K540-E542 WeakPolarHBondContact CE-OE1 3.46Å; K540-E542 VanDerWaalsContact CE-OE2 3.31Å; K540-E542 WeakPolarHBondContact CE-OE2 3.43Å; K540-E542 IonicContact NZ-OE1 2.72Å; K540-E542 PolarHBondContact NZ-OE1 3.3Å; K540-E542 IonicContact NZ-OE2 3.49Å; K540-E542 PolarHBondContact NZ-OE2 2.84Å
543	L	24.9	Very low	24.7	Very low	177 Å²	177	147 Å²	147	93%	0.927	81%	0.813	S	S	*	*			trans	-140.7	149.6	165.9	-107.1	167.2	0	0	0	110.5
544	L	24.2	Very low	24.6	Very low	157 Å²	157	147.1 Å²	147.1	82%	0.822	81%	0.809	S	S	*	*			trans	-124.5	134.4	-153.4	-72.5	158.8	0	0	0	113
545	A	24.2	Very low	24.5	Very low	105 Å²	105	146.3 Å²	146.3	87%	0.868	80%	0.799	S	S	*	*			trans	62.1	175.3	155.7	0	0	0	0	0	116
546	A	27.2	Very low	24.6	Very low	80 Å²	80	149.3 Å²	149.3	66%	0.661	79%	0.794	S	S	*	*			cis	-147.1	150.3	-1.1	0	0	0	0	0	112.6
547	N	26	Very low	24.6	Very low	138 Å²	138	149.5 Å²	149.5	74%	0.738	79%	0.785	S	S	*	*			trans	50.5	142.2	134.3	-68.7	-15.2	0	0	0	124.3
548	Q	28.5	Very low	24.7	Very low	194 Å²	194	144.4 Å²	144.4	91%	0.907	77%	0.772	S	S	*	*			trans	70.5	142.8	156.9	-63.8	159.9	22.4	0	0	117.1
549	G	26.1	Very low	24.9	Very low	67 Å²	67	147 Å²	147	69%	0.691	78%	0.778	S	S	*	*			cis	178.2	163.4	-8.8	0	0	0	0	0	114.2
550	N	27.6	Very low	25	Very low	168 Å²	168	143.9 Å²	143.9	90%	0.898	77%	0.771	S	S	*	*			trans	73.8	151.6	172.2	-63.4	-14.1	0	0	0	119.6
551	F	22.3	Very low	25	Very low	163 Å²	163	148.1 Å²	148.1	72%	0.715	78%	0.784	S	S	*	*			trans	-122.5	156	-172.5	-63.2	-115.7	0	0	0	110.3	T664	F551-T664 HydrophobicContact CE1-CG2 4.4Å; F551-T664 HydrophobicContact CZ-CG2 4.34Å
552	V	25.1	Very low	25.4	Very low	146 Å²	146	144.4 Å²	144.4	89%	0.885	77%	0.77	S	S	*	*				-140.6	148.6	129.9	-177.5	0	0	0	0	107.9
553	L	22.4	Very low	25.7	Very low	130 Å²	130	148.8 Å²	148.8	68%	0.681	78%	0.782	S	S	*	*			trans	-111.8	154.6	179.1	-79.1	152.8	0	0	0	110.6
554	H	24.2	Very low	25.7	Very low	191 Å²	191	149.7 Å²	149.7	88%	0.884	78%	0.775	S	S	*	*			trans	-155.2	152.2	139	-115.5	-82.4	0	0	0	112.1
555	Q	23.6	Very low	25.7	Very low	150 Å²	150	146.2 Å²	146.2	70%	0.701	77%	0.768	S	S	*	*			trans	-109.3	171.6	173.4	-58	174.1	-118.4	0	0	107.5
556	E	26.1	Very low	25.8	Very low	135 Å²	135	151.2 Å²	151.2	63%	0.631	77%	0.765	S	S	*	*			cis	-176.5	141.8	48.7	-140.9	160.1	-156.6	0	0	108.2
557	N	28	Very low	25.7	Very low	135 Å²	135	156.1 Å²	156.1	72%	0.722	77%	0.768	S	S	*	*				170.2	141.6	95.7	-84	-58.9	0	0	0	107.1
558	Q	25.2	Very low	25.6	Very low	141 Å²	141	154.2 Å²	154.2	66%	0.659	76%	0.763	S	S	*	*			cis	84.8	96.8	45	-71.5	-153.6	70.7	0	0	116.6
559	N	27.6	Very low	25.4	Very low	165 Å²	165	152 Å²	152	88%	0.882	76%	0.757	S	S	*	*			trans	-175.3	129.1	144.8	-89.7	-34.6	0	0	0	107
560	V	25.7	Very low	25.4	Very low	120 Å²	120	157.2 Å²	157.2	73%	0.727	77%	0.766	S	S	*	*			cis	117.8	139	15.1	172.8	0	0	0	0	110.8
561	W	22.3	Very low	25.3	Very low	233 Å²	233	154.3 Å²	154.3	88%	0.883	76%	0.757	S	S	*	*			trans	-97.7	-150.7	-164.4	-71.3	46.8	0	0	0	112.9
562	P	32.9	Very low	25.3	Very low	97 Å²	97	155.6 Å²	155.6	63%	0.63	77%	0.766	S	S	*	*				-120.1	-166.4	-92.8	40.6	-24.5	0	0	0	112.6
563	Y	25.9	Very low	25.3	Very low	232 Å²	232	157.3 Å²	157.3	91%	0.91	77%	0.766	S	S	*	*			trans	-136	147.1	169.9	-121	-96.1	0	0	0	114.5
564	Y	24	Very low	25.4	Very low	197 Å²	197	156.4 Å²	156.4	77%	0.773	77%	0.768	S	S	*	*			trans	-106.1	-173	178.6	-94	-97.2	0	0	0	111.3
565	A	25.5	Very low	25.3	Very low	84 Å²	84	154.2 Å²	154.2	69%	0.694	76%	0.763	S	S	*	*			trans	97.1	143.2	163.4	0	0	0	0	0	117.3
566	W	26.1	Very low	25.3	Very low	210 Å²	210	153.2 Å²	153.2	80%	0.795	77%	0.767	S	S	*	*			cis	-160	139.3	-3	-129.6	46.6	0	0	0	112.7
567	Y	23.9	Very low	25.1	Very low	182 Å²	182	155.1 Å²	155.1	71%	0.714	78%	0.776	S	S	*	*			trans	75.7	161.4	138.7	-84.3	-119	0	0	0	121.7
568	P	25.9	Very low	24.9	Very low	98 Å²	98	156.2 Å²	156.2	64%	0.636	78%	0.78	S	S	*	*			trans	-128.1	-156.9	-137.5	47.8	-36.1	0	0	0	116.4
569	N	23.9	Very low	24.8	Very low	149 Å²	149	157.1 Å²	157.1	80%	0.797	79%	0.785	S	S	*	*			trans	92.2	109.1	173.9	-56.3	-36.1	0	0	0	116.6
570	M	26	Very low	24.5	Very low	176 Å²	176	157.3 Å²	157.3	87%	0.867	78%	0.784	S	S	*	*			trans	-164.6	127.3	133.8	-84.5	-124.1	96.6	0	0	111.7
571	C	25.7	Very low	24.4	Very low	106 Å²	106	159.2 Å²	159.2	72%	0.716	79%	0.785	S	S	*	*			trans	46.9	99.6	151.5	-58.6	0	0	0	0	122
572	Q	22.3	Very low	24.5	Very low	191 Å²	191	154.1 Å²	154.1	89%	0.893	78%	0.775	S	S	*	*			trans	-11.9	136.5	136.6	-60.8	160.8	-36.7	0	0	118.2
573	M	23.6	Very low	24.2	Very low	181 Å²	181	157.6 Å²	157.6	89%	0.892	78%	0.78	S	S	*	*			trans	-139.6	154.9	136.4	-76.9	-153.4	77.8	0	0	108.7
574	P	24.7	Very low	24.1	Very low	112 Å²	112	151.5 Å²	151.5	73%	0.727	77%	0.772	S	S	*	*			trans	-90.3	170.5	-154.9	35.3	-37.7	0	0	0	116
575	N	22.4	Very low	24.3	Very low	145 Å²	145	147.9 Å²	147.9	78%	0.775	78%	0.775	S	S	*	*			trans	-55.6	145.3	177	-57	-13.3	0	0	0	113.1
576	V	23.8	Very low	24.3	Very low	128 Å²	128	150.5 Å²	150.5	78%	0.776	78%	0.782	S	S	*	*			trans	-126.7	101.5	152.8	177.8	0	0	0	0	107	L578	V576-L578 HydrophobicContact CG1-CG 4.27Å
577	E	20.9	Very low	24.4	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	78%	0.783	S	S	*	*			trans	-79	138.4	163	-67.4	174.9	126.2	0	0	108.2
578	L	25.3	Very low	24.4	Very low	157 Å²	157	142.9 Å²	142.9	82%	0.822	79%	0.785	S	S	*	*			trans	-126.2	112.6	166.2	-82.4	170.9	0	0	0	107.7	V576 I580	V576-L578 HydrophobicContact CG1-CG 4.27Å; L578-I580 PolarHBondContact O-N 3.46Å
579	E	22.4	Very low	24.6	Very low	160 Å²	160	143.5 Å²	143.5	75%	0.748	79%	0.789	S	S	*	*			trans	-60.5	133.7	174.1	-68.1	179	79.4	0	0	110.6	Q581	E579-Q581 HydrophobicContact CB-CG 4.35Å; E579-Q581 PolarHBondContact OE1-NE2 3.28Å
580	I	21.9	Very low	24.6	Very low	170 Å²	170	142 Å²	142	87%	0.872	79%	0.785	S	S	*	*			trans	-99.3	97.4	161.1	-59.6	177.6	0	0	0	106.4	L578	L578-I580 PolarHBondContact O-N 3.46Å
581	Q	23.9	Very low	24.6	Very low	160 Å²	160	140.8 Å²	140.8	75%	0.748	78%	0.777	S	S	*	*			trans	-83.4	134.9	170	-67	-163.4	5.1	0	0	110.8	E579	E579-Q581 HydrophobicContact CB-CG 4.35Å; E579-Q581 PolarHBondContact OE1-NE2 3.28Å
582	D	23.3	Very low	24.5	Very low	126 Å²	126	143.1 Å²	143.1	67%	0.674	78%	0.777	S	S	*	*			trans	-86.4	135.7	-170.4	164.7	45.5	0	0	0	112.2
583	K	26.5	Very low	24.6	Very low	169 Å²	169	139.7 Å²	139.7	74%	0.735	77%	0.765	S	S	*	*				170.6	126.3	125.9	-93.2	147.7	-159	168.4	0	117.6
584	S	25.1	Very low	24.6	Very low	105 Å²	105	139.4 Å²	139.4	73%	0.734	76%	0.755	S	S	*	*			trans	43.1	110.8	139.3	67	0	0	0	0	121.6
585	S	28	Very low	24.5	Very low	121 Å²	121	139.3 Å²	139.3	85%	0.846	75%	0.752	S	S	*	*				-166.7	147.5	117.3	44.7	0	0	0	0	111.9
586	V	23.7	Very low	24.6	Very low	139 Å²	139	143 Å²	143	84%	0.842	76%	0.757	S	S	*	*			trans	-147.1	130.7	-171.4	168.3	0	0	0	0	105.5
587	P	28.8	Very low	24.5	Very low	125 Å²	125	144.1 Å²	144.1	81%	0.812	76%	0.757	S	S	*	*				-148.7	164.8	83.5	38.9	-19.3	0	0	0	117.8
588	S	24.8	Very low	24.8	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	75%	0.753	S	S	*	*			trans	-87.1	179.9	164.1	60.2	0	0	0	0	111.4
