A0A077Z8C8_TRITR Loading...

Protein Mo25

AlphaFold DB , UniProt , Accession A0A077Z8C8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 321 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	45.3	Very low	242 Å²	242	133.5 Å²	133.5	100%	1.192	72%	0.724	S	S	*	*				0	135.6	0	-72.3	-177.1	-174.2	0	0	108.3
2	P	34.4	Very low	47.3	Very low	125 Å²	125	125.5 Å²	125.5	81%	0.812	69%	0.69	S	S	*	*				-121.3	129.9	-127.2	33.3	-18.3	0	0	0	113.5
3	L	33.5	Very low	49.2	Very low	155 Å²	155	121.9 Å²	121.9	81%	0.812	67%	0.669	S	S	*	*			trans	-138.7	118.9	174	-82.4	165.5	0	0	0	110.8
4	F	37.4	Very low	50.8	Low	168 Å²	168	113.8 Å²	113.8	74%	0.737	62%	0.624	S	S	*	*			trans	86.8	76.6	170.3	-57.2	-73.8	0	0	0	118.8	K6	F4-K6 VanDerWaalsContact C-N 3.31Å; F4-K6 PolarHBondContact O-N 2.77Å; F4-K6 VanDerWaalsContact O-N 3.08Å
5	G	28.8	Very low	51.9	Low	90 Å²	90	106.7 Å²	106.7	93%	0.928	59%	0.586	S	S	*	*			trans	-68.8	82.9	148.5	0	0	0	0	0	111.9
6	K	39.3	Very low	53.2	Low	167 Å²	167	108.4 Å²	108.4	73%	0.726	59%	0.586	S	S	*	*			trans	-110.3	130.8	156.8	-71.8	-177.1	178.9	176.7	0	106.7	F4 L8	F4-K6 VanDerWaalsContact C-N 3.31Å; F4-K6 PolarHBondContact O-N 2.77Å; F4-K6 VanDerWaalsContact O-N 3.08Å; K6-L8 PolarHBondContact O-N 2.74Å
7	S	44.3	Very low	54.3	Low	106 Å²	106	103.9 Å²	103.9	74%	0.741	56%	0.564	S	S	*	*			trans	-45.2	137.7	-178.1	64.5	0	0	0	0	110.6	K9	S7-K9 VanDerWaalsContact C-N 3.33Å; S7-K9 PolarHBondContact O-N 3.49Å
8	L	50	Low	55.1	Low	152 Å²	152	98.5 Å²	98.5	80%	0.796	54%	0.535	S	S	*	.			trans	-51.4	100.5	172.5	-87.9	141.7	0	0	0	107.6	K6	K6-L8 PolarHBondContact O-N 2.74Å
9	K	59.8	Low	55.9	Low	124 Å²	124	99.5 Å²	99.5	54%	0.539	53%	0.533	S	S	.	.			trans	-56.7	145	179	-71.9	-173.6	176.8	-176.9	0	108.3	S7 D13 I14	S7-K9 VanDerWaalsContact C-N 3.33Å; S7-K9 PolarHBondContact O-N 3.49Å; K9-D13 HydrophobicContact CB-CB 4.39Å; K9-I14 HydrophobicContact CB-CG1 4.09Å
10	H	70	Confident	56.8	Low	120 Å²	120	98.7 Å²	98.7	56%	0.556	53%	0.529	S	S	*	.			trans	-55.1	133.2	178.8	-171.2	-89.7	0	0	0	107.9	A12 D13 I14	H10-A12 PolarHBondContact ND1-N 2.86Å; H10-A12 PolarHBondContact O-N 3.42Å; H10-D13 WeakPolarHBondContact CB-OD2 3.11Å; H10-D13 WeakPolarHBondContact O-CA 3.18Å; H10-D13 VanDerWaalsContact O-CB 3.25Å; H10-D13 WeakPolarHBondContact O-CB 3.28Å; H10-D13 PolarHBondContact O-N 2.91Å; H10-I14 PolarHBondContact O-N 3.06Å
11	P	66.3	Low	57.4	Low	19 Å²	19	94.1 Å²	94.1	12%	0.123	51%	0.505	C	S	.	.	H	α-helix	trans	-56.1	-28.3	-170.9	-37.8	44.6	0	0	0	115.6	D13 I14 V15 T49 C56 V58	P11-D13 VanDerWaalsContact C-N 3.32Å; P11-D13 PolarHBondContact O-N 3.3Å; P11-I14 PolarHBondContact O-N 3.22Å; P11-V15 PolarHBondContact O-N 3.42Å; P11-V15 VanDerWaalsContact O-N 3.11Å; P11-T49 HydrophobicContact CB-CG2 4.17Å; P11-T49 HydrophobicContact CG-CG2 3.58Å; P11-C56 VanDerWaalsContact CG-SG 3.59Å; P11-V58 HydrophobicContact CB-CB 4.11Å; P11-V58 HydrophobicContact CB-CG1 3.97Å; P11-V58 HydrophobicContact CB-CG2 3.13Å; P11-V58 HydrophobicContact CG-CG2 4.21Å
12	A	69.9	Low	58.9	Low	38 Å²	38	83.1 Å²	83.1	31%	0.314	45%	0.452	S	S	.	.	H	α-helix	trans	-61	-37.1	170.4	0	0	0	0	0	113.2	H10 I14 V15 K16	H10-A12 PolarHBondContact ND1-N 2.86Å; H10-A12 PolarHBondContact O-N 3.42Å; A12-I14 VanDerWaalsContact C-N 3.32Å; A12-V15 PolarHBondContact O-N 3.44Å; A12-K16 PolarHBondContact O-N 2.97Å
13	D	72.3	Confident	60.5	Low	79 Å²	79	79.6 Å²	79.6	42%	0.422	43%	0.427	S	S	.	.	H	α-helix	trans	-68.9	-34	176.7	-58.8	-36.2	0	0	0	111.4	K9 H10 P11 K16 S17	K9-D13 HydrophobicContact CB-CB 4.39Å; H10-D13 WeakPolarHBondContact CB-OD2 3.11Å; H10-D13 WeakPolarHBondContact O-CA 3.18Å; H10-D13 VanDerWaalsContact O-CB 3.25Å; H10-D13 WeakPolarHBondContact O-CB 3.28Å; H10-D13 PolarHBondContact O-N 2.91Å; P11-D13 VanDerWaalsContact C-N 3.32Å; P11-D13 PolarHBondContact O-N 3.3Å; D13-K16 PolarHBondContact O-N 3.34Å; D13-S17 WeakPolarHBondContact O-CB 3.29Å; D13-S17 PolarHBondContact O-N 2.97Å; D13-S17 PolarHBondContact O-OG 3.34Å
14	I	70.4	Confident	62.3	Low	8 Å²	8	75.5 Å²	75.5	4%	0.041	41%	0.406	C	S	.	.	H	α-helix	trans	-66.4	-44	175.7	-48.7	172.7	0	0	0	109.7	K9 H10 P11 A12 S17 L18 S42 C45 L46	K9-I14 HydrophobicContact CB-CG1 4.09Å; H10-I14 PolarHBondContact O-N 3.06Å; P11-I14 PolarHBondContact O-N 3.22Å; A12-I14 VanDerWaalsContact C-N 3.32Å; I14-S17 PolarHBondContact O-N 3.15Å; I14-L18 WeakPolarHBondContact O-CB 3.47Å; I14-L18 PolarHBondContact O-N 3.26Å; I14-S42 VanDerWaalsContact CG2-O 3.28Å; I14-S42 WeakPolarHBondContact CG2-O 3.31Å; I14-C45 HydrophobicContact CD1-CB 3.87Å; I14-C45 HydrophobicContact CG2-CB 4Å; I14-L46 HydrophobicContact CB-CD2 4.07Å; I14-L46 HydrophobicContact CB-CG 4.2Å; I14-L46 HydrophobicContact CG2-CD1 4.21Å; I14-L46 HydrophobicContact CG2-CD2 4.05Å; I14-L46 HydrophobicContact CG2-CG 3.61Å
15	V	68.5	Low	63.7	Low	8 Å²	8	67.8 Å²	67.8	5%	0.048	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-41.9	176.2	-179.7	0	0	0	0	111.8	P11 A12 L18 K19 L46 V58 H61	P11-V15 PolarHBondContact O-N 3.42Å; P11-V15 VanDerWaalsContact O-N 3.11Å; A12-V15 PolarHBondContact O-N 3.44Å; V15-L18 PolarHBondContact O-N 3.22Å; V15-K19 WeakPolarHBondContact O-CB 3.15Å; V15-K19 PolarHBondContact O-N 3.41Å; V15-L46 HydrophobicContact CG2-CD1 4.29Å; V15-L46 HydrophobicContact CG2-CD2 3.72Å; V15-V58 HydrophobicContact CG2-CG1 3.29Å; V15-H61 HydrophobicContact CB-CB 4.32Å; V15-H61 HydrophobicContact CG1-CB 3.62Å
16	K	72	Confident	65.4	Low	134 Å²	134	66.1 Å²	66.1	58%	0.583	34%	0.341	S	S	*	.	H	α-helix	trans	-60.2	-46.9	174.9	-173.9	178.6	178.1	-178.7	0	111.3	A12 D13 L18 K19 D20	A12-K16 PolarHBondContact O-N 2.97Å; D13-K16 PolarHBondContact O-N 3.34Å; K16-L18 VanDerWaalsContact C-N 3.3Å; K16-L18 PolarHBondContact O-N 3.19Å; K16-K19 PolarHBondContact O-N 2.83Å; K16-K19 VanDerWaalsContact O-N 3.16Å; K16-D20 VanDerWaalsContact O-CG 3.31Å; K16-D20 PolarHBondContact O-N 3.04Å
17	S	71.8	Confident	66.7	Low	32 Å²	32	66.2 Å²	66.2	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-59.5	-40.5	177.1	-57.6	0	0	0	0	112	D13 I14 A21	D13-S17 WeakPolarHBondContact O-CB 3.29Å; D13-S17 PolarHBondContact O-N 2.97Å; D13-S17 PolarHBondContact O-OG 3.34Å; I14-S17 PolarHBondContact O-N 3.15Å; S17-A21 WeakPolarHBondContact O-CB 3.37Å; S17-A21 PolarHBondContact O-N 2.69Å
18	L	69.6	Low	67.6	Low	6 Å²	6	63.8 Å²	63.8	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-45.7	175.3	-176	63.4	0	0	0	111.4	I14 V15 K16 D20 A21 V22 L46 F62 M65 F67	I14-L18 WeakPolarHBondContact O-CB 3.47Å; I14-L18 PolarHBondContact O-N 3.26Å; V15-L18 PolarHBondContact O-N 3.22Å; K16-L18 VanDerWaalsContact C-N 3.3Å; K16-L18 PolarHBondContact O-N 3.19Å; L18-D20 VanDerWaalsContact C-N 3.35Å; L18-D20 PolarHBondContact O-N 2.87Å; L18-A21 PolarHBondContact O-N 3.31Å; L18-V22 WeakPolarHBondContact O-CG2 3.4Å; L18-V22 PolarHBondContact O-N 3.31Å; L18-L46 HydrophobicContact CD2-CD1 3.77Å; L18-F62 HydrophobicContact CD2-CD2 4.22Å; L18-F62 HydrophobicContact CD2-CE2 3.7Å; L18-M65 HydrophobicContact CD2-CE 4.05Å; L18-F67 HydrophobicContact CD1-CE2 3.68Å; L18-F67 HydrophobicContact CD1-CZ 4.23Å; L18-F67 HydrophobicContact CD2-CE2 4.32Å; L18-F67 HydrophobicContact CG-CE2 4.01Å
19	K	68.8	Low	67.9	Low	117 Å²	117	60.7 Å²	60.7	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-60.9	-44	178.6	-172.7	178	-178.6	177.8	0	111.7	V15 K16 V22 V23	V15-K19 WeakPolarHBondContact O-CB 3.15Å; V15-K19 PolarHBondContact O-N 3.41Å; K16-K19 PolarHBondContact O-N 2.83Å; K16-K19 VanDerWaalsContact O-N 3.16Å; K19-V22 WeakPolarHBondContact O-CB 3.5Å; K19-V22 PolarHBondContact O-N 3.5Å; K19-V23 WeakPolarHBondContact O-CG2 3.42Å; K19-V23 PolarHBondContact O-N 3.26Å; K19-V23 VanDerWaalsContact O-N 3.09Å
20	D	74.1	Confident	67.7	Low	83 Å²	83	65.5 Å²	65.5	44%	0.444	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-43	178.9	-66.4	-19.2	0	0	0	111.1	K16 L18 V22 V23 L24	K16-D20 VanDerWaalsContact O-CG 3.31Å; K16-D20 PolarHBondContact O-N 3.04Å; L18-D20 VanDerWaalsContact C-N 3.35Å; L18-D20 PolarHBondContact O-N 2.87Å; D20-V22 VanDerWaalsContact C-N 3.26Å; D20-V22 PolarHBondContact O-N 3.49Å; D20-V23 PolarHBondContact O-N 3.32Å; D20-L24 WeakPolarHBondContact O-CG 3.31Å; D20-L24 PolarHBondContact O-N 2.67Å; D20-L24 VanDerWaalsContact O-N 3.14Å
21	A	69.3	Low	67.2	Low	4 Å²	4	67.3 Å²	67.3	3%	0.033	34%	0.337	C	S	.	.	H	α-helix	trans	-58.6	-39.8	174.8	0	0	0	0	0	111.9	S17 L18 L24 L25	S17-A21 WeakPolarHBondContact O-CB 3.37Å; S17-A21 PolarHBondContact O-N 2.69Å; L18-A21 PolarHBondContact O-N 3.31Å; A21-L24 WeakPolarHBondContact O-CB 3.37Å; A21-L24 PolarHBondContact O-N 3.27Å; A21-L25 VanDerWaalsContact O-CG 3.3Å; A21-L25 WeakPolarHBondContact O-CG 3.46Å; A21-L25 PolarHBondContact O-N 3.48Å
22	V	65.9	Low	67.1	Low	11 Å²	11	67.9 Å²	67.9	7%	0.067	34%	0.341	C	S	.	.	H	α-helix	trans	-66.5	-46.5	-179.6	168.1	0	0	0	0	112.2	L18 K19 D20 L24 L25 E26 F67 T73	L18-V22 WeakPolarHBondContact O-CG2 3.4Å; L18-V22 PolarHBondContact O-N 3.31Å; K19-V22 WeakPolarHBondContact O-CB 3.5Å; K19-V22 PolarHBondContact O-N 3.5Å; D20-V22 VanDerWaalsContact C-N 3.26Å; D20-V22 PolarHBondContact O-N 3.49Å; V22-L24 PolarHBondContact O-N 2.96Å; V22-L25 PolarHBondContact O-N 3.3Å; V22-E26 WeakPolarHBondContact O-CG 3.26Å; V22-E26 PolarHBondContact O-N 3.44Å; V22-F67 HydrophobicContact CB-CD2 4.29Å; V22-F67 HydrophobicContact CG1-CD2 4.26Å; V22-F67 HydrophobicContact CG2-CD2 3.12Å; V22-F67 HydrophobicContact CG2-CE2 3.12Å; V22-F67 HydrophobicContact CG2-CG 4.34Å; V22-F67 HydrophobicContact CG2-CZ 4.37Å; V22-T73 HydrophobicContact CG1-CG2 3.64Å
23	V	69.5	Low	66.9	Low	50 Å²	50	72.1 Å²	72.1	30%	0.303	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-38.2	176.5	172.6	0	0	0	0	110.6	K19 D20 E26 R27	K19-V23 WeakPolarHBondContact O-CG2 3.42Å; K19-V23 PolarHBondContact O-N 3.26Å; K19-V23 VanDerWaalsContact O-N 3.09Å; D20-V23 PolarHBondContact O-N 3.32Å; V23-E26 PolarHBondContact O-N 3.05Å; V23-R27 WeakPolarHBondContact O-CG 3.45Å; V23-R27 PolarHBondContact O-N 2.85Å
24	L	70.6	Confident	66.7	Low	69 Å²	69	76.1 Å²	76.1	36%	0.361	37%	0.368	S	S	.	.	H	α-helix	trans	-65.7	-39.5	175	-69.1	171.7	0	0	0	112.5	D20 A21 V22 R27 A35	D20-L24 WeakPolarHBondContact O-CG 3.31Å; D20-L24 PolarHBondContact O-N 2.67Å; D20-L24 VanDerWaalsContact O-N 3.14Å; A21-L24 WeakPolarHBondContact O-CB 3.37Å; A21-L24 PolarHBondContact O-N 3.27Å; V22-L24 PolarHBondContact O-N 2.96Å; L24-R27 PolarHBondContact O-N 3.1Å; L24-A35 HydrophobicContact CB-CB 4.06Å; L24-A35 HydrophobicContact CD1-CB 4.38Å
25	L	66.5	Low	66.4	Low	6 Å²	6	76 Å²	76	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-68.5	-36.2	176.8	-66.3	175	0	0	0	112.4	A21 V22 R27 G28 C32 A35 R36 C76 L77	A21-L25 VanDerWaalsContact O-CG 3.3Å; A21-L25 WeakPolarHBondContact O-CG 3.46Å; A21-L25 PolarHBondContact O-N 3.48Å; V22-L25 PolarHBondContact O-N 3.3Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 3.31Å; L25-G28 PolarHBondContact O-N 2.72Å; L25-C32 HydrophobicContact CD2-CB 4.42Å; L25-A35 HydrophobicContact CD2-CB 3.86Å; L25-A35 HydrophobicContact CG-CB 4.16Å; L25-R36 HydrophobicContact CD1-CG 4.35Å; L25-R36 HydrophobicContact CD2-CG 3.52Å; L25-C76 HydrophobicContact CB-CB 4.08Å; L25-C76 HydrophobicContact CD1-CB 4.01Å; L25-C76 HydrophobicContact CD2-CB 3.99Å; L25-C76 HydrophobicContact CG-CB 4.22Å; L25-L77 HydrophobicContact CD1-CD2 4.15Å
26	E	64.1	Low	66.2	Low	56 Å²	56	79.4 Å²	79.4	26%	0.262	38%	0.38	S	S	.	.	H	α-helix	trans	-65.7	-33	175.7	-72.7	-176.9	158.6	0	0	112.8	V22 V23 G28 S70 T73	V22-E26 WeakPolarHBondContact O-CG 3.26Å; V22-E26 PolarHBondContact O-N 3.44Å; V23-E26 PolarHBondContact O-N 3.05Å; E26-G28 VanDerWaalsContact C-N 3.3Å; E26-G28 PolarHBondContact O-N 2.78Å; E26-S70 WeakPolarHBondContact OE1-CB 3.3Å; E26-S70 PolarHBondContact OE1-OG 3.43Å; E26-T73 HydrophobicContact CG-CG2 3.5Å
27	R	68.2	Low	65.8	Low	168 Å²	168	78 Å²	78	63%	0.634	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.6	179.8	-70.9	175.9	-176.7	-173.1	1.5	114.1	V23 L24 L25 E29	V23-R27 WeakPolarHBondContact O-CG 3.45Å; V23-R27 PolarHBondContact O-N 2.85Å; L24-R27 PolarHBondContact O-N 3.1Å; L25-R27 VanDerWaalsContact C-N 3.31Å; L25-R27 PolarHBondContact O-N 3.31Å; R27-E29 HydrophobicContact CB-CG 4.05Å; R27-E29 PolarHBondContact O-N 3.5Å
28	G	61.2	Low	65.6	Low	56 Å²	56	79 Å²	79	58%	0.577	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	22.8	178.3	0	0	0	0	0	114.8	L25 E26	L25-G28 PolarHBondContact O-N 2.72Å; E26-G28 VanDerWaalsContact C-N 3.3Å; E26-G28 PolarHBondContact O-N 2.78Å
29	E	57.9	Low	65.3	Low	87 Å²	87	78.7 Å²	78.7	41%	0.407	38%	0.382	S	S	.	.			trans	-71.8	146.5	-177	-68.4	177	-162.5	0	0	112	R27 K31 C32	R27-E29 HydrophobicContact CB-CG 4.05Å; R27-E29 PolarHBondContact O-N 3.5Å; E29-K31 PolarHBondContact O-N 3.42Å; E29-C32 PolarHBondContact O-N 3.18Å; E29-C32 PolarHBondContact O-SG 3.38Å
30	K	55.9	Low	65	Low	224 Å²	224	74.6 Å²	74.6	97%	0.974	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-10.5	-178.4	-73.8	-178.3	176	179.6	0	116.2	C32	K30-C32 VanDerWaalsContact C-N 3.3Å
31	K	59.5	Low	64.3	Low	159 Å²	159	75.8 Å²	75.8	69%	0.691	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	17.5	172.6	-67.6	-178.9	179.8	173.5	0	114	E29 E33 K34 A35	E29-K31 PolarHBondContact O-N 3.42Å; K31-E33 VanDerWaalsContact C-N 3.3Å; K31-E33 PolarHBondContact O-N 3.02Å; K31-K34 PolarHBondContact O-N 2.97Å; K31-A35 PolarHBondContact O-N 3.41Å
32	C	62.4	Low	64.1	Low	31 Å²	31	76 Å²	76	21%	0.209	37%	0.374	C	S	.	.	H	α-helix	trans	-49.8	-45.8	-177.8	-74.5	0	0	0	0	113.2	L25 E29 K30 K34 A35 R36	L25-C32 HydrophobicContact CD2-CB 4.42Å; E29-C32 PolarHBondContact O-N 3.18Å; E29-C32 PolarHBondContact O-SG 3.38Å; K30-C32 VanDerWaalsContact C-N 3.3Å; C32-K34 PolarHBondContact O-N 2.95Å; C32-A35 PolarHBondContact O-N 3.22Å; C32-A35 VanDerWaalsContact O-N 3.16Å; C32-R36 WeakPolarHBondContact O-CG 3.42Å; C32-R36 PolarHBondContact O-N 2.92Å
33	E	66.4	Low	63.8	Low	127 Å²	127	75.5 Å²	75.5	59%	0.593	37%	0.37	S	S	*	.	H	α-helix	trans	-61.8	-47.8	-172.8	-165.9	170.4	-159.8	0	0	113.5	K31 A35 R36 E37	K31-E33 VanDerWaalsContact C-N 3.3Å; K31-E33 PolarHBondContact O-N 3.02Å; E33-A35 VanDerWaalsContact C-N 3.3Å; E33-A35 PolarHBondContact O-N 3.4Å; E33-R36 WeakPolarHBondContact O-CB 3.35Å; E33-R36 PolarHBondContact O-N 3.32Å; E33-R36 VanDerWaalsContact O-N 3.14Å; E33-E37 PolarHBondContact O-N 3.49Å
34	K	67.6	Low	63.1	Low	163 Å²	163	78.8 Å²	78.8	71%	0.709	38%	0.381	S	S	*	.	H	α-helix	trans	-63.4	-36.1	175.4	-69.2	-173.4	178.9	-177.6	0	112.4	K31 C32 S38	K31-K34 PolarHBondContact O-N 2.97Å; C32-K34 PolarHBondContact O-N 2.95Å; K34-S38 VanDerWaalsContact O-CB 3.27Å; K34-S38 WeakPolarHBondContact O-CB 3.36Å; K34-S38 PolarHBondContact O-N 3.21Å
35	A	64.5	Low	62.4	Low	6 Å²	6	77.6 Å²	77.6	5%	0.05	38%	0.378	C	S	.	.	H	α-helix	trans	-68	-37.8	175.3	0	0	0	0	0	111.4	L24 L25 K31 C32 E33 S38 G39	L24-A35 HydrophobicContact CB-CB 4.06Å; L24-A35 HydrophobicContact CD1-CB 4.38Å; L25-A35 HydrophobicContact CD2-CB 3.86Å; L25-A35 HydrophobicContact CG-CB 4.16Å; K31-A35 PolarHBondContact O-N 3.41Å; C32-A35 PolarHBondContact O-N 3.22Å; C32-A35 VanDerWaalsContact O-N 3.16Å; E33-A35 VanDerWaalsContact C-N 3.3Å; E33-A35 PolarHBondContact O-N 3.4Å; A35-S38 PolarHBondContact O-N 3.41Å; A35-G39 PolarHBondContact O-N 3.42Å
36	R	63.9	Low	62.2	Low	78 Å²	78	77.6 Å²	77.6	29%	0.294	38%	0.378	S	S	.	.	H	α-helix	trans	-63.5	-46.4	174.7	-68.8	-180	178.1	-171.5	-7	111.8	L25 C32 E33 G39 T40 C76 Y78	L25-R36 HydrophobicContact CD1-CG 4.35Å; L25-R36 HydrophobicContact CD2-CG 3.52Å; C32-R36 WeakPolarHBondContact O-CG 3.42Å; C32-R36 PolarHBondContact O-N 2.92Å; E33-R36 WeakPolarHBondContact O-CB 3.35Å; E33-R36 PolarHBondContact O-N 3.32Å; E33-R36 VanDerWaalsContact O-N 3.14Å; R36-G39 PolarHBondContact O-N 3.45Å; R36-T40 WeakPolarHBondContact O-CB 3.47Å; R36-T40 PolarHBondContact O-N 3.31Å; R36-T40 PolarHBondContact O-OG1 2.92Å; R36-C76 WeakPolarHBondContact CD-O 3.42Å; R36-C76 WeakPolarHBondContact CG-O 3.45Å; R36-C76 PolarHBondContact NE-O 2.91Å; R36-C76 PolarHBondContact NH2-SG 3.23Å; R36-C76 VanDerWaalsContact NH2-SG 3.4Å; R36-Y78 HydrophobicContact CB-CD2 4.38Å; R36-Y78 HydrophobicContact CB-CE2 4.08Å
37	E	64.8	Low	61.9	Low	105 Å²	105	78.1 Å²	78.1	49%	0.491	38%	0.378	S	S	.	.	H	α-helix	trans	-62.2	-47.7	175.7	-71.6	178.5	168.7	0	0	111.6	E33 G39 T40 L41	E33-E37 PolarHBondContact O-N 3.49Å; E37-G39 VanDerWaalsContact C-N 3.32Å; E37-G39 PolarHBondContact O-N 3.46Å; E37-T40 PolarHBondContact O-N 3.03Å; E37-L41 WeakPolarHBondContact O-CB 3.3Å; E37-L41 PolarHBondContact O-N 3Å
38	S	66.1	Low	60.7	Low	52 Å²	52	71.8 Å²	71.8	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-61.6	-40.3	178	-174.1	0	0	0	0	112.2	K34 A35 S42	K34-S38 VanDerWaalsContact O-CB 3.27Å; K34-S38 WeakPolarHBondContact O-CB 3.36Å; K34-S38 PolarHBondContact O-N 3.21Å; A35-S38 PolarHBondContact O-N 3.41Å; S38-S42 WeakPolarHBondContact O-CB 3.48Å; S38-S42 PolarHBondContact O-N 3.04Å; S38-S42 PolarHBondContact O-OG 3.44Å
39	G	64	Low	60.4	Low	1 Å²	1	69.8 Å²	69.8	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-46.1	174.6	0	0	0	0	0	111.9	A35 R36 E37 L41 S42 C43	A35-G39 PolarHBondContact O-N 3.42Å; R36-G39 PolarHBondContact O-N 3.45Å; E37-G39 VanDerWaalsContact C-N 3.32Å; E37-G39 PolarHBondContact O-N 3.46Å; G39-L41 PolarHBondContact O-N 3.32Å; G39-S42 PolarHBondContact O-N 3.49Å; G39-C43 PolarHBondContact O-N 3.11Å; G39-C43 PolarHBondContact O-SG 3.32Å; G39-C43 VanDerWaalsContact O-SG 3.41Å
40	T	63.2	Low	60.4	Low	30 Å²	30	67.7 Å²	67.7	18%	0.184	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-47.3	177	-56.2	0	0	0	0	111.8	R36 E37 S42 C43 F44 S81	R36-T40 WeakPolarHBondContact O-CB 3.47Å; R36-T40 PolarHBondContact O-N 3.31Å; R36-T40 PolarHBondContact O-OG1 2.92Å; E37-T40 PolarHBondContact O-N 3.03Å; T40-S42 VanDerWaalsContact C-N 3.31Å; T40-S42 PolarHBondContact O-N 3.18Å; T40-C43 WeakPolarHBondContact O-CB 3.25Å; T40-C43 PolarHBondContact O-N 3.42Å; T40-F44 PolarHBondContact O-N 3.47Å; T40-S81 WeakPolarHBondContact CB-OG 2.84Å; T40-S81 VanDerWaalsContact CG2-OG 3.24Å; T40-S81 WeakPolarHBondContact CG2-OG 3.49Å; T40-S81 PolarHBondContact OG1-OG 3.39Å
41	L	59.2	Low	60.1	Low	109 Å²	109	60.4 Å²	60.4	57%	0.571	31%	0.306	S	S	*	.	H	α-helix	trans	-62.7	-40.7	177.3	-173.9	67	0	0	0	111.2	E37 G39 F44 C45	E37-L41 WeakPolarHBondContact O-CB 3.3Å; E37-L41 PolarHBondContact O-N 3Å; G39-L41 PolarHBondContact O-N 3.32Å; L41-F44 PolarHBondContact O-N 2.86Å; L41-C45 WeakPolarHBondContact O-CB 3.49Å; L41-C45 PolarHBondContact O-N 3.19Å; L41-C45 PolarHBondContact O-SG 3.36Å