589	P	28.8	Very low	24.9	Very low	111 Å²	111	140.5 Å²	140.5	72%	0.721	76%	0.755	S	S	*	*				-150.5	152.4	97	37.2	-20.1	0	0	0	117
590	V	24.6	Very low	24.9	Very low	118 Å²	118	140 Å²	140	72%	0.715	76%	0.757	S	S	*	*			trans	72.1	142.9	142.7	168.1	0	0	0	0	115.9
591	Q	25.2	Very low	25.2	Very low	151 Å²	151	137.1 Å²	137.1	71%	0.706	75%	0.749	S	S	*	*			cis	-159.7	145.6	29.4	-145.1	140.3	26.1	0	0	112.7
592	Q	25.2	Very low	25.2	Very low	155 Å²	155	137.1 Å²	137.1	72%	0.724	75%	0.753	S	S	*	*			trans	62.1	149.2	147	-74.8	170.2	4.2	0	0	121.3
593	L	24.4	Very low	25.3	Very low	119 Å²	119	138.9 Å²	138.9	62%	0.623	75%	0.754	S	S	*	*			cis	-144.3	133.6	-7	-77.3	116.5	0	0	0	113.4
594	Y	23.7	Very low	25.2	Very low	175 Å²	175	139.9 Å²	139.9	69%	0.686	76%	0.762	S	S	*	*			trans	29.2	114	137.3	-57.6	-84.7	0	0	0	126.5
595	T	21.8	Very low	25.3	Very low	110 Å²	110	139 Å²	139	68%	0.675	76%	0.761	S	S	*	*				41	135.3	126.7	60.5	0	0	0	0	124.4
596	Y	23.5	Very low	25.6	Very low	222 Å²	222	139.3 Å²	139.3	87%	0.871	76%	0.76	S	S	*	*				-178.9	156.5	112	-112.1	-83.8	0	0	0	114.3
597	I	22.5	Very low	25.8	Very low	152 Å²	152	142.8 Å²	142.8	78%	0.779	76%	0.764	S	S	*	*			trans	-154.1	156.3	-179.7	-65.2	-179.4	0	0	0	107.7
598	P	27.4	Very low	26	Very low	113 Å²	113	140.1 Å²	140.1	73%	0.734	76%	0.759	S	S	*	*			cis	-120.1	-173.8	-19.2	37.9	-22.9	0	0	0	113
599	V	27.2	Very low	26.3	Very low	144 Å²	144	141.2 Å²	141.2	87%	0.873	76%	0.764	S	S	*	*			trans	-135.7	143.4	161.2	-178	0	0	0	0	111
600	L	22.9	Very low	26.5	Very low	150 Å²	150	141 Å²	141	79%	0.785	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-92.4	143.1	178.8	-66.4	161.1	0	0	0	111.7
601	P	27.9	Very low	26.8	Very low	109 Å²	109	142.3 Å²	142.3	71%	0.708	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.1	161.8	31.3	-30.8	0	0	0	110.5
602	I	24.4	Very low	26.9	Very low	160 Å²	160	145 Å²	145	82%	0.821	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-92.6	136.5	166.9	-63.4	174.4	0	0	0	107.6
603	F	25.9	Very low	27.1	Very low	162 Å²	162	143.1 Å²	143.1	71%	0.711	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-99.4	139.4	174.8	-81.3	-100.1	0	0	0	110.7
604	E	24.4	Very low	27.4	Very low	190 Å²	190	143 Å²	143	89%	0.888	79%	0.786	S	S	*	*			trans	-116.9	147.9	152.2	-66.6	-166.6	139.4	0	0	108.2
605	A	27	Very low	27.8	Very low	88 Å²	88	141.5 Å²	141.5	73%	0.727	80%	0.795	S	S	*	*			trans	-126.5	134.2	-172.3	0	0	0	0	0	111.5
606	P	33.6	Very low	28.2	Very low	126 Å²	126	143 Å²	143	82%	0.818	80%	0.799	S	S	*	*			trans	-64.3	150.7	170.4	-18.4	31.7	0	0	0	112
607	K	28	Very low	28.5	Very low	212 Å²	212	137 Å²	137	92%	0.922	79%	0.789	S	S	*	*			trans	-108	130.9	174.7	-64.3	178.6	-177.6	175.3	0	110.6
608	G	32.1	Very low	28.6	Very low	69 Å²	69	134.4 Å²	134.4	71%	0.711	79%	0.785	S	S	*	*			trans	-165.7	132.4	170.5	0	0	0	0	0	111
609	P	32.6	Very low	28.6	Very low	129 Å²	129	133.4 Å²	133.4	84%	0.838	78%	0.781	S	S	*	*			trans	-95.4	143.9	-177.3	35.4	-32.8	0	0	0	113.2
610	P	32.7	Very low	28.7	Very low	107 Å²	107	137 Å²	137	70%	0.695	78%	0.78	S	S	*	*			trans	-91	160.4	167.1	36.2	-33.2	0	0	0	112.4
611	V	29.6	Very low	28.8	Very low	145 Å²	145	138.8 Å²	138.8	88%	0.879	78%	0.782	S	S	*	*			trans	-112.6	145	170.5	179	0	0	0	0	109
612	Y	27.3	Very low	28.7	Very low	208 Å²	208	138 Å²	138	82%	0.816	78%	0.779	S	S	*	*			trans	-149.2	152	-174.7	-104	-83.6	0	0	0	111.6
613	S	29.5	Very low	28.9	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	78%	0.782	S	S	*	*			trans	-153.1	116	166.3	54.7	0	0	0	0	110.9
614	P	32.3	Very low	28.8	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	79%	0.785	S	S	*	*			trans	-121.7	162.2	-172.5	41	-31.6	0	0	0	116
615	T	32.2	Very low	29	Very low	143 Å²	143	133.1 Å²	133.1	88%	0.877	78%	0.784	S	S	*	*			trans	-155.6	174.2	160.9	49.3	0	0	0	0	110
616	D	28.7	Very low	29	Very low	141 Å²	141	137 Å²	137	75%	0.754	79%	0.787	S	S	*	*				-157.5	156.6	-61.7	-175.3	36.3	0	0	0	110.7
617	S	30	Very low	28.7	Very low	97 Å²	97	136.7 Å²	136.7	68%	0.678	79%	0.785	S	S	*	*			trans	68.7	159.7	163.4	84.9	0	0	0	0	118.9
618	S	26	Very low	28.6	Very low	97 Å²	97	133.4 Å²	133.4	68%	0.678	78%	0.778	S	S	*	*			cis	-167.4	153	-39.5	60.2	0	0	0	0	111.6
619	S	27.1	Very low	28.4	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	79%	0.785	S	S	*	*			trans	65.4	143.6	167.6	72.2	0	0	0	0	117.2
620	Y	27.8	Very low	28.1	Very low	219 Å²	219	145 Å²	145	86%	0.859	79%	0.791	S	S	*	*				-152.5	168.2	59.4	-117.4	-94.3	0	0	0	115.2
621	F	26.1	Very low	27.8	Very low	187 Å²	187	145.4 Å²	145.4	82%	0.82	79%	0.787	S	S	*	*			trans	-109.4	161.2	-179.5	-74.8	-107	0	0	0	111.6
622	S	25.9	Very low	27.8	Very low	94 Å²	94	147.1 Å²	147.1	66%	0.657	79%	0.786	S	S	*	*			cis	-175.9	173.6	-22.7	62.5	0	0	0	0	108.6
623	N	28.9	Very low	27.9	Very low	163 Å²	163	146.4 Å²	146.4	87%	0.872	79%	0.79	S	S	*	*			trans	-177.7	142.7	151.5	-97.1	-35.3	0	0	0	113.6
624	S	23.9	Very low	27.8	Very low	112 Å²	112	150.3 Å²	150.3	78%	0.783	79%	0.787	S	S	*	*			trans	-163.6	133.3	171	-71.7	0	0	0	0	112.3
625	P	27.4	Very low	27.6	Very low	133 Å²	133	153.2 Å²	153.2	86%	0.864	79%	0.788	S	S	*	*			trans	-72.3	165.2	171.6	-18.5	33.3	0	0	0	114.1
626	Q	27	Very low	27.4	Very low	169 Å²	169	151.9 Å²	151.9	79%	0.79	78%	0.783	S	S	*	*			trans	-98.2	160.9	-177.3	-62.9	-151.6	-3	0	0	114.3
627	P	27.1	Very low	27.6	Very low	120 Å²	120	149.6 Å²	149.6	78%	0.779	77%	0.771	S	S	*	*			trans	-113.4	87.8	-172.1	38.2	-23.9	0	0	0	113.8
628	D	26.9	Very low	27.8	Very low	143 Å²	143	148.5 Å²	148.5	77%	0.765	76%	0.762	S	S	*	*			trans	-117.8	37.8	-178.3	-67.6	-45	0	0	0	114.1
629	Q	26.5	Very low	28.3	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	75%	0.754	S	S	*	*			trans	-148.2	94.3	171.1	-74	-166.9	-27.1	0	0	112.3
630	W	27.7	Very low	29	Very low	259 Å²	259	147.6 Å²	147.6	98%	0.981	75%	0.752	S	S	*	*			trans	-146.3	129.5	161.4	-87	-8.8	0	0	0	109.7
631	D	26.1	Very low	29.7	Very low	114 Å²	114	140.4 Å²	140.4	61%	0.61	73%	0.728	S	S	*	*			trans	-63	138.9	-174.9	-50.9	-44.4	0	0	0	113.3	R634	D631-R634 IonicContact OD2-CZ 2.73Å; D631-R634 IonicContact OD2-NE 2.61Å; D631-R634 IonicContact OD2-NH2 3.78Å; D631-R634 PolarHBondContact OD2-NH2 3.01Å
632	E	28.6	Very low	30.5	Very low	182 Å²	182	136 Å²	136	85%	0.85	71%	0.706	S	S	*	*	S	Bend	trans	-79.5	-19	-179.7	-60.3	-163.1	114.5	0	0	114.1	R634	E632-R634 VanDerWaalsContact C-N 3.26Å; E632-R634 PolarHBondContact O-N 2.97Å
633	E	30.1	Very low	31.5	Very low	192 Å²	192	134.6 Å²	134.6	90%	0.897	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	6.1	-166	-59.3	-167	138.2	0	0	116.5
634	R	28.2	Very low	32.4	Very low	198 Å²	198	131.4 Å²	131.4	75%	0.747	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	6.9	-168.2	-59.9	-170.1	-165.7	-176.8	11.2	116.4	D631 E632	D631-R634 IonicContact OD2-CZ 2.73Å; D631-R634 IonicContact OD2-NE 2.61Å; D631-R634 IonicContact OD2-NH2 3.78Å; D631-R634 PolarHBondContact OD2-NH2 3.01Å; E632-R634 VanDerWaalsContact C-N 3.26Å; E632-R634 PolarHBondContact O-N 2.97Å
635	F	26.8	Very low	33.4	Very low	177 Å²	177	129.7 Å²	129.7	78%	0.776	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-93	124.2	177.2	-81.3	-88.4	0	0	0	112.7
636	C	29.4	Very low	34.3	Very low	115 Å²	115	124.6 Å²	124.6	78%	0.777	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-62.8	141.8	170.9	-64.8	0	0	0	0	111.5	P638	C636-P638 VanDerWaalsContact O-CD 3.31Å; C636-P638 WeakPolarHBondContact O-CD 3.33Å
637	D	31.7	Very low	35.5	Very low	93 Å²	93	124.3 Å²	124.3	50%	0.497	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-60.6	120.6	-177.6	-178.6	3	0	0	0	112.4	T639 S640	D637-T639 PolarHBondContact O-N 3.32Å; D637-T639 WeakPolarHBondContact OD1-CG2 3.4Å; D637-T639 PolarHBondContact OD1-N 3.43Å; D637-T639 PolarHBondContact OD1-OG1 3.33Å; D637-T639 WeakPolarHBondContact OD2-CB 3.45Å; D637-T639 VanDerWaalsContact OD2-CG2 3.31Å; D637-T639 WeakPolarHBondContact OD2-CG2 3.43Å; D637-T639 PolarHBondContact OD2-OG1 3.43Å; D637-S640 WeakPolarHBondContact O-CB 3.39Å; D637-S640 PolarHBondContact O-N 2.82Å; D637-S640 VanDerWaalsContact O-N 3.17Å; D637-S640 PolarHBondContact O-OG 2.75Å
638	P	35	Very low	36.6	Very low	75 Å²	75	124.9 Å²	124.9	49%	0.487	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-59.4	-11.8	174.4	-24.8	35.5	0	0	0	115.5	C636 S640 K646	C636-P638 VanDerWaalsContact O-CD 3.31Å; C636-P638 WeakPolarHBondContact O-CD 3.33Å; P638-S640 PolarHBondContact O-N 3.12Å; P638-K646 WeakPolarHBondContact O-CE 3.31Å; P638-K646 PolarHBondContact O-NZ 2.92Å
639	T	36.9	Very low	37.5	Very low	82 Å²	82	120.5 Å²	120.5	50%	0.503	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-57.5	-38.1	171.1	63.5	0	0	0	0	111.8	D637 L641 K646	D637-T639 PolarHBondContact O-N 3.32Å; D637-T639 WeakPolarHBondContact OD1-CG2 3.4Å; D637-T639 PolarHBondContact OD1-N 3.43Å; D637-T639 PolarHBondContact OD1-OG1 3.33Å; D637-T639 WeakPolarHBondContact OD2-CB 3.45Å; D637-T639 VanDerWaalsContact OD2-CG2 3.31Å; D637-T639 WeakPolarHBondContact OD2-CG2 3.43Å; D637-T639 PolarHBondContact OD2-OG1 3.43Å; T639-L641 VanDerWaalsContact C-N 3.34Å; T639-L641 PolarHBondContact O-N 3.45Å; T639-K646 PolarHBondContact O-NZ 3.32Å
640	S	40.4	Very low	38.6	Very low	89 Å²	89	112.5 Å²	112.5	62%	0.622	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-59.6	-29.2	-172.1	60.3	0	0	0	0	116.3	D637 P638	D637-S640 WeakPolarHBondContact O-CB 3.39Å; D637-S640 PolarHBondContact O-N 2.82Å; D637-S640 VanDerWaalsContact O-N 3.17Å; D637-S640 PolarHBondContact O-OG 2.75Å; P638-S640 PolarHBondContact O-N 3.12Å
641	L	42.7	Very low	39.7	Very low	68 Å²	68	104 Å²	104	36%	0.356	54%	0.535	S	S	.	.	S	Bend	trans	-67.7	143.5	-179.5	-65.5	168.6	0	0	0	111.8	T639 F645 K646	T639-L641 VanDerWaalsContact C-N 3.34Å; T639-L641 PolarHBondContact O-N 3.45Å; L641-F645 HydrophobicContact CD1-CE1 4.48Å; L641-F645 HydrophobicContact CD2-CD1 3.98Å; L641-F645 HydrophobicContact CD2-CE1 4.04Å; L641-K646 HydrophobicContact CB-CD 3.93Å; L641-K646 HydrophobicContact CB-CG 3.91Å; L641-K646 WeakPolarHBondContact O-CD 3.46Å; L641-K646 WeakPolarHBondContact O-CE 3.35Å; L641-K646 PolarHBondContact O-NZ 2.99Å
642	R	43.9	Very low	40.9	Very low	95 Å²	95	104.4 Å²	104.4	36%	0.358	54%	0.535	S	S	.	.			trans	-67.4	149.3	175.6	-67.3	-170.9	-178.9	-174.6	0.9	112.8	D644 F645 K646	R642-D644 VanDerWaalsContact C-N 3.26Å; R642-D644 WeakPolarHBondContact CB-OD2 3.45Å; R642-D644 VanDerWaalsContact CD-OD2 3.25Å; R642-D644 WeakPolarHBondContact CD-OD2 3.4Å; R642-D644 PolarHBondContact O-N 3.48Å; R642-F645 PolarHBondContact O-N 3.42Å; R642-K646 WeakPolarHBondContact O-CB 3.45Å; R642-K646 WeakPolarHBondContact O-CD 3.43Å; R642-K646 WeakPolarHBondContact O-CG 3.42Å; R642-K646 PolarHBondContact O-N 3.07Å
643	A	46.7	Very low	41.9	Very low	64 Å²	64	96.6 Å²	96.6	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-58	-38.9	177.6	0	0	0	0	0	112.5	K647	A643-K647 VanDerWaalsContact O-CB 3.27Å; A643-K647 WeakPolarHBondContact O-CB 3.5Å; A643-K647 PolarHBondContact O-N 2.84Å
644	D	47.1	Very low	43	Very low	96 Å²	96	88 Å²	88	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-60.6	-56.9	175.9	9.3	-60.6	0	0	0	111.8	R642 K646 K647 E648	R642-D644 VanDerWaalsContact C-N 3.26Å; R642-D644 WeakPolarHBondContact CB-OD2 3.45Å; R642-D644 VanDerWaalsContact CD-OD2 3.25Å; R642-D644 WeakPolarHBondContact CD-OD2 3.4Å; R642-D644 PolarHBondContact O-N 3.48Å; D644-K646 VanDerWaalsContact C-N 3.32Å; D644-K646 PolarHBondContact O-N 3.5Å; D644-K647 CarbonylContact O-C 3.4Å; D644-K647 WeakPolarHBondContact O-CA 3.48Å; D644-K647 WeakPolarHBondContact O-CB 3.38Å; D644-K647 PolarHBondContact O-N 3.13Å; D644-E648 PolarHBondContact O-N 3.31Å
645	F	46.2	Very low	44.2	Very low	76 Å²	76	81.3 Å²	81.3	33%	0.333	44%	0.444	S	S	.	.	H	α-helix	trans	-58.3	-42.2	175.5	-178.9	-93	0	0	0	112.4	L641 R642 K647 E648 M649	L641-F645 HydrophobicContact CD1-CE1 4.48Å; L641-F645 HydrophobicContact CD2-CD1 3.98Å; L641-F645 HydrophobicContact CD2-CE1 4.04Å; R642-F645 PolarHBondContact O-N 3.42Å; F645-K647 VanDerWaalsContact C-N 3.26Å; F645-K647 PolarHBondContact O-N 2.77Å; F645-E648 PolarHBondContact O-N 3.28Å; F645-M649 HydrophobicContact CD1-CG 4.42Å; F645-M649 HydrophobicContact CD1-SD 4.41Å; F645-M649 HydrophobicContact CE1-CG 3.93Å; F645-M649 HydrophobicContact CE1-SD 3.7Å; F645-M649 HydrophobicContact CZ-CG 4.33Å; F645-M649 HydrophobicContact CZ-SD 4.4Å; F645-M649 PolarHBondContact O-N 2.99Å
646	K	46	Very low	45.2	Very low	26 Å²	26	75.7 Å²	75.7	11%	0.113	42%	0.421	C	S	.	.	H	α-helix	trans	-61.1	-33.6	173.8	-80.1	157.2	153.4	151.2	0	112.8	P638 T639 L641 R642 D644 A650 Y689	P638-K646 WeakPolarHBondContact O-CE 3.31Å; P638-K646 PolarHBondContact O-NZ 2.92Å; T639-K646 PolarHBondContact O-NZ 3.32Å; L641-K646 HydrophobicContact CB-CD 3.93Å; L641-K646 HydrophobicContact CB-CG 3.91Å; L641-K646 WeakPolarHBondContact O-CD 3.46Å; L641-K646 WeakPolarHBondContact O-CE 3.35Å; L641-K646 PolarHBondContact O-NZ 2.99Å; R642-K646 WeakPolarHBondContact O-CB 3.45Å; R642-K646 WeakPolarHBondContact O-CD 3.43Å; R642-K646 WeakPolarHBondContact O-CG 3.42Å; R642-K646 PolarHBondContact O-N 3.07Å; D644-K646 VanDerWaalsContact C-N 3.32Å; D644-K646 PolarHBondContact O-N 3.5Å; K646-A650 WeakPolarHBondContact O-CB 3.43Å; K646-A650 PolarHBondContact O-N 3.02Å; K646-Y689 HydrophobicContact CB-CE1 3.7Å; K646-Y689 HydrophobicContact CB-CE2 4.04Å; K646-Y689 VanDerWaalsContact CB-CZ 3.43Å; K646-Y689 VanDerWaalsContact CB-OH 3.31Å; K646-Y689 WeakPolarHBondContact CB-OH 3.28Å; K646-Y689 HydrophobicContact CD-CD2 4.05Å; K646-Y689 HydrophobicContact CD-CE2 3.38Å; K646-Y689 VanDerWaalsContact CE-CE2 3.48Å; K646-Y689 HydrophobicContact CG-CD2 4.37Å; K646-Y689 HydrophobicContact CG-CE1 4.2Å; K646-Y689 HydrophobicContact CG-CE2 3.87Å