42	S	64.2	Low	59.3	Low	9 Å²	9	58.3 Å²	58.3	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-40.4	177.8	-57.7	0	0	0	0	111.7	I14 S38 G39 T40 C45 L46	I14-S42 VanDerWaalsContact CG2-O 3.28Å; I14-S42 WeakPolarHBondContact CG2-O 3.31Å; S38-S42 WeakPolarHBondContact O-CB 3.48Å; S38-S42 PolarHBondContact O-N 3.04Å; S38-S42 PolarHBondContact O-OG 3.44Å; G39-S42 PolarHBondContact O-N 3.49Å; T40-S42 VanDerWaalsContact C-N 3.31Å; T40-S42 PolarHBondContact O-N 3.18Å; S42-C45 PolarHBondContact O-N 3.06Å; S42-L46 WeakPolarHBondContact O-CB 3.34Å; S42-L46 VanDerWaalsContact O-CG 3.3Å; S42-L46 WeakPolarHBondContact O-CG 3.37Å; S42-L46 PolarHBondContact O-N 3.29Å
43	C	60.1	Low	58.6	Low	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.1	-49.5	170.7	-71.6	0	0	0	0	111.1	G39 T40 C45 L46 Y47 D84 I88	G39-C43 PolarHBondContact O-N 3.11Å; G39-C43 PolarHBondContact O-SG 3.32Å; G39-C43 VanDerWaalsContact O-SG 3.41Å; T40-C43 WeakPolarHBondContact O-CB 3.25Å; T40-C43 PolarHBondContact O-N 3.42Å; C43-C45 PolarHBondContact O-N 3.35Å; C43-L46 PolarHBondContact O-N 3.47Å; C43-Y47 WeakPolarHBondContact O-CB 3.35Å; C43-Y47 PolarHBondContact O-N 2.96Å; C43-D84 HydrophobicContact CB-CB 4.45Å; C43-I88 HydrophobicContact CB-CD1 4.42Å; C43-I88 VanDerWaalsContact O-CD1 3.32Å; C43-I88 WeakPolarHBondContact O-CD1 3.31Å
44	F	55	Low	57.7	Low	119 Å²	119	58 Å²	58	52%	0.522	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-44.8	178.8	-176.1	-97.7	0	0	0	112.4	T40 L41 L46 Y47 A48	T40-F44 PolarHBondContact O-N 3.47Å; L41-F44 PolarHBondContact O-N 2.86Å; F44-L46 PolarHBondContact O-N 3.08Å; F44-Y47 PolarHBondContact O-N 2.88Å; F44-A48 WeakPolarHBondContact O-CB 3.39Å; F44-A48 PolarHBondContact O-N 2.68Å
45	C	56.3	Low	56.7	Low	44 Å²	44	55.3 Å²	55.3	30%	0.297	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-37.7	177	-65.8	0	0	0	0	112.3	I14 L41 S42 C43 T49	I14-C45 HydrophobicContact CD1-CB 3.87Å; I14-C45 HydrophobicContact CG2-CB 4Å; L41-C45 WeakPolarHBondContact O-CB 3.49Å; L41-C45 PolarHBondContact O-N 3.19Å; L41-C45 PolarHBondContact O-SG 3.36Å; S42-C45 PolarHBondContact O-N 3.06Å; C43-C45 PolarHBondContact O-N 3.35Å; C45-T49 WeakPolarHBondContact O-CB 3.48Å; C45-T49 PolarHBondContact O-N 3.24Å; C45-T49 PolarHBondContact O-OG1 2.97Å
46	L	61.9	Low	55.8	Low	5 Å²	5	56 Å²	56	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-64.9	-44.4	173.7	-76.2	167.3	0	0	0	111.6	I14 V15 L18 S42 C43 F44 T49 L50 V58 F62 I88	I14-L46 HydrophobicContact CB-CD2 4.07Å; I14-L46 HydrophobicContact CB-CG 4.2Å; I14-L46 HydrophobicContact CG2-CD1 4.21Å; I14-L46 HydrophobicContact CG2-CD2 4.05Å; I14-L46 HydrophobicContact CG2-CG 3.61Å; V15-L46 HydrophobicContact CG2-CD1 4.29Å; V15-L46 HydrophobicContact CG2-CD2 3.72Å; L18-L46 HydrophobicContact CD2-CD1 3.77Å; S42-L46 WeakPolarHBondContact O-CB 3.34Å; S42-L46 VanDerWaalsContact O-CG 3.3Å; S42-L46 WeakPolarHBondContact O-CG 3.37Å; S42-L46 PolarHBondContact O-N 3.29Å; C43-L46 PolarHBondContact O-N 3.47Å; F44-L46 PolarHBondContact O-N 3.08Å; L46-T49 PolarHBondContact O-N 3.34Å; L46-L50 WeakPolarHBondContact O-CB 3.44Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.48Å; L46-L50 PolarHBondContact O-N 3.39Å; L46-V58 HydrophobicContact CD2-CG1 4.19Å; L46-F62 HydrophobicContact CD1-CD2 3.85Å; L46-F62 HydrophobicContact CD1-CE2 3.69Å; L46-I88 HydrophobicContact CB-CD1 3.94Å
47	Y	58.3	Low	55.2	Low	67 Å²	67	57.3 Å²	57.3	26%	0.263	34%	0.342	S	S	.	.	H	α-helix	trans	-58.6	-50.2	175.8	-178.4	-108.3	0	0	0	111.1	C43 F44 T49 L50 C51 L87 I88	C43-Y47 WeakPolarHBondContact O-CB 3.35Å; C43-Y47 PolarHBondContact O-N 2.96Å; F44-Y47 PolarHBondContact O-N 2.88Å; Y47-T49 VanDerWaalsContact C-N 3.32Å; Y47-T49 PolarHBondContact O-N 2.82Å; Y47-L50 PolarHBondContact O-N 3.29Å; Y47-C51 PolarHBondContact O-N 3Å; Y47-C51 PolarHBondContact O-SG 3.42Å; Y47-C51 VanDerWaalsContact O-SG 3.34Å; Y47-L87 HydrophobicContact CD2-CB 3.89Å; Y47-L87 HydrophobicContact CE2-CB 3.53Å; Y47-L87 HydrophobicContact CE2-CD1 3.92Å; Y47-L87 HydrophobicContact CE2-CG 4.28Å; Y47-I88 HydrophobicContact CD2-CG1 4.07Å; Y47-I88 HydrophobicContact CG-CG1 4.46Å
48	A	42.4	Very low	54.5	Low	35 Å²	35	53.2 Å²	53.2	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-58.1	-42.8	176.3	0	0	0	0	0	112.3	F44 L50 C51 C52	F44-A48 WeakPolarHBondContact O-CB 3.39Å; F44-A48 PolarHBondContact O-N 2.68Å; A48-L50 PolarHBondContact O-N 3.16Å; A48-C51 PolarHBondContact O-N 2.99Å; A48-C52 WeakPolarHBondContact O-CB 3.32Å; A48-C52 PolarHBondContact O-N 3.13Å; A48-C52 PolarHBondContact O-SG 3.16Å
49	T	55.2	Low	53.7	Low	15 Å²	15	51.3 Å²	51.3	9%	0.092	31%	0.311	C	S	.	.	H	α-helix	trans	-63	-42.6	178	-55.9	0	0	0	0	111.9	P11 C45 L46 Y47 C52 S53	P11-T49 HydrophobicContact CB-CG2 4.17Å; P11-T49 HydrophobicContact CG-CG2 3.58Å; C45-T49 WeakPolarHBondContact O-CB 3.48Å; C45-T49 PolarHBondContact O-N 3.24Å; C45-T49 PolarHBondContact O-OG1 2.97Å; L46-T49 PolarHBondContact O-N 3.34Å; Y47-T49 VanDerWaalsContact C-N 3.32Å; Y47-T49 PolarHBondContact O-N 2.82Å; T49-C52 PolarHBondContact O-N 3.24Å; T49-S53 PolarHBondContact O-N 3.32Å; T49-S53 PolarHBondContact O-OG 3.14Å
50	L	57.6	Low	52.6	Low	42 Å²	42	56.2 Å²	56.2	22%	0.22	34%	0.344	C	S	.	.	H	α-helix	trans	-69.5	-36	179.2	-72.9	165.8	0	0	0	112.2	L46 Y47 A48 I88 L92	L46-L50 WeakPolarHBondContact O-CB 3.44Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.48Å; L46-L50 PolarHBondContact O-N 3.39Å; Y47-L50 PolarHBondContact O-N 3.29Å; A48-L50 PolarHBondContact O-N 3.16Å; L50-I88 HydrophobicContact CD1-CB 4.17Å; L50-I88 HydrophobicContact CD1-CG1 4.12Å; L50-I88 HydrophobicContact CD1-CG2 3.52Å; L50-L92 HydrophobicContact CD1-CD2 4.26Å; L50-L92 HydrophobicContact CD1-CG 4.26Å; L50-L92 HydrophobicContact CD2-CD2 3.79Å
51	C	49.6	Very low	51.7	Low	72 Å²	72	60.5 Å²	60.5	49%	0.486	36%	0.362	S	S	.	.	H	α-helix	trans	-69.1	-33.3	173.9	-69.1	0	0	0	0	112.6	Y47 A48	Y47-C51 PolarHBondContact O-N 3Å; Y47-C51 PolarHBondContact O-SG 3.42Å; Y47-C51 VanDerWaalsContact O-SG 3.34Å; A48-C51 PolarHBondContact O-N 2.99Å
52	C	42.6	Very low	51.3	Low	115 Å²	115	55.9 Å²	55.9	78%	0.777	34%	0.337	S	S	*	.	H	α-helix	trans	-91.8	-15.7	-175	-67.5	0	0	0	0	114.8	A48 T49	A48-C52 WeakPolarHBondContact O-CB 3.32Å; A48-C52 PolarHBondContact O-N 3.13Å; A48-C52 PolarHBondContact O-SG 3.16Å; T49-C52 PolarHBondContact O-N 3.24Å
53	S	47.7	Very low	50.5	Low	39 Å²	39	56.4 Å²	56.4	27%	0.273	34%	0.338	S	S	.	.			trans	-143.2	115.7	-176.3	62.6	0	0	0	0	112.8	T49 T55	T49-S53 PolarHBondContact O-N 3.32Å; T49-S53 PolarHBondContact O-OG 3.14Å; S53-T55 PolarHBondContact O-N 3.19Å; S53-T55 VanDerWaalsContact O-N 3.17Å
54	S	46.6	Very low	49.6	Very low	111 Å²	111	59.4 Å²	59.4	78%	0.776	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-1.4	177	44.5	0	0	0	0	114
55	T	46.6	Very low	49.3	Very low	107 Å²	107	54.8 Å²	54.8	66%	0.656	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	18	-162.4	49.7	0	0	0	0	115.2	S53 P57	S53-T55 PolarHBondContact O-N 3.19Å; S53-T55 VanDerWaalsContact O-N 3.17Å; T55-P57 WeakPolarHBondContact O-CD 3.35Å
56	C	46.7	Very low	48.8	Very low	20 Å²	20	61.5 Å²	61.5	14%	0.135	36%	0.359	C	S	.	.			trans	-83.7	122.9	-172.6	-138.2	0	0	0	0	114	P11 V58 R95	P11-C56 VanDerWaalsContact CG-SG 3.59Å; C56-V58 HydrophobicContact CB-CB 4.49Å; C56-V58 HydrophobicContact CB-CG2 4.12Å; C56-V58 PolarHBondContact O-N 3.05Å; C56-V58 WeakPolarHBondContact SG-CG2 3.32Å; C56-R95 PolarHBondContact O-NH1 3.47Å
57	P	50.7	Low	48.1	Very low	107 Å²	107	61.7 Å²	61.7	70%	0.695	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	16.6	177.1	26	-32	0	0	0	115.2	T55	T55-P57 WeakPolarHBondContact O-CD 3.35Å
58	V	50.9	Low	47.7	Very low	18 Å²	18	59.1 Å²	59.1	11%	0.109	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.4	-167.2	-179.8	0	0	0	0	112.9	P11 V15 L46 C56 C60 H61	P11-V58 HydrophobicContact CB-CB 4.11Å; P11-V58 HydrophobicContact CB-CG1 3.97Å; P11-V58 HydrophobicContact CB-CG2 3.13Å; P11-V58 HydrophobicContact CG-CG2 4.21Å; V15-V58 HydrophobicContact CG2-CG1 3.29Å; L46-V58 HydrophobicContact CD2-CG1 4.19Å; C56-V58 HydrophobicContact CB-CB 4.49Å; C56-V58 HydrophobicContact CB-CG2 4.12Å; C56-V58 PolarHBondContact O-N 3.05Å; C56-V58 WeakPolarHBondContact SG-CG2 3.32Å; V58-C60 VanDerWaalsContact C-N 3.25Å; V58-C60 PolarHBondContact O-N 3.35Å; V58-H61 PolarHBondContact O-N 2.87Å
59	C	47.9	Very low	47.7	Very low	12 Å²	12	60.2 Å²	60.2	8%	0.081	36%	0.355	C	S	.	.	H	α-helix	trans	-55.3	-41.1	-179.3	-58.7	0	0	0	0	111.6	H61 F62 F63 L92 R95	C59-H61 PolarHBondContact O-N 2.97Å; C59-H61 VanDerWaalsContact O-N 3.09Å; C59-F62 PolarHBondContact O-N 3.29Å; C59-F63 HydrophobicContact CB-CE2 4.08Å; C59-F63 WeakPolarHBondContact O-CD2 3.49Å; C59-F63 WeakPolarHBondContact O-CE2 3.27Å; C59-L92 HydrophobicContact CB-CD2 3.99Å; C59-L92 WeakPolarHBondContact SG-CD2 3.36Å; C59-R95 PolarHBondContact SG-NH1 3.24Å
60	C	41.1	Very low	47.3	Very low	105 Å²	105	60.4 Å²	60.4	71%	0.709	36%	0.357	S	S	*	.	H	α-helix	trans	-63.2	-19.7	-176.1	-64.4	0	0	0	0	114.5	V58	V58-C60 VanDerWaalsContact C-N 3.25Å; V58-C60 PolarHBondContact O-N 3.35Å
61	H	45.6	Very low	46.8	Very low	119 Å²	119	66.3 Å²	66.3	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-96.9	-30.2	177.3	-85.2	1	0	0	0	114.1	V15 V58 C59 F63 S64	V15-H61 HydrophobicContact CB-CB 4.32Å; V15-H61 HydrophobicContact CG1-CB 3.62Å; V58-H61 PolarHBondContact O-N 2.87Å; C59-H61 PolarHBondContact O-N 2.97Å; C59-H61 VanDerWaalsContact O-N 3.09Å; H61-F63 PolarHBondContact O-N 3.33Å; H61-S64 PolarHBondContact O-N 3.48Å; H61-S64 PolarHBondContact O-OG 3.02Å
62	F	50.8	Low	46.5	Very low	12 Å²	12	66 Å²	66	5%	0.053	38%	0.375	C	S	.	.	H	α-helix	trans	-58.1	-39.9	175.7	-162.5	-101.3	0	0	0	109.7	L18 L46 C59 S64 M65 I88 L92	L18-F62 HydrophobicContact CD2-CD2 4.22Å; L18-F62 HydrophobicContact CD2-CE2 3.7Å; L46-F62 HydrophobicContact CD1-CD2 3.85Å; L46-F62 HydrophobicContact CD1-CE2 3.69Å; C59-F62 PolarHBondContact O-N 3.29Å; F62-S64 PolarHBondContact O-N 3.38Å; F62-M65 HydrophobicContact CD1-CE 3.92Å; F62-M65 HydrophobicContact CD1-CG 4.34Å; F62-M65 HydrophobicContact CD1-SD 4.06Å; F62-M65 HydrophobicContact CD2-CE 3.96Å; F62-M65 HydrophobicContact CE1-CE 3.29Å; F62-M65 HydrophobicContact CE1-CG 4.38Å; F62-M65 HydrophobicContact CE1-SD 3.53Å; F62-M65 VanDerWaalsContact CE1-SD 3.53Å; F62-M65 HydrophobicContact CE2-CE 3.33Å; F62-M65 HydrophobicContact CG-CE 4.25Å; F62-M65 HydrophobicContact CZ-CE 2.98Å; F62-M65 HydrophobicContact CZ-SD 3.88Å; F62-M65 WeakPolarHBondContact O-CG 3.15Å; F62-M65 PolarHBondContact O-N 3.31Å; F62-I88 HydrophobicContact CD1-CG2 4.31Å; F62-I88 HydrophobicContact CD2-CG2 4.5Å; F62-I88 HydrophobicContact CE1-CG2 3.67Å; F62-I88 HydrophobicContact CE2-CG2 3.89Å; F62-I88 HydrophobicContact CZ-CB 4.21Å; F62-I88 HydrophobicContact CZ-CD1 4.45Å; F62-I88 HydrophobicContact CZ-CG2 3.39Å; F62-L92 HydrophobicContact CB-CD1 4.29Å; F62-L92 HydrophobicContact CD1-CD1 3.6Å; F62-L92 HydrophobicContact CE1-CD1 4.1Å; F62-L92 HydrophobicContact CG-CD1 4.09Å
63	F	46.8	Very low	46.7	Very low	20 Å²	20	60.7 Å²	60.7	9%	0.088	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-11.2	-178.7	-80.1	-49	0	0	0	117.5	C59 H61 M65 L92 T103 Y106	C59-F63 HydrophobicContact CB-CE2 4.08Å; C59-F63 WeakPolarHBondContact O-CD2 3.49Å; C59-F63 WeakPolarHBondContact O-CE2 3.27Å; H61-F63 PolarHBondContact O-N 3.33Å; F63-M65 PolarHBondContact O-N 2.94Å; F63-L92 HydrophobicContact CZ-CB 4.27Å; F63-L92 HydrophobicContact CZ-CD1 4.35Å; F63-T103 HydrophobicContact CE1-CG2 3.56Å; F63-T103 HydrophobicContact CE2-CG2 4.23Å; F63-T103 HydrophobicContact CZ-CG2 3.2Å; F63-T103 WeakPolarHBondContact CZ-OG1 3.33Å; F63-Y106 HydrophobicContact CB-CD1 3.66Å; F63-Y106 HydrophobicContact CB-CD2 4.12Å; F63-Y106 HydrophobicContact CB-CE1 3.33Å; F63-Y106 HydrophobicContact CB-CE2 3.8Å; F63-Y106 HydrophobicContact CB-CG 4.06Å; F63-Y106 VanDerWaalsContact CB-CZ 3.42Å; F63-Y106 AromaticContact CD1-CD1 3.21Å; F63-Y106 HydrophobicContact CD1-CD1 3.21Å; F63-Y106 AromaticContact CD1-CE1 3.51Å; F63-Y106 HydrophobicContact CD1-CE1 3.51Å; F63-Y106 HydrophobicContact CD1-CG 4.01Å; F63-Y106 HydrophobicContact CD2-CD1 4.07Å; F63-Y106 HydrophobicContact CD2-CD2 4.49Å; F63-Y106 HydrophobicContact CD2-CG 4.04Å; F63-Y106 HydrophobicContact CE1-CD1 4Å; F63-Y106 AromaticContact CG-CD1 3.34Å; F63-Y106 HydrophobicContact CG-CD1 3.34Å; F63-Y106 HydrophobicContact CG-CD2 4.23Å; F63-Y106 AromaticContact CG-CE1 3.55Å; F63-Y106 HydrophobicContact CG-CE1 3.55Å; F63-Y106 HydrophobicContact CG-CE2 4.38Å; F63-Y106 AromaticContact CG-CG 3.73Å; F63-Y106 HydrophobicContact CG-CG 3.73Å; F63-Y106 PolarHBondContact O-OH 3.05Å
64	S	42.3	Very low	46.8	Very low	63 Å²	63	60 Å²	60	44%	0.441	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	15.9	168.3	64.4	0	0	0	0	114.6	H61 F62 R66	H61-S64 PolarHBondContact O-N 3.48Å; H61-S64 PolarHBondContact O-OG 3.02Å; F62-S64 PolarHBondContact O-N 3.38Å; S64-R66 PolarHBondContact O-N 2.92Å
65	M	48.5	Very low	46.9	Very low	23 Å²	23	62.1 Å²	62.1	11%	0.113	33%	0.327	C	S	.	.			trans	-63.2	85.1	-174.4	-82.7	-152.5	159.5	0	0	113.6	L18 F62 F63 F67 I68	L18-M65 HydrophobicContact CD2-CE 4.05Å; F62-M65 HydrophobicContact CD1-CE 3.92Å; F62-M65 HydrophobicContact CD1-CG 4.34Å; F62-M65 HydrophobicContact CD1-SD 4.06Å; F62-M65 HydrophobicContact CD2-CE 3.96Å; F62-M65 HydrophobicContact CE1-CE 3.29Å; F62-M65 HydrophobicContact CE1-CG 4.38Å; F62-M65 HydrophobicContact CE1-SD 3.53Å; F62-M65 VanDerWaalsContact CE1-SD 3.53Å; F62-M65 HydrophobicContact CE2-CE 3.33Å; F62-M65 HydrophobicContact CG-CE 4.25Å; F62-M65 HydrophobicContact CZ-CE 2.98Å; F62-M65 HydrophobicContact CZ-SD 3.88Å; F62-M65 WeakPolarHBondContact O-CG 3.15Å; F62-M65 PolarHBondContact O-N 3.31Å; F63-M65 PolarHBondContact O-N 2.94Å; M65-F67 HydrophobicContact CB-CB 3.63Å; M65-F67 HydrophobicContact CE-CB 3.75Å; M65-F67 HydrophobicContact CE-CD1 3.89Å; M65-F67 HydrophobicContact CE-CD2 3.77Å; M65-F67 HydrophobicContact CE-CE1 4.39Å; M65-F67 HydrophobicContact CE-CE2 4.31Å; M65-F67 HydrophobicContact CE-CG 3.56Å; M65-F67 HydrophobicContact CG-CB 3.45Å; M65-F67 VanDerWaalsContact CG-CB 3.45Å; M65-F67 HydrophobicContact CG-CG 4.3Å; M65-F67 PolarHBondContact O-N 3.01Å; M65-F67 VanDerWaalsContact O-N 3.16Å; M65-F67 HydrophobicContact SD-CB 3.4Å; M65-F67 WeakPolarHBondContact SD-CB 3.36Å; M65-F67 HydrophobicContact SD-CD1 4.04Å; M65-F67 HydrophobicContact SD-CG 3.78Å; M65-I68 HydrophobicContact SD-CD1 4.26Å; M65-I68 HydrophobicContact SD-CG1 4.05Å
66	R	45.4	Very low	47	Very low	185 Å²	185	57.8 Å²	57.8	70%	0.698	30%	0.301	S	S	*	.	H	α-helix	trans	-52.5	-15.2	139.7	-90.7	-176.1	169.4	169.7	-2.5	112.7	S64 I68 C69 S70	S64-R66 PolarHBondContact O-N 2.92Å; R66-I68 PolarHBondContact O-N 3.09Å; R66-C69 PolarHBondContact O-N 2.62Å; R66-S70 VanDerWaalsContact O-CB 3.29Å; R66-S70 WeakPolarHBondContact O-CB 3.37Å; R66-S70 PolarHBondContact O-N 3.29Å
67	F	47.3	Very low	47.3	Very low	8 Å²	8	57.4 Å²	57.4	4%	0.035	30%	0.298	C	S	.	.	H	α-helix	trans	-54.4	-41.9	-179.8	-153.3	-82	0	0	0	114.5	L18 V22 M65 T73 L77 V85	L18-F67 HydrophobicContact CD1-CE2 3.68Å; L18-F67 HydrophobicContact CD1-CZ 4.23Å; L18-F67 HydrophobicContact CD2-CE2 4.32Å; L18-F67 HydrophobicContact CG-CE2 4.01Å; V22-F67 HydrophobicContact CB-CD2 4.29Å; V22-F67 HydrophobicContact CG1-CD2 4.26Å; V22-F67 HydrophobicContact CG2-CD2 3.12Å; V22-F67 HydrophobicContact CG2-CE2 3.12Å; V22-F67 HydrophobicContact CG2-CG 4.34Å; V22-F67 HydrophobicContact CG2-CZ 4.37Å; M65-F67 HydrophobicContact CB-CB 3.63Å; M65-F67 HydrophobicContact CE-CB 3.75Å; M65-F67 HydrophobicContact CE-CD1 3.89Å; M65-F67 HydrophobicContact CE-CD2 3.77Å; M65-F67 HydrophobicContact CE-CE1 4.39Å; M65-F67 HydrophobicContact CE-CE2 4.31Å; M65-F67 HydrophobicContact CE-CG 3.56Å; M65-F67 HydrophobicContact CG-CB 3.45Å; M65-F67 VanDerWaalsContact CG-CB 3.45Å; M65-F67 HydrophobicContact CG-CG 4.3Å; M65-F67 PolarHBondContact O-N 3.01Å; M65-F67 VanDerWaalsContact O-N 3.16Å; M65-F67 HydrophobicContact SD-CB 3.4Å; M65-F67 WeakPolarHBondContact SD-CB 3.36Å; M65-F67 HydrophobicContact SD-CD1 4.04Å; M65-F67 HydrophobicContact SD-CG 3.78Å; F67-T73 PolarHBondContact O-OG1 3.13Å; F67-L77 HydrophobicContact CD1-CD1 4.23Å; F67-L77 HydrophobicContact CE1-CD1 3.16Å; F67-L77 HydrophobicContact CE2-CD1 4.22Å; F67-L77 HydrophobicContact CZ-CD1 3.15Å; F67-L77 HydrophobicContact CZ-CD2 4.14Å; F67-L77 HydrophobicContact CZ-CG 4.25Å; F67-V85 HydrophobicContact CD1-CG1 4.48Å; F67-V85 HydrophobicContact CD1-CG2 4.5Å; F67-V85 HydrophobicContact CE1-CG1 4.34Å; F67-V85 HydrophobicContact CE1-CG2 3.64Å; F67-V85 HydrophobicContact CZ-CG2 4.11Å
68	I	49.4	Very low	47.4	Very low	14 Å²	14	57.3 Å²	57.3	7%	0.072	28%	0.284	C	S	.	.	H	α-helix	trans	-81.5	-37.2	-177.6	-62.6	173.7	0	0	0	110.1	M65 R66 N74 F89 V113 A116 L117 M133	M65-I68 HydrophobicContact SD-CD1 4.26Å; M65-I68 HydrophobicContact SD-CG1 4.05Å; R66-I68 PolarHBondContact O-N 3.09Å; I68-N74 PolarHBondContact O-ND2 3.38Å; I68-F89 HydrophobicContact CD1-CD2 3.96Å; I68-F89 HydrophobicContact CD1-CE2 4Å; I68-V113 HydrophobicContact CD1-CG1 4.16Å; I68-A116 HydrophobicContact CG2-CB 4.29Å; I68-L117 HydrophobicContact CG2-CD2 3.71Å; I68-L117 HydrophobicContact CG2-CG 4.2Å; I68-M133 HydrophobicContact CD1-SD 4.35Å
69	C	43.2	Very low	47.5	Very low	58 Å²	58	62.9 Å²	62.9	39%	0.392	31%	0.307	S	S	.	.	H	α-helix	trans	-86.9	-17.3	-172.5	-57	0	0	0	0	114.8	R66 R71 A116	R66-C69 PolarHBondContact O-N 2.62Å; C69-R71 PolarHBondContact O-N 3.2Å; C69-A116 HydrophobicContact CB-CB 4.04Å; C69-A116 WeakPolarHBondContact SG-CB 3.4Å
70	S	46	Very low	47.8	Very low	19 Å²	19	67.5 Å²	67.5	13%	0.133	33%	0.328	C	S	.	.			trans	-80.2	109	-179.4	168.7	0	0	0	0	110.5	E26 R66 S72 T73	E26-S70 WeakPolarHBondContact OE1-CB 3.3Å; E26-S70 PolarHBondContact OE1-OG 3.43Å; R66-S70 VanDerWaalsContact O-CB 3.29Å; R66-S70 WeakPolarHBondContact O-CB 3.37Å; R66-S70 PolarHBondContact O-N 3.29Å; S70-S72 PolarHBondContact O-N 3.17Å; S70-S72 WeakPolarHBondContact OG-CB 3.48Å; S70-S72 PolarHBondContact OG-N 2.82Å; S70-T73 WeakPolarHBondContact CB-OG1 3.39Å; S70-T73 PolarHBondContact O-N 3.04Å; S70-T73 PolarHBondContact O-OG1 3.06Å; S70-T73 PolarHBondContact OG-N 3.23Å; S70-T73 PolarHBondContact OG-OG1 3.35Å
71	R	46.7	Very low	48.9	Very low	166 Å²	166	62.5 Å²	62.5	63%	0.626	29%	0.294	S	S	*	.	H	α-helix	trans	-52.6	-22.5	171.2	-135.2	172.5	175.5	112.7	3.6	111.3	C69 E122	C69-R71 PolarHBondContact O-N 3.2Å; R71-E122 IonicContact CZ-OE2 3.81Å; R71-E122 IonicContact NH1-OE2 3.12Å; R71-E122 PolarHBondContact NH1-OE2 3.1Å; R71-E122 VanDerWaalsContact NH1-OE2 3.13Å; R71-E122 IonicContact NH2-OE2 2.64Å; R71-E122 PolarHBondContact NH2-OE2 3.18Å
72	S	42.7	Very low	50	Low	66 Å²	66	57.7 Å²	57.7	46%	0.462	27%	0.271	S	S	.	.	H	α-helix	trans	-84.2	-33.9	178.6	-44.6	0	0	0	0	113.8	S70	S70-S72 PolarHBondContact O-N 3.17Å; S70-S72 WeakPolarHBondContact OG-CB 3.48Å; S70-S72 PolarHBondContact OG-N 2.82Å
73	T	47.9	Very low	51	Low	2 Å²	2	62 Å²	62	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-73.5	-39	-178.8	43.7	0	0	0	0	112.6	V22 E26 F67 S70 K75 C76	V22-T73 HydrophobicContact CG1-CG2 3.64Å; E26-T73 HydrophobicContact CG-CG2 3.5Å; F67-T73 PolarHBondContact O-OG1 3.13Å; S70-T73 WeakPolarHBondContact CB-OG1 3.39Å; S70-T73 PolarHBondContact O-N 3.04Å; S70-T73 PolarHBondContact O-OG1 3.06Å; S70-T73 PolarHBondContact OG-N 3.23Å; S70-T73 PolarHBondContact OG-OG1 3.35Å; T73-K75 VanDerWaalsContact C-N 3.34Å; T73-K75 PolarHBondContact O-N 3.36Å; T73-C76 PolarHBondContact O-N 3.31Å
74	N	48.8	Very low	52.2	Low	25 Å²	25	61.5 Å²	61.5	13%	0.134	29%	0.288	C	S	.	.	H	α-helix	trans	-70.4	-26.9	-176.9	-84.5	-39.3	0	0	0	114.1	I68 C76 K82 I126	I68-N74 PolarHBondContact O-ND2 3.38Å; N74-C76 PolarHBondContact O-N 2.94Å; N74-K82 WeakPolarHBondContact O-CE 3.24Å; N74-K82 PolarHBondContact O-NZ 3.35Å; N74-I126 HydrophobicContact CB-CD1 4Å; N74-I126 HydrophobicContact CB-CG2 3.91Å; N74-I126 WeakPolarHBondContact ND2-CD1 3.44Å
75	K	49.5	Very low	53.7	Low	156 Å²	156	59 Å²	59	68%	0.678	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.8	170.4	-76.5	-171.2	175.5	-175.2	0	113.1	T73	T73-K75 VanDerWaalsContact C-N 3.34Å; T73-K75 PolarHBondContact O-N 3.36Å
76	C	48.7	Very low	55.3	Low	16 Å²	16	58.1 Å²	58.1	11%	0.108	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-17.9	-170.5	-79.3	0	0	0	0	114.1	L25 R36 T73 N74	L25-C76 HydrophobicContact CB-CB 4.08Å; L25-C76 HydrophobicContact CD1-CB 4.01Å; L25-C76 HydrophobicContact CD2-CB 3.99Å; L25-C76 HydrophobicContact CG-CB 4.22Å; R36-C76 WeakPolarHBondContact CD-O 3.42Å; R36-C76 WeakPolarHBondContact CG-O 3.45Å; R36-C76 PolarHBondContact NE-O 2.91Å; R36-C76 PolarHBondContact NH2-SG 3.23Å; R36-C76 VanDerWaalsContact NH2-SG 3.4Å; T73-C76 PolarHBondContact O-N 3.31Å; N74-C76 PolarHBondContact O-N 2.94Å
77	L	52.9	Low	57.1	Low	12 Å²	12	52.6 Å²	52.6	6%	0.063	25%	0.251	C	S	.	.	S	Bend	trans	-88.3	143.7	-177.4	-65.7	162.7	0	0	0	112.1	L25 F67	L25-L77 HydrophobicContact CD1-CD2 4.15Å; F67-L77 HydrophobicContact CD1-CD1 4.23Å; F67-L77 HydrophobicContact CE1-CD1 3.16Å; F67-L77 HydrophobicContact CE2-CD1 4.22Å; F67-L77 HydrophobicContact CZ-CD1 3.15Å; F67-L77 HydrophobicContact CZ-CD2 4.14Å; F67-L77 HydrophobicContact CZ-CG 4.25Å
78	Y	53.4	Low	58.6	Low	105 Å²	105	52.2 Å²	52.2	41%	0.412	25%	0.249	S	C	.	.			trans	-60.7	149.7	171.9	-74.1	-69.9	0	0	0	110.4	R36 Q80 S81 K82	R36-Y78 HydrophobicContact CB-CD2 4.38Å; R36-Y78 HydrophobicContact CB-CE2 4.08Å; Y78-Q80 PolarHBondContact O-N 3.44Å; Y78-Q80 VanDerWaalsContact O-N 3.15Å; Y78-S81 WeakPolarHBondContact O-CB 3.43Å; Y78-S81 PolarHBondContact O-N 3.24Å; Y78-S81 PolarHBondContact O-OG 3.14Å; Y78-K82 PolarHBondContact O-N 3.49Å
79	F	53.7	Low	60.3	Low	135 Å²	135	51.9 Å²	51.9	59%	0.592	25%	0.247	S	C	*	.	H	α-helix	trans	-51.1	-41.6	-176.3	179.9	-100.7	0	0	0	113.3	S81 K82 K83	F79-S81 VanDerWaalsContact C-N 3.34Å; F79-S81 PolarHBondContact O-N 3.4Å; F79-K82 WeakPolarHBondContact O-CB 2.98Å; F79-K82 PolarHBondContact O-N 3.36Å; F79-K83 HydrophobicContact CE1-CD 4.32Å; F79-K83 VanDerWaalsContact CE1-CE 3.5Å
80	Q	54.1	Low	62.5	Low	109 Å²	109	49.7 Å²	49.7	51%	0.509	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-38.7	179.8	-168.3	61.9	21.3	0	0	112.5	Y78 K82 K83 D84	Y78-Q80 PolarHBondContact O-N 3.44Å; Y78-Q80 VanDerWaalsContact O-N 3.15Å; Q80-K82 PolarHBondContact O-N 2.76Å; Q80-K83 PolarHBondContact O-N 3.29Å; Q80-K83 VanDerWaalsContact O-N 3.12Å; Q80-D84 PolarHBondContact O-N 3.04Å; Q80-D84 VanDerWaalsContact O-N 3.08Å
81	S	63.3	Low	64.4	Low	0 Å²	0	52 Å²	52	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-31.4	178.8	-32.1	0	0	0	0	111.8	T40 Y78 F79 K83 D84 V85	T40-S81 WeakPolarHBondContact CB-OG 2.84Å; T40-S81 VanDerWaalsContact CG2-OG 3.24Å; T40-S81 WeakPolarHBondContact CG2-OG 3.49Å; T40-S81 PolarHBondContact OG1-OG 3.39Å; Y78-S81 WeakPolarHBondContact O-CB 3.43Å; Y78-S81 PolarHBondContact O-N 3.24Å; Y78-S81 PolarHBondContact O-OG 3.14Å; F79-S81 VanDerWaalsContact C-N 3.34Å; F79-S81 PolarHBondContact O-N 3.4Å; S81-K83 VanDerWaalsContact C-N 3.34Å; S81-D84 PolarHBondContact O-N 3.05Å; S81-V85 WeakPolarHBondContact O-CB 3.34Å; S81-V85 WeakPolarHBondContact O-CG2 3.37Å; S81-V85 PolarHBondContact O-N 2.73Å
82	K	67.8	Low	66.1	Low	17 Å²	17	44.3 Å²	44.3	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-36.2	177	-63.1	170.4	170.5	-174.2	0	111.7	N74 Y78 F79 Q80 A86 E125 I126 S129	N74-K82 WeakPolarHBondContact O-CE 3.24Å; N74-K82 PolarHBondContact O-NZ 3.35Å; Y78-K82 PolarHBondContact O-N 3.49Å; F79-K82 WeakPolarHBondContact O-CB 2.98Å; F79-K82 PolarHBondContact O-N 3.36Å; Q80-K82 PolarHBondContact O-N 2.76Å; K82-A86 PolarHBondContact O-N 2.95Å; K82-E125 VanDerWaalsContact NZ-CB 3.34Å; K82-E125 IonicContact NZ-OE2 3.91Å; K82-E125 PolarHBondContact NZ-OE2 2.74Å; K82-I126 HydrophobicContact CD-CG2 3.81Å; K82-I126 HydrophobicContact CG-CG2 4.41Å; K82-S129 PolarHBondContact O-OG 3.23Å
83	K	73	Confident	68.3	Low	102 Å²	102	41.2 Å²	41.2	44%	0.443	19%	0.192	S	C	.	.	H	α-helix	trans	-71.4	-44.6	174.1	-69.3	-174	176.8	-178.9	0	111.3	F79 Q80 S81 V85 A86 L87	F79-K83 HydrophobicContact CE1-CD 4.32Å; F79-K83 VanDerWaalsContact CE1-CE 3.5Å; Q80-K83 PolarHBondContact O-N 3.29Å; Q80-K83 VanDerWaalsContact O-N 3.12Å; S81-K83 VanDerWaalsContact C-N 3.34Å; K83-V85 VanDerWaalsContact C-N 3.29Å; K83-V85 PolarHBondContact O-N 3.3Å; K83-A86 PolarHBondContact O-N 3.37Å; K83-L87 WeakPolarHBondContact O-CG 3.5Å; K83-L87 PolarHBondContact O-N 2.92Å
84	D	71.6	Confident	70.2	Confident	11 Å²	11	47.4 Å²	47.4	6%	0.059	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-38.8	178.8	-63.7	-21.9	0	0	0	111.5	C43 Q80 S81 L87 I88	C43-D84 HydrophobicContact CB-CB 4.45Å; Q80-D84 PolarHBondContact O-N 3.04Å; Q80-D84 VanDerWaalsContact O-N 3.08Å; S81-D84 PolarHBondContact O-N 3.05Å; D84-L87 PolarHBondContact O-N 2.94Å; D84-I88 WeakPolarHBondContact O-CB 3.32Å; D84-I88 WeakPolarHBondContact O-CD1 3.39Å; D84-I88 VanDerWaalsContact O-CG1 3.22Å; D84-I88 WeakPolarHBondContact O-CG1 3.44Å; D84-I88 PolarHBondContact O-N 2.86Å
85	V	74.7	Confident	71.8	Confident	9 Å²	9	49.2 Å²	49.2	6%	0.055	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-46.7	174.7	169.4	0	0	0	0	111.4	F67 S81 K83 L87 I88 F89	F67-V85 HydrophobicContact CD1-CG1 4.48Å; F67-V85 HydrophobicContact CD1-CG2 4.5Å; F67-V85 HydrophobicContact CE1-CG1 4.34Å; F67-V85 HydrophobicContact CE1-CG2 3.64Å; F67-V85 HydrophobicContact CZ-CG2 4.11Å; S81-V85 WeakPolarHBondContact O-CB 3.34Å; S81-V85 WeakPolarHBondContact O-CG2 3.37Å; S81-V85 PolarHBondContact O-N 2.73Å; K83-V85 VanDerWaalsContact C-N 3.29Å; K83-V85 PolarHBondContact O-N 3.3Å; V85-L87 VanDerWaalsContact C-N 3.32Å; V85-L87 PolarHBondContact O-N 3.34Å; V85-I88 PolarHBondContact O-N 2.98Å; V85-F89 VanDerWaalsContact O-CB 3.31Å; V85-F89 WeakPolarHBondContact O-CB 3.43Å; V85-F89 PolarHBondContact O-N 3.27Å
86	A	81.1	Confident	73.5	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-40.6	176.9	0	0	0	0	0	111.7	K82 K83 F89 N90 M133	K82-A86 PolarHBondContact O-N 2.95Å; K83-A86 PolarHBondContact O-N 3.37Å; A86-F89 PolarHBondContact O-N 3.46Å; A86-N90 WeakPolarHBondContact O-CB 3.13Å; A86-N90 PolarHBondContact O-N 2.95Å; A86-N90 PolarHBondContact O-ND2 3.45Å; A86-N90 PolarHBondContact O-OD1 3.15Å; A86-M133 HydrophobicContact CB-CG 3.91Å; A86-M133 HydrophobicContact CB-SD 4.38Å
87	L	82.4	Confident	75.2	Confident	69 Å²	69	51.9 Å²	51.9	36%	0.361	24%	0.235	S	C	.	.	H	α-helix	trans	-64.9	-44.7	176.6	-70	173.6	0	0	0	112.3	Y47 K83 D84 V85 N90 N91	Y47-L87 HydrophobicContact CD2-CB 3.89Å; Y47-L87 HydrophobicContact CE2-CB 3.53Å; Y47-L87 HydrophobicContact CE2-CD1 3.92Å; Y47-L87 HydrophobicContact CE2-CG 4.28Å; K83-L87 WeakPolarHBondContact O-CG 3.5Å; K83-L87 PolarHBondContact O-N 2.92Å; D84-L87 PolarHBondContact O-N 2.94Å; V85-L87 VanDerWaalsContact C-N 3.32Å; V85-L87 PolarHBondContact O-N 3.34Å; L87-N90 PolarHBondContact O-N 3.42Å; L87-N91 WeakPolarHBondContact O-CB 3.36Å; L87-N91 PolarHBondContact O-N 2.92Å; L87-N91 PolarHBondContact O-ND2 2.99Å
88	I	80.3	Confident	76.9	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-50.2	174.6	-70.4	163.1	0	0	0	109.9	C43 L46 Y47 L50 F62 D84 V85 N90 N91 L92	C43-I88 HydrophobicContact CB-CD1 4.42Å; C43-I88 VanDerWaalsContact O-CD1 3.32Å; C43-I88 WeakPolarHBondContact O-CD1 3.31Å; L46-I88 HydrophobicContact CB-CD1 3.94Å; Y47-I88 HydrophobicContact CD2-CG1 4.07Å; Y47-I88 HydrophobicContact CG-CG1 4.46Å; L50-I88 HydrophobicContact CD1-CB 4.17Å; L50-I88 HydrophobicContact CD1-CG1 4.12Å; L50-I88 HydrophobicContact CD1-CG2 3.52Å; F62-I88 HydrophobicContact CD1-CG2 4.31Å; F62-I88 HydrophobicContact CD2-CG2 4.5Å; F62-I88 HydrophobicContact CE1-CG2 3.67Å; F62-I88 HydrophobicContact CE2-CG2 3.89Å; F62-I88 HydrophobicContact CZ-CB 4.21Å; F62-I88 HydrophobicContact CZ-CD1 4.45Å; F62-I88 HydrophobicContact CZ-CG2 3.39Å; D84-I88 WeakPolarHBondContact O-CB 3.32Å; D84-I88 WeakPolarHBondContact O-CD1 3.39Å; D84-I88 VanDerWaalsContact O-CG1 3.22Å; D84-I88 WeakPolarHBondContact O-CG1 3.44Å; D84-I88 PolarHBondContact O-N 2.86Å; V85-I88 PolarHBondContact O-N 2.98Å; I88-N90 PolarHBondContact O-N 3.42Å; I88-N91 PolarHBondContact O-N 3.26Å; I88-L92 HydrophobicContact CG2-CD1 3.77Å; I88-L92 HydrophobicContact CG2-CG 4.27Å; I88-L92 WeakPolarHBondContact O-CB 3.34Å; I88-L92 VanDerWaalsContact O-CG 3.22Å; I88-L92 WeakPolarHBondContact O-CG 3.47Å; I88-L92 PolarHBondContact O-N 3.17Å
89	F	84.7	Confident	78.6	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-49.2	179.2	-176.8	-84.1	0	0	0	111.5	I68 V85 A86 N91 L92 L93 L107 L117 M133	I68-F89 HydrophobicContact CD1-CD2 3.96Å; I68-F89 HydrophobicContact CD1-CE2 4Å; V85-F89 VanDerWaalsContact O-CB 3.31Å; V85-F89 WeakPolarHBondContact O-CB 3.43Å; V85-F89 PolarHBondContact O-N 3.27Å; A86-F89 PolarHBondContact O-N 3.46Å; F89-N91 PolarHBondContact O-N 2.94Å; F89-L92 WeakPolarHBondContact O-CB 3.45Å; F89-L92 PolarHBondContact O-N 3.49Å; F89-L93 HydrophobicContact CE1-CD2 3.9Å; F89-L93 WeakPolarHBondContact O-CB 3.38Å; F89-L93 PolarHBondContact O-N 2.93Å; F89-L107 HydrophobicContact CE2-CD1 4.32Å; F89-L107 HydrophobicContact CE2-CD2 4.3Å; F89-L107 HydrophobicContact CZ-CD1 3.71Å; F89-L107 HydrophobicContact CZ-CD2 4.36Å; F89-L117 HydrophobicContact CE1-CD1 4.49Å; F89-L117 HydrophobicContact CZ-CD1 4.05Å; F89-M133 HydrophobicContact CB-CG 3.93Å; F89-M133 HydrophobicContact CB-SD 3.67Å; F89-M133 HydrophobicContact CD1-CB 3.67Å; F89-M133 HydrophobicContact CD1-CG 3.52Å; F89-M133 HydrophobicContact CD1-SD 3.95Å; F89-M133 HydrophobicContact CD2-SD 3.96Å; F89-M133 HydrophobicContact CE1-CB 3.78Å; F89-M133 HydrophobicContact CE1-CG 4.15Å; F89-M133 HydrophobicContact CG-CB 4.32Å; F89-M133 HydrophobicContact CG-CG 3.78Å; F89-M133 HydrophobicContact CG-SD 3.59Å; F89-M133 VanDerWaalsContact CG-SD 3.59Å
90	N	89.1	Confident	80.2	Confident	13 Å²	13	59.8 Å²	59.8	7%	0.07	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-40.3	-179.2	-66.8	-13.7	0	0	0	112.1	A86 L87 I88 L93 R94 S132 M133 E136	A86-N90 WeakPolarHBondContact O-CB 3.13Å; A86-N90 PolarHBondContact O-N 2.95Å; A86-N90 PolarHBondContact O-ND2 3.45Å; A86-N90 PolarHBondContact O-OD1 3.15Å; L87-N90 PolarHBondContact O-N 3.42Å; I88-N90 PolarHBondContact O-N 3.42Å; N90-L93 PolarHBondContact O-N 3.22Å; N90-R94 WeakPolarHBondContact O-CG 3.4Å; N90-R94 PolarHBondContact O-N 3.26Å; N90-R94 VanDerWaalsContact O-N 3.1Å; N90-S132 PolarHBondContact ND2-OG 3.45Å; N90-M133 WeakPolarHBondContact OD1-CA 3.08Å; N90-E136 HydrophobicContact CB-CB 4.43Å; N90-E136 HydrophobicContact CB-CG 4Å; N90-E136 VanDerWaalsContact OD1-CB 3.32Å; N90-E136 WeakPolarHBondContact OD1-CB 2.91Å
91	N	85.2	Confident	81.9	Confident	67 Å²	67	55.5 Å²	55.5	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-64.6	-41.9	175.4	-80.3	-60.1	0	0	0	112	L87 I88 F89 L93 R94 R95	L87-N91 WeakPolarHBondContact O-CB 3.36Å; L87-N91 PolarHBondContact O-N 2.92Å; L87-N91 PolarHBondContact O-ND2 2.99Å; I88-N91 PolarHBondContact O-N 3.26Å; F89-N91 PolarHBondContact O-N 2.94Å; N91-L93 VanDerWaalsContact C-N 3.32Å; N91-L93 PolarHBondContact O-N 3.22Å; N91-R94 PolarHBondContact O-N 2.92Å; N91-R95 PolarHBondContact O-N 3.39Å
92	L	83.9	Confident	83.1	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-41.2	175.1	-69.9	174	0	0	0	111.4	L50 C59 F62 F63 I88 F89 R95 T103	L50-L92 HydrophobicContact CD1-CD2 4.26Å; L50-L92 HydrophobicContact CD1-CG 4.26Å; L50-L92 HydrophobicContact CD2-CD2 3.79Å; C59-L92 HydrophobicContact CB-CD2 3.99Å; C59-L92 WeakPolarHBondContact SG-CD2 3.36Å; F62-L92 HydrophobicContact CB-CD1 4.29Å; F62-L92 HydrophobicContact CD1-CD1 3.6Å; F62-L92 HydrophobicContact CE1-CD1 4.1Å; F62-L92 HydrophobicContact CG-CD1 4.09Å; F63-L92 HydrophobicContact CZ-CB 4.27Å; F63-L92 HydrophobicContact CZ-CD1 4.35Å; I88-L92 HydrophobicContact CG2-CD1 3.77Å; I88-L92 HydrophobicContact CG2-CG 4.27Å; I88-L92 WeakPolarHBondContact O-CB 3.34Å; I88-L92 VanDerWaalsContact O-CG 3.22Å; I88-L92 WeakPolarHBondContact O-CG 3.47Å; I88-L92 PolarHBondContact O-N 3.17Å; F89-L92 WeakPolarHBondContact O-CB 3.45Å; F89-L92 PolarHBondContact O-N 3.49Å; L92-R95 VanDerWaalsContact O-CB 3.26Å; L92-R95 WeakPolarHBondContact O-CB 3.45Å; L92-R95 PolarHBondContact O-N 3.04Å; L92-T103 HydrophobicContact CB-CG2 4.47Å; L92-T103 VanDerWaalsContact O-CB 3.29Å; L92-T103 WeakPolarHBondContact O-CB 3.36Å; L92-T103 PolarHBondContact O-OG1 3.46Å
93	L	87.2	Confident	84	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.1	-36.2	-177.8	-170.1	58.6	0	0	0	113	F89 N90 N91 R95 T103 V104 L107 E136 C137 L143	F89-L93 HydrophobicContact CE1-CD2 3.9Å; F89-L93 WeakPolarHBondContact O-CB 3.38Å; F89-L93 PolarHBondContact O-N 2.93Å; N90-L93 PolarHBondContact O-N 3.22Å; N91-L93 VanDerWaalsContact C-N 3.32Å; N91-L93 PolarHBondContact O-N 3.22Å; L93-R95 PolarHBondContact O-N 3.04Å; L93-T103 HydrophobicContact CB-CG2 4.06Å; L93-T103 HydrophobicContact CD1-CG2 3.61Å; L93-T103 HydrophobicContact CG-CG2 4.44Å; L93-V104 HydrophobicContact CD1-CG2 3.74Å; L93-L107 HydrophobicContact CD1-CD1 3.76Å; L93-E136 HydrophobicContact CB-CG 4.38Å; L93-E136 VanDerWaalsContact CD2-C 3.45Å; L93-E136 HydrophobicContact CD2-CB 3.88Å; L93-E136 HydrophobicContact CD2-CG 3.77Å; L93-E136 HydrophobicContact CG-CG 4.37Å; L93-C137 HydrophobicContact CD2-CB 4.25Å; L93-C137 VanDerWaalsContact CD2-N 3.35Å; L93-L143 HydrophobicContact CD1-CD1 3.95Å
94	R	87.9	Confident	84.8	Confident	132 Å²	132	52.6 Å²	52.6	50%	0.498	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.5	174.6	-68.7	178.1	-172.6	179.9	9.4	114.1	N90 N91 Q96 E136	N90-R94 WeakPolarHBondContact O-CG 3.4Å; N90-R94 PolarHBondContact O-N 3.26Å; N90-R94 VanDerWaalsContact O-N 3.1Å; N91-R94 PolarHBondContact O-N 2.92Å; R94-Q96 PolarHBondContact O-N 3.36Å; R94-E136 WeakPolarHBondContact CG-OE1 3.04Å; R94-E136 IonicContact CZ-OE1 3.5Å; R94-E136 IonicContact CZ-OE2 3.47Å; R94-E136 VanDerWaalsContact NE-CD 3.26Å; R94-E136 IonicContact NE-OE1 2.73Å; R94-E136 PolarHBondContact NE-OE1 3.43Å; R94-E136 IonicContact NE-OE2 3.38Å; R94-E136 PolarHBondContact NE-OE2 2.88Å; R94-E136 IonicContact NH2-OE1 3.95Å; R94-E136 PolarHBondContact NH2-OE1 3.4Å; R94-E136 IonicContact NH2-OE2 2.76Å; R94-E136 PolarHBondContact NH2-OE2 3.39Å
95	R	84.1	Confident	85.7	Confident	64 Å²	64	55.7 Å²	55.7	24%	0.242	28%	0.281	C	S	.	.			trans	-67.7	128.3	-176.8	-175.4	-178.6	174.5	-179.3	2.5	111	C56 C59 N91 L92 L93	C56-R95 PolarHBondContact O-NH1 3.47Å; C59-R95 PolarHBondContact SG-NH1 3.24Å; N91-R95 PolarHBondContact O-N 3.39Å; L92-R95 VanDerWaalsContact O-CB 3.26Å; L92-R95 WeakPolarHBondContact O-CB 3.45Å; L92-R95 PolarHBondContact O-N 3.04Å; L93-R95 PolarHBondContact O-N 3.04Å
96	Q	85.2	Confident	86.3	Confident	133 Å²	133	58.4 Å²	58.4	62%	0.621	29%	0.291	S	S	*	.			trans	-113.8	145.4	172.5	-66.3	-179.7	-24.3	0	0	111.1	R94 R100	R94-Q96 PolarHBondContact O-N 3.36Å; Q96-R100 CarbonylContact C-O 3.57Å; Q96-R100 VanDerWaalsContact CA-O 3.3Å; Q96-R100 WeakPolarHBondContact CA-O 3.45Å
97	I	84.2	Confident	86.5	Confident	94 Å²	94	58.2 Å²	58.2	48%	0.482	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-124.3	100.6	168.4	-59	-178.9	0	0	0	106.3	M99 R100 P102	I97-M99 PolarHBondContact O-N 3.43Å; I97-R100 PolarHBondContact N-O 3.46Å; I97-R100 PolarHBondContact O-N 3.18Å; I97-R100 VanDerWaalsContact O-N 3.11Å; I97-P102 HydrophobicContact CB-CG 4.25Å; I97-P102 HydrophobicContact CD1-CG 3.65Å; I97-P102 HydrophobicContact CG1-CG 3.82Å
98	G	88	Confident	86.8	Confident	70 Å²	70	61 Å²	61	72%	0.722	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	-127.9	-165.4	0	0	0	0	0	110.3
99	M	88.4	Confident	87.2	Confident	192 Å²	192	65.3 Å²	65.3	95%	0.946	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.9	176	-61.7	-177.2	71	0	0	113.8	I97	I97-M99 PolarHBondContact O-N 3.43Å
100	R	88.4	Confident	87.1	Confident	156 Å²	156	68.4 Å²	68.4	59%	0.589	34%	0.336	S	S	*	.	B	Isolated β-bridge	trans	-90.1	147.2	-177.2	-67.7	-178.5	67.1	-178.5	2.7	110.9	Q96 I97 P102 E105	Q96-R100 CarbonylContact C-O 3.57Å; Q96-R100 VanDerWaalsContact CA-O 3.3Å; Q96-R100 WeakPolarHBondContact CA-O 3.45Å; I97-R100 PolarHBondContact N-O 3.46Å; I97-R100 PolarHBondContact O-N 3.18Å; I97-R100 VanDerWaalsContact O-N 3.11Å; R100-P102 WeakPolarHBondContact O-CD 3.28Å; R100-E105 WeakPolarHBondContact CB-OE1 3.48Å; R100-E105 IonicContact CZ-OE1 3.63Å; R100-E105 IonicContact CZ-OE2 3.38Å; R100-E105 IonicContact NE-OE1 2.84Å; R100-E105 PolarHBondContact NE-OE1 2.9Å; R100-E105 IonicContact NE-OE2 3.35Å; R100-E105 PolarHBondContact NE-OE2 3.04Å; R100-E105 IonicContact NH2-OE1 3.57Å; R100-E105 IonicContact NH2-OE2 2.65Å; R100-E105 PolarHBondContact NH2-OE2 3.39Å
101	S	90	Very high	87.1	Confident	20 Å²	20	70 Å²	70	14%	0.14	35%	0.347	C	S	.	.			trans	-115.5	87.1	173.2	-61.7	0	0	0	0	108.3	T103 V104 E105	S101-T103 PolarHBondContact O-N 3.32Å; S101-T103 VanDerWaalsContact O-N 3.13Å; S101-V104 WeakPolarHBondContact O-CB 3.36Å; S101-V104 PolarHBondContact O-N 3.33Å; S101-E105 PolarHBondContact O-N 3.43Å
102	P	87.9	Confident	87.1	Confident	44 Å²	44	71.1 Å²	71.1	29%	0.286	35%	0.35	S	S	.	.	H	α-helix	trans	-57.8	-34.6	-169.3	-24.6	32.7	0	0	0	113.5	I97 R100 Y106	I97-P102 HydrophobicContact CB-CG 4.25Å; I97-P102 HydrophobicContact CD1-CG 3.65Å; I97-P102 HydrophobicContact CG1-CG 3.82Å; R100-P102 WeakPolarHBondContact O-CD 3.28Å; P102-Y106 WeakPolarHBondContact O-CB 3.42Å; P102-Y106 PolarHBondContact O-N 2.88Å