647	K	50.6	Low	46.3	Very low	163 Å²	163	71.5 Å²	71.5	71%	0.709	39%	0.392	S	S	*	.	H	α-helix	trans	-74.8	-35.9	176.7	-166.5	179.5	-175.1	-177.5	0	111.4	A643 D644 F645 A650 S651	A643-K647 VanDerWaalsContact O-CB 3.27Å; A643-K647 WeakPolarHBondContact O-CB 3.5Å; A643-K647 PolarHBondContact O-N 2.84Å; D644-K647 CarbonylContact O-C 3.4Å; D644-K647 WeakPolarHBondContact O-CA 3.48Å; D644-K647 WeakPolarHBondContact O-CB 3.38Å; D644-K647 PolarHBondContact O-N 3.13Å; F645-K647 VanDerWaalsContact C-N 3.26Å; F645-K647 PolarHBondContact O-N 2.77Å; K647-A650 PolarHBondContact O-N 2.7Å; K647-S651 WeakPolarHBondContact O-CB 3.49Å; K647-S651 PolarHBondContact O-N 2.76Å
648	E	50.6	Low	47.2	Very low	131 Å²	131	70.8 Å²	70.8	61%	0.612	39%	0.385	S	S	*	.	H	α-helix	trans	-64.5	-47.3	168.8	-69.7	-164.7	135	0	0	111.8	D644 F645 A650 S651 M652	D644-E648 PolarHBondContact O-N 3.31Å; F645-E648 PolarHBondContact O-N 3.28Å; E648-A650 VanDerWaalsContact C-N 3.34Å; E648-A650 PolarHBondContact O-N 2.7Å; E648-S651 CarbonylContact O-C 3.48Å; E648-S651 WeakPolarHBondContact O-CB 3.29Å; E648-S651 PolarHBondContact O-N 3.12Å; E648-S651 VanDerWaalsContact O-N 3.13Å; E648-M652 WeakPolarHBondContact O-CB 3.31Å; E648-M652 PolarHBondContact O-N 2.86Å
649	M	45.7	Very low	48	Very low	51 Å²	51	74 Å²	74	25%	0.251	39%	0.391	S	S	.	.	H	α-helix	trans	-55.4	-47	172.7	-89.4	-166.1	71	0	0	111.9	F645 S651 M652 V653	F645-M649 HydrophobicContact CD1-CG 4.42Å; F645-M649 HydrophobicContact CD1-SD 4.41Å; F645-M649 HydrophobicContact CE1-CG 3.93Å; F645-M649 HydrophobicContact CE1-SD 3.7Å; F645-M649 HydrophobicContact CZ-CG 4.33Å; F645-M649 HydrophobicContact CZ-SD 4.4Å; F645-M649 PolarHBondContact O-N 2.99Å; M649-S651 VanDerWaalsContact C-N 3.33Å; M649-S651 PolarHBondContact O-N 2.71Å; M649-M652 PolarHBondContact O-N 3.01Å; M649-V653 WeakPolarHBondContact O-CB 3.39Å; M649-V653 VanDerWaalsContact O-CG2 3.31Å; M649-V653 WeakPolarHBondContact O-CG2 3.19Å; M649-V653 PolarHBondContact O-N 3.03Å
650	A	49.6	Very low	48.5	Very low	17 Å²	17	74 Å²	74	14%	0.14	38%	0.383	C	S	.	.	H	α-helix	trans	-61.7	-40.2	176.9	0	0	0	0	0	112.2	K646 K647 E648 V654 V693	K646-A650 WeakPolarHBondContact O-CB 3.43Å; K646-A650 PolarHBondContact O-N 3.02Å; K647-A650 PolarHBondContact O-N 2.7Å; E648-A650 VanDerWaalsContact C-N 3.34Å; E648-A650 PolarHBondContact O-N 2.7Å; A650-V654 WeakPolarHBondContact O-CB 3.08Å; A650-V654 VanDerWaalsContact O-CG2 3.25Å; A650-V654 WeakPolarHBondContact O-CG2 3.48Å; A650-V654 PolarHBondContact O-N 2.77Å; A650-V693 HydrophobicContact CB-CG1 4.43Å; A650-V693 HydrophobicContact CB-CG2 3.82Å
651	S	52.5	Low	49	Very low	80 Å²	80	73.6 Å²	73.6	56%	0.559	39%	0.385	S	S	*	.	H	α-helix	trans	-66.1	-42	175.5	-167.1	0	0	0	0	112.3	K647 E648 M649 V654 S655	K647-S651 WeakPolarHBondContact O-CB 3.49Å; K647-S651 PolarHBondContact O-N 2.76Å; E648-S651 CarbonylContact O-C 3.48Å; E648-S651 WeakPolarHBondContact O-CB 3.29Å; E648-S651 PolarHBondContact O-N 3.12Å; E648-S651 VanDerWaalsContact O-N 3.13Å; M649-S651 VanDerWaalsContact C-N 3.33Å; M649-S651 PolarHBondContact O-N 2.71Å; S651-V654 PolarHBondContact O-N 3.21Å; S651-S655 VanDerWaalsContact O-CB 3.24Å; S651-S655 WeakPolarHBondContact O-CB 3.37Å; S651-S655 PolarHBondContact O-N 3.14Å
652	M	50.1	Low	49.4	Very low	122 Å²	122	75.5 Å²	75.5	60%	0.601	40%	0.399	S	S	*	.	H	α-helix	trans	-66.9	-41.3	178.2	-168.9	-171.6	-57.9	0	0	111.5	E648 M649 S655 M656	E648-M652 WeakPolarHBondContact O-CB 3.31Å; E648-M652 PolarHBondContact O-N 2.86Å; M649-M652 PolarHBondContact O-N 3.01Å; M652-S655 PolarHBondContact O-N 2.85Å; M652-M656 WeakPolarHBondContact O-CB 3.4Å; M652-M656 PolarHBondContact O-N 2.87Å
653	V	49.6	Very low	49.3	Very low	18 Å²	18	73.2 Å²	73.2	11%	0.109	40%	0.398	C	S	.	.	H	α-helix	trans	-65	-45.8	173.3	166.5	0	0	0	0	111.2	M649 S655 M656 V657 L681 I685	M649-V653 WeakPolarHBondContact O-CB 3.39Å; M649-V653 VanDerWaalsContact O-CG2 3.31Å; M649-V653 WeakPolarHBondContact O-CG2 3.19Å; M649-V653 PolarHBondContact O-N 3.03Å; V653-S655 VanDerWaalsContact C-N 3.31Å; V653-S655 PolarHBondContact O-N 3.44Å; V653-M656 PolarHBondContact O-N 3.06Å; V653-V657 HydrophobicContact CG1-CG2 4.37Å; V653-V657 WeakPolarHBondContact O-CB 3.39Å; V653-V657 VanDerWaalsContact O-CG2 3.32Å; V653-V657 WeakPolarHBondContact O-CG2 3.34Å; V653-V657 PolarHBondContact O-N 3.42Å; V653-L681 HydrophobicContact CB-CD1 4.46Å; V653-L681 HydrophobicContact CG1-CD1 3.83Å; V653-L681 HydrophobicContact CG1-CD2 3.91Å; V653-L681 HydrophobicContact CG1-CG 4.2Å; V653-L681 HydrophobicContact CG2-CD1 3.78Å; V653-I685 HydrophobicContact CG1-CD1 4.14Å; V653-I685 HydrophobicContact CG2-CD1 4.31Å
654	V	53.2	Low	49	Very low	13 Å²	13	75.2 Å²	75.2	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-61.4	-41.9	175.5	168.4	0	0	0	0	110.5	A650 S651 V657 E658	A650-V654 WeakPolarHBondContact O-CB 3.08Å; A650-V654 VanDerWaalsContact O-CG2 3.25Å; A650-V654 WeakPolarHBondContact O-CG2 3.48Å; A650-V654 PolarHBondContact O-N 2.77Å; S651-V654 PolarHBondContact O-N 3.21Å; V654-V657 PolarHBondContact O-N 3.21Å; V654-E658 HydrophobicContact CG1-CG 4.23Å; V654-E658 WeakPolarHBondContact CG1-OE1 3.4Å; V654-E658 VanDerWaalsContact O-CB 3.28Å; V654-E658 WeakPolarHBondContact O-CB 3.2Å; V654-E658 VanDerWaalsContact O-CG 3.29Å; V654-E658 WeakPolarHBondContact O-CG 3.23Å; V654-E658 PolarHBondContact O-N 2.92Å
655	S	53.2	Low	49	Very low	56 Å²	56	77.5 Å²	77.5	39%	0.392	42%	0.416	S	S	.	.	H	α-helix	trans	-64.1	-40.3	175.1	-176.5	0	0	0	0	112.9	S651 M652 V653 K659	S651-S655 VanDerWaalsContact O-CB 3.24Å; S651-S655 WeakPolarHBondContact O-CB 3.37Å; S651-S655 PolarHBondContact O-N 3.14Å; M652-S655 PolarHBondContact O-N 2.85Å; V653-S655 VanDerWaalsContact C-N 3.31Å; V653-S655 PolarHBondContact O-N 3.44Å; S655-K659 VanDerWaalsContact O-CB 3.31Å; S655-K659 WeakPolarHBondContact O-CB 3.46Å; S655-K659 WeakPolarHBondContact O-CG 3.26Å; S655-K659 PolarHBondContact O-N 3.27Å
656	M	48.2	Very low	48.5	Very low	59 Å²	59	76.4 Å²	76.4	29%	0.291	42%	0.416	S	S	.	.	H	α-helix	trans	-64	-45.2	172.3	-83.4	-170.3	76.2	0	0	111.9	V28 M652 V653 K659 Y660 F677	V28-M656 HydrophobicContact CG1-CE 4.47Å; M652-M656 WeakPolarHBondContact O-CB 3.4Å; M652-M656 PolarHBondContact O-N 2.87Å; V653-M656 PolarHBondContact O-N 3.06Å; M656-K659 PolarHBondContact O-N 3.47Å; M656-Y660 WeakPolarHBondContact O-CB 3.46Å; M656-Y660 PolarHBondContact O-N 3.45Å; M656-F677 HydrophobicContact CE-CE2 4.35Å; M656-F677 HydrophobicContact CE-CZ 4.49Å
657	V	52.2	Low	48.1	Very low	28 Å²	28	80.1 Å²	80.1	17%	0.17	44%	0.442	C	S	.	.	H	α-helix	trans	-66.9	-41	179	168.2	0	0	0	0	111.1	V653 V654 Y660 A661 A708	V653-V657 HydrophobicContact CG1-CG2 4.37Å; V653-V657 WeakPolarHBondContact O-CB 3.39Å; V653-V657 VanDerWaalsContact O-CG2 3.32Å; V653-V657 WeakPolarHBondContact O-CG2 3.34Å; V653-V657 PolarHBondContact O-N 3.42Å; V654-V657 PolarHBondContact O-N 3.21Å; V657-Y660 CarbonylContact O-C 3.59Å; V657-Y660 WeakPolarHBondContact O-CB 3.44Å; V657-Y660 PolarHBondContact O-N 3.01Å; V657-Y660 VanDerWaalsContact O-N 3.17Å; V657-A661 WeakPolarHBondContact O-CB 3.44Å; V657-A661 PolarHBondContact O-N 3.34Å; V657-A708 HydrophobicContact CG1-CB 4.07Å