103	T	86.2	Confident	87	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-69.1	-38.1	177.7	-57.9	0	0	0	0	112.2	F63 L92 L93 S101 Y106 L107	F63-T103 HydrophobicContact CE1-CG2 3.56Å; F63-T103 HydrophobicContact CE2-CG2 4.23Å; F63-T103 HydrophobicContact CZ-CG2 3.2Å; F63-T103 WeakPolarHBondContact CZ-OG1 3.33Å; L92-T103 HydrophobicContact CB-CG2 4.47Å; L92-T103 VanDerWaalsContact O-CB 3.29Å; L92-T103 WeakPolarHBondContact O-CB 3.36Å; L92-T103 PolarHBondContact O-OG1 3.46Å; L93-T103 HydrophobicContact CB-CG2 4.06Å; L93-T103 HydrophobicContact CD1-CG2 3.61Å; L93-T103 HydrophobicContact CG-CG2 4.44Å; S101-T103 PolarHBondContact O-N 3.32Å; S101-T103 VanDerWaalsContact O-N 3.13Å; T103-Y106 PolarHBondContact O-N 3.31Å; T103-L107 HydrophobicContact CG2-CD1 4.28Å; T103-L107 HydrophobicContact CG2-CG 4.49Å; T103-L107 WeakPolarHBondContact O-CB 3.46Å; T103-L107 WeakPolarHBondContact O-CG 3.42Å; T103-L107 PolarHBondContact O-N 3.41Å
104	V	91	Very high	87	Confident	13 Å²	13	71.5 Å²	71.5	8%	0.079	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-48.1	175.1	173	0	0	0	0	109.7	L93 S101 Y106 L107 Y108 H140 L143	L93-V104 HydrophobicContact CD1-CG2 3.74Å; S101-V104 WeakPolarHBondContact O-CB 3.36Å; S101-V104 PolarHBondContact O-N 3.33Å; V104-Y106 VanDerWaalsContact C-N 3.29Å; V104-Y106 PolarHBondContact O-N 3.31Å; V104-L107 PolarHBondContact O-N 2.67Å; V104-Y108 WeakPolarHBondContact O-CB 3.32Å; V104-Y108 PolarHBondContact O-N 2.89Å; V104-H140 HydrophobicContact CG1-CB 4.21Å; V104-H140 HydrophobicContact CG2-CB 4Å; V104-H140 VanDerWaalsContact CG2-CG 3.47Å; V104-H140 WeakPolarHBondContact CG2-ND1 3.46Å; V104-L143 HydrophobicContact CG1-CD1 4.26Å; V104-L143 HydrophobicContact CG1-CD2 4.32Å; V104-L143 HydrophobicContact CG1-CG 3.99Å; V104-L143 HydrophobicContact CG2-CD1 4.32Å
105	E	90.3	Very high	87	Confident	75 Å²	75	67.1 Å²	67.1	35%	0.35	34%	0.339	S	S	.	.	H	α-helix	trans	-59.2	-41.4	176.5	-65	171.6	-171.8	0	0	111.5	R100 S101 Y108	R100-E105 WeakPolarHBondContact CB-OE1 3.48Å; R100-E105 IonicContact CZ-OE1 3.63Å; R100-E105 IonicContact CZ-OE2 3.38Å; R100-E105 IonicContact NE-OE1 2.84Å; R100-E105 PolarHBondContact NE-OE1 2.9Å; R100-E105 IonicContact NE-OE2 3.35Å; R100-E105 PolarHBondContact NE-OE2 3.04Å; R100-E105 IonicContact NH2-OE1 3.57Å; R100-E105 IonicContact NH2-OE2 2.65Å; R100-E105 PolarHBondContact NH2-OE2 3.39Å; S101-E105 PolarHBondContact O-N 3.43Å; E105-Y108 WeakPolarHBondContact O-CB 3.27Å; E105-Y108 PolarHBondContact O-N 3.28Å
106	Y	86	Confident	87	Confident	66 Å²	66	65 Å²	65	26%	0.259	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-52.3	175.7	-179.9	-90.2	0	0	0	112.2	F63 P102 T103 V104 Y108 T109 K110	F63-Y106 HydrophobicContact CB-CD1 3.66Å; F63-Y106 HydrophobicContact CB-CD2 4.12Å; F63-Y106 HydrophobicContact CB-CE1 3.33Å; F63-Y106 HydrophobicContact CB-CE2 3.8Å; F63-Y106 HydrophobicContact CB-CG 4.06Å; F63-Y106 VanDerWaalsContact CB-CZ 3.42Å; F63-Y106 AromaticContact CD1-CD1 3.21Å; F63-Y106 HydrophobicContact CD1-CD1 3.21Å; F63-Y106 AromaticContact CD1-CE1 3.51Å; F63-Y106 HydrophobicContact CD1-CE1 3.51Å; F63-Y106 HydrophobicContact CD1-CG 4.01Å; F63-Y106 HydrophobicContact CD2-CD1 4.07Å; F63-Y106 HydrophobicContact CD2-CD2 4.49Å; F63-Y106 HydrophobicContact CD2-CG 4.04Å; F63-Y106 HydrophobicContact CE1-CD1 4Å; F63-Y106 AromaticContact CG-CD1 3.34Å; F63-Y106 HydrophobicContact CG-CD1 3.34Å; F63-Y106 HydrophobicContact CG-CD2 4.23Å; F63-Y106 AromaticContact CG-CE1 3.55Å; F63-Y106 HydrophobicContact CG-CE1 3.55Å; F63-Y106 HydrophobicContact CG-CE2 4.38Å; F63-Y106 AromaticContact CG-CG 3.73Å; F63-Y106 HydrophobicContact CG-CG 3.73Å; F63-Y106 PolarHBondContact O-OH 3.05Å; P102-Y106 WeakPolarHBondContact O-CB 3.42Å; P102-Y106 PolarHBondContact O-N 2.88Å; T103-Y106 PolarHBondContact O-N 3.31Å; V104-Y106 VanDerWaalsContact C-N 3.29Å; V104-Y106 PolarHBondContact O-N 3.31Å; Y106-Y108 PolarHBondContact O-N 3.32Å; Y106-T109 PolarHBondContact O-N 3.46Å; Y106-T109 PolarHBondContact O-OG1 3.15Å; Y106-K110 HydrophobicContact CD1-CG 4.42Å; Y106-K110 HydrophobicContact CE1-CB 4.35Å; Y106-K110 HydrophobicContact CE1-CG 3.68Å; Y106-K110 HydrophobicContact CE2-CG 4.42Å
107	L	85.4	Confident	87.1	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-31.8	-179.2	-73	177.2	0	0	0	112.1	F89 L93 T103 V104 T109 K110 V113 L143	F89-L107 HydrophobicContact CE2-CD1 4.32Å; F89-L107 HydrophobicContact CE2-CD2 4.3Å; F89-L107 HydrophobicContact CZ-CD1 3.71Å; F89-L107 HydrophobicContact CZ-CD2 4.36Å; L93-L107 HydrophobicContact CD1-CD1 3.76Å; T103-L107 HydrophobicContact CG2-CD1 4.28Å; T103-L107 HydrophobicContact CG2-CG 4.49Å; T103-L107 WeakPolarHBondContact O-CB 3.46Å; T103-L107 WeakPolarHBondContact O-CG 3.42Å; T103-L107 PolarHBondContact O-N 3.41Å; V104-L107 PolarHBondContact O-N 2.67Å; L107-T109 PolarHBondContact O-N 3.31Å; L107-K110 CarbonylContact O-C 3.33Å; L107-K110 WeakPolarHBondContact O-CA 3.41Å; L107-K110 PolarHBondContact O-N 3.1Å; L107-V113 HydrophobicContact CD2-CB 4.2Å; L107-V113 HydrophobicContact CD2-CG1 3.86Å; L107-L143 HydrophobicContact CB-CD1 4.35Å; L107-L143 HydrophobicContact CB-CD2 3.84Å; L107-L143 HydrophobicContact CD1-CD1 3.99Å
108	Y	90.1	Very high	87.5	Confident	127 Å²	127	54.2 Å²	54.2	50%	0.498	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-28.2	174.2	-163	-90.2	0	0	0	112.5	V104 E105 Y106 K110 P142 M146	V104-Y108 WeakPolarHBondContact O-CB 3.32Å; V104-Y108 PolarHBondContact O-N 2.89Å; E105-Y108 WeakPolarHBondContact O-CB 3.27Å; E105-Y108 PolarHBondContact O-N 3.28Å; Y106-Y108 PolarHBondContact O-N 3.32Å; Y108-K110 VanDerWaalsContact C-N 3.28Å; Y108-P142 HydrophobicContact CD2-CB 4.11Å; Y108-P142 HydrophobicContact CE2-CB 4.23Å; Y108-M146 HydrophobicContact CD1-CE 3.96Å; Y108-M146 HydrophobicContact CD2-CE 3.46Å; Y108-M146 VanDerWaalsContact CD2-CE 3.46Å; Y108-M146 HydrophobicContact CD2-SD 4.49Å; Y108-M146 HydrophobicContact CE1-CE 4.03Å; Y108-M146 HydrophobicContact CE2-CE 3.55Å; Y108-M146 HydrophobicContact CG-CE 3.68Å; Y108-M146 WeakPolarHBondContact O-CE 3.41Å
109	T	88	Confident	87.5	Confident	91 Å²	91	54.5 Å²	54.5	56%	0.558	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	0.7	174	70.4	0	0	0	0	113.8	Y106 L107	Y106-T109 PolarHBondContact O-N 3.46Å; Y106-T109 PolarHBondContact O-OG1 3.15Å; L107-T109 PolarHBondContact O-N 3.31Å
110	K	82.5	Confident	87.4	Confident	72 Å²	72	45.6 Å²	45.6	31%	0.313	22%	0.221	S	C	.	.			trans	-137.1	61.1	-170.7	-63.3	-66.5	172.3	-167.1	0	112.5	Y106 L107 Y108 E112 V113	Y106-K110 HydrophobicContact CD1-CG 4.42Å; Y106-K110 HydrophobicContact CE1-CB 4.35Å; Y106-K110 HydrophobicContact CE1-CG 3.68Å; Y106-K110 HydrophobicContact CE2-CG 4.42Å; L107-K110 CarbonylContact O-C 3.33Å; L107-K110 WeakPolarHBondContact O-CA 3.41Å; L107-K110 PolarHBondContact O-N 3.1Å; Y108-K110 VanDerWaalsContact C-N 3.28Å; K110-E112 VanDerWaalsContact CA-OE2 3.27Å; K110-E112 WeakPolarHBondContact CA-OE2 3.32Å; K110-E112 WeakPolarHBondContact CD-OE1 3.42Å; K110-E112 IonicContact NZ-OE1 3.74Å; K110-E112 PolarHBondContact O-N 3.07Å; K110-E112 VanDerWaalsContact O-N 3.1Å; K110-V113 HydrophobicContact CB-CG2 4.04Å; K110-V113 PolarHBondContact O-N 3.3Å
111	P	89.1	Confident	87.5	Confident	47 Å²	47	38.6 Å²	38.6	31%	0.305	19%	0.194	S	C	.	.	H	α-helix	trans	-55.8	-28.9	-179.5	24.7	-35.2	0	0	0	113.3	V113 L114 I115 M146 F150	P111-V113 PolarHBondContact O-N 2.82Å; P111-L114 PolarHBondContact O-N 3.33Å; P111-L114 VanDerWaalsContact O-N 3.08Å; P111-I115 WeakPolarHBondContact O-CG1 3.32Å; P111-I115 PolarHBondContact O-N 3.04Å; P111-M146 HydrophobicContact CB-SD 4.14Å; P111-F150 HydrophobicContact CB-CE1 3.99Å; P111-F150 HydrophobicContact CB-CZ 3.66Å
112	E	84.8	Confident	87.4	Confident	90 Å²	90	41.7 Å²	41.7	42%	0.421	21%	0.206	S	C	.	.	H	α-helix	trans	-58	-29.4	177.7	66.4	-86.5	-156.2	0	0	113.6	K110 A116	K110-E112 VanDerWaalsContact CA-OE2 3.27Å; K110-E112 WeakPolarHBondContact CA-OE2 3.32Å; K110-E112 WeakPolarHBondContact CD-OE1 3.42Å; K110-E112 IonicContact NZ-OE1 3.74Å; K110-E112 PolarHBondContact O-N 3.07Å; K110-E112 VanDerWaalsContact O-N 3.1Å; E112-A116 WeakPolarHBondContact O-CB 3.4Å; E112-A116 PolarHBondContact O-N 3.39Å
113	V	81.8	Confident	87.2	Confident	13 Å²	13	41.4 Å²	41.4	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-70.9	-43.9	177.3	178.4	0	0	0	0	110.1	I68 L107 K110 P111 A116 L117	I68-V113 HydrophobicContact CD1-CG1 4.16Å; L107-V113 HydrophobicContact CD2-CB 4.2Å; L107-V113 HydrophobicContact CD2-CG1 3.86Å; K110-V113 HydrophobicContact CB-CG2 4.04Å; K110-V113 PolarHBondContact O-N 3.3Å; P111-V113 PolarHBondContact O-N 2.82Å; V113-A116 PolarHBondContact O-N 2.87Å; V113-L117 WeakPolarHBondContact O-CG 3.29Å; V113-L117 PolarHBondContact O-N 2.87Å
114	L	87.7	Confident	87.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-41.8	179.2	-59.5	177.7	0	0	0	111	P111 A116 L117 I118 C137 L143 M146 I147 F150	P111-L114 PolarHBondContact O-N 3.33Å; P111-L114 VanDerWaalsContact O-N 3.08Å; L114-A116 VanDerWaalsContact C-N 3.32Å; L114-A116 PolarHBondContact O-N 3.24Å; L114-L117 WeakPolarHBondContact O-CB 3.48Å; L114-L117 PolarHBondContact O-N 3.32Å; L114-I118 WeakPolarHBondContact O-CG1 3.36Å; L114-I118 PolarHBondContact O-N 3.48Å; L114-C137 HydrophobicContact CD2-CB 4.22Å; L114-L143 HydrophobicContact CD1-CD2 4.28Å; L114-M146 HydrophobicContact CD1-CB 4.48Å; L114-M146 HydrophobicContact CD1-CG 4.06Å; L114-M146 HydrophobicContact CD1-SD 3.62Å; L114-I147 HydrophobicContact CB-CG1 4.27Å; L114-I147 HydrophobicContact CD1-CG1 4.05Å; L114-I147 HydrophobicContact CD2-CD1 4.44Å; L114-F150 HydrophobicContact CB-CE2 3.75Å; L114-F150 HydrophobicContact CB-CZ 4.42Å; L114-F150 HydrophobicContact CD1-CE2 4.29Å; L114-F150 HydrophobicContact CD1-CZ 4.5Å
115	I	88	Confident	86.8	Confident	40 Å²	40	49.2 Å²	49.2	21%	0.205	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-43.3	174	-68	169.2	0	0	0	110.8	P111 L117 I118 K119 F150 E152	P111-I115 WeakPolarHBondContact O-CG1 3.32Å; P111-I115 PolarHBondContact O-N 3.04Å; I115-L117 VanDerWaalsContact C-N 3.34Å; I115-L117 PolarHBondContact O-N 2.84Å; I115-I118 PolarHBondContact O-N 3.29Å; I115-K119 HydrophobicContact CG2-CD 4.08Å; I115-K119 PolarHBondContact O-N 2.88Å; I115-F150 HydrophobicContact CD1-CD1 4.43Å; I115-F150 HydrophobicContact CD1-CE1 4.35Å; I115-F150 HydrophobicContact CD1-CZ 4.43Å; I115-F150 HydrophobicContact CG1-CD1 4.42Å; I115-F150 HydrophobicContact CG1-CD2 3.86Å; I115-F150 HydrophobicContact CG1-CE1 4.42Å; I115-F150 HydrophobicContact CG1-CE2 3.88Å; I115-F150 HydrophobicContact CG1-CG 4.14Å; I115-F150 HydrophobicContact CG1-CZ 4.14Å; I115-E152 HydrophobicContact CG2-CG 4.11Å; I115-E152 WeakPolarHBondContact CG2-OE1 3.3Å
116	A	83	Confident	86.3	Confident	19 Å²	19	46.1 Å²	46.1	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-36	176.8	0	0	0	0	0	112.9	I68 C69 E112 V113 L114 I118 K119 G120	I68-A116 HydrophobicContact CG2-CB 4.29Å; C69-A116 HydrophobicContact CB-CB 4.04Å; C69-A116 WeakPolarHBondContact SG-CB 3.4Å; E112-A116 WeakPolarHBondContact O-CB 3.4Å; E112-A116 PolarHBondContact O-N 3.39Å; V113-A116 PolarHBondContact O-N 2.87Å; L114-A116 VanDerWaalsContact C-N 3.32Å; L114-A116 PolarHBondContact O-N 3.24Å; A116-I118 VanDerWaalsContact C-N 3.34Å; A116-K119 PolarHBondContact O-N 3.46Å; A116-G120 PolarHBondContact O-N 2.93Å
117	L	88.7	Confident	86.3	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-40.7	172.8	-69.6	176.6	0	0	0	111.7	I68 F89 V113 L114 I115 G120 C130 M133 L134	I68-L117 HydrophobicContact CG2-CD2 3.71Å; I68-L117 HydrophobicContact CG2-CG 4.2Å; F89-L117 HydrophobicContact CE1-CD1 4.49Å; F89-L117 HydrophobicContact CZ-CD1 4.05Å; V113-L117 WeakPolarHBondContact O-CG 3.29Å; V113-L117 PolarHBondContact O-N 2.87Å; L114-L117 WeakPolarHBondContact O-CB 3.48Å; L114-L117 PolarHBondContact O-N 3.32Å; I115-L117 VanDerWaalsContact C-N 3.34Å; I115-L117 PolarHBondContact O-N 2.84Å; L117-G120 PolarHBondContact O-N 3.03Å; L117-C130 HydrophobicContact CD2-CB 4.46Å; L117-C130 WeakPolarHBondContact O-CB 3.16Å; L117-M133 HydrophobicContact CD1-CB 4.07Å; L117-M133 HydrophobicContact CD2-CB 3.85Å; L117-M133 HydrophobicContact CD2-CE 3.54Å; L117-M133 HydrophobicContact CD2-SD 4.05Å; L117-L134 HydrophobicContact CB-CB 4.41Å; L117-L134 HydrophobicContact CB-CD1 4.36Å
118	I	91.7	Very high	86.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-48	176	-60.7	163.8	0	0	0	110.8	L114 I115 A116 G120 Y121 L134 I147 F150 E152 F156 Y159	L114-I118 WeakPolarHBondContact O-CG1 3.36Å; L114-I118 PolarHBondContact O-N 3.48Å; I115-I118 PolarHBondContact O-N 3.29Å; A116-I118 VanDerWaalsContact C-N 3.34Å; I118-G120 PolarHBondContact O-N 3.28Å; I118-Y121 PolarHBondContact O-N 2.93Å; I118-L134 HydrophobicContact CG1-CD1 4.29Å; I118-L134 HydrophobicContact CG1-CD2 3.75Å; I118-I147 HydrophobicContact CD1-CG2 3.97Å; I118-F150 HydrophobicContact CD1-CD2 3.99Å; I118-E152 HydrophobicContact CB-CB 4.39Å; I118-E152 HydrophobicContact CD1-CB 4.1Å; I118-E152 HydrophobicContact CG2-CB 3.87Å; I118-F156 HydrophobicContact CG2-CE2 3.94Å; I118-Y159 HydrophobicContact CG2-CE2 4.11Å; I118-Y159 WeakPolarHBondContact O-CE2 3.5Å
119	K	88.2	Confident	86.3	Confident	77 Å²	77	41.3 Å²	41.3	34%	0.335	22%	0.221	S	C	.	.	H	α-helix	trans	-66.8	-13.9	177	-67.7	179.8	-177.7	163.9	0	113.1	I115 A116 Y121 E122 E152	I115-K119 HydrophobicContact CG2-CD 4.08Å; I115-K119 PolarHBondContact O-N 2.88Å; A116-K119 PolarHBondContact O-N 3.46Å; K119-Y121 PolarHBondContact O-N 3.35Å; K119-E122 VanDerWaalsContact O-CB 3.26Å; K119-E122 WeakPolarHBondContact O-CB 3.35Å; K119-E122 WeakPolarHBondContact O-CG 3.08Å; K119-E122 PolarHBondContact O-N 2.92Å; K119-E152 VanDerWaalsContact CE-CG 3.5Å; K119-E152 VanDerWaalsContact CE-OE1 3.23Å; K119-E152 WeakPolarHBondContact CE-OE1 3.36Å; K119-E152 HydrophobicContact CG-CG 4.48Å; K119-E152 IonicContact NZ-OE1 2.83Å; K119-E152 PolarHBondContact NZ-OE1 2.9Å
120	G	86.1	Confident	86.4	Confident	4 Å²	4	37.1 Å²	37.1	4%	0.041	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-58.7	-25.7	173.3	0	0	0	0	0	113.8	A116 L117 I118 E122 V123	A116-G120 PolarHBondContact O-N 2.93Å; L117-G120 PolarHBondContact O-N 3.03Å; I118-G120 PolarHBondContact O-N 3.28Å; G120-E122 PolarHBondContact O-N 3.13Å; G120-V123 PolarHBondContact O-N 2.97Å; G120-V123 VanDerWaalsContact O-N 3.13Å
121	Y	90.4	Very high	86.8	Confident	9 Å²	9	33.7 Å²	33.7	4%	0.035	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-65.9	-19.3	173.2	-82.4	-74.2	0	0	0	113.8	I118 K119 V123 A127 G131 F156 Y159 V167 D170 A171 T174	I118-Y121 PolarHBondContact O-N 2.93Å; K119-Y121 PolarHBondContact O-N 3.35Å; Y121-V123 PolarHBondContact O-N 3.35Å; Y121-A127 HydrophobicContact CD1-CB 3.94Å; Y121-A127 HydrophobicContact CE1-CB 4.38Å; Y121-G131 VanDerWaalsContact OH-CA 3.25Å; Y121-G131 WeakPolarHBondContact OH-CA 3.39Å; Y121-F156 HydrophobicContact CD2-CE1 4.04Å; Y121-F156 HydrophobicContact CD2-CZ 4.24Å; Y121-F156 AromaticContact CE2-CE1 3.71Å; Y121-F156 HydrophobicContact CE2-CE1 3.71Å; Y121-F156 AromaticContact CE2-CZ 3.99Å; Y121-F156 HydrophobicContact CE2-CZ 3.99Å; Y121-Y159 HydrophobicContact CD2-CD2 4.19Å; Y121-Y159 HydrophobicContact CD2-CE2 4.46Å; Y121-Y159 HydrophobicContact CG-CD2 4.01Å; Y121-Y159 HydrophobicContact CG-CE2 4.43Å; Y121-Y159 HydrophobicContact CG-CG 4.39Å; Y121-V167 HydrophobicContact CD1-CG1 3.88Å; Y121-D170 HydrophobicContact CE1-CB 4.38Å; Y121-D170 VanDerWaalsContact OH-C 3.31Å; Y121-D170 PolarHBondContact OH-O 3.47Å; Y121-D170 PolarHBondContact OH-OD2 3.3Å; Y121-D170 VanDerWaalsContact OH-OD2 3.12Å; Y121-A171 HydrophobicContact CD1-CB 3.8Å; Y121-A171 VanDerWaalsContact CE1-CA 3.47Å; Y121-A171 HydrophobicContact CE1-CB 3.59Å; Y121-A171 HydrophobicContact CG-CB 4.43Å; Y121-A171 WeakPolarHBondContact OH-CA 3.42Å; Y121-A171 PolarHBondContact OH-N 3.19Å; Y121-T174 PolarHBondContact OH-OG1 3.38Å
122	E	88.4	Confident	87	Confident	85 Å²	85	33.4 Å²	33.4	40%	0.397	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-68	-14.2	172.5	-61.1	173.9	-165.5	0	0	112.8	R71 K119 G120 Y159	R71-E122 IonicContact CZ-OE2 3.81Å; R71-E122 IonicContact NH1-OE2 3.12Å; R71-E122 PolarHBondContact NH1-OE2 3.1Å; R71-E122 VanDerWaalsContact NH1-OE2 3.13Å; R71-E122 IonicContact NH2-OE2 2.64Å; R71-E122 PolarHBondContact NH2-OE2 3.18Å; K119-E122 VanDerWaalsContact O-CB 3.26Å; K119-E122 WeakPolarHBondContact O-CB 3.35Å; K119-E122 WeakPolarHBondContact O-CG 3.08Å; K119-E122 PolarHBondContact O-N 2.92Å; G120-E122 PolarHBondContact O-N 3.13Å; E122-Y159 HydrophobicContact CG-CE1 4.09Å
123	V	84.5	Confident	87.2	Confident	39 Å²	39	29.4 Å²	29.4	24%	0.236	16%	0.161	C	C	.	.	S	Bend	trans	-123	98	-175.8	-177.7	0	0	0	0	109.2	G120 Y121 E125 I126 A127	G120-V123 PolarHBondContact O-N 2.97Å; G120-V123 VanDerWaalsContact O-N 3.13Å; Y121-V123 PolarHBondContact O-N 3.35Å; V123-E125 PolarHBondContact O-N 3.03Å; V123-I126 HydrophobicContact CB-CD1 4.1Å; V123-I126 HydrophobicContact CB-CG1 3.83Å; V123-I126 HydrophobicContact CG1-CD1 4.34Å; V123-I126 HydrophobicContact CG1-CG1 3.98Å; V123-I126 WeakPolarHBondContact O-CG1 3.4Å; V123-I126 PolarHBondContact O-N 3.31Å; V123-A127 PolarHBondContact O-N 3.23Å
124	A	86	Confident	87.8	Confident	58 Å²	58	28.8 Å²	28.8	48%	0.479	16%	0.158	S	C	.	.	H	α-helix	trans	-49.2	-38.3	-174.3	0	0	0	0	0	113.9	I126 A127 V167	A124-I126 PolarHBondContact O-N 3.42Å; A124-A127 PolarHBondContact O-N 2.66Å; A124-V167 HydrophobicContact CB-CG2 4.18Å
125	E	81.2	Confident	88.2	Confident	119 Å²	119	31.4 Å²	31.4	56%	0.556	17%	0.167	S	C	*	.	H	α-helix	trans	-66.1	-18.8	-177.9	-54.9	174.5	-177.8	0	0	115.3	K82 V123	K82-E125 VanDerWaalsContact NZ-CB 3.34Å; K82-E125 IonicContact NZ-OE2 3.91Å; K82-E125 PolarHBondContact NZ-OE2 2.74Å; V123-E125 PolarHBondContact O-N 3.03Å
126	I	79.9	Confident	88.5	Confident	11 Å²	11	30 Å²	30	6%	0.056	16%	0.16	C	C	.	.	H	α-helix	trans	-120.3	-8.9	179	64	174.6	0	0	0	112.8	N74 K82 V123 A124 H128 S129 C130	N74-I126 HydrophobicContact CB-CD1 4Å; N74-I126 HydrophobicContact CB-CG2 3.91Å; N74-I126 WeakPolarHBondContact ND2-CD1 3.44Å; K82-I126 HydrophobicContact CD-CG2 3.81Å; K82-I126 HydrophobicContact CG-CG2 4.41Å; V123-I126 HydrophobicContact CB-CD1 4.1Å; V123-I126 HydrophobicContact CB-CG1 3.83Å; V123-I126 HydrophobicContact CG1-CD1 4.34Å; V123-I126 HydrophobicContact CG1-CG1 3.98Å; V123-I126 WeakPolarHBondContact O-CG1 3.4Å; V123-I126 PolarHBondContact O-N 3.31Å; A124-I126 PolarHBondContact O-N 3.42Å; I126-H128 VanDerWaalsContact C-N 3.28Å; I126-H128 PolarHBondContact O-N 3.11Å; I126-S129 WeakPolarHBondContact O-CB 3.18Å; I126-S129 PolarHBondContact O-N 2.64Å; I126-C130 PolarHBondContact O-N 3.48Å
127	A	87.1	Confident	89.1	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-50.3	-46.9	-172.6	0	0	0	0	0	112.3	Y121 V123 A124 S129 C130 G131 V167	Y121-A127 HydrophobicContact CD1-CB 3.94Å; Y121-A127 HydrophobicContact CE1-CB 4.38Å; V123-A127 PolarHBondContact O-N 3.23Å; A124-A127 PolarHBondContact O-N 2.66Å; A127-S129 PolarHBondContact O-N 3.28Å; A127-C130 CarbonylContact O-C 3.59Å; A127-C130 WeakPolarHBondContact O-CB 3.46Å; A127-C130 PolarHBondContact O-N 3.26Å; A127-G131 PolarHBondContact O-N 3.39Å; A127-V167 HydrophobicContact CB-CB 4.46Å; A127-V167 HydrophobicContact CB-CG1 3.73Å; A127-V167 HydrophobicContact CB-CG2 4.05Å
128	H	90.2	Very high	89.5	Confident	76 Å²	76	29 Å²	29	35%	0.352	15%	0.152	S	C	.	.	H	α-helix	trans	-63.6	-40	177.7	-68.6	-37.1	0	0	0	114.8	I126 C130 G131 S132 E166 D170	I126-H128 VanDerWaalsContact C-N 3.28Å; I126-H128 PolarHBondContact O-N 3.11Å; H128-C130 VanDerWaalsContact C-N 3.34Å; H128-G131 PolarHBondContact O-N 2.88Å; H128-S132 WeakPolarHBondContact O-CB 3.39Å; H128-S132 PolarHBondContact O-N 3.2Å; H128-E166 PolarHBondContact CE1-O 3.39Å; H128-E166 IonicContact NE2-OE2 3.56Å; H128-D170 WeakPolarHBondContact CA-OD2 3.29Å; H128-D170 WeakPolarHBondContact ND1-CB 3.37Å; H128-D170 VanDerWaalsContact ND1-CG 3.34Å; H128-D170 IonicContact ND1-OD2 3.66Å; H128-D170 PolarHBondContact ND1-OD2 3.06Å
129	S	85.9	Confident	89.8	Confident	17 Å²	17	34.5 Å²	34.5	12%	0.119	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-43	175.6	-70.8	0	0	0	0	110.3	K82 I126 A127 S132 M133	K82-S129 PolarHBondContact O-OG 3.23Å; I126-S129 WeakPolarHBondContact O-CB 3.18Å; I126-S129 PolarHBondContact O-N 2.64Å; A127-S129 PolarHBondContact O-N 3.28Å; S129-S132 PolarHBondContact O-N 3.14Å; S129-M133 WeakPolarHBondContact O-CE 3.27Å; S129-M133 WeakPolarHBondContact O-CG 3.48Å; S129-M133 PolarHBondContact O-N 3.01Å
130	C	88.2	Confident	90.1	Very high	4 Å²	4	32.6 Å²	32.6	3%	0.027	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-45	175.2	-70.1	0	0	0	0	112	L117 I126 A127 H128 S132 M133 L134	L117-C130 HydrophobicContact CD2-CB 4.46Å; L117-C130 WeakPolarHBondContact O-CB 3.16Å; I126-C130 PolarHBondContact O-N 3.48Å; A127-C130 CarbonylContact O-C 3.59Å; A127-C130 WeakPolarHBondContact O-CB 3.46Å; A127-C130 PolarHBondContact O-N 3.26Å; H128-C130 VanDerWaalsContact C-N 3.34Å; C130-S132 PolarHBondContact O-N 3.39Å; C130-M133 PolarHBondContact O-N 2.73Å; C130-L134 WeakPolarHBondContact O-CB 3.33Å; C130-L134 PolarHBondContact O-N 3.41Å
131	G	92	Very high	90.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-43.7	175.2	0	0	0	0	0	112.5	Y121 A127 H128 L134 R135	Y121-G131 VanDerWaalsContact OH-CA 3.25Å; Y121-G131 WeakPolarHBondContact OH-CA 3.39Å; A127-G131 PolarHBondContact O-N 3.39Å; H128-G131 PolarHBondContact O-N 2.88Å; G131-L134 PolarHBondContact O-N 3.43Å; G131-R135 WeakPolarHBondContact O-CB 3.36Å; G131-R135 WeakPolarHBondContact O-CG 3.36Å; G131-R135 PolarHBondContact O-N 3.5Å
132	S	92.5	Very high	91	Very high	40 Å²	40	39.2 Å²	39.2	28%	0.28	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-47.7	175.5	178.9	0	0	0	0	112.6	N90 H128 S129 C130 E136	N90-S132 PolarHBondContact ND2-OG 3.45Å; H128-S132 WeakPolarHBondContact O-CB 3.39Å; H128-S132 PolarHBondContact O-N 3.2Å; S129-S132 PolarHBondContact O-N 3.14Å; C130-S132 PolarHBondContact O-N 3.39Å; S132-E136 PolarHBondContact O-N 3.49Å; S132-E136 VanDerWaalsContact O-N 3.1Å
133	M	90.1	Very high	91.4	Very high	7 Å²	7	35.2 Å²	35.2	3%	0.034	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-43.3	177.4	-71.7	-174.4	-76.6	0	0	111.5	I68 A86 F89 N90 L117 S129 C130 E136 C137	I68-M133 HydrophobicContact CD1-SD 4.35Å; A86-M133 HydrophobicContact CB-CG 3.91Å; A86-M133 HydrophobicContact CB-SD 4.38Å; F89-M133 HydrophobicContact CB-CG 3.93Å; F89-M133 HydrophobicContact CB-SD 3.67Å; F89-M133 HydrophobicContact CD1-CB 3.67Å; F89-M133 HydrophobicContact CD1-CG 3.52Å; F89-M133 HydrophobicContact CD1-SD 3.95Å; F89-M133 HydrophobicContact CD2-SD 3.96Å; F89-M133 HydrophobicContact CE1-CB 3.78Å; F89-M133 HydrophobicContact CE1-CG 4.15Å; F89-M133 HydrophobicContact CG-CB 4.32Å; F89-M133 HydrophobicContact CG-CG 3.78Å; F89-M133 HydrophobicContact CG-SD 3.59Å; F89-M133 VanDerWaalsContact CG-SD 3.59Å; N90-M133 WeakPolarHBondContact OD1-CA 3.08Å; L117-M133 HydrophobicContact CD1-CB 4.07Å; L117-M133 HydrophobicContact CD2-CB 3.85Å; L117-M133 HydrophobicContact CD2-CE 3.54Å; L117-M133 HydrophobicContact CD2-SD 4.05Å; S129-M133 WeakPolarHBondContact O-CE 3.27Å; S129-M133 WeakPolarHBondContact O-CG 3.48Å; S129-M133 PolarHBondContact O-N 3.01Å; C130-M133 PolarHBondContact O-N 2.73Å; M133-E136 PolarHBondContact O-N 2.9Å; M133-C137 PolarHBondContact O-N 2.76Å; M133-C137 PolarHBondContact O-SG 3.19Å; M133-C137 VanDerWaalsContact O-SG 3.33Å
134	L	93.4	Very high	92	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-44.1	-179.9	-172	57	0	0	0	111.5	L117 I118 C130 G131 E136 C137 V138 I147 F156 T174	L117-L134 HydrophobicContact CB-CB 4.41Å; L117-L134 HydrophobicContact CB-CD1 4.36Å; I118-L134 HydrophobicContact CG1-CD1 4.29Å; I118-L134 HydrophobicContact CG1-CD2 3.75Å; C130-L134 WeakPolarHBondContact O-CB 3.33Å; C130-L134 PolarHBondContact O-N 3.41Å; G131-L134 PolarHBondContact O-N 3.43Å; L134-E136 VanDerWaalsContact C-N 3.29Å; L134-E136 PolarHBondContact O-N 3.39Å; L134-C137 WeakPolarHBondContact O-CB 3.24Å; L134-C137 PolarHBondContact O-N 2.91Å; L134-C137 VanDerWaalsContact O-N 3.11Å; L134-V138 VanDerWaalsContact O-CG2 3.26Å; L134-V138 WeakPolarHBondContact O-CG2 3.34Å; L134-V138 PolarHBondContact O-N 3.24Å; L134-I147 HydrophobicContact CD1-CD1 3.58Å; L134-I147 HydrophobicContact CD1-CG1 4.28Å; L134-F156 HydrophobicContact CD2-CE2 4.4Å; L134-F156 HydrophobicContact CD2-CZ 3.82Å; L134-T174 HydrophobicContact CB-CG2 4.37Å; L134-T174 HydrophobicContact CD2-CG2 3.71Å; L134-T174 HydrophobicContact CG-CG2 3.94Å
135	R	97.1	Very high	92.6	Very high	54 Å²	54	35.4 Å²	35.4	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-36	174.4	-75.3	-172.3	-61.2	-92.4	9.1	112.6	G131 V138 R139 D170 T174 E177	G131-R135 WeakPolarHBondContact O-CB 3.36Å; G131-R135 WeakPolarHBondContact O-CG 3.36Å; G131-R135 PolarHBondContact O-N 3.5Å; R135-V138 PolarHBondContact O-N 2.89Å; R135-R139 PolarHBondContact O-N 3.45Å; R135-D170 IonicContact CZ-OD1 3.45Å; R135-D170 PolarHBondContact NH1-O 3.14Å; R135-D170 IonicContact NH1-OD1 2.73Å; R135-D170 PolarHBondContact NH1-OD1 3Å; R135-D170 IonicContact NH1-OD2 3.45Å; R135-D170 IonicContact NH2-OD1 2.91Å; R135-D170 PolarHBondContact NH2-OD1 3.21Å; R135-T174 HydrophobicContact CG-CG2 4.16Å; R135-T174 WeakPolarHBondContact CG-OG1 3.48Å; R135-T174 PolarHBondContact NH1-OG1 2.93Å; R135-E177 WeakPolarHBondContact CB-OE2 3.06Å; R135-E177 WeakPolarHBondContact CD-OE2 3.48Å; R135-E177 WeakPolarHBondContact CG-OE2 3.36Å
136	E	94.7	Very high	93.4	Very high	10 Å²	10	30.9 Å²	30.9	5%	0.047	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-41.7	172.9	-159.4	68.5	-139.6	0	0	111.1	N90 L93 R94 S132 M133 L134 V138 R139	N90-E136 HydrophobicContact CB-CB 4.43Å; N90-E136 HydrophobicContact CB-CG 4Å; N90-E136 VanDerWaalsContact OD1-CB 3.32Å; N90-E136 WeakPolarHBondContact OD1-CB 2.91Å; L93-E136 HydrophobicContact CB-CG 4.38Å; L93-E136 VanDerWaalsContact CD2-C 3.45Å; L93-E136 HydrophobicContact CD2-CB 3.88Å; L93-E136 HydrophobicContact CD2-CG 3.77Å; L93-E136 HydrophobicContact CG-CG 4.37Å; R94-E136 WeakPolarHBondContact CG-OE1 3.04Å; R94-E136 IonicContact CZ-OE1 3.5Å; R94-E136 IonicContact CZ-OE2 3.47Å; R94-E136 VanDerWaalsContact NE-CD 3.26Å; R94-E136 IonicContact NE-OE1 2.73Å; R94-E136 PolarHBondContact NE-OE1 3.43Å; R94-E136 IonicContact NE-OE2 3.38Å; R94-E136 PolarHBondContact NE-OE2 2.88Å; R94-E136 IonicContact NH2-OE1 3.95Å; R94-E136 PolarHBondContact NH2-OE1 3.4Å; R94-E136 IonicContact NH2-OE2 2.76Å; R94-E136 PolarHBondContact NH2-OE2 3.39Å; S132-E136 PolarHBondContact O-N 3.49Å; S132-E136 VanDerWaalsContact O-N 3.1Å; M133-E136 PolarHBondContact O-N 2.9Å; L134-E136 VanDerWaalsContact C-N 3.29Å; L134-E136 PolarHBondContact O-N 3.39Å; E136-V138 VanDerWaalsContact C-N 3.32Å; E136-V138 PolarHBondContact O-N 3.24Å; E136-R139 VanDerWaalsContact CD-NH1 3.3Å; E136-R139 WeakPolarHBondContact O-CB 3.43Å; E136-R139 PolarHBondContact O-N 3.02Å; E136-R139 VanDerWaalsContact OE1-CD 3.28Å; E136-R139 WeakPolarHBondContact OE1-CD 3.35Å; E136-R139 IonicContact OE1-CZ 3.18Å; E136-R139 IonicContact OE1-NE 2.89Å; E136-R139 IonicContact OE1-NH1 3.18Å; E136-R139 PolarHBondContact OE1-NH1 3.46Å; E136-R139 IonicContact OE2-CZ 2.69Å; E136-R139 IonicContact OE2-NE 3.99Å; E136-R139 IonicContact OE2-NH1 2.76Å; E136-R139 PolarHBondContact OE2-NH1 3.45Å
137	C	95.4	Very high	94.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.4	-45.2	173.2	-66.2	0	0	0	0	112	L93 L114 M133 L134 R139 H140 L143 I147	L93-C137 HydrophobicContact CD2-CB 4.25Å; L93-C137 VanDerWaalsContact CD2-N 3.35Å; L114-C137 HydrophobicContact CD2-CB 4.22Å; M133-C137 PolarHBondContact O-N 2.76Å; M133-C137 PolarHBondContact O-SG 3.19Å; M133-C137 VanDerWaalsContact O-SG 3.33Å; L134-C137 WeakPolarHBondContact O-CB 3.24Å; L134-C137 PolarHBondContact O-N 2.91Å; L134-C137 VanDerWaalsContact O-N 3.11Å; C137-R139 PolarHBondContact O-N 3.18Å; C137-R139 VanDerWaalsContact O-N 3.11Å; C137-H140 PolarHBondContact O-N 3.45Å; C137-L143 HydrophobicContact CB-CB 4.36Å; C137-L143 HydrophobicContact CB-CD1 3.95Å; C137-I147 HydrophobicContact CB-CD1 4.2Å
138	V	97.1	Very high	94.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.7	-19.4	-177.9	173.6	0	0	0	0	112.7	L134 R135 E136 H140 A144 I147 E177 L178 K181 H182	L134-V138 VanDerWaalsContact O-CG2 3.26Å; L134-V138 WeakPolarHBondContact O-CG2 3.34Å; L134-V138 PolarHBondContact O-N 3.24Å; R135-V138 PolarHBondContact O-N 2.89Å; E136-V138 VanDerWaalsContact C-N 3.32Å; E136-V138 PolarHBondContact O-N 3.24Å; V138-H140 PolarHBondContact O-N 3.48Å; V138-A144 HydrophobicContact CG1-CB 4.36Å; V138-I147 HydrophobicContact CG2-CD1 3.93Å; V138-E177 HydrophobicContact CG1-CG 3.94Å; V138-L178 HydrophobicContact CB-CD2 4.45Å; V138-L178 HydrophobicContact CG1-CD2 4.27Å; V138-L178 HydrophobicContact CG1-CG 4.49Å; V138-L178 HydrophobicContact CG2-CD2 3.28Å; V138-L178 HydrophobicContact CG2-CG 3.78Å; V138-K181 HydrophobicContact CG1-CB 4.19Å; V138-K181 HydrophobicContact CG1-CG 4.47Å; V138-H182 PolarHBondContact O-NE2 3.44Å
139	R	96.5	Very high	95.1	Very high	114 Å²	114	31.4 Å²	31.4	43%	0.43	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.6	173	-66.9	174	175.7	-171.1	-6.2	113.4	R135 E136 C137 H182	R135-R139 PolarHBondContact O-N 3.45Å; E136-R139 VanDerWaalsContact CD-NH1 3.3Å; E136-R139 WeakPolarHBondContact O-CB 3.43Å; E136-R139 PolarHBondContact O-N 3.02Å; E136-R139 VanDerWaalsContact OE1-CD 3.28Å; E136-R139 WeakPolarHBondContact OE1-CD 3.35Å; E136-R139 IonicContact OE1-CZ 3.18Å; E136-R139 IonicContact OE1-NE 2.89Å; E136-R139 IonicContact OE1-NH1 3.18Å; E136-R139 PolarHBondContact OE1-NH1 3.46Å; E136-R139 IonicContact OE2-CZ 2.69Å; E136-R139 IonicContact OE2-NE 3.99Å; E136-R139 IonicContact OE2-NH1 2.76Å; E136-R139 PolarHBondContact OE2-NH1 3.45Å; C137-R139 PolarHBondContact O-N 3.18Å; C137-R139 VanDerWaalsContact O-N 3.11Å; R139-H182 PolarHBondContact O-CE1 2.66Å
140	H	96.3	Very high	95.6	Very high	37 Å²	37	31.9 Å²	31.9	17%	0.171	16%	0.158	C	C	.	.	S	Bend	trans	-99.1	115.6	178.4	-58.2	-83.9	0	0	0	109.7	V104 C137 V138 P142 L143 A144	V104-H140 HydrophobicContact CG1-CB 4.21Å; V104-H140 HydrophobicContact CG2-CB 4Å; V104-H140 VanDerWaalsContact CG2-CG 3.47Å; V104-H140 WeakPolarHBondContact CG2-ND1 3.46Å; C137-H140 PolarHBondContact O-N 3.45Å; V138-H140 PolarHBondContact O-N 3.48Å; H140-P142 VanDerWaalsContact C-CD 3.42Å; H140-P142 VanDerWaalsContact C-N 3.33Å; H140-L143 HydrophobicContact CB-CD1 4.35Å; H140-L143 HydrophobicContact CB-CG 4.37Å; H140-L143 PolarHBondContact O-N 3.09Å; H140-A144 PolarHBondContact O-N 3.22Å
141	E	96.9	Very high	96	Very high	88 Å²	88	37.2 Å²	37.2	41%	0.411	18%	0.182	S	C	.	.	H	α-helix	trans	-51.5	-42.1	-177.1	-167.4	-169.2	145.2	0	0	113.8	L143 A144 R145 H182 L185	E141-L143 VanDerWaalsContact C-N 3.3Å; E141-L143 PolarHBondContact O-N 3.13Å; E141-A144 PolarHBondContact O-N 3.26Å; E141-R145 WeakPolarHBondContact O-CB 3.23Å; E141-R145 PolarHBondContact O-N 3.24Å; E141-R145 IonicContact OE1-CZ 3.97Å; E141-R145 IonicContact OE1-NH2 2.73Å; E141-R145 PolarHBondContact OE1-NH2 3.5Å; E141-H182 HydrophobicContact CG-CB 4.34Å; E141-H182 PolarHBondContact N-CE1 3.18Å; E141-H182 PolarHBondContact N-NE2 2.78Å; E141-L185 HydrophobicContact CG-CD2 4.19Å
142	P	96.8	Very high	96.2	Very high	65 Å²	65	38.8 Å²	38.8	42%	0.422	19%	0.19	S	C	.	.	H	α-helix	trans	-59.5	-38	178.3	-25.8	35.8	0	0	0	113.8	Y108 H140 M146	Y108-P142 HydrophobicContact CD2-CB 4.11Å; Y108-P142 HydrophobicContact CE2-CB 4.23Å; H140-P142 VanDerWaalsContact C-CD 3.42Å; H140-P142 VanDerWaalsContact C-N 3.33Å; P142-M146 PolarHBondContact O-N 3.31Å
143	L	97	Very high	96.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-77.1	-39.7	177.8	-58.9	-179.7	0	0	0	111	L93 V104 L107 L114 C137 H140 E141 R145 M146 I147	L93-L143 HydrophobicContact CD1-CD1 3.95Å; V104-L143 HydrophobicContact CG1-CD1 4.26Å; V104-L143 HydrophobicContact CG1-CD2 4.32Å; V104-L143 HydrophobicContact CG1-CG 3.99Å; V104-L143 HydrophobicContact CG2-CD1 4.32Å; L107-L143 HydrophobicContact CB-CD1 4.35Å; L107-L143 HydrophobicContact CB-CD2 3.84Å; L107-L143 HydrophobicContact CD1-CD1 3.99Å; L114-L143 HydrophobicContact CD1-CD2 4.28Å; C137-L143 HydrophobicContact CB-CB 4.36Å; C137-L143 HydrophobicContact CB-CD1 3.95Å; H140-L143 HydrophobicContact CB-CD1 4.35Å; H140-L143 HydrophobicContact CB-CG 4.37Å; H140-L143 PolarHBondContact O-N 3.09Å; E141-L143 VanDerWaalsContact C-N 3.3Å; E141-L143 PolarHBondContact O-N 3.13Å; L143-R145 VanDerWaalsContact C-N 3.31Å; L143-R145 PolarHBondContact O-N 2.92Å; L143-M146 PolarHBondContact O-N 3.22Å; L143-I147 WeakPolarHBondContact O-CD1 3.34Å; L143-I147 VanDerWaalsContact O-CG1 3.22Å; L143-I147 WeakPolarHBondContact O-CG1 3.28Å; L143-I147 PolarHBondContact O-N 2.98Å
144	A	98.1	Very high	96.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-59.3	-43.4	175	0	0	0	0	0	111.5	V138 H140 E141 M146 I147 L148 H182 L185	V138-A144 HydrophobicContact CG1-CB 4.36Å; H140-A144 PolarHBondContact O-N 3.22Å; E141-A144 PolarHBondContact O-N 3.26Å; A144-M146 VanDerWaalsContact C-N 3.34Å; A144-M146 PolarHBondContact O-N 3.28Å; A144-I147 PolarHBondContact O-N 3.19Å; A144-L148 WeakPolarHBondContact O-CG 3.33Å; A144-L148 PolarHBondContact O-N 2.97Å; A144-H182 WeakPolarHBondContact CB-CD2 3.39Å; A144-L185 HydrophobicContact CB-CD2 4.02Å
145	R	98	Very high	97	Very high	100 Å²	100	40.5 Å²	40.5	38%	0.377	19%	0.194	S	C	.	.	H	α-helix	trans	-60	-44.9	176.1	-174.6	175.3	-62	-86.8	1.2	111.6	E141 L143 S149 L185 E188	E141-R145 WeakPolarHBondContact O-CB 3.23Å; E141-R145 PolarHBondContact O-N 3.24Å; E141-R145 IonicContact OE1-CZ 3.97Å; E141-R145 IonicContact OE1-NH2 2.73Å; E141-R145 PolarHBondContact OE1-NH2 3.5Å; L143-R145 VanDerWaalsContact C-N 3.31Å; L143-R145 PolarHBondContact O-N 2.92Å; R145-S149 PolarHBondContact O-N 3.24Å; R145-L185 HydrophobicContact CB-CD1 3.94Å; R145-L185 HydrophobicContact CB-CD2 3.88Å; R145-L185 HydrophobicContact CG-CD1 3.81Å; R145-E188 IonicContact NH1-OE2 3.73Å; R145-E188 PolarHBondContact NH1-OE2 2.82Å; R145-E188 VanDerWaalsContact NH1-OE2 3.12Å
146	M	97.5	Very high	97	Very high	25 Å²	25	37.9 Å²	37.9	12%	0.123	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-46	175.2	-178.8	175	-75	0	0	111.6	Y108 P111 L114 P142 L143 A144 L148 S149 F150	Y108-M146 HydrophobicContact CD1-CE 3.96Å; Y108-M146 HydrophobicContact CD2-CE 3.46Å; Y108-M146 VanDerWaalsContact CD2-CE 3.46Å; Y108-M146 HydrophobicContact CD2-SD 4.49Å; Y108-M146 HydrophobicContact CE1-CE 4.03Å; Y108-M146 HydrophobicContact CE2-CE 3.55Å; Y108-M146 HydrophobicContact CG-CE 3.68Å; Y108-M146 WeakPolarHBondContact O-CE 3.41Å; P111-M146 HydrophobicContact CB-SD 4.14Å; L114-M146 HydrophobicContact CD1-CB 4.48Å; L114-M146 HydrophobicContact CD1-CG 4.06Å; L114-M146 HydrophobicContact CD1-SD 3.62Å; P142-M146 PolarHBondContact O-N 3.31Å; L143-M146 PolarHBondContact O-N 3.22Å; A144-M146 VanDerWaalsContact C-N 3.34Å; A144-M146 PolarHBondContact O-N 3.28Å; M146-L148 PolarHBondContact O-N 3.34Å; M146-S149 WeakPolarHBondContact O-CB 3.28Å; M146-S149 PolarHBondContact O-N 3.12Å; M146-S149 VanDerWaalsContact O-N 3.12Å; M146-S149 PolarHBondContact O-OG 3.03Å; M146-F150 HydrophobicContact CG-CE1 3.9Å; M146-F150 HydrophobicContact CG-CE2 4.12Å; M146-F150 HydrophobicContact CG-CZ 3.4Å; M146-F150 HydrophobicContact SD-CZ 4.14Å
147	I	97.9	Very high	97.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-43	179.5	-67.3	158.6	0	0	0	111.8	L114 I118 L134 C137 V138 L143 A144 S149 F150 I153 L178	L114-I147 HydrophobicContact CB-CG1 4.27Å; L114-I147 HydrophobicContact CD1-CG1 4.05Å; L114-I147 HydrophobicContact CD2-CD1 4.44Å; I118-I147 HydrophobicContact CD1-CG2 3.97Å; L134-I147 HydrophobicContact CD1-CD1 3.58Å; L134-I147 HydrophobicContact CD1-CG1 4.28Å; C137-I147 HydrophobicContact CB-CD1 4.2Å; V138-I147 HydrophobicContact CG2-CD1 3.93Å; L143-I147 WeakPolarHBondContact O-CD1 3.34Å; L143-I147 VanDerWaalsContact O-CG1 3.22Å; L143-I147 WeakPolarHBondContact O-CG1 3.28Å; L143-I147 PolarHBondContact O-N 2.98Å; A144-I147 PolarHBondContact O-N 3.19Å; I147-S149 PolarHBondContact O-N 2.79Å; I147-F150 HydrophobicContact CG1-CE2 4.4Å; I147-F150 WeakPolarHBondContact O-CB 3.47Å; I147-F150 PolarHBondContact O-N 3.44Å; I147-F150 VanDerWaalsContact O-N 3.13Å; I147-I153 HydrophobicContact CG2-CD1 4.1Å; I147-L178 HydrophobicContact CB-CD2 4.11Å; I147-L178 HydrophobicContact CG2-CD1 4.42Å; I147-L178 HydrophobicContact CG2-CD2 3.45Å; I147-L178 VanDerWaalsContact CG2-CD2 3.45Å
148	L	97.8	Very high	97.2	Very high	11 Å²	11	42.3 Å²	42.3	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-19.4	178.1	-72.2	173.2	0	0	0	113.3	A144 M146 F150 I153 L178 L185 F189	A144-L148 WeakPolarHBondContact O-CG 3.33Å; A144-L148 PolarHBondContact O-N 2.97Å; M146-L148 PolarHBondContact O-N 3.34Å; L148-F150 VanDerWaalsContact C-N 3.33Å; L148-I153 HydrophobicContact CD2-CD1 4.08Å; L148-I153 HydrophobicContact CD2-CG1 4.21Å; L148-L178 HydrophobicContact CD2-CB 4.49Å; L148-L185 HydrophobicContact CD1-CD1 4.25Å; L148-L185 HydrophobicContact CD1-CD2 3.95Å; L148-L185 HydrophobicContact CD1-CG 3.8Å; L148-F189 HydrophobicContact CB-CD2 4.02Å; L148-F189 HydrophobicContact CB-CE2 4.43Å; L148-F189 HydrophobicContact CB-CG 4.43Å; L148-F189 HydrophobicContact CD1-CB 4.31Å; L148-F189 HydrophobicContact CD1-CG 4.43Å; L148-F189 HydrophobicContact CD2-CD1 4.15Å; L148-F189 HydrophobicContact CD2-CD2 4.27Å; L148-F189 HydrophobicContact CD2-CE1 4.22Å; L148-F189 HydrophobicContact CD2-CE2 4.34Å; L148-F189 HydrophobicContact CD2-CG 4.18Å; L148-F189 HydrophobicContact CD2-CZ 4.32Å; L148-F189 WeakPolarHBondContact O-CE2 3.48Å