658	E	51.7	Low	48	Very low	77 Å²	77	83.7 Å²	83.7	36%	0.36	45%	0.451	S	S	.	.	H	α-helix	trans	-67.2	-40.5	175.8	-74.5	174.9	-174.5	0	0	111.1	V654 Y660 A661 T662 S704	V654-E658 HydrophobicContact CG1-CG 4.23Å; V654-E658 WeakPolarHBondContact CG1-OE1 3.4Å; V654-E658 VanDerWaalsContact O-CB 3.28Å; V654-E658 WeakPolarHBondContact O-CB 3.2Å; V654-E658 VanDerWaalsContact O-CG 3.29Å; V654-E658 WeakPolarHBondContact O-CG 3.23Å; V654-E658 PolarHBondContact O-N 2.92Å; E658-Y660 VanDerWaalsContact C-N 3.33Å; E658-Y660 PolarHBondContact O-N 3.27Å; E658-A661 PolarHBondContact O-N 2.97Å; E658-T662 WeakPolarHBondContact O-CB 3.24Å; E658-T662 WeakPolarHBondContact O-CG2 3.35Å; E658-T662 PolarHBondContact O-N 3.42Å; E658-T662 PolarHBondContact O-OG1 2.92Å; E658-S704 PolarHBondContact OE1-OG 3.04Å
659	K	50.4	Low	47.7	Very low	142 Å²	142	79.5 Å²	79.5	62%	0.617	43%	0.433	S	S	*	.	H	α-helix	trans	-62.9	-35.4	168.3	-77.9	-175.2	175.1	-173.6	0	112.7	S655 M656 S663	S655-K659 VanDerWaalsContact O-CB 3.31Å; S655-K659 WeakPolarHBondContact O-CB 3.46Å; S655-K659 WeakPolarHBondContact O-CG 3.26Å; S655-K659 PolarHBondContact O-N 3.27Å; M656-K659 PolarHBondContact O-N 3.47Å; K659-S663 WeakPolarHBondContact O-CB 3.49Å; K659-S663 PolarHBondContact O-N 3.18Å
660	Y	48.5	Very low	47.9	Very low	83 Å²	83	79.8 Å²	79.8	33%	0.325	44%	0.44	S	S	.	.	H	α-helix	trans	-70	-34.8	175.8	-128.6	-77.6	0	0	0	112.8	M656 V657 E658 V666 P667 L669	M656-Y660 WeakPolarHBondContact O-CB 3.46Å; M656-Y660 PolarHBondContact O-N 3.45Å; V657-Y660 CarbonylContact O-C 3.59Å; V657-Y660 WeakPolarHBondContact O-CB 3.44Å; V657-Y660 PolarHBondContact O-N 3.01Å; V657-Y660 VanDerWaalsContact O-N 3.17Å; E658-Y660 VanDerWaalsContact C-N 3.33Å; E658-Y660 PolarHBondContact O-N 3.27Å; Y660-V666 HydrophobicContact CD1-CG1 4.03Å; Y660-V666 HydrophobicContact CD2-CG1 4.23Å; Y660-V666 HydrophobicContact CE1-CG1 3.43Å; Y660-V666 VanDerWaalsContact CE1-CG1 3.43Å; Y660-V666 HydrophobicContact CE2-CG1 3.66Å; Y660-V666 HydrophobicContact CG-CG1 4.39Å; Y660-V666 VanDerWaalsContact OH-CG1 3.29Å; Y660-V666 WeakPolarHBondContact OH-CG1 3.34Å; Y660-P667 PolarHBondContact OH-O 3.19Å; Y660-L669 HydrophobicContact CD1-CD1 4.34Å; Y660-L669 HydrophobicContact CE1-CD1 3.59Å; Y660-L669 HydrophobicContact CE1-CG 3.72Å; Y660-L669 HydrophobicContact CE2-CD1 4.16Å; Y660-L669 VanDerWaalsContact OH-CG 3.25Å; Y660-L669 WeakPolarHBondContact OH-CG 3.47Å
661	A	51.2	Low	48	Very low	81 Å²	81	87.3 Å²	87.3	67%	0.669	47%	0.47	S	S	*	.	H	α-helix	trans	-82	-24.8	179.7	0	0	0	0	0	113.1	V657 E658	V657-A661 WeakPolarHBondContact O-CB 3.44Å; V657-A661 PolarHBondContact O-N 3.34Å; E658-A661 PolarHBondContact O-N 2.97Å
662	T	49.7	Very low	48.1	Very low	107 Å²	107	88.3 Å²	88.3	66%	0.656	47%	0.472	S	S	*	.	H	α-helix	trans	-100.2	-24	180	55.8	0	0	0	0	114.2	E658 T664	E658-T662 WeakPolarHBondContact O-CB 3.24Å; E658-T662 WeakPolarHBondContact O-CG2 3.35Å; E658-T662 PolarHBondContact O-N 3.42Å; E658-T662 PolarHBondContact O-OG1 2.92Å; T662-T664 PolarHBondContact O-N 2.95Å
663	S	41.7	Very low	48.1	Very low	48 Å²	48	87.3 Å²	87.3	34%	0.336	47%	0.466	S	S	.	.			trans	-79.2	110.3	-180	-172	0	0	0	0	112	K659 N665 V666	K659-S663 WeakPolarHBondContact O-CB 3.49Å; K659-S663 PolarHBondContact O-N 3.18Å; S663-N665 PolarHBondContact O-N 2.84Å; S663-N665 PolarHBondContact OG-N 3.45Å; S663-V666 WeakPolarHBondContact OG-CG2 3.32Å; S663-V666 PolarHBondContact OG-N 2.89Å
664	T	41.4	Very low	48.1	Very low	106 Å²	106	89 Å²	89	65%	0.65	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.6	167.9	52.7	0	0	0	0	113.3	F551 T662	F551-T664 HydrophobicContact CE1-CG2 4.4Å; F551-T664 HydrophobicContact CZ-CG2 4.34Å; T662-T664 PolarHBondContact O-N 2.95Å
665	N	47	Very low	48.1	Very low	144 Å²	144	94.6 Å²	94.6	77%	0.77	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	3	-171.6	-67.2	16.2	0	0	0	113.4	S663	S663-N665 PolarHBondContact O-N 2.84Å; S663-N665 PolarHBondContact OG-N 3.45Å
666	V	36.1	Very low	48.2	Very low	52 Å²	52	100.7 Å²	100.7	32%	0.315	51%	0.51	S	S	.	.	S	Bend	trans	-89.9	128.7	171.1	170.6	0	0	0	0	108.6	Y660 S663 R668	Y660-V666 HydrophobicContact CD1-CG1 4.03Å; Y660-V666 HydrophobicContact CD2-CG1 4.23Å; Y660-V666 HydrophobicContact CE1-CG1 3.43Å; Y660-V666 VanDerWaalsContact CE1-CG1 3.43Å; Y660-V666 HydrophobicContact CE2-CG1 3.66Å; Y660-V666 HydrophobicContact CG-CG1 4.39Å; Y660-V666 VanDerWaalsContact OH-CG1 3.29Å; Y660-V666 WeakPolarHBondContact OH-CG1 3.34Å; S663-V666 WeakPolarHBondContact OG-CG2 3.32Å; S663-V666 PolarHBondContact OG-N 2.89Å; V666-R668 PolarHBondContact O-N 3.39Å
667	P	37.9	Very low	48.3	Very low	104 Å²	104	100.5 Å²	100.5	68%	0.675	51%	0.507	S	S	*	.			trans	-54.1	127.2	176.8	-26.4	34.6	0	0	0	110.9	Y660 L669	Y660-P667 PolarHBondContact OH-O 3.19Å; P667-L669 PolarHBondContact O-N 3.35Å
668	R	47.5	Very low	48.3	Very low	238 Å²	238	100.6 Å²	100.6	90%	0.898	51%	0.512	S	S	*	.			trans	-58.1	113.1	174.5	-78	-176.9	172.4	178.5	-1.4	108.7	V666 S670	V666-R668 PolarHBondContact O-N 3.39Å; R668-S670 PolarHBondContact O-N 3.25Å; R668-S670 VanDerWaalsContact O-N 3.14Å
669	L	44.8	Very low	48.4	Very low	43 Å²	43	104.7 Å²	104.7	23%	0.225	52%	0.523	C	S	.	.			trans	-50.9	123.6	171.4	-70.4	162.9	0	0	0	108.3	Y660 P667 Q673 F674 F677	Y660-L669 HydrophobicContact CD1-CD1 4.34Å; Y660-L669 HydrophobicContact CE1-CD1 3.59Å; Y660-L669 HydrophobicContact CE1-CG 3.72Å; Y660-L669 HydrophobicContact CE2-CD1 4.16Å; Y660-L669 VanDerWaalsContact OH-CG 3.25Å; Y660-L669 WeakPolarHBondContact OH-CG 3.47Å; P667-L669 PolarHBondContact O-N 3.35Å; L669-Q673 HydrophobicContact CB-CB 4.01Å; L669-Q673 HydrophobicContact CD2-CB 3.71Å; L669-Q673 HydrophobicContact CG-CB 4.47Å; L669-F674 HydrophobicContact CB-CB 3.92Å; L669-F674 HydrophobicContact CB-CD2 4.39Å; L669-F674 HydrophobicContact CD1-CD2 3.83Å; L669-F677 HydrophobicContact CD1-CB 4.3Å; L669-F677 HydrophobicContact CD1-CG 4.45Å
670	S	50.5	Low	48.4	Very low	57 Å²	57	101.5 Å²	101.5	40%	0.399	52%	0.518	S	S	.	.			trans	-55.5	153.9	171.5	80.3	0	0	0	0	109.3	R668 T672 Q673 F674	R668-S670 PolarHBondContact O-N 3.25Å; R668-S670 VanDerWaalsContact O-N 3.14Å; S670-T672 CarbonylContact O-C 3.54Å; S670-T672 PolarHBondContact O-N 2.98Å; S670-Q673 CarbonylContact O-C 3.54Å; S670-Q673 WeakPolarHBondContact O-CA 3.31Å; S670-Q673 PolarHBondContact O-N 2.97Å; S670-Q673 WeakPolarHBondContact OG-CG 3.46Å; S670-Q673 PolarHBondContact OG-N 2.94Å; S670-F674 PolarHBondContact O-N 3.22Å
671	K	50.2	Low	48.5	Very low	176 Å²	176	98.5 Å²	98.5	77%	0.765	51%	0.508	S	S	*	.	H	α-helix	trans	-54.3	-27.6	-177.1	-154.3	169.4	-169.8	171.5	0	112.4	K675	K671-K675 VanDerWaalsContact O-CB 3.3Å; K671-K675 WeakPolarHBondContact O-CB 3.28Å; K671-K675 VanDerWaalsContact O-CG 3.31Å; K671-K675 WeakPolarHBondContact O-CG 3.4Å; K671-K675 PolarHBondContact O-N 2.98Å; K671-K675 VanDerWaalsContact O-N 3.15Å
672	T	56.1	Low	48.6	Very low	100 Å²	100	97.3 Å²	97.3	61%	0.613	49%	0.492	S	S	*	.	H	α-helix	trans	-74.3	-45.1	171.7	-49.5	0	0	0	0	113.2	S670 K675 R676	S670-T672 CarbonylContact O-C 3.54Å; S670-T672 PolarHBondContact O-N 2.98Å; T672-K675 CarbonylContact O-C 3.25Å; T672-K675 PolarHBondContact O-N 2.57Å; T672-R676 PolarHBondContact O-N 3.07Å