149	S	97.1	Very high	97.2	Very high	87 Å²	87	43.5 Å²	43.5	61%	0.608	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-9.2	173.9	73.1	0	0	0	0	114.3	R145 M146 I147	R145-S149 PolarHBondContact O-N 3.24Å; M146-S149 WeakPolarHBondContact O-CB 3.28Å; M146-S149 PolarHBondContact O-N 3.12Å; M146-S149 VanDerWaalsContact O-N 3.12Å; M146-S149 PolarHBondContact O-OG 3.03Å; I147-S149 PolarHBondContact O-N 2.79Å
150	F	97.3	Very high	97.2	Very high	26 Å²	26	38.1 Å²	38.1	11%	0.114	20%	0.199	C	C	.	.	S	Bend	trans	-84.7	142.4	-179.6	-59.5	-32.4	0	0	0	112	P111 L114 I115 I118 M146 I147 L148 E152 I153	P111-F150 HydrophobicContact CB-CE1 3.99Å; P111-F150 HydrophobicContact CB-CZ 3.66Å; L114-F150 HydrophobicContact CB-CE2 3.75Å; L114-F150 HydrophobicContact CB-CZ 4.42Å; L114-F150 HydrophobicContact CD1-CE2 4.29Å; L114-F150 HydrophobicContact CD1-CZ 4.5Å; I115-F150 HydrophobicContact CD1-CD1 4.43Å; I115-F150 HydrophobicContact CD1-CE1 4.35Å; I115-F150 HydrophobicContact CD1-CZ 4.43Å; I115-F150 HydrophobicContact CG1-CD1 4.42Å; I115-F150 HydrophobicContact CG1-CD2 3.86Å; I115-F150 HydrophobicContact CG1-CE1 4.42Å; I115-F150 HydrophobicContact CG1-CE2 3.88Å; I115-F150 HydrophobicContact CG1-CG 4.14Å; I115-F150 HydrophobicContact CG1-CZ 4.14Å; I118-F150 HydrophobicContact CD1-CD2 3.99Å; M146-F150 HydrophobicContact CG-CE1 3.9Å; M146-F150 HydrophobicContact CG-CE2 4.12Å; M146-F150 HydrophobicContact CG-CZ 3.4Å; M146-F150 HydrophobicContact SD-CZ 4.14Å; I147-F150 HydrophobicContact CG1-CE2 4.4Å; I147-F150 WeakPolarHBondContact O-CB 3.47Å; I147-F150 PolarHBondContact O-N 3.44Å; I147-F150 VanDerWaalsContact O-N 3.13Å; L148-F150 VanDerWaalsContact C-N 3.33Å; F150-E152 HydrophobicContact CB-CB 4.48Å; F150-E152 PolarHBondContact O-N 3.48Å; F150-I153 WeakPolarHBondContact O-CB 3.35Å; F150-I153 WeakPolarHBondContact O-CG2 3.37Å; F150-I153 PolarHBondContact O-N 3.37Å
151	E	97	Very high	97	Very high	116 Å²	116	39.6 Å²	39.6	54%	0.542	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-61.6	-31.7	172.3	-74	-63.9	141.6	0	0	111.9	I153 Y154 R196	E151-I153 PolarHBondContact O-N 2.8Å; E151-Y154 PolarHBondContact O-N 2.69Å; E151-Y154 VanDerWaalsContact O-N 3.12Å; E151-R196 IonicContact OE1-NH1 3.94Å; E151-R196 PolarHBondContact OE1-NH1 2.96Å; E151-R196 IonicContact OE2-CZ 2.68Å; E151-R196 IonicContact OE2-NH1 2.75Å; E151-R196 PolarHBondContact OE2-NH1 3.33Å; E151-R196 IonicContact OE2-NH2 3.32Å; E151-R196 PolarHBondContact OE2-NH2 3.33Å
152	E	96	Very high	96.6	Very high	34 Å²	34	36.1 Å²	36.1	16%	0.159	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-58.6	-16.9	177.3	-74.3	83.9	173.2	0	0	114.5	I115 I118 K119 F150 Y154 N155	I115-E152 HydrophobicContact CG2-CG 4.11Å; I115-E152 WeakPolarHBondContact CG2-OE1 3.3Å; I118-E152 HydrophobicContact CB-CB 4.39Å; I118-E152 HydrophobicContact CD1-CB 4.1Å; I118-E152 HydrophobicContact CG2-CB 3.87Å; K119-E152 VanDerWaalsContact CE-CG 3.5Å; K119-E152 VanDerWaalsContact CE-OE1 3.23Å; K119-E152 WeakPolarHBondContact CE-OE1 3.36Å; K119-E152 HydrophobicContact CG-CG 4.48Å; K119-E152 IonicContact NZ-OE1 2.83Å; K119-E152 PolarHBondContact NZ-OE1 2.9Å; F150-E152 HydrophobicContact CB-CB 4.48Å; F150-E152 PolarHBondContact O-N 3.48Å; E152-Y154 PolarHBondContact O-N 2.89Å; E152-N155 VanDerWaalsContact O-CB 3.31Å; E152-N155 WeakPolarHBondContact O-CB 3.32Å; E152-N155 PolarHBondContact O-N 3.07Å
153	I	96.9	Very high	96.1	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-58	-32.6	174.8	-161.5	70.7	0	0	0	111.5	I147 L148 F150 E151 N155 F156 L178 F189	I147-I153 HydrophobicContact CG2-CD1 4.1Å; L148-I153 HydrophobicContact CD2-CD1 4.08Å; L148-I153 HydrophobicContact CD2-CG1 4.21Å; F150-I153 WeakPolarHBondContact O-CB 3.35Å; F150-I153 WeakPolarHBondContact O-CG2 3.37Å; F150-I153 PolarHBondContact O-N 3.37Å; E151-I153 PolarHBondContact O-N 2.8Å; I153-N155 PolarHBondContact O-N 2.76Å; I153-F156 HydrophobicContact CD1-CD2 4.2Å; I153-F156 HydrophobicContact CD1-CE2 4.31Å; I153-F156 WeakPolarHBondContact O-CB 3.37Å; I153-F156 WeakPolarHBondContact O-CD2 3.28Å; I153-F156 PolarHBondContact O-N 3.02Å; I153-L178 HydrophobicContact CD1-CB 4.37Å; I153-L178 HydrophobicContact CD1-CD1 3.68Å; I153-L178 HydrophobicContact CD1-CD2 4.21Å; I153-L178 HydrophobicContact CD1-CG 4.31Å; I153-F189 HydrophobicContact CG2-CE2 4.49Å; I153-F189 HydrophobicContact CG2-CZ 4.29Å
154	Y	97.9	Very high	95.8	Very high	24 Å²	24	42.8 Å²	42.8	9%	0.094	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-73.5	-15.6	179.4	-72.1	-86.4	0	0	0	112.9	E151 E152 F156 F157 R196	E151-Y154 PolarHBondContact O-N 2.69Å; E151-Y154 VanDerWaalsContact O-N 3.12Å; E152-Y154 PolarHBondContact O-N 2.89Å; Y154-F156 PolarHBondContact O-N 3.21Å; Y154-F157 AromaticContact CD1-CD2 3.92Å; Y154-F157 HydrophobicContact CD1-CD2 3.92Å; Y154-F157 AromaticContact CD1-CE2 3.62Å; Y154-F157 HydrophobicContact CD1-CE2 3.62Å; Y154-F157 HydrophobicContact CE1-CE2 4.09Å; Y154-F157 WeakPolarHBondContact O-CD2 3.3Å; Y154-F157 PolarHBondContact O-N 3.45Å; Y154-R196 HydrophobicContact CD1-CG 4.38Å; Y154-R196 HydrophobicContact CE1-CB 4.41Å; Y154-R196 HydrophobicContact CE1-CG 3.64Å; Y154-R196 VanDerWaalsContact CE2-CZ 3.49Å
155	N	97.5	Very high	95.5	Very high	54 Å²	54	48.8 Å²	48.8	29%	0.289	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-65.7	-21.2	173.7	-63.6	-1.2	0	0	0	111.7	E152 I153 F157 S158 Y159	E152-N155 VanDerWaalsContact O-CB 3.31Å; E152-N155 WeakPolarHBondContact O-CB 3.32Å; E152-N155 PolarHBondContact O-N 3.07Å; I153-N155 PolarHBondContact O-N 2.76Å; N155-F157 PolarHBondContact O-N 3.18Å; N155-S158 WeakPolarHBondContact O-CB 3.45Å; N155-S158 PolarHBondContact O-N 3.33Å; N155-Y159 HydrophobicContact CB-CD2 4.25Å; N155-Y159 HydrophobicContact CB-CE1 4.02Å; N155-Y159 HydrophobicContact CB-CE2 3.55Å; N155-Y159 VanDerWaalsContact CB-CZ 3.42Å; N155-Y159 WeakPolarHBondContact CB-OH 3.4Å; N155-Y159 PolarHBondContact ND2-OH 3.45Å; N155-Y159 WeakPolarHBondContact O-CD2 3.43Å; N155-Y159 VanDerWaalsContact O-CG 3.25Å; N155-Y159 PolarHBondContact O-N 3.34Å
156	F	97.9	Very high	95.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-33	174.6	-82	-79.9	0	0	0	112.6	I118 Y121 L134 I153 Y154 S158 Y159 V160 A171 T174 F175 L178	I118-F156 HydrophobicContact CG2-CE2 3.94Å; Y121-F156 HydrophobicContact CD2-CE1 4.04Å; Y121-F156 HydrophobicContact CD2-CZ 4.24Å; Y121-F156 AromaticContact CE2-CE1 3.71Å; Y121-F156 HydrophobicContact CE2-CE1 3.71Å; Y121-F156 AromaticContact CE2-CZ 3.99Å; Y121-F156 HydrophobicContact CE2-CZ 3.99Å; L134-F156 HydrophobicContact CD2-CE2 4.4Å; L134-F156 HydrophobicContact CD2-CZ 3.82Å; I153-F156 HydrophobicContact CD1-CD2 4.2Å; I153-F156 HydrophobicContact CD1-CE2 4.31Å; I153-F156 WeakPolarHBondContact O-CB 3.37Å; I153-F156 WeakPolarHBondContact O-CD2 3.28Å; I153-F156 PolarHBondContact O-N 3.02Å; Y154-F156 PolarHBondContact O-N 3.21Å; F156-S158 PolarHBondContact O-N 3Å; F156-Y159 HydrophobicContact CD1-CD2 4.13Å; F156-Y159 HydrophobicContact CE1-CD2 4.42Å; F156-Y159 HydrophobicContact CG-CD2 4.29Å; F156-Y159 PolarHBondContact O-N 2.92Å; F156-Y159 VanDerWaalsContact O-N 3.13Å; F156-V160 VanDerWaalsContact O-CG1 3.3Å; F156-V160 WeakPolarHBondContact O-CG1 3.27Å; F156-V160 WeakPolarHBondContact O-CG2 3.34Å; F156-V160 PolarHBondContact O-N 3.09Å; F156-A171 HydrophobicContact CD1-CB 4.33Å; F156-A171 WeakPolarHBondContact CD1-O 3.42Å; F156-A171 HydrophobicContact CE1-CB 4.48Å; F156-T174 HydrophobicContact CE1-CG2 3.82Å; F156-T174 HydrophobicContact CZ-CG2 3.62Å; F156-F175 HydrophobicContact CB-CB 4.05Å; F156-F175 HydrophobicContact CB-CD2 3.54Å; F156-F175 HydrophobicContact CB-CE2 4.21Å; F156-F175 HydrophobicContact CB-CG 3.94Å; F156-F175 HydrophobicContact CD1-CB 3.78Å; F156-F175 HydrophobicContact CD2-CD2 4.42Å; F156-F175 HydrophobicContact CE1-CB 4.49Å; F156-F175 HydrophobicContact CG-CB 4Å; F156-F175 AromaticContact CG-CD2 3.96Å; F156-F175 HydrophobicContact CG-CD2 3.96Å; F156-F175 HydrophobicContact CG-CG 4.33Å; F156-L178 HydrophobicContact CD2-CD1 4.3Å; F156-L178 HydrophobicContact CE2-CD1 3.64Å; F156-L178 HydrophobicContact CZ-CD1 3.86Å
157	F	97.5	Very high	95.1	Very high	17 Å²	17	50 Å²	50	8%	0.075	27%	0.272	C	S	.	.	H	α-helix	trans	-60.3	-29.5	174.5	-68.5	-74.8	0	0	0	112.5	Y154 N155 V160 F175 F197 Y201 L204	Y154-F157 AromaticContact CD1-CD2 3.92Å; Y154-F157 HydrophobicContact CD1-CD2 3.92Å; Y154-F157 AromaticContact CD1-CE2 3.62Å; Y154-F157 HydrophobicContact CD1-CE2 3.62Å; Y154-F157 HydrophobicContact CE1-CE2 4.09Å; Y154-F157 WeakPolarHBondContact O-CD2 3.3Å; Y154-F157 PolarHBondContact O-N 3.45Å; N155-F157 PolarHBondContact O-N 3.18Å; F157-V160 WeakPolarHBondContact O-CG2 3.31Å; F157-F175 HydrophobicContact CE1-CE1 4.37Å; F157-F175 AromaticContact CE1-CZ 3.94Å; F157-F175 HydrophobicContact CE1-CZ 3.94Å; F157-F175 HydrophobicContact CE2-CZ 4.3Å; F157-F175 HydrophobicContact CZ-CE2 4.39Å; F157-F175 AromaticContact CZ-CZ 3.74Å; F157-F175 HydrophobicContact CZ-CZ 3.74Å; F157-F197 HydrophobicContact CE2-CD2 4.46Å; F157-F197 AromaticContact CZ-CD2 3.98Å; F157-F197 HydrophobicContact CZ-CD2 3.98Å; F157-F197 AromaticContact CZ-CE2 3.9Å; F157-F197 HydrophobicContact CZ-CE2 3.9Å; F157-F197 HydrophobicContact CZ-CZ 4.39Å; F157-Y201 HydrophobicContact CE1-CD2 4Å; F157-Y201 HydrophobicContact CE1-CG 4.39Å; F157-Y201 HydrophobicContact CZ-CD2 4.48Å; F157-L204 HydrophobicContact CD1-CD1 3.65Å; F157-L204 HydrophobicContact CD1-CD2 4.28Å; F157-L204 HydrophobicContact CD1-CG 3.88Å; F157-L204 HydrophobicContact CE1-CD1 3.92Å; F157-L204 HydrophobicContact CE1-CG 4.42Å
158	S	96.2	Very high	95	Very high	85 Å²	85	50.3 Å²	50.3	59%	0.594	28%	0.275	S	S	*	.	H	α-helix	trans	-84.8	-38.7	171.9	-58.6	0	0	0	0	112.4	N155 F156 V160 E161 G162	N155-S158 WeakPolarHBondContact O-CB 3.45Å; N155-S158 PolarHBondContact O-N 3.33Å; F156-S158 PolarHBondContact O-N 3Å; S158-V160 VanDerWaalsContact C-N 3.35Å; S158-V160 PolarHBondContact O-N 2.89Å; S158-E161 CarbonylContact O-C 3.53Å; S158-E161 PolarHBondContact O-N 2.72Å; S158-E161 VanDerWaalsContact O-N 3.15Å; S158-G162 PolarHBondContact O-N 3.06Å
159	Y	96.5	Very high	95	Very high	26 Å²	26	52.2 Å²	52.2	10%	0.102	29%	0.289	C	S	.	.	H	α-helix	trans	-66.1	-35.5	-178.3	-57.4	-27.9	0	0	0	113	I118 Y121 E122 N155 F156 E161 G162 A168	I118-Y159 HydrophobicContact CG2-CE2 4.11Å; I118-Y159 WeakPolarHBondContact O-CE2 3.5Å; Y121-Y159 HydrophobicContact CD2-CD2 4.19Å; Y121-Y159 HydrophobicContact CD2-CE2 4.46Å; Y121-Y159 HydrophobicContact CG-CD2 4.01Å; Y121-Y159 HydrophobicContact CG-CE2 4.43Å; Y121-Y159 HydrophobicContact CG-CG 4.39Å; E122-Y159 HydrophobicContact CG-CE1 4.09Å; N155-Y159 HydrophobicContact CB-CD2 4.25Å; N155-Y159 HydrophobicContact CB-CE1 4.02Å; N155-Y159 HydrophobicContact CB-CE2 3.55Å; N155-Y159 VanDerWaalsContact CB-CZ 3.42Å; N155-Y159 WeakPolarHBondContact CB-OH 3.4Å; N155-Y159 PolarHBondContact ND2-OH 3.45Å; N155-Y159 WeakPolarHBondContact O-CD2 3.43Å; N155-Y159 VanDerWaalsContact O-CG 3.25Å; N155-Y159 PolarHBondContact O-N 3.34Å; F156-Y159 HydrophobicContact CD1-CD2 4.13Å; F156-Y159 HydrophobicContact CE1-CD2 4.42Å; F156-Y159 HydrophobicContact CG-CD2 4.29Å; F156-Y159 PolarHBondContact O-N 2.92Å; F156-Y159 VanDerWaalsContact O-N 3.13Å; Y159-E161 PolarHBondContact O-N 2.99Å; Y159-G162 PolarHBondContact O-N 3.13Å; Y159-A168 WeakPolarHBondContact O-CA 3.46Å
160	V	96.6	Very high	94.9	Very high	1 Å²	1	49 Å²	49	1%	0.006	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.3	175.7	-60.2	0	0	0	0	113.2	F156 F157 S158 A171 F172 L204 T212	F156-V160 VanDerWaalsContact O-CG1 3.3Å; F156-V160 WeakPolarHBondContact O-CG1 3.27Å; F156-V160 WeakPolarHBondContact O-CG2 3.34Å; F156-V160 PolarHBondContact O-N 3.09Å; F157-V160 WeakPolarHBondContact O-CG2 3.31Å; S158-V160 VanDerWaalsContact C-N 3.35Å; S158-V160 PolarHBondContact O-N 2.89Å; V160-A171 HydrophobicContact CG1-CB 4.4Å; V160-F172 HydrophobicContact CB-CD2 4.3Å; V160-F172 HydrophobicContact CG1-CB 3.89Å; V160-F172 HydrophobicContact CG1-CD2 3.97Å; V160-F172 HydrophobicContact CG1-CG 4.4Å; V160-L204 HydrophobicContact CG2-CD1 4.07Å; V160-L204 HydrophobicContact CG2-CD2 3.41Å; V160-L204 VanDerWaalsContact CG2-CD2 3.41Å; V160-L204 HydrophobicContact CG2-CG 4.4Å; V160-T212 HydrophobicContact CB-CG2 4.46Å; V160-T212 HydrophobicContact CG2-CG2 4.14Å; V160-T212 PolarHBondContact O-OG1 3.35Å
161	E	93.1	Very high	95	Very high	67 Å²	67	47.7 Å²	47.7	31%	0.313	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	14.6	172.4	-64.1	-66.1	178.2	0	0	112.2	S158 Y159 L204 S207 T212	S158-E161 CarbonylContact O-C 3.53Å; S158-E161 PolarHBondContact O-N 2.72Å; S158-E161 VanDerWaalsContact O-N 3.15Å; Y159-E161 PolarHBondContact O-N 2.99Å; E161-L204 HydrophobicContact CG-CD2 4.14Å; E161-S207 WeakPolarHBondContact OE1-CB 3.45Å; E161-S207 PolarHBondContact OE1-OG 3.28Å; E161-S207 PolarHBondContact OE2-OG 3.12Å; E161-T212 HydrophobicContact CG-CG2 4.44Å; E161-T212 WeakPolarHBondContact OE1-CG2 3.4Å
162	G	88.8	Confident	95	Very high	15 Å²	15	43 Å²	43	16%	0.155	24%	0.237	C	C	.	.			trans	-58.1	149.1	-178.6	0	0	0	0	0	112.9	S158 Y159 T164	S158-G162 PolarHBondContact O-N 3.06Å; Y159-G162 PolarHBondContact O-N 3.13Å; G162-T164 PolarHBondContact O-N 3.25Å
163	P	85.1	Confident	95.1	Very high	139 Å²	139	44 Å²	44	90%	0.903	25%	0.248	S	C	*	.	S	Bend	trans	-67	-26.8	-175.3	27.3	-35.7	0	0	0	113
164	T	90.6	Very high	95.1	Very high	66 Å²	66	43.9 Å²	43.9	41%	0.405	25%	0.247	S	C	.	.	S	Bend	trans	-93.6	112.6	178	48.4	0	0	0	0	109.9	G162 E166 V167 A168	G162-T164 PolarHBondContact O-N 3.25Å; T164-E166 VanDerWaalsContact C-N 3.28Å; T164-E166 PolarHBondContact O-N 3.43Å; T164-V167 PolarHBondContact O-N 3.31Å; T164-V167 VanDerWaalsContact O-N 3.14Å; T164-V167 VanDerWaalsContact OG1-CB 3.28Å; T164-V167 WeakPolarHBondContact OG1-CB 3.47Å; T164-V167 VanDerWaalsContact OG1-CG2 3.23Å; T164-V167 WeakPolarHBondContact OG1-CG2 3.42Å; T164-A168 PolarHBondContact O-N 2.85Å
165	F	92.5	Very high	95.1	Very high	127 Å²	127	42.8 Å²	42.8	56%	0.557	24%	0.243	S	C	*	.	H	α-helix	trans	-49.9	-44.4	-178.4	174.8	-100.8	0	0	0	113.6	V167 A168 S169 V211	F165-V167 PolarHBondContact O-N 3.44Å; F165-A168 PolarHBondContact O-N 3.13Å; F165-S169 VanDerWaalsContact O-CB 3.28Å; F165-S169 WeakPolarHBondContact O-CB 3.27Å; F165-S169 PolarHBondContact O-N 2.82Å; F165-V211 HydrophobicContact CE2-CB 4.24Å; F165-V211 HydrophobicContact CE2-CG1 4.02Å; F165-V211 HydrophobicContact CE2-CG2 4Å
166	E	93.1	Very high	95.2	Very high	138 Å²	138	43.1 Å²	43.1	65%	0.645	24%	0.242	S	C	*	.	H	α-helix	trans	-59.4	-50.3	-179.2	-60.8	-176.5	165.7	0	0	111.2	H128 T164 S169 D170	H128-E166 PolarHBondContact CE1-O 3.39Å; H128-E166 IonicContact NE2-OE2 3.56Å; T164-E166 VanDerWaalsContact C-N 3.28Å; T164-E166 PolarHBondContact O-N 3.43Å; E166-S169 PolarHBondContact O-N 3.43Å; E166-D170 WeakPolarHBondContact O-CB 3.34Å; E166-D170 PolarHBondContact O-N 3.46Å
167	V	94	Very high	95.2	Very high	13 Å²	13	44.7 Å²	44.7	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-45	179.2	179.4	0	0	0	0	111.2	Y121 A124 A127 T164 F165 S169 D170 A171	Y121-V167 HydrophobicContact CD1-CG1 3.88Å; A124-V167 HydrophobicContact CB-CG2 4.18Å; A127-V167 HydrophobicContact CB-CB 4.46Å; A127-V167 HydrophobicContact CB-CG1 3.73Å; A127-V167 HydrophobicContact CB-CG2 4.05Å; T164-V167 PolarHBondContact O-N 3.31Å; T164-V167 VanDerWaalsContact O-N 3.14Å; T164-V167 VanDerWaalsContact OG1-CB 3.28Å; T164-V167 WeakPolarHBondContact OG1-CB 3.47Å; T164-V167 VanDerWaalsContact OG1-CG2 3.23Å; T164-V167 WeakPolarHBondContact OG1-CG2 3.42Å; F165-V167 PolarHBondContact O-N 3.44Å; V167-S169 PolarHBondContact O-N 3.28Å; V167-D170 PolarHBondContact O-N 2.97Å; V167-A171 VanDerWaalsContact O-CB 3.3Å; V167-A171 WeakPolarHBondContact O-CB 3.15Å; V167-A171 PolarHBondContact O-N 3.14Å
168	A	96.2	Very high	95.2	Very high	7 Å²	7	44 Å²	44	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-43.1	179.2	0	0	0	0	0	112.2	Y159 T164 F165 A171 F172	Y159-A168 WeakPolarHBondContact O-CA 3.46Å; T164-A168 PolarHBondContact O-N 2.85Å; F165-A168 PolarHBondContact O-N 3.13Å; A168-A171 PolarHBondContact O-N 3.47Å; A168-F172 WeakPolarHBondContact O-CB 3.39Å; A168-F172 PolarHBondContact O-N 3.34Å
169	S	96.4	Very high	95.2	Very high	50 Å²	50	39.9 Å²	39.9	35%	0.35	22%	0.218	S	C	.	.	H	α-helix	trans	-66.7	-37.9	177.2	-173.3	0	0	0	0	112.6	F165 E166 V167 S173	F165-S169 VanDerWaalsContact O-CB 3.28Å; F165-S169 WeakPolarHBondContact O-CB 3.27Å; F165-S169 PolarHBondContact O-N 2.82Å; E166-S169 PolarHBondContact O-N 3.43Å; V167-S169 PolarHBondContact O-N 3.28Å; S169-S173 PolarHBondContact O-N 2.83Å; S169-S173 VanDerWaalsContact O-N 3.09Å; S169-S173 PolarHBondContact O-OG 3.22Å
170	D	96.5	Very high	95.3	Very high	19 Å²	19	39.8 Å²	39.8	10%	0.102	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-41.7	175.8	-173	59.2	0	0	0	111.2	Y121 H128 R135 E166 V167 F172 S173 T174	Y121-D170 HydrophobicContact CE1-CB 4.38Å; Y121-D170 VanDerWaalsContact OH-C 3.31Å; Y121-D170 PolarHBondContact OH-O 3.47Å; Y121-D170 PolarHBondContact OH-OD2 3.3Å; Y121-D170 VanDerWaalsContact OH-OD2 3.12Å; H128-D170 WeakPolarHBondContact CA-OD2 3.29Å; H128-D170 WeakPolarHBondContact ND1-CB 3.37Å; H128-D170 VanDerWaalsContact ND1-CG 3.34Å; H128-D170 IonicContact ND1-OD2 3.66Å; H128-D170 PolarHBondContact ND1-OD2 3.06Å; R135-D170 IonicContact CZ-OD1 3.45Å; R135-D170 PolarHBondContact NH1-O 3.14Å; R135-D170 IonicContact NH1-OD1 2.73Å; R135-D170 PolarHBondContact NH1-OD1 3Å; R135-D170 IonicContact NH1-OD2 3.45Å; R135-D170 IonicContact NH2-OD1 2.91Å; R135-D170 PolarHBondContact NH2-OD1 3.21Å; E166-D170 WeakPolarHBondContact O-CB 3.34Å; E166-D170 PolarHBondContact O-N 3.46Å; V167-D170 PolarHBondContact O-N 2.97Å; D170-F172 VanDerWaalsContact C-N 3.32Å; D170-F172 PolarHBondContact O-N 3.41Å; D170-S173 WeakPolarHBondContact O-CB 3.3Å; D170-S173 PolarHBondContact O-N 2.93Å; D170-S173 VanDerWaalsContact O-N 3.13Å; D170-T174 PolarHBondContact O-N 3.47Å; D170-T174 PolarHBondContact O-OG1 2.86Å
171	A	97.9	Very high	95.4	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.3	-44.4	172.9	0	0	0	0	0	111.4	Y121 F156 V160 V167 A168 S173 T174 F175	Y121-A171 HydrophobicContact CD1-CB 3.8Å; Y121-A171 VanDerWaalsContact CE1-CA 3.47Å; Y121-A171 HydrophobicContact CE1-CB 3.59Å; Y121-A171 HydrophobicContact CG-CB 4.43Å; Y121-A171 WeakPolarHBondContact OH-CA 3.42Å; Y121-A171 PolarHBondContact OH-N 3.19Å; F156-A171 HydrophobicContact CD1-CB 4.33Å; F156-A171 WeakPolarHBondContact CD1-O 3.42Å; F156-A171 HydrophobicContact CE1-CB 4.48Å; V160-A171 HydrophobicContact CG1-CB 4.4Å; V167-A171 VanDerWaalsContact O-CB 3.3Å; V167-A171 WeakPolarHBondContact O-CB 3.15Å; V167-A171 PolarHBondContact O-N 3.14Å; A168-A171 PolarHBondContact O-N 3.47Å; A171-S173 VanDerWaalsContact C-N 3.31Å; A171-S173 PolarHBondContact O-N 3.13Å; A171-T174 PolarHBondContact O-N 3.24Å; A171-F175 WeakPolarHBondContact O-CB 3.41Å; A171-F175 PolarHBondContact O-N 2.83Å
172	F	97.9	Very high	95.6	Very high	16 Å²	16	42.4 Å²	42.4	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-41.4	176.1	-170.8	-82.4	0	0	0	111.5	V160 A168 D170 T174 F175 K176 Q215 L219	V160-F172 HydrophobicContact CB-CD2 4.3Å; V160-F172 HydrophobicContact CG1-CB 3.89Å; V160-F172 HydrophobicContact CG1-CD2 3.97Å; V160-F172 HydrophobicContact CG1-CG 4.4Å; A168-F172 WeakPolarHBondContact O-CB 3.39Å; A168-F172 PolarHBondContact O-N 3.34Å; D170-F172 VanDerWaalsContact C-N 3.32Å; D170-F172 PolarHBondContact O-N 3.41Å; F172-T174 PolarHBondContact O-N 3.37Å; F172-F175 PolarHBondContact O-N 3.48Å; F172-K176 HydrophobicContact CE1-CB 4.37Å; F172-K176 VanDerWaalsContact O-CB 3.29Å; F172-K176 WeakPolarHBondContact O-CB 3.4Å; F172-K176 PolarHBondContact O-N 3.07Å; F172-Q215 HydrophobicContact CD1-CB 4.17Å; F172-Q215 HydrophobicContact CD2-CB 4.37Å; F172-Q215 HydrophobicContact CE1-CB 3.67Å; F172-Q215 HydrophobicContact CE2-CB 3.88Å; F172-Q215 VanDerWaalsContact CZ-C 3.41Å; F172-Q215 HydrophobicContact CZ-CB 3.52Å; F172-Q215 WeakPolarHBondContact CZ-O 3.27Å; F172-L219 HydrophobicContact CE1-CD2 4.2Å; F172-L219 HydrophobicContact CE2-CD2 4.37Å; F172-L219 HydrophobicContact CZ-CB 4.02Å; F172-L219 HydrophobicContact CZ-CD2 3.68Å
173	S	97.5	Very high	96.1	Very high	57 Å²	57	45.7 Å²	45.7	40%	0.399	24%	0.241	S	C	.	.	H	α-helix	trans	-62.9	-41.8	177.8	-59	0	0	0	0	111.7	S169 D170 A171 E177	S169-S173 PolarHBondContact O-N 2.83Å; S169-S173 VanDerWaalsContact O-N 3.09Å; S169-S173 PolarHBondContact O-OG 3.22Å; D170-S173 WeakPolarHBondContact O-CB 3.3Å; D170-S173 PolarHBondContact O-N 2.93Å; D170-S173 VanDerWaalsContact O-N 3.13Å; A171-S173 VanDerWaalsContact C-N 3.31Å; A171-S173 PolarHBondContact O-N 3.13Å; S173-E177 PolarHBondContact O-N 3.03Å; S173-E177 VanDerWaalsContact O-N 3.1Å
174	T	97.8	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.2	-45.3	174.2	-63.9	0	0	0	0	112.1	Y121 L134 R135 F156 D170 A171 F172 K176 E177 L178	Y121-T174 PolarHBondContact OH-OG1 3.38Å; L134-T174 HydrophobicContact CB-CG2 4.37Å; L134-T174 HydrophobicContact CD2-CG2 3.71Å; L134-T174 HydrophobicContact CG-CG2 3.94Å; R135-T174 HydrophobicContact CG-CG2 4.16Å; R135-T174 WeakPolarHBondContact CG-OG1 3.48Å; R135-T174 PolarHBondContact NH1-OG1 2.93Å; F156-T174 HydrophobicContact CE1-CG2 3.82Å; F156-T174 HydrophobicContact CZ-CG2 3.62Å; D170-T174 PolarHBondContact O-N 3.47Å; D170-T174 PolarHBondContact O-OG1 2.86Å; A171-T174 PolarHBondContact O-N 3.24Å; F172-T174 PolarHBondContact O-N 3.37Å; T174-K176 VanDerWaalsContact C-N 3.35Å; T174-K176 PolarHBondContact O-N 3.28Å; T174-E177 PolarHBondContact O-N 2.91Å; T174-L178 HydrophobicContact CG2-CD1 3.81Å; T174-L178 HydrophobicContact CG2-CG 4.48Å; T174-L178 WeakPolarHBondContact O-CG 3.26Å; T174-L178 PolarHBondContact O-N 2.94Å
175	F	98.1	Very high	97	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-46.2	177.3	-179.6	-118.9	0	0	0	111.5	F156 F157 A171 F172 E177 L178 I179 F197 Y201	F156-F175 HydrophobicContact CB-CB 4.05Å; F156-F175 HydrophobicContact CB-CD2 3.54Å; F156-F175 HydrophobicContact CB-CE2 4.21Å; F156-F175 HydrophobicContact CB-CG 3.94Å; F156-F175 HydrophobicContact CD1-CB 3.78Å; F156-F175 HydrophobicContact CD2-CD2 4.42Å; F156-F175 HydrophobicContact CE1-CB 4.49Å; F156-F175 HydrophobicContact CG-CB 4Å; F156-F175 AromaticContact CG-CD2 3.96Å; F156-F175 HydrophobicContact CG-CD2 3.96Å; F156-F175 HydrophobicContact CG-CG 4.33Å; F157-F175 HydrophobicContact CE1-CE1 4.37Å; F157-F175 AromaticContact CE1-CZ 3.94Å; F157-F175 HydrophobicContact CE1-CZ 3.94Å; F157-F175 HydrophobicContact CE2-CZ 4.3Å; F157-F175 HydrophobicContact CZ-CE2 4.39Å; F157-F175 AromaticContact CZ-CZ 3.74Å; F157-F175 HydrophobicContact CZ-CZ 3.74Å; A171-F175 WeakPolarHBondContact O-CB 3.41Å; A171-F175 PolarHBondContact O-N 2.83Å; F172-F175 PolarHBondContact O-N 3.48Å; F175-E177 PolarHBondContact O-N 3.48Å; F175-L178 WeakPolarHBondContact O-CB 3.29Å; F175-L178 PolarHBondContact O-N 3.39Å; F175-I179 HydrophobicContact CD1-CD1 4.37Å; F175-I179 HydrophobicContact CD2-CG2 4.41Å; F175-I179 HydrophobicContact CE1-CD1 3.86Å; F175-I179 HydrophobicContact CE2-CG2 4.03Å; F175-I179 HydrophobicContact CZ-CD1 3.95Å; F175-I179 HydrophobicContact CZ-CG2 4.4Å; F175-I179 WeakPolarHBondContact O-CG1 3.4Å; F175-I179 PolarHBondContact O-N 3.14Å; F175-I179 VanDerWaalsContact O-N 3.14Å; F175-F197 HydrophobicContact CE2-CE2 4.24Å; F175-F197 AromaticContact CZ-CE2 3.73Å; F175-F197 HydrophobicContact CZ-CE2 3.73Å; F175-F197 AromaticContact CZ-CZ 3.98Å; F175-F197 HydrophobicContact CZ-CZ 3.98Å; F175-Y201 HydrophobicContact CE1-CE2 4.19Å
176	K	98.1	Very high	97.3	Very high	60 Å²	60	34.4 Å²	34.4	26%	0.261	18%	0.179	S	C	.	.	H	α-helix	trans	-55.4	-50.5	173.6	175	169.4	-176.6	166	0	111.3	F172 T174 L178 I179 T180 L219 E222	F172-K176 HydrophobicContact CE1-CB 4.37Å; F172-K176 VanDerWaalsContact O-CB 3.29Å; F172-K176 WeakPolarHBondContact O-CB 3.4Å; F172-K176 PolarHBondContact O-N 3.07Å; T174-K176 VanDerWaalsContact C-N 3.35Å; T174-K176 PolarHBondContact O-N 3.28Å; K176-L178 VanDerWaalsContact C-N 3.32Å; K176-L178 PolarHBondContact O-N 3.02Å; K176-I179 PolarHBondContact O-N 2.97Å; K176-T180 HydrophobicContact CG-CG2 4.44Å; K176-T180 WeakPolarHBondContact O-CB 3.38Å; K176-T180 WeakPolarHBondContact O-CG2 3.42Å; K176-T180 PolarHBondContact O-N 3.42Å; K176-T180 VanDerWaalsContact O-N 3.09Å; K176-T180 PolarHBondContact O-OG1 2.79Å; K176-L219 HydrophobicContact CB-CD1 4.5Å; K176-L219 HydrophobicContact CB-CD2 4.15Å; K176-L219 HydrophobicContact CD-CD1 4.22Å; K176-L219 HydrophobicContact CG-CD1 3.9Å; K176-L219 HydrophobicContact CG-CD2 4.42Å; K176-E222 WeakPolarHBondContact CE-OE2 3.41Å; K176-E222 IonicContact NZ-OE1 3.83Å; K176-E222 PolarHBondContact NZ-OE1 2.83Å; K176-E222 IonicContact NZ-OE2 2.74Å; K176-E222 PolarHBondContact NZ-OE2 3.31Å
177	E	97.9	Very high	97.6	Very high	34 Å²	34	28.3 Å²	28.3	16%	0.159	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-41.2	-179.6	-166.8	164.4	-168.3	0	0	111.4	R135 V138 S173 T174 F175 I179 T180 K181	R135-E177 WeakPolarHBondContact CB-OE2 3.06Å; R135-E177 WeakPolarHBondContact CD-OE2 3.48Å; R135-E177 WeakPolarHBondContact CG-OE2 3.36Å; V138-E177 HydrophobicContact CG1-CG 3.94Å; S173-E177 PolarHBondContact O-N 3.03Å; S173-E177 VanDerWaalsContact O-N 3.1Å; T174-E177 PolarHBondContact O-N 2.91Å; F175-E177 PolarHBondContact O-N 3.48Å; E177-I179 VanDerWaalsContact C-N 3.31Å; E177-I179 PolarHBondContact O-N 3.02Å; E177-T180 PolarHBondContact O-N 2.93Å; E177-K181 HydrophobicContact CG-CB 4.12Å; E177-K181 HydrophobicContact CG-CD 4.16Å; E177-K181 HydrophobicContact CG-CG 4.44Å; E177-K181 WeakPolarHBondContact O-CB 3.47Å; E177-K181 PolarHBondContact O-N 3.32Å; E177-K181 IonicContact OE1-NZ 3.5Å; E177-K181 PolarHBondContact OE1-NZ 2.84Å
178	L	97.6	Very high	97.8	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-56.3	-41.7	177.1	-81	159.8	0	0	0	113.4	V138 I147 L148 I153 F156 T174 F175 K176 C186	V138-L178 HydrophobicContact CB-CD2 4.45Å; V138-L178 HydrophobicContact CG1-CD2 4.27Å; V138-L178 HydrophobicContact CG1-CG 4.49Å; V138-L178 HydrophobicContact CG2-CD2 3.28Å; V138-L178 HydrophobicContact CG2-CG 3.78Å; I147-L178 HydrophobicContact CB-CD2 4.11Å; I147-L178 HydrophobicContact CG2-CD1 4.42Å; I147-L178 HydrophobicContact CG2-CD2 3.45Å; I147-L178 VanDerWaalsContact CG2-CD2 3.45Å; L148-L178 HydrophobicContact CD2-CB 4.49Å; I153-L178 HydrophobicContact CD1-CB 4.37Å; I153-L178 HydrophobicContact CD1-CD1 3.68Å; I153-L178 HydrophobicContact CD1-CD2 4.21Å; I153-L178 HydrophobicContact CD1-CG 4.31Å; F156-L178 HydrophobicContact CD2-CD1 4.3Å; F156-L178 HydrophobicContact CE2-CD1 3.64Å; F156-L178 HydrophobicContact CZ-CD1 3.86Å; T174-L178 HydrophobicContact CG2-CD1 3.81Å; T174-L178 HydrophobicContact CG2-CG 4.48Å; T174-L178 WeakPolarHBondContact O-CG 3.26Å; T174-L178 PolarHBondContact O-N 2.94Å; F175-L178 WeakPolarHBondContact O-CB 3.29Å; F175-L178 PolarHBondContact O-N 3.39Å; K176-L178 VanDerWaalsContact C-N 3.32Å; K176-L178 PolarHBondContact O-N 3.02Å; L178-C186 PolarHBondContact O-SG 3.43Å; L178-C186 VanDerWaalsContact O-SG 3.35Å
179	I	97.6	Very high	97.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-98.5	4.8	-175.5	72.9	175.6	0	0	0	114.3	F175 K176 E177 C186 F189 F197 L219 L223	F175-I179 HydrophobicContact CD1-CD1 4.37Å; F175-I179 HydrophobicContact CD2-CG2 4.41Å; F175-I179 HydrophobicContact CE1-CD1 3.86Å; F175-I179 HydrophobicContact CE2-CG2 4.03Å; F175-I179 HydrophobicContact CZ-CD1 3.95Å; F175-I179 HydrophobicContact CZ-CG2 4.4Å; F175-I179 WeakPolarHBondContact O-CG1 3.4Å; F175-I179 PolarHBondContact O-N 3.14Å; F175-I179 VanDerWaalsContact O-N 3.14Å; K176-I179 PolarHBondContact O-N 2.97Å; E177-I179 VanDerWaalsContact C-N 3.31Å; E177-I179 PolarHBondContact O-N 3.02Å; I179-C186 VanDerWaalsContact O-CB 3.32Å; I179-C186 WeakPolarHBondContact O-CB 3.4Å; I179-F189 HydrophobicContact CG2-CE1 4.45Å; I179-F197 HydrophobicContact CD1-CE2 4.38Å; I179-F197 HydrophobicContact CD1-CZ 3.8Å; I179-F197 HydrophobicContact CG2-CE2 4.32Å; I179-L219 HydrophobicContact CD1-CD2 3.99Å; I179-L219 HydrophobicContact CD1-CG 4.46Å; I179-L223 HydrophobicContact CD1-CD1 3.88Å; I179-L223 HydrophobicContact CD1-CD2 4.43Å; I179-L223 HydrophobicContact CG1-CD2 4.39Å
180	T	97.9	Very high	98	Very high	24 Å²	24	29.2 Å²	29.2	15%	0.147	15%	0.149	C	C	.	.	H	α-helix	trans	-133.4	-13.4	-179.5	63.6	0	0	0	0	115.7	K176 E177 K183 L219 L223	K176-T180 HydrophobicContact CG-CG2 4.44Å; K176-T180 WeakPolarHBondContact O-CB 3.38Å; K176-T180 WeakPolarHBondContact O-CG2 3.42Å; K176-T180 PolarHBondContact O-N 3.42Å; K176-T180 VanDerWaalsContact O-N 3.09Å; K176-T180 PolarHBondContact O-OG1 2.79Å; E177-T180 PolarHBondContact O-N 2.93Å; T180-K183 WeakPolarHBondContact O-CD 3.45Å; T180-K183 VanDerWaalsContact O-CE 3.27Å; T180-K183 WeakPolarHBondContact O-CE 3.47Å; T180-K183 PolarHBondContact O-NZ 3.49Å; T180-L219 HydrophobicContact CG2-CD1 3.76Å; T180-L223 HydrophobicContact CG2-CD2 3.88Å
181	K	97.8	Very high	98.1	Very high	89 Å²	89	33 Å²	33	39%	0.387	17%	0.166	S	C	.	.	S	Bend	trans	-67.5	-56.6	-173.8	-172.4	68.3	165.1	-146.5	0	112.9	V138 E177	V138-K181 HydrophobicContact CG1-CB 4.19Å; V138-K181 HydrophobicContact CG1-CG 4.47Å; E177-K181 HydrophobicContact CG-CB 4.12Å; E177-K181 HydrophobicContact CG-CD 4.16Å; E177-K181 HydrophobicContact CG-CG 4.44Å; E177-K181 WeakPolarHBondContact O-CB 3.47Å; E177-K181 PolarHBondContact O-N 3.32Å; E177-K181 IonicContact OE1-NZ 3.5Å; E177-K181 PolarHBondContact OE1-NZ 2.84Å
182	H	98.3	Very high	98.1	Very high	34 Å²	34	40.3 Å²	40.3	16%	0.157	20%	0.2	C	C	.	.	S	Bend	trans	-103.8	87.9	-173.9	-61.4	-66.4	0	0	0	109.2	V138 R139 E141 A144 V184 L185 C186	V138-H182 PolarHBondContact O-NE2 3.44Å; R139-H182 PolarHBondContact O-CE1 2.66Å; E141-H182 HydrophobicContact CG-CB 4.34Å; E141-H182 PolarHBondContact N-CE1 3.18Å; E141-H182 PolarHBondContact N-NE2 2.78Å; A144-H182 WeakPolarHBondContact CB-CD2 3.39Å; H182-V184 VanDerWaalsContact C-N 3.34Å; H182-V184 PolarHBondContact O-N 3.06Å; H182-V184 VanDerWaalsContact O-N 3.15Å; H182-L185 HydrophobicContact CB-CB 3.94Å; H182-L185 HydrophobicContact CB-CD2 4.1Å; H182-L185 PolarHBondContact O-N 3.37Å; H182-C186 PolarHBondContact O-N 2.71Å; H182-C186 PolarHBondContact O-SG 3.24Å
183	K	98.2	Very high	98.1	Very high	83 Å²	83	42 Å²	42	36%	0.361	21%	0.21	S	C	.	.	H	α-helix	trans	-49.5	-46.8	-164.3	-58.8	-58.1	-171.9	166	0	115.2	T180 A187 D226 H228	T180-K183 WeakPolarHBondContact O-CD 3.45Å; T180-K183 VanDerWaalsContact O-CE 3.27Å; T180-K183 WeakPolarHBondContact O-CE 3.47Å; T180-K183 PolarHBondContact O-NZ 3.49Å; K183-A187 WeakPolarHBondContact O-CB 3.32Å; K183-A187 PolarHBondContact O-N 3.46Å; K183-D226 VanDerWaalsContact CD-OD2 3.27Å; K183-D226 WeakPolarHBondContact CD-OD2 3.37Å; K183-D226 WeakPolarHBondContact CE-OD2 3.39Å; K183-D226 IonicContact NZ-OD2 3.58Å; K183-D226 PolarHBondContact NZ-OD2 2.93Å; K183-H228 HydrophobicContact CB-CB 4.39Å; K183-H228 WeakPolarHBondContact CB-ND1 3.35Å
184	V	98.2	Very high	98.1	Very high	84 Å²	84	40.1 Å²	40.1	51%	0.509	19%	0.194	S	C	.	.	H	α-helix	trans	-66.1	-49.5	179.7	-179.6	0	0	0	0	111	H182 C186 A187 E188	H182-V184 VanDerWaalsContact C-N 3.34Å; H182-V184 PolarHBondContact O-N 3.06Å; H182-V184 VanDerWaalsContact O-N 3.15Å; V184-C186 PolarHBondContact O-N 3.42Å; V184-A187 PolarHBondContact O-N 2.75Å; V184-E188 WeakPolarHBondContact O-CG 3.44Å; V184-E188 PolarHBondContact O-N 2.93Å
185	L	98.3	Very high	98.1	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-43.4	177.3	168	65.7	0	0	0	112.2	E141 A144 R145 L148 H182 E188 F189	E141-L185 HydrophobicContact CG-CD2 4.19Å; A144-L185 HydrophobicContact CB-CD2 4.02Å; R145-L185 HydrophobicContact CB-CD1 3.94Å; R145-L185 HydrophobicContact CB-CD2 3.88Å; R145-L185 HydrophobicContact CG-CD1 3.81Å; L148-L185 HydrophobicContact CD1-CD1 4.25Å; L148-L185 HydrophobicContact CD1-CD2 3.95Å; L148-L185 HydrophobicContact CD1-CG 3.8Å; H182-L185 HydrophobicContact CB-CB 3.94Å; H182-L185 HydrophobicContact CB-CD2 4.1Å; H182-L185 PolarHBondContact O-N 3.37Å; L185-E188 PolarHBondContact O-N 2.98Å; L185-F189 WeakPolarHBondContact O-CB 3.3Å; L185-F189 PolarHBondContact O-N 3.47Å
186	C	98.3	Very high	98.1	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.02	24%	0.236	C	C	.	.	H	α-helix	trans	-66.1	-39.9	178.9	-60.8	0	0	0	0	111.2	L178 I179 H182 V184 F189 L190	L178-C186 PolarHBondContact O-SG 3.43Å; L178-C186 VanDerWaalsContact O-SG 3.35Å; I179-C186 VanDerWaalsContact O-CB 3.32Å; I179-C186 WeakPolarHBondContact O-CB 3.4Å; H182-C186 PolarHBondContact O-N 2.71Å; H182-C186 PolarHBondContact O-SG 3.24Å; V184-C186 PolarHBondContact O-N 3.42Å; C186-F189 PolarHBondContact O-N 3.38Å; C186-L190 WeakPolarHBondContact O-CB 3.31Å; C186-L190 VanDerWaalsContact O-CG 3.24Å; C186-L190 WeakPolarHBondContact O-CG 3.36Å; C186-L190 PolarHBondContact O-N 3.18Å
187	A	98.4	Very high	98.1	Very high	10 Å²	10	46.6 Å²	46.6	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-46.5	174.7	0	0	0	0	0	111.9	K183 V184 F189 L190 E191 H228 N229	K183-A187 WeakPolarHBondContact O-CB 3.32Å; K183-A187 PolarHBondContact O-N 3.46Å; V184-A187 PolarHBondContact O-N 2.75Å; A187-F189 VanDerWaalsContact C-N 3.34Å; A187-F189 PolarHBondContact O-N 2.83Å; A187-L190 PolarHBondContact O-N 3.44Å; A187-E191 WeakPolarHBondContact O-CB 3.24Å; A187-E191 PolarHBondContact O-N 3.22Å; A187-H228 HydrophobicContact CB-CB 4.03Å; A187-H228 WeakPolarHBondContact CB-O 3.44Å; A187-N229 VanDerWaalsContact CA-OD1 3.31Å; A187-N229 WeakPolarHBondContact CA-OD1 3.42Å; A187-N229 VanDerWaalsContact CB-OD1 3.3Å; A187-N229 WeakPolarHBondContact CB-OD1 3.39Å
188	E	98.1	Very high	98.1	Very high	73 Å²	73	45.7 Å²	45.7	34%	0.341	22%	0.219	S	C	.	.	H	α-helix	trans	-55.6	-48.2	174	-73.2	171.1	-177.3	0	0	111.3	R145 V184 L185 E191 Q192	R145-E188 IonicContact NH1-OE2 3.73Å; R145-E188 PolarHBondContact NH1-OE2 2.82Å; R145-E188 VanDerWaalsContact NH1-OE2 3.12Å; V184-E188 WeakPolarHBondContact O-CG 3.44Å; V184-E188 PolarHBondContact O-N 2.93Å; L185-E188 PolarHBondContact O-N 2.98Å; E188-E191 PolarHBondContact O-N 3.42Å; E188-Q192 WeakPolarHBondContact O-CB 3.46Å; E188-Q192 VanDerWaalsContact O-CG 3.22Å; E188-Q192 WeakPolarHBondContact O-CG 3.24Å; E188-Q192 PolarHBondContact O-N 3.12Å
189	F	98.5	Very high	98.1	Very high	14 Å²	14	50.6 Å²	50.6	6%	0.061	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-48.3	178.6	168.4	-98.9	0	0	0	112.2	L148 I153 I179 L185 C186 A187 N193 F197	L148-F189 HydrophobicContact CB-CD2 4.02Å; L148-F189 HydrophobicContact CB-CE2 4.43Å; L148-F189 HydrophobicContact CB-CG 4.43Å; L148-F189 HydrophobicContact CD1-CB 4.31Å; L148-F189 HydrophobicContact CD1-CG 4.43Å; L148-F189 HydrophobicContact CD2-CD1 4.15Å; L148-F189 HydrophobicContact CD2-CD2 4.27Å; L148-F189 HydrophobicContact CD2-CE1 4.22Å; L148-F189 HydrophobicContact CD2-CE2 4.34Å; L148-F189 HydrophobicContact CD2-CG 4.18Å; L148-F189 HydrophobicContact CD2-CZ 4.32Å; L148-F189 WeakPolarHBondContact O-CE2 3.48Å; I153-F189 HydrophobicContact CG2-CE2 4.49Å; I153-F189 HydrophobicContact CG2-CZ 4.29Å; I179-F189 HydrophobicContact CG2-CE1 4.45Å; L185-F189 WeakPolarHBondContact O-CB 3.3Å; L185-F189 PolarHBondContact O-N 3.47Å; C186-F189 PolarHBondContact O-N 3.38Å; A187-F189 VanDerWaalsContact C-N 3.34Å; A187-F189 PolarHBondContact O-N 2.83Å; F189-N193 WeakPolarHBondContact CD2-ND2 3.35Å; F189-N193 WeakPolarHBondContact O-CB 3.23Å; F189-N193 PolarHBondContact O-N 3.1Å; F189-N193 PolarHBondContact O-ND2 2.92Å; F189-F197 AromaticContact CE1-CD2 3.89Å; F189-F197 HydrophobicContact CE1-CD2 3.89Å; F189-F197 HydrophobicContact CE1-CE2 4.14Å; F189-F197 HydrophobicContact CZ-CD2 4.38Å
190	L	98.6	Very high	98.1	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-37.3	-178.6	-71.1	171.2	0	0	0	112.3	C186 A187 Y194 F197 L223 V232	C186-L190 WeakPolarHBondContact O-CB 3.31Å; C186-L190 VanDerWaalsContact O-CG 3.24Å; C186-L190 WeakPolarHBondContact O-CG 3.36Å; C186-L190 PolarHBondContact O-N 3.18Å; A187-L190 PolarHBondContact O-N 3.44Å; L190-Y194 WeakPolarHBondContact O-CA 3.19Å; L190-Y194 WeakPolarHBondContact O-CB 3.39Å; L190-Y194 PolarHBondContact O-N 3.44Å; L190-F197 HydrophobicContact CD2-CD1 3.56Å; L190-F197 HydrophobicContact CD2-CD2 3.98Å; L190-F197 HydrophobicContact CD2-CE1 3.43Å; L190-F197 VanDerWaalsContact CD2-CE1 3.43Å; L190-F197 HydrophobicContact CD2-CE2 3.85Å; L190-F197 HydrophobicContact CD2-CG 3.84Å; L190-F197 HydrophobicContact CD2-CZ 3.59Å; L190-L223 HydrophobicContact CD1-CD2 4.05Å; L190-V232 HydrophobicContact CB-CG2 3.8Å
191	E	98	Very high	98.1	Very high	98 Å²	98	50.7 Å²	50.7	46%	0.458	25%	0.247	S	C	.	.	H	α-helix	trans	-68.9	-45.9	177.7	-175.6	167.7	-161.2	0	0	111.5	A187 E188 N193 N231 V232	A187-E191 WeakPolarHBondContact O-CB 3.24Å; A187-E191 PolarHBondContact O-N 3.22Å; E188-E191 PolarHBondContact O-N 3.42Å; E191-N193 VanDerWaalsContact C-N 3.34Å; E191-N193 PolarHBondContact O-N 3.27Å; E191-N231 PolarHBondContact OE1-ND2 3.21Å; E191-N231 PolarHBondContact OE2-ND2 2.97Å; E191-V232 HydrophobicContact CB-CG2 4.22Å
192	Q	97.9	Very high	98.1	Very high	155 Å²	155	50.3 Å²	50.3	72%	0.724	25%	0.247	S	C	*	.	H	α-helix	trans	-67.6	-32.3	179.8	-70.7	172.9	13.4	0	0	113.1	E188	E188-Q192 WeakPolarHBondContact O-CB 3.46Å; E188-Q192 VanDerWaalsContact O-CG 3.22Å; E188-Q192 WeakPolarHBondContact O-CG 3.24Å; E188-Q192 PolarHBondContact O-N 3.12Å