673	Q	49.8	Very low	48.8	Very low	102 Å²	102	100.3 Å²	100.3	48%	0.477	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-42.2	175.1	-71.1	169.8	-22.9	0	0	111.8	L669 S670 R676 F677	L669-Q673 HydrophobicContact CB-CB 4.01Å; L669-Q673 HydrophobicContact CD2-CB 3.71Å; L669-Q673 HydrophobicContact CG-CB 4.47Å; S670-Q673 CarbonylContact O-C 3.54Å; S670-Q673 WeakPolarHBondContact O-CA 3.31Å; S670-Q673 PolarHBondContact O-N 2.97Å; S670-Q673 WeakPolarHBondContact OG-CG 3.46Å; S670-Q673 PolarHBondContact OG-N 2.94Å; Q673-R676 CarbonylContact O-C 3.48Å; Q673-R676 WeakPolarHBondContact O-CA 3.42Å; Q673-R676 WeakPolarHBondContact O-CB 3.07Å; Q673-R676 PolarHBondContact O-N 3.49Å; Q673-F677 PolarHBondContact O-N 2.89Å
674	F	49.5	Very low	49	Very low	53 Å²	53	102.1 Å²	102.1	23%	0.232	50%	0.501	C	S	.	.	H	α-helix	trans	-64.3	-44.7	175.7	-168.3	-96.2	0	0	0	110.8	L669 S670 R676 F677 A678 L711	L669-F674 HydrophobicContact CB-CB 3.92Å; L669-F674 HydrophobicContact CB-CD2 4.39Å; L669-F674 HydrophobicContact CD1-CD2 3.83Å; S670-F674 PolarHBondContact O-N 3.22Å; F674-R676 PolarHBondContact O-N 2.87Å; F674-F677 PolarHBondContact O-N 3.13Å; F674-A678 VanDerWaalsContact O-CB 3.25Å; F674-A678 WeakPolarHBondContact O-CB 3.03Å; F674-A678 PolarHBondContact O-N 3.46Å; F674-L711 HydrophobicContact CE1-CB 4.09Å; F674-L711 WeakPolarHBondContact CE1-OXT 3.48Å; F674-L711 HydrophobicContact CZ-CB 3.98Å
675	K	52.8	Low	49.4	Very low	130 Å²	130	98.3 Å²	98.3	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-63	-16.6	170	-80.3	-174.1	172.5	-169.7	0	114.5	K671 T672 R679	K671-K675 VanDerWaalsContact O-CB 3.3Å; K671-K675 WeakPolarHBondContact O-CB 3.28Å; K671-K675 VanDerWaalsContact O-CG 3.31Å; K671-K675 WeakPolarHBondContact O-CG 3.4Å; K671-K675 PolarHBondContact O-N 2.98Å; K671-K675 VanDerWaalsContact O-N 3.15Å; T672-K675 CarbonylContact O-C 3.25Å; T672-K675 PolarHBondContact O-N 2.57Å; K675-R679 WeakPolarHBondContact O-CB 3.27Å; K675-R679 WeakPolarHBondContact O-CG 3.46Å; K675-R679 PolarHBondContact O-NE 3Å
676	R	54.8	Low	49.6	Very low	184 Å²	184	92.4 Å²	92.4	69%	0.694	45%	0.449	S	S	*	.	H	α-helix	trans	-84.3	-51.4	170.6	-114.7	179.8	173.8	171.4	-1.6	110.3	T672 Q673 F674 A678 R679 C680	T672-R676 PolarHBondContact O-N 3.07Å; Q673-R676 CarbonylContact O-C 3.48Å; Q673-R676 WeakPolarHBondContact O-CA 3.42Å; Q673-R676 WeakPolarHBondContact O-CB 3.07Å; Q673-R676 PolarHBondContact O-N 3.49Å; F674-R676 PolarHBondContact O-N 2.87Å; R676-A678 PolarHBondContact O-N 3.41Å; R676-R679 PolarHBondContact O-N 3.35Å; R676-C680 PolarHBondContact O-N 3.48Å; R676-C680 PolarHBondContact O-SG 3.21Å
677	F	50.9	Low	50.4	Low	55 Å²	55	97.3 Å²	97.3	24%	0.241	47%	0.468	C	S	.	.	H	α-helix	trans	-54.9	-52.8	175.6	179	-104.1	0	0	0	111.3	M656 L669 Q673 F674 R679 C680 L681	M656-F677 HydrophobicContact CE-CE2 4.35Å; M656-F677 HydrophobicContact CE-CZ 4.49Å; L669-F677 HydrophobicContact CD1-CB 4.3Å; L669-F677 HydrophobicContact CD1-CG 4.45Å; Q673-F677 PolarHBondContact O-N 2.89Å; F674-F677 PolarHBondContact O-N 3.13Å; F677-R679 VanDerWaalsContact C-N 3.34Å; F677-R679 PolarHBondContact O-N 2.78Å; F677-C680 PolarHBondContact O-N 3.33Å; F677-L681 HydrophobicContact CE1-CD2 4.09Å; F677-L681 HydrophobicContact CZ-CD1 4.18Å; F677-L681 VanDerWaalsContact O-CB 3.28Å; F677-L681 WeakPolarHBondContact O-CB 3.47Å; F677-L681 PolarHBondContact O-N 3.42Å
678	A	51.6	Low	51	Low	31 Å²	31	100 Å²	100	26%	0.256	47%	0.469	S	S	.	.	H	α-helix	trans	-58.5	-40.8	177.1	0	0	0	0	0	112.6	F674 R676 L681 T682	F674-A678 VanDerWaalsContact O-CB 3.25Å; F674-A678 WeakPolarHBondContact O-CB 3.03Å; F674-A678 PolarHBondContact O-N 3.46Å; R676-A678 PolarHBondContact O-N 3.41Å; A678-L681 WeakPolarHBondContact O-CB 3.14Å; A678-L681 PolarHBondContact O-N 2.75Å; A678-T682 WeakPolarHBondContact O-CB 3.34Å; A678-T682 PolarHBondContact O-N 3.33Å; A678-T682 PolarHBondContact O-OG1 3.42Å
679	R	53.8	Low	51.1	Low	162 Å²	162	90.5 Å²	90.5	61%	0.611	43%	0.434	S	S	*	.	H	α-helix	trans	-67.1	-40.6	175.2	-84.6	-175.1	-72.2	175.5	-3	112.9	K675 R676 F677 L681 K683	K675-R679 WeakPolarHBondContact O-CB 3.27Å; K675-R679 WeakPolarHBondContact O-CG 3.46Å; K675-R679 PolarHBondContact O-NE 3Å; R676-R679 PolarHBondContact O-N 3.35Å; F677-R679 VanDerWaalsContact C-N 3.34Å; F677-R679 PolarHBondContact O-N 2.78Å; R679-L681 VanDerWaalsContact C-N 3.32Å; R679-K683 WeakPolarHBondContact O-CB 3.48Å; R679-K683 PolarHBondContact O-N 3.24Å
680	C	51.1	Low	51.6	Low	75 Å²	75	90.4 Å²	90.4	51%	0.507	43%	0.433	S	S	.	.	H	α-helix	trans	-64.2	-39.2	172.3	-66.8	0	0	0	0	111.4	R676 F677 K683 M684	R676-C680 PolarHBondContact O-N 3.48Å; R676-C680 PolarHBondContact O-SG 3.21Å; F677-C680 PolarHBondContact O-N 3.33Å; C680-K683 PolarHBondContact O-N 2.65Å; C680-M684 WeakPolarHBondContact O-CB 3.35Å; C680-M684 WeakPolarHBondContact O-CG 3.49Å; C680-M684 PolarHBondContact O-N 3.41Å
681	L	50.7	Low	51.7	Low	21 Å²	21	90.8 Å²	90.8	11%	0.11	44%	0.436	C	S	.	.	H	α-helix	trans	-64.5	-46.5	177.5	-160	72.1	0	0	0	111.3	V653 F677 A678 R679 M684 I685	V653-L681 HydrophobicContact CB-CD1 4.46Å; V653-L681 HydrophobicContact CG1-CD1 3.83Å; V653-L681 HydrophobicContact CG1-CD2 3.91Å; V653-L681 HydrophobicContact CG1-CG 4.2Å; V653-L681 HydrophobicContact CG2-CD1 3.78Å; F677-L681 HydrophobicContact CE1-CD2 4.09Å; F677-L681 HydrophobicContact CZ-CD1 4.18Å; F677-L681 VanDerWaalsContact O-CB 3.28Å; F677-L681 WeakPolarHBondContact O-CB 3.47Å; F677-L681 PolarHBondContact O-N 3.42Å; A678-L681 WeakPolarHBondContact O-CB 3.14Å; A678-L681 PolarHBondContact O-N 2.75Å; R679-L681 VanDerWaalsContact C-N 3.32Å; L681-M684 HydrophobicContact CD1-CE 4.13Å; L681-M684 PolarHBondContact O-N 3.11Å; L681-I685 HydrophobicContact CD1-CD1 4.33Å; L681-I685 HydrophobicContact CG-CD1 3.88Å; L681-I685 VanDerWaalsContact O-CB 3.31Å; L681-I685 WeakPolarHBondContact O-CB 3.36Å; L681-I685 VanDerWaalsContact O-CG1 3.26Å; L681-I685 WeakPolarHBondContact O-CG1 3.43Å; L681-I685 PolarHBondContact O-N 3.29Å
682	T	52.2	Low	51.8	Low	56 Å²	56	85.9 Å²	85.9	34%	0.344	42%	0.417	S	S	.	.	H	α-helix	trans	-65.6	-35.5	174.6	-54.7	0	0	0	0	112.1	A678 G686 E687	A678-T682 WeakPolarHBondContact O-CB 3.34Å; A678-T682 PolarHBondContact O-N 3.33Å; A678-T682 PolarHBondContact O-OG1 3.42Å; T682-G686 VanDerWaalsContact O-CA 3.25Å; T682-G686 WeakPolarHBondContact O-CA 3.46Å; T682-G686 PolarHBondContact O-N 2.66Å; T682-E687 HydrophobicContact CG2-CG 4.24Å
683	K	53.9	Low	51.4	Low	169 Å²	169	81.6 Å²	81.6	74%	0.735	39%	0.391	S	S	*	.	H	α-helix	trans	-69.5	-40.6	172.6	-80.9	-159.2	170.2	-161.1	0	113.1	R679 C680	R679-K683 WeakPolarHBondContact O-CB 3.48Å; R679-K683 PolarHBondContact O-N 3.24Å; C680-K683 PolarHBondContact O-N 2.65Å
684	M	45.5	Very low	51.7	Low	87 Å²	87	80 Å²	80	43%	0.429	39%	0.386	S	S	.	.	H	α-helix	trans	-68.9	-41.3	177.2	-76.7	-172.1	-60.8	0	0	112.8	C680 L681	C680-M684 WeakPolarHBondContact O-CB 3.35Å; C680-M684 WeakPolarHBondContact O-CG 3.49Å; C680-M684 PolarHBondContact O-N 3.41Å; L681-M684 HydrophobicContact CD1-CE 4.13Å; L681-M684 PolarHBondContact O-N 3.11Å
685	I	51.8	Low	52	Low	26 Å²	26	82 Å²	82	13%	0.133	41%	0.406	C	S	.	.	H	α-helix	trans	-77.3	-39.5	179.7	-65.7	173.5	0	0	0	110.1	V653 L681 Y689 L690	V653-I685 HydrophobicContact CG1-CD1 4.14Å; V653-I685 HydrophobicContact CG2-CD1 4.31Å; L681-I685 HydrophobicContact CD1-CD1 4.33Å; L681-I685 HydrophobicContact CG-CD1 3.88Å; L681-I685 VanDerWaalsContact O-CB 3.31Å; L681-I685 WeakPolarHBondContact O-CB 3.36Å; L681-I685 VanDerWaalsContact O-CG1 3.26Å; L681-I685 WeakPolarHBondContact O-CG1 3.43Å; L681-I685 PolarHBondContact O-N 3.29Å; I685-Y689 WeakPolarHBondContact O-CB 3.49Å; I685-L690 HydrophobicContact CG2-CD1 4.41Å
686	G	50.5	Low	52.1	Low	19 Å²	19	79 Å²	79	20%	0.196	40%	0.401	C	S	.	.			trans	75	140.4	-169.5	0	0	0	0	0	111.9	T682 K688 Y689 L690	T682-G686 VanDerWaalsContact O-CA 3.25Å; T682-G686 WeakPolarHBondContact O-CA 3.46Å; T682-G686 PolarHBondContact O-N 2.66Å; G686-K688 PolarHBondContact O-N 2.72Å; G686-Y689 PolarHBondContact O-N 3.15Å; G686-L690 PolarHBondContact O-N 3.16Å
687	E	52.3	Low	51.8	Low	156 Å²	156	73.1 Å²	73.1	73%	0.729	40%	0.398	S	S	*	.	H	α-helix	trans	-58.1	-37.2	-177.9	-59.6	-163.1	133	0	0	112.7	T682 Y689 L690 S691	T682-E687 HydrophobicContact CG2-CG 4.24Å; E687-Y689 PolarHBondContact O-N 2.98Å; E687-L690 WeakPolarHBondContact O-CB 3.16Å; E687-L690 PolarHBondContact O-N 2.81Å; E687-L690 VanDerWaalsContact O-N 3.12Å; E687-S691 PolarHBondContact O-N 2.93Å; E687-S691 VanDerWaalsContact O-N 3.12Å
688	K	51	Low	52	Low	160 Å²	160	74.4 Å²	74.4	70%	0.696	41%	0.407	S	S	*	.	H	α-helix	trans	-61.8	-24.1	176	-152.7	175.6	-170.2	177.2	0	112.9	G686 S691 I692	G686-K688 PolarHBondContact O-N 2.72Å; K688-S691 PolarHBondContact O-OG 3.47Å; K688-I692 WeakPolarHBondContact O-CD1 3.33Å; K688-I692 WeakPolarHBondContact O-CG1 3.35Å
689	Y	50.3	Low	52.1	Low	38 Å²	38	81.5 Å²	81.5	15%	0.149	43%	0.432	C	S	.	.	H	α-helix	trans	-94	-25.7	174.1	-141.6	-91.9	0	0	0	113.1	K646 I685 G686 E687 S691 I692 V693	K646-Y689 HydrophobicContact CB-CE1 3.7Å; K646-Y689 HydrophobicContact CB-CE2 4.04Å; K646-Y689 VanDerWaalsContact CB-CZ 3.43Å; K646-Y689 VanDerWaalsContact CB-OH 3.31Å; K646-Y689 WeakPolarHBondContact CB-OH 3.28Å; K646-Y689 HydrophobicContact CD-CD2 4.05Å; K646-Y689 HydrophobicContact CD-CE2 3.38Å; K646-Y689 VanDerWaalsContact CE-CE2 3.48Å; K646-Y689 HydrophobicContact CG-CD2 4.37Å; K646-Y689 HydrophobicContact CG-CE1 4.2Å; K646-Y689 HydrophobicContact CG-CE2 3.87Å; I685-Y689 WeakPolarHBondContact O-CB 3.49Å; G686-Y689 PolarHBondContact O-N 3.15Å; E687-Y689 PolarHBondContact O-N 2.98Å; Y689-S691 VanDerWaalsContact C-N 3.26Å; Y689-S691 PolarHBondContact O-N 3.05Å; Y689-I692 HydrophobicContact CD2-CB 4.2Å; Y689-I692 HydrophobicContact CD2-CD1 3.59Å; Y689-I692 HydrophobicContact CD2-CG1 4.45Å; Y689-I692 HydrophobicContact CD2-CG2 4.46Å; Y689-I692 HydrophobicContact CE1-CB 4.41Å; Y689-I692 HydrophobicContact CE1-CG2 4.09Å; Y689-I692 HydrophobicContact CE2-CB 4Å; Y689-I692 HydrophobicContact CE2-CD1 3.52Å; Y689-I692 HydrophobicContact CE2-CG1 4.35Å; Y689-I692 HydrophobicContact CE2-CG2 3.77Å; Y689-I692 HydrophobicContact CG-CB 4.43Å; Y689-I692 HydrophobicContact CG-CD1 4.5Å; Y689-I692 PolarHBondContact O-N 2.61Å; Y689-I692 VanDerWaalsContact O-N 3.14Å; Y689-V693 HydrophobicContact CD1-CG2 3.88Å; Y689-V693 HydrophobicContact CE1-CG2 3.87Å; Y689-V693 WeakPolarHBondContact O-CG2 3.46Å; Y689-V693 PolarHBondContact O-N 3.05Å
690	L	53.6	Low	52.1	Low	42 Å²	42	81.3 Å²	81.3	22%	0.22	44%	0.436	C	S	.	.	H	α-helix	trans	-58.9	-40.3	167.8	-152.7	78.9	0	0	0	110.9	I685 G686 E687 L694 L705	I685-L690 HydrophobicContact CG2-CD1 4.41Å; G686-L690 PolarHBondContact O-N 3.16Å; E687-L690 WeakPolarHBondContact O-CB 3.16Å; E687-L690 PolarHBondContact O-N 2.81Å; E687-L690 VanDerWaalsContact O-N 3.12Å; L690-L694 WeakPolarHBondContact O-CB 3.42Å; L690-L694 WeakPolarHBondContact O-CD1 3.14Å; L690-L694 WeakPolarHBondContact O-CG 3.36Å; L690-L694 PolarHBondContact O-N 2.89Å; L690-L705 HydrophobicContact CD1-CD2 4.03Å
691	S	54.3	Low	52	Low	65 Å²	65	78.5 Å²	78.5	46%	0.455	42%	0.417	S	S	.	.	H	α-helix	trans	-67.7	-33.7	174	70.1	0	0	0	0	113.3	E687 K688 Y689 L694 S695	E687-S691 PolarHBondContact O-N 2.93Å; E687-S691 VanDerWaalsContact O-N 3.12Å; K688-S691 PolarHBondContact O-OG 3.47Å; Y689-S691 VanDerWaalsContact C-N 3.26Å; Y689-S691 PolarHBondContact O-N 3.05Å; S691-L694 PolarHBondContact O-N 3.41Å; S691-S695 PolarHBondContact O-N 3.47Å; S691-S695 PolarHBondContact O-OG 3.26Å
692	I	51.3	Low	52.2	Low	72 Å²	72	78.5 Å²	78.5	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-42.5	175.5	-68.5	166.3	0	0	0	111.4	K688 Y689 L694 S695 S696	K688-I692 WeakPolarHBondContact O-CD1 3.33Å; K688-I692 WeakPolarHBondContact O-CG1 3.35Å; Y689-I692 HydrophobicContact CD2-CB 4.2Å; Y689-I692 HydrophobicContact CD2-CD1 3.59Å; Y689-I692 HydrophobicContact CD2-CG1 4.45Å; Y689-I692 HydrophobicContact CD2-CG2 4.46Å; Y689-I692 HydrophobicContact CE1-CB 4.41Å; Y689-I692 HydrophobicContact CE1-CG2 4.09Å; Y689-I692 HydrophobicContact CE2-CB 4Å; Y689-I692 HydrophobicContact CE2-CD1 3.52Å; Y689-I692 HydrophobicContact CE2-CG1 4.35Å; Y689-I692 HydrophobicContact CE2-CG2 3.77Å; Y689-I692 HydrophobicContact CG-CB 4.43Å; Y689-I692 HydrophobicContact CG-CD1 4.5Å; Y689-I692 PolarHBondContact O-N 2.61Å; Y689-I692 VanDerWaalsContact O-N 3.14Å; I692-L694 VanDerWaalsContact C-N 3.34Å; I692-S695 WeakPolarHBondContact CA-OG 3.35Å; I692-S695 PolarHBondContact O-N 3.02Å; I692-S695 PolarHBondContact O-OG 2.86Å; I692-S695 VanDerWaalsContact O-OG 3.12Å; I692-S696 WeakPolarHBondContact O-CB 3.37Å; I692-S696 PolarHBondContact O-N 3.28Å
693	V	48.4	Very low	52.6	Low	10 Å²	10	82.4 Å²	82.4	6%	0.061	43%	0.432	C	S	.	.	H	α-helix	trans	-68.6	-36.2	174.9	-173.2	0	0	0	0	110.8	A650 Y689 S695 S696 L705	A650-V693 HydrophobicContact CB-CG1 4.43Å; A650-V693 HydrophobicContact CB-CG2 3.82Å; Y689-V693 HydrophobicContact CD1-CG2 3.88Å; Y689-V693 HydrophobicContact CE1-CG2 3.87Å; Y689-V693 WeakPolarHBondContact O-CG2 3.46Å; Y689-V693 PolarHBondContact O-N 3.05Å; V693-S695 VanDerWaalsContact C-N 3.29Å; V693-S695 PolarHBondContact O-N 3.44Å; V693-S696 WeakPolarHBondContact O-CB 3.36Å; V693-S696 PolarHBondContact O-N 3.22Å; V693-S696 PolarHBondContact O-OG 2.88Å; V693-L705 HydrophobicContact CB-CD1 3.9Å; V693-L705 HydrophobicContact CG1-CD1 3.35Å
694	L	55.3	Low	52.6	Low	70 Å²	70	75.4 Å²	75.4	37%	0.366	41%	0.405	S	S	.	.	H	α-helix	trans	-65.7	-26.2	174.1	-73.7	169.8	0	0	0	113.9	L690 S691 I692 V702	L690-L694 WeakPolarHBondContact O-CB 3.42Å; L690-L694 WeakPolarHBondContact O-CD1 3.14Å; L690-L694 WeakPolarHBondContact O-CG 3.36Å; L690-L694 PolarHBondContact O-N 2.89Å; S691-L694 PolarHBondContact O-N 3.41Å; I692-L694 VanDerWaalsContact C-N 3.34Å; L694-V702 HydrophobicContact CD2-CG1 4.21Å
695	S	57.1	Low	52.8	Low	94 Å²	94	72.4 Å²	72.4	66%	0.657	39%	0.391	S	S	*	.	H	α-helix	trans	-94.3	-10.8	173.9	60.9	0	0	0	0	114.4	S691 I692 V693 G697	S691-S695 PolarHBondContact O-N 3.47Å; S691-S695 PolarHBondContact O-OG 3.26Å; I692-S695 WeakPolarHBondContact CA-OG 3.35Å; I692-S695 PolarHBondContact O-N 3.02Å; I692-S695 PolarHBondContact O-OG 2.86Å; I692-S695 VanDerWaalsContact O-OG 3.12Å; V693-S695 VanDerWaalsContact C-N 3.29Å; V693-S695 PolarHBondContact O-N 3.44Å; S695-G697 PolarHBondContact O-N 2.86Å
696	S	53.7	Low	53.1	Low	67 Å²	67	79.4 Å²	79.4	47%	0.469	42%	0.415	S	S	.	.	S	Bend	trans	-65.1	4.5	-175.2	72.3	0	0	0	0	117.1	I692 V693 N698	I692-S696 WeakPolarHBondContact O-CB 3.37Å; I692-S696 PolarHBondContact O-N 3.28Å; V693-S696 WeakPolarHBondContact O-CB 3.36Å; V693-S696 PolarHBondContact O-N 3.22Å; V693-S696 PolarHBondContact O-OG 2.88Å; S696-N698 PolarHBondContact O-N 3.02Å
697	G	48.1	Very low	53.4	Low	61 Å²	61	81.5 Å²	81.5	63%	0.629	43%	0.427	S	S	*	.			trans	71.2	-16.4	175.2	0	0	0	0	0	116.5	S695 K699	S695-G697 PolarHBondContact O-N 2.86Å; G697-K699 PolarHBondContact O-N 2.85Å
698	N	55.4	Low	53.2	Low	81 Å²	81	75.3 Å²	75.3	43%	0.433	40%	0.402	S	S	.	.			trans	-71.5	95.6	179.7	-174	-13	0	0	0	111.2	S696 K700 S701 V702	S696-N698 PolarHBondContact O-N 3.02Å; N698-K700 PolarHBondContact O-N 3.45Å; N698-K700 VanDerWaalsContact O-N 3.14Å; N698-K700 PolarHBondContact OD1-N 2.88Å; N698-S701 PolarHBondContact ND2-OG 3.46Å; N698-S701 PolarHBondContact O-N 2.84Å; N698-S701 VanDerWaalsContact O-N 3.11Å; N698-V702 WeakPolarHBondContact O-CG2 3.31Å; N698-V702 PolarHBondContact O-N 3.49Å
699	K	53.9	Low	53.3	Low	180 Å²	180	75.5 Å²	75.5	78%	0.783	40%	0.403	S	S	*	.	H	α-helix	trans	-51.3	-37.6	-178.3	-69.3	-174.2	178.3	-179.8	0	113.5	G697 Q703	G697-K699 PolarHBondContact O-N 2.85Å; K699-Q703 VanDerWaalsContact O-CB 3.28Å; K699-Q703 WeakPolarHBondContact O-CB 3.36Å; K699-Q703 PolarHBondContact O-N 3.12Å
700	K	53.9	Low	53.5	Low	158 Å²	158	78 Å²	78	69%	0.687	43%	0.432	S	S	*	.	H	α-helix	trans	-65.1	-55.7	176.2	-79.6	-166.7	172.7	-170.2	0	111	N698 V702 Q703 S704	N698-K700 PolarHBondContact O-N 3.45Å; N698-K700 VanDerWaalsContact O-N 3.14Å; N698-K700 PolarHBondContact OD1-N 2.88Å; K700-V702 VanDerWaalsContact C-N 3.28Å; K700-V702 PolarHBondContact O-N 2.91Å; K700-Q703 PolarHBondContact O-N 2.93Å; K700-S704 PolarHBondContact O-N 2.92Å; K700-S704 PolarHBondContact O-OG 3.19Å
701	S	49.6	Very low	52.7	Low	16 Å²	16	83.6 Å²	83.6	11%	0.112	46%	0.461	C	S	.	.	H	α-helix	trans	-57.1	-40.4	178.6	-55.4	0	0	0	0	112.6	N698 L705	N698-S701 PolarHBondContact ND2-OG 3.46Å; N698-S701 PolarHBondContact O-N 2.84Å; N698-S701 VanDerWaalsContact O-N 3.11Å; S701-L705 VanDerWaalsContact O-CB 3.3Å; S701-L705 WeakPolarHBondContact O-CB 3.4Å; S701-L705 PolarHBondContact O-N 2.94Å
702	V	54.8	Low	52.6	Low	22 Å²	22	84.6 Å²	84.6	13%	0.133	46%	0.461	C	S	.	.	H	α-helix	trans	-65	-39.3	175.7	174.3	0	0	0	0	111.7	L694 N698 K700 R706	L694-V702 HydrophobicContact CD2-CG1 4.21Å; N698-V702 WeakPolarHBondContact O-CG2 3.31Å; N698-V702 PolarHBondContact O-N 3.49Å; K700-V702 VanDerWaalsContact C-N 3.28Å; K700-V702 PolarHBondContact O-N 2.91Å; V702-R706 WeakPolarHBondContact O-CB 3.45Å; V702-R706 VanDerWaalsContact O-CG 3.24Å; V702-R706 WeakPolarHBondContact O-CG 3.32Å; V702-R706 PolarHBondContact O-N 2.75Å
703	Q	60.2	Low	52.7	Low	137 Å²	137	85.2 Å²	85.2	64%	0.64	47%	0.466	S	S	*	.	H	α-helix	trans	-73.3	-43.6	178.7	-169	161.2	-4.6	0	0	111.9	K699 K700 L705 R706 S707	K699-Q703 VanDerWaalsContact O-CB 3.28Å; K699-Q703 WeakPolarHBondContact O-CB 3.36Å; K699-Q703 PolarHBondContact O-N 3.12Å; K700-Q703 PolarHBondContact O-N 2.93Å; Q703-L705 VanDerWaalsContact C-N 3.33Å; Q703-L705 PolarHBondContact O-N 3.29Å; Q703-R706 PolarHBondContact O-N 3.01Å; Q703-R706 VanDerWaalsContact O-N 3.16Å; Q703-S707 PolarHBondContact O-N 2.94Å; Q703-S707 PolarHBondContact O-OG 3.27Å
704	S	53.3	Low	52.9	Low	22 Å²	22	89.4 Å²	89.4	15%	0.154	49%	0.489	C	S	.	.	H	α-helix	trans	-62.4	-37.7	174.7	-55.5	0	0	0	0	111.9	E658 K700 A708	E658-S704 PolarHBondContact OE1-OG 3.04Å; K700-S704 PolarHBondContact O-N 2.92Å; K700-S704 PolarHBondContact O-OG 3.19Å; S704-A708 WeakPolarHBondContact O-CB 3.39Å; S704-A708 PolarHBondContact O-N 3.17Å
705	L	50.7	Low	52.8	Low	25 Å²	25	90.5 Å²	90.5	13%	0.131	50%	0.496	C	S	.	.	H	α-helix	trans	-72.2	-31.7	171.9	-85.5	163.5	0	0	0	114.2	L690 V693 S701 Q703 A708 K709	L690-L705 HydrophobicContact CD1-CD2 4.03Å; V693-L705 HydrophobicContact CB-CD1 3.9Å; V693-L705 HydrophobicContact CG1-CD1 3.35Å; S701-L705 VanDerWaalsContact O-CB 3.3Å; S701-L705 WeakPolarHBondContact O-CB 3.4Å; S701-L705 PolarHBondContact O-N 2.94Å; Q703-L705 VanDerWaalsContact C-N 3.33Å; Q703-L705 PolarHBondContact O-N 3.29Å; L705-A708 CarbonylContact O-C 3.59Å; L705-A708 PolarHBondContact O-N 2.99Å; L705-K709 WeakPolarHBondContact O-CB 3.18Å; L705-K709 PolarHBondContact O-N 2.72Å
706	R	57.7	Low	52.5	Low	173 Å²	173	90.3 Å²	90.3	65%	0.653	49%	0.486	S	S	*	.	H	α-helix	trans	-66.7	-42.6	171.5	-79.6	174.2	-179.2	-163.2	0.2	110.9	V702 Q703 K709 A710	V702-R706 WeakPolarHBondContact O-CB 3.45Å; V702-R706 VanDerWaalsContact O-CG 3.24Å; V702-R706 WeakPolarHBondContact O-CG 3.32Å; V702-R706 PolarHBondContact O-N 2.75Å; Q703-R706 PolarHBondContact O-N 3.01Å; Q703-R706 VanDerWaalsContact O-N 3.16Å; R706-K709 PolarHBondContact O-N 2.87Å; R706-K709 VanDerWaalsContact O-N 3.16Å; R706-A710 PolarHBondContact O-N 3.06Å
707	S	55.6	Low	52.4	Low	63 Å²	63	91.9 Å²	91.9	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-60	-45.7	171.7	-60.4	0	0	0	0	111.5	Q703 K709 A710 L711	Q703-S707 PolarHBondContact O-N 2.94Å; Q703-S707 PolarHBondContact O-OG 3.27Å; S707-K709 PolarHBondContact O-N 2.91Å; S707-A710 PolarHBondContact O-N 3.4Å; S707-L711 PolarHBondContact O-N 3.2Å
708	A	49.8	Very low	52.7	Low	26 Å²	26	94.1 Å²	94.1	22%	0.215	48%	0.477	C	S	.	.	H	α-helix	trans	-70.6	-5.3	176.5	0	0	0	0	0	115.2	V657 S704 L705	V657-A708 HydrophobicContact CG1-CB 4.07Å; S704-A708 WeakPolarHBondContact O-CB 3.39Å; S704-A708 PolarHBondContact O-N 3.17Å; L705-A708 CarbonylContact O-C 3.59Å; L705-A708 PolarHBondContact O-N 2.99Å
709	K	52.1	Low	52.5	Low	164 Å²	164	95.1 Å²	95.1	71%	0.713	48%	0.48	S	S	*	.	H	α-helix	trans	-103.8	-13.7	169.7	-172.7	172	179.8	177.6	0	112.6	L705 R706 S707	L705-K709 WeakPolarHBondContact O-CB 3.18Å; L705-K709 PolarHBondContact O-N 2.72Å; R706-K709 PolarHBondContact O-N 2.87Å; R706-K709 VanDerWaalsContact O-N 3.16Å; S707-K709 PolarHBondContact O-N 2.91Å
710	A	54.5	Low	52.4	Low	91 Å²	91	88 Å²	88	75%	0.752	46%	0.455	S	S	*	.	H	α-helix	trans	-94.1	-23.6	174.9	0	0	0	0	0	112.8	R706 S707	R706-A710 PolarHBondContact O-N 3.06Å; S707-A710 PolarHBondContact O-N 3.4Å
711	L	36.8	Very low	52.3	Low	159 Å²	159	81.6 Å²	81.6	83%	0.832	43%	0.434	S	S	*	.			trans	-79.5	0	166.6	-72.9	161.7	0	0	0	111.7	F674 S707	F674-L711 HydrophobicContact CE1-CB 4.09Å; F674-L711 WeakPolarHBondContact CE1-OXT 3.48Å; F674-L711 HydrophobicContact CZ-CB 3.98Å; S707-L711 PolarHBondContact O-N 3.2Å

Retrieved 711 of 711 residues in 353.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).