193	N	98.1	Very high	98	Very high	52 Å²	52	55.3 Å²	55.3	28%	0.278	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	18.2	-175.6	-63.4	-85.1	0	0	0	113.3	F189 E191 D195 R196 F197	F189-N193 WeakPolarHBondContact CD2-ND2 3.35Å; F189-N193 WeakPolarHBondContact O-CB 3.23Å; F189-N193 PolarHBondContact O-N 3.1Å; F189-N193 PolarHBondContact O-ND2 2.92Å; E191-N193 VanDerWaalsContact C-N 3.34Å; E191-N193 PolarHBondContact O-N 3.27Å; N193-D195 PolarHBondContact O-N 3.32Å; N193-R196 PolarHBondContact O-N 3.44Å; N193-F197 VanDerWaalsContact O-CB 3.27Å; N193-F197 WeakPolarHBondContact O-CB 3.46Å; N193-F197 PolarHBondContact O-N 2.61Å
194	Y	98.5	Very high	97.9	Very high	16 Å²	16	51.5 Å²	51.5	6%	0.063	25%	0.253	C	S	.	.	H	α-helix	trans	-48.1	-55	-166.1	-177.6	-80.6	0	0	0	113.8	L190 F197 F198 V232 R235 Y236	L190-Y194 WeakPolarHBondContact O-CA 3.19Å; L190-Y194 WeakPolarHBondContact O-CB 3.39Å; L190-Y194 PolarHBondContact O-N 3.44Å; Y194-F197 PolarHBondContact O-N 2.93Å; Y194-F198 HydrophobicContact CD1-CD2 4.17Å; Y194-F198 AromaticContact CD2-CD2 3.65Å; Y194-F198 HydrophobicContact CD2-CD2 3.65Å; Y194-F198 AromaticContact CD2-CE2 3.64Å; Y194-F198 HydrophobicContact CD2-CE2 3.64Å; Y194-F198 HydrophobicContact CE1-CD2 4.08Å; Y194-F198 AromaticContact CE2-CD2 3.56Å; Y194-F198 HydrophobicContact CE2-CD2 3.56Å; Y194-F198 AromaticContact CE2-CE2 3.51Å; Y194-F198 HydrophobicContact CE2-CE2 3.51Å; Y194-F198 HydrophobicContact CE2-CZ 4.43Å; Y194-F198 AromaticContact CG-CD2 3.96Å; Y194-F198 HydrophobicContact CG-CD2 3.96Å; Y194-F198 HydrophobicContact CG-CE2 4.37Å; Y194-F198 AromaticContact CZ-CD2 3.76Å; Y194-F198 WeakPolarHBondContact O-CB 3.43Å; Y194-F198 WeakPolarHBondContact O-CD2 3.22Å; Y194-F198 PolarHBondContact O-N 3.09Å; Y194-V232 HydrophobicContact CD2-CG1 4.17Å; Y194-V232 HydrophobicContact CE2-CG1 4.03Å; Y194-R235 VanDerWaalsContact CD1-CD 3.49Å; Y194-R235 HydrophobicContact CD1-CG 4.24Å; Y194-R235 HydrophobicContact CD2-CB 4.38Å; Y194-R235 HydrophobicContact CD2-CG 4.37Å; Y194-R235 HydrophobicContact CE1-CB 4.48Å; Y194-R235 VanDerWaalsContact CE1-CD 3.5Å; Y194-R235 HydrophobicContact CE1-CG 3.71Å; Y194-R235 HydrophobicContact CE2-CB 3.7Å; Y194-R235 HydrophobicContact CE2-CG 3.83Å; Y194-R235 VanDerWaalsContact CZ-CG 3.49Å; Y194-R235 VanDerWaalsContact OH-C 3.29Å; Y194-Y236 WeakPolarHBondContact OH-CA 3.47Å; Y194-Y236 PolarHBondContact OH-N 3.26Å
195	D	98	Very high	97.8	Very high	88 Å²	88	47.6 Å²	47.6	47%	0.471	23%	0.23	S	C	.	.	H	α-helix	trans	-63.2	-54.2	-173.3	-63.5	-54.6	0	0	0	110.9	N193 F197 F198 D199 R235	N193-D195 PolarHBondContact O-N 3.32Å; D195-F197 VanDerWaalsContact C-N 3.31Å; D195-F197 PolarHBondContact O-N 3.33Å; D195-F198 PolarHBondContact O-N 3.31Å; D195-D199 VanDerWaalsContact O-CB 3.28Å; D195-D199 WeakPolarHBondContact O-CB 3.37Å; D195-D199 PolarHBondContact O-N 2.72Å; D195-R235 IonicContact OD1-CZ 2.72Å; D195-R235 IonicContact OD1-NH2 3.96Å; D195-R235 PolarHBondContact OD1-NH2 3.24Å; D195-R235 IonicContact OD2-CZ 3.69Å; D195-R235 IonicContact OD2-NH1 2.88Å; D195-R235 IonicContact OD2-NH2 3.29Å; D195-R235 PolarHBondContact OD2-NH2 2.84Å
196	R	97.8	Very high	97.7	Very high	109 Å²	109	51.6 Å²	51.6	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-59.7	-41	179.4	-173	-177.9	173.3	-176.1	-0.2	112.5	E151 Y154 N193 S200	E151-R196 IonicContact OE1-NH1 3.94Å; E151-R196 PolarHBondContact OE1-NH1 2.96Å; E151-R196 IonicContact OE2-CZ 2.68Å; E151-R196 IonicContact OE2-NH1 2.75Å; E151-R196 PolarHBondContact OE2-NH1 3.33Å; E151-R196 IonicContact OE2-NH2 3.32Å; E151-R196 PolarHBondContact OE2-NH2 3.33Å; Y154-R196 HydrophobicContact CD1-CG 4.38Å; Y154-R196 HydrophobicContact CE1-CB 4.41Å; Y154-R196 HydrophobicContact CE1-CG 3.64Å; Y154-R196 VanDerWaalsContact CE2-CZ 3.49Å; N193-R196 PolarHBondContact O-N 3.44Å; R196-S200 PolarHBondContact O-N 2.75Å; R196-S200 PolarHBondContact O-OG 3.22Å
197	F	98.4	Very high	97.5	Very high	2 Å²	2	52 Å²	52	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-52.3	179.5	-178.1	-89.8	0	0	0	111.2	F157 F175 I179 F189 L190 N193 Y194 D195 S200 Y201	F157-F197 HydrophobicContact CE2-CD2 4.46Å; F157-F197 AromaticContact CZ-CD2 3.98Å; F157-F197 HydrophobicContact CZ-CD2 3.98Å; F157-F197 AromaticContact CZ-CE2 3.9Å; F157-F197 HydrophobicContact CZ-CE2 3.9Å; F157-F197 HydrophobicContact CZ-CZ 4.39Å; F175-F197 HydrophobicContact CE2-CE2 4.24Å; F175-F197 AromaticContact CZ-CE2 3.73Å; F175-F197 HydrophobicContact CZ-CE2 3.73Å; F175-F197 AromaticContact CZ-CZ 3.98Å; F175-F197 HydrophobicContact CZ-CZ 3.98Å; I179-F197 HydrophobicContact CD1-CE2 4.38Å; I179-F197 HydrophobicContact CD1-CZ 3.8Å; I179-F197 HydrophobicContact CG2-CE2 4.32Å; F189-F197 AromaticContact CE1-CD2 3.89Å; F189-F197 HydrophobicContact CE1-CD2 3.89Å; F189-F197 HydrophobicContact CE1-CE2 4.14Å; F189-F197 HydrophobicContact CZ-CD2 4.38Å; L190-F197 HydrophobicContact CD2-CD1 3.56Å; L190-F197 HydrophobicContact CD2-CD2 3.98Å; L190-F197 HydrophobicContact CD2-CE1 3.43Å; L190-F197 VanDerWaalsContact CD2-CE1 3.43Å; L190-F197 HydrophobicContact CD2-CE2 3.85Å; L190-F197 HydrophobicContact CD2-CG 3.84Å; L190-F197 HydrophobicContact CD2-CZ 3.59Å; N193-F197 VanDerWaalsContact O-CB 3.27Å; N193-F197 WeakPolarHBondContact O-CB 3.46Å; N193-F197 PolarHBondContact O-N 2.61Å; Y194-F197 PolarHBondContact O-N 2.93Å; D195-F197 VanDerWaalsContact C-N 3.31Å; D195-F197 PolarHBondContact O-N 3.33Å; F197-S200 PolarHBondContact O-N 3.05Å; F197-Y201 HydrophobicContact CD1-CD2 4.46Å; F197-Y201 AromaticContact CE1-CD2 3.51Å; F197-Y201 HydrophobicContact CE1-CD2 3.51Å; F197-Y201 HydrophobicContact CE1-CE2 4.17Å; F197-Y201 HydrophobicContact CE1-CG 4.2Å; F197-Y201 AromaticContact CZ-CD2 3.59Å; F197-Y201 HydrophobicContact CZ-CD2 3.59Å; F197-Y201 HydrophobicContact CZ-CE2 4.04Å; F197-Y201 WeakPolarHBondContact O-CB 3.36Å; F197-Y201 PolarHBondContact O-N 3.07Å
198	F	98.2	Very high	97.2	Very high	15 Å²	15	60.9 Å²	60.9	7%	0.066	29%	0.294	C	S	.	.	H	α-helix	trans	-73.7	-29.1	-176.3	-79.4	-75.7	0	0	0	113.4	Y194 D195 S200 Y201 Q202 L220 V232 Y236	Y194-F198 HydrophobicContact CD1-CD2 4.17Å; Y194-F198 AromaticContact CD2-CD2 3.65Å; Y194-F198 HydrophobicContact CD2-CD2 3.65Å; Y194-F198 AromaticContact CD2-CE2 3.64Å; Y194-F198 HydrophobicContact CD2-CE2 3.64Å; Y194-F198 HydrophobicContact CE1-CD2 4.08Å; Y194-F198 AromaticContact CE2-CD2 3.56Å; Y194-F198 HydrophobicContact CE2-CD2 3.56Å; Y194-F198 AromaticContact CE2-CE2 3.51Å; Y194-F198 HydrophobicContact CE2-CE2 3.51Å; Y194-F198 HydrophobicContact CE2-CZ 4.43Å; Y194-F198 AromaticContact CG-CD2 3.96Å; Y194-F198 HydrophobicContact CG-CD2 3.96Å; Y194-F198 HydrophobicContact CG-CE2 4.37Å; Y194-F198 AromaticContact CZ-CD2 3.76Å; Y194-F198 WeakPolarHBondContact O-CB 3.43Å; Y194-F198 WeakPolarHBondContact O-CD2 3.22Å; Y194-F198 PolarHBondContact O-N 3.09Å; D195-F198 PolarHBondContact O-N 3.31Å; F198-S200 VanDerWaalsContact C-N 3.31Å; F198-S200 PolarHBondContact O-N 3.26Å; F198-Y201 PolarHBondContact O-N 3.47Å; F198-Q202 WeakPolarHBondContact O-CB 3.43Å; F198-Q202 PolarHBondContact O-N 3.2Å; F198-L220 HydrophobicContact CE1-CD1 3.84Å; F198-V232 HydrophobicContact CE2-CG1 3.53Å; F198-V232 HydrophobicContact CZ-CG1 3.62Å; F198-Y236 AromaticContact CD1-CD2 3.66Å; F198-Y236 HydrophobicContact CD1-CD2 3.66Å; F198-Y236 AromaticContact CD1-CE2 3.66Å; F198-Y236 HydrophobicContact CD1-CE2 3.66Å; F198-Y236 AromaticContact CE1-CD2 3.57Å; F198-Y236 HydrophobicContact CE1-CD2 3.57Å; F198-Y236 AromaticContact CE1-CE2 3.8Å; F198-Y236 HydrophobicContact CE1-CE2 3.8Å; F198-Y236 HydrophobicContact CG-CD2 4.34Å; F198-Y236 HydrophobicContact CZ-CD2 4.2Å
199	D	97.2	Very high	96.9	Very high	104 Å²	104	60 Å²	60	56%	0.556	29%	0.292	S	S	*	.	H	α-helix	trans	-60.6	-42.9	170.1	-73.2	-14.8	0	0	0	111.1	D195	D195-D199 VanDerWaalsContact O-CB 3.28Å; D195-D199 WeakPolarHBondContact O-CB 3.37Å; D195-D199 PolarHBondContact O-N 2.72Å
200	S	97.5	Very high	96.7	Very high	25 Å²	25	64 Å²	64	18%	0.175	31%	0.307	C	S	.	.	H	α-helix	trans	-70.7	-41.5	175.6	-53.5	0	0	0	0	111.4	R196 F197 F198 Q202 Q203	R196-S200 PolarHBondContact O-N 2.75Å; R196-S200 PolarHBondContact O-OG 3.22Å; F197-S200 PolarHBondContact O-N 3.05Å; F198-S200 VanDerWaalsContact C-N 3.31Å; F198-S200 PolarHBondContact O-N 3.26Å; S200-Q202 VanDerWaalsContact C-N 3.31Å; S200-Q202 PolarHBondContact O-N 2.95Å; S200-Q203 WeakPolarHBondContact O-CB 3.41Å; S200-Q203 PolarHBondContact O-N 3.44Å; S200-Q203 VanDerWaalsContact O-N 3.14Å
201	Y	98.2	Very high	96.5	Very high	1 Å²	1	66.3 Å²	66.3	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-34.7	-179.8	-154.8	-78	0	0	0	112.6	F157 F175 F197 F198 Q203 L204 L205 S216 L219 L220 L223	F157-Y201 HydrophobicContact CE1-CD2 4Å; F157-Y201 HydrophobicContact CE1-CG 4.39Å; F157-Y201 HydrophobicContact CZ-CD2 4.48Å; F175-Y201 HydrophobicContact CE1-CE2 4.19Å; F197-Y201 HydrophobicContact CD1-CD2 4.46Å; F197-Y201 AromaticContact CE1-CD2 3.51Å; F197-Y201 HydrophobicContact CE1-CD2 3.51Å; F197-Y201 HydrophobicContact CE1-CE2 4.17Å; F197-Y201 HydrophobicContact CE1-CG 4.2Å; F197-Y201 AromaticContact CZ-CD2 3.59Å; F197-Y201 HydrophobicContact CZ-CD2 3.59Å; F197-Y201 HydrophobicContact CZ-CE2 4.04Å; F197-Y201 WeakPolarHBondContact O-CB 3.36Å; F197-Y201 PolarHBondContact O-N 3.07Å; F198-Y201 PolarHBondContact O-N 3.47Å; Y201-Q203 PolarHBondContact O-N 3.3Å; Y201-L204 WeakPolarHBondContact O-CB 3.48Å; Y201-L204 PolarHBondContact O-N 3.04Å; Y201-L205 HydrophobicContact CD1-CD1 4.3Å; Y201-L205 HydrophobicContact CD1-CD2 4.36Å; Y201-L205 HydrophobicContact CD1-CG 4.12Å; Y201-L205 HydrophobicContact CE1-CD2 4.04Å; Y201-L205 HydrophobicContact CE1-CG 4.31Å; Y201-L205 PolarHBondContact O-N 3.01Å; Y201-S216 WeakPolarHBondContact CE1-O 3.47Å; Y201-S216 PolarHBondContact OH-O 3.43Å; Y201-L219 VanDerWaalsContact OH-CB 3.32Å; Y201-L219 WeakPolarHBondContact OH-CB 3.5Å; Y201-L219 WeakPolarHBondContact OH-CG 2.91Å; Y201-L220 HydrophobicContact CE1-CB 3.93Å; Y201-L220 HydrophobicContact CE1-CD1 4.44Å; Y201-L220 PolarHBondContact OH-N 2.83Å; Y201-L223 HydrophobicContact CE2-CD1 4.46Å
202	Q	96.9	Very high	96.4	Very high	81 Å²	81	62 Å²	62	38%	0.379	30%	0.301	S	S	.	.	H	α-helix	trans	-59.6	-30	175.6	-178.9	171	-42.3	0	0	112.2	F198 S200 L204 L205 N206	F198-Q202 WeakPolarHBondContact O-CB 3.43Å; F198-Q202 PolarHBondContact O-N 3.2Å; S200-Q202 VanDerWaalsContact C-N 3.31Å; S200-Q202 PolarHBondContact O-N 2.95Å; Q202-L204 VanDerWaalsContact C-N 3.32Å; Q202-L204 PolarHBondContact O-N 2.99Å; Q202-L205 PolarHBondContact O-N 3.35Å; Q202-N206 PolarHBondContact O-N 3Å; Q202-N206 PolarHBondContact O-ND2 3.43Å
203	Q	96	Very high	96.3	Very high	138 Å²	138	56.7 Å²	56.7	65%	0.645	28%	0.275	S	S	*	.	H	α-helix	trans	-64.3	-39	174.9	-57.7	-179.4	6	0	0	111.4	S200 Y201 L205 N206 S207	S200-Q203 WeakPolarHBondContact O-CB 3.41Å; S200-Q203 PolarHBondContact O-N 3.44Å; S200-Q203 VanDerWaalsContact O-N 3.14Å; Y201-Q203 PolarHBondContact O-N 3.3Å; Q203-L205 VanDerWaalsContact C-N 3.34Å; Q203-L205 PolarHBondContact O-N 3.26Å; Q203-N206 CarbonylContact O-C 3.47Å; Q203-N206 PolarHBondContact O-N 3.22Å; Q203-S207 PolarHBondContact O-N 3.06Å; Q203-S207 VanDerWaalsContact O-N 3.09Å
204	L	97	Very high	96.2	Very high	3 Å²	3	58 Å²	58	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-35.8	176.9	-54.1	-175.9	0	0	0	112.4	F157 V160 E161 Y201 Q202 N206 S207 T212 S216	F157-L204 HydrophobicContact CD1-CD1 3.65Å; F157-L204 HydrophobicContact CD1-CD2 4.28Å; F157-L204 HydrophobicContact CD1-CG 3.88Å; F157-L204 HydrophobicContact CE1-CD1 3.92Å; F157-L204 HydrophobicContact CE1-CG 4.42Å; V160-L204 HydrophobicContact CG2-CD1 4.07Å; V160-L204 HydrophobicContact CG2-CD2 3.41Å; V160-L204 VanDerWaalsContact CG2-CD2 3.41Å; V160-L204 HydrophobicContact CG2-CG 4.4Å; E161-L204 HydrophobicContact CG-CD2 4.14Å; Y201-L204 WeakPolarHBondContact O-CB 3.48Å; Y201-L204 PolarHBondContact O-N 3.04Å; Q202-L204 VanDerWaalsContact C-N 3.32Å; Q202-L204 PolarHBondContact O-N 2.99Å; L204-N206 PolarHBondContact O-N 2.85Å; L204-S207 VanDerWaalsContact O-CB 3.24Å; L204-S207 WeakPolarHBondContact O-CB 3.47Å; L204-S207 PolarHBondContact O-N 3.15Å; L204-T212 HydrophobicContact CB-CG2 4.49Å; L204-T212 HydrophobicContact CD2-CG2 4.13Å; L204-S216 WeakPolarHBondContact CB-OG 3.48Å
205	L	96.8	Very high	96.1	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-68.6	-26.1	176.2	-60.1	177.6	0	0	0	112.4	Y201 Q202 Q203 R213 L217 L220 L245 M246	Y201-L205 HydrophobicContact CD1-CD1 4.3Å; Y201-L205 HydrophobicContact CD1-CD2 4.36Å; Y201-L205 HydrophobicContact CD1-CG 4.12Å; Y201-L205 HydrophobicContact CE1-CD2 4.04Å; Y201-L205 HydrophobicContact CE1-CG 4.31Å; Y201-L205 PolarHBondContact O-N 3.01Å; Q202-L205 PolarHBondContact O-N 3.35Å; Q203-L205 VanDerWaalsContact C-N 3.34Å; Q203-L205 PolarHBondContact O-N 3.26Å; L205-R213 WeakPolarHBondContact O-CD 3.38Å; L205-R213 WeakPolarHBondContact O-CG 3.27Å; L205-L217 HydrophobicContact CD2-CB 4.2Å; L205-L217 HydrophobicContact CD2-CD1 4.13Å; L205-L220 HydrophobicContact CD1-CD2 3.9Å; L205-L220 HydrophobicContact CD2-CD2 4.34Å; L205-L245 HydrophobicContact CB-CD2 4.15Å; L205-L245 HydrophobicContact CD1-CD2 3.71Å; L205-M246 HydrophobicContact CD1-CE 4.2Å
206	N	94.9	Very high	96.1	Very high	92 Å²	92	55.9 Å²	55.9	49%	0.492	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	7	177.1	-67	-45.1	0	0	0	113.3	Q202 Q203 L204	Q202-N206 PolarHBondContact O-N 3Å; Q202-N206 PolarHBondContact O-ND2 3.43Å; Q203-N206 CarbonylContact O-C 3.47Å; Q203-N206 PolarHBondContact O-N 3.22Å; L204-N206 PolarHBondContact O-N 2.85Å
207	S	94.2	Very high	96.1	Very high	12 Å²	12	50.8 Å²	50.8	8%	0.084	24%	0.244	C	C	.	.			trans	-60.8	140	-178.5	-177.7	0	0	0	0	112.7	E161 Q203 L204 N209 R213	E161-S207 WeakPolarHBondContact OE1-CB 3.45Å; E161-S207 PolarHBondContact OE1-OG 3.28Å; E161-S207 PolarHBondContact OE2-OG 3.12Å; Q203-S207 PolarHBondContact O-N 3.06Å; Q203-S207 VanDerWaalsContact O-N 3.09Å; L204-S207 VanDerWaalsContact O-CB 3.24Å; L204-S207 WeakPolarHBondContact O-CB 3.47Å; L204-S207 PolarHBondContact O-N 3.15Å; S207-N209 PolarHBondContact O-N 3.25Å; S207-N209 WeakPolarHBondContact OG-CB 3.39Å; S207-N209 PolarHBondContact OG-N 3.43Å; S207-R213 WeakPolarHBondContact O-CD 3.25Å; S207-R213 PolarHBondContact O-NE 3.13Å
208	E	92.5	Very high	96.1	Very high	196 Å²	196	54.5 Å²	54.5	92%	0.916	26%	0.261	S	S	*	.	S	Bend	trans	-70.3	-21.7	169.4	-62.2	-172.3	168.9	0	0	111.7	Y210	E208-Y210 PolarHBondContact O-N 3.12Å
209	N	92.7	Very high	96.1	Very high	55 Å²	55	53.9 Å²	53.9	29%	0.294	26%	0.258	S	S	.	.			trans	-73.2	110	176.2	-173.4	-37.5	0	0	0	110.2	S207 V211 T212 R213	S207-N209 PolarHBondContact O-N 3.25Å; S207-N209 WeakPolarHBondContact OG-CB 3.39Å; S207-N209 PolarHBondContact OG-N 3.43Å; N209-V211 VanDerWaalsContact C-N 3.26Å; N209-V211 PolarHBondContact O-N 3.44Å; N209-V211 PolarHBondContact OD1-N 2.96Å; N209-T212 VanDerWaalsContact CG-OG1 3.3Å; N209-T212 PolarHBondContact O-N 3.22Å; N209-T212 PolarHBondContact OD1-N 2.99Å; N209-R213 WeakPolarHBondContact O-CB 3.12Å; N209-R213 PolarHBondContact O-N 2.61Å
210	Y	93.5	Very high	96.1	Very high	97 Å²	97	48.9 Å²	48.9	38%	0.38	23%	0.231	S	C	.	.	H	α-helix	trans	-51.2	-43.7	179	167.3	-111	0	0	0	113.3	E208 R214 S254 S256 I257	E208-Y210 PolarHBondContact O-N 3.12Å; Y210-R214 HydrophobicContact CE2-CB 4.42Å; Y210-R214 WeakPolarHBondContact O-CB 3.21Å; Y210-R214 PolarHBondContact O-N 3.42Å; Y210-S254 VanDerWaalsContact CE2-OG 3.32Å; Y210-S254 WeakPolarHBondContact CE2-OG 3.11Å; Y210-S256 WeakPolarHBondContact OH-CB 3.42Å; Y210-I257 HydrophobicContact CD2-CD1 3.96Å; Y210-I257 HydrophobicContact CD2-CG1 4.4Å; Y210-I257 HydrophobicContact CE2-CD1 4.15Å; Y210-I257 HydrophobicContact CE2-CG1 4.11Å
211	V	94.3	Very high	96.1	Very high	50 Å²	50	48 Å²	48	30%	0.303	23%	0.226	S	C	.	.	H	α-helix	trans	-71.1	-46.3	-176.2	-179.2	0	0	0	0	110.3	F165 N209 R213 R214 Q215	F165-V211 HydrophobicContact CE2-CB 4.24Å; F165-V211 HydrophobicContact CE2-CG1 4.02Å; F165-V211 HydrophobicContact CE2-CG2 4Å; N209-V211 VanDerWaalsContact C-N 3.26Å; N209-V211 PolarHBondContact O-N 3.44Å; N209-V211 PolarHBondContact OD1-N 2.96Å; V211-R213 VanDerWaalsContact C-N 3.34Å; V211-R213 PolarHBondContact O-N 3.01Å; V211-R214 PolarHBondContact O-N 2.98Å; V211-Q215 HydrophobicContact CG1-CG 4.11Å; V211-Q215 WeakPolarHBondContact O-CB 3.5Å; V211-Q215 WeakPolarHBondContact O-CG 3.43Å; V211-Q215 PolarHBondContact O-N 3.15Å
212	T	95.4	Very high	96.1	Very high	8 Å²	8	51.4 Å²	51.4	5%	0.049	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-47.9	177.6	-51.4	0	0	0	0	110.8	V160 E161 L204 N209 R214 Q215 S216	V160-T212 HydrophobicContact CB-CG2 4.46Å; V160-T212 HydrophobicContact CG2-CG2 4.14Å; V160-T212 PolarHBondContact O-OG1 3.35Å; E161-T212 HydrophobicContact CG-CG2 4.44Å; E161-T212 WeakPolarHBondContact OE1-CG2 3.4Å; L204-T212 HydrophobicContact CB-CG2 4.49Å; L204-T212 HydrophobicContact CD2-CG2 4.13Å; N209-T212 VanDerWaalsContact CG-OG1 3.3Å; N209-T212 PolarHBondContact O-N 3.22Å; N209-T212 PolarHBondContact OD1-N 2.99Å; T212-R214 PolarHBondContact O-N 2.71Å; T212-Q215 PolarHBondContact O-N 2.9Å; T212-S216 WeakPolarHBondContact O-CB 3.39Å; T212-S216 PolarHBondContact O-N 3.44Å; T212-S216 PolarHBondContact O-OG 2.91Å
213	R	95.5	Very high	96.2	Very high	44 Å²	44	47.8 Å²	47.8	17%	0.166	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-48.4	179.3	-174.5	160.7	59.9	150.8	7.3	112.3	L205 S207 N209 V211 L217 E252 I257	L205-R213 WeakPolarHBondContact O-CD 3.38Å; L205-R213 WeakPolarHBondContact O-CG 3.27Å; S207-R213 WeakPolarHBondContact O-CD 3.25Å; S207-R213 PolarHBondContact O-NE 3.13Å; N209-R213 WeakPolarHBondContact O-CB 3.12Å; N209-R213 PolarHBondContact O-N 2.61Å; V211-R213 VanDerWaalsContact C-N 3.34Å; V211-R213 PolarHBondContact O-N 3.01Å; R213-L217 WeakPolarHBondContact O-CB 3.37Å; R213-L217 PolarHBondContact O-N 3.22Å; R213-E252 IonicContact CZ-OE1 3.47Å; R213-E252 IonicContact NH1-OE1 2.86Å; R213-E252 PolarHBondContact NH1-OE1 3.36Å; R213-E252 IonicContact NH2-OE1 3.13Å; R213-E252 IonicContact NH2-OE2 2.72Å; R213-I257 HydrophobicContact CG-CD1 4.17Å
214	R	96.4	Very high	96.3	Very high	80 Å²	80	41.3 Å²	41.3	30%	0.302	20%	0.195	S	C	.	.	H	α-helix	trans	-62.8	-48.3	178.8	-179.3	-176.9	168.1	-128.4	-2.7	112.1	Y210 V211 T212 L217 K218 I257 E260	Y210-R214 HydrophobicContact CE2-CB 4.42Å; Y210-R214 WeakPolarHBondContact O-CB 3.21Å; Y210-R214 PolarHBondContact O-N 3.42Å; V211-R214 PolarHBondContact O-N 2.98Å; T212-R214 PolarHBondContact O-N 2.71Å; R214-L217 PolarHBondContact O-N 3.08Å; R214-K218 PolarHBondContact O-N 3.4Å; R214-I257 HydrophobicContact CB-CG1 4.38Å; R214-E260 HydrophobicContact CG-CG 4.43Å
215	Q	96.9	Very high	96.2	Very high	59 Å²	59	45.7 Å²	45.7	28%	0.276	22%	0.218	S	C	.	.	H	α-helix	trans	-67.9	-38.2	-177.5	-68.3	-65.4	-16.9	0	0	111.7	F172 V211 T212 L217 K218 L219	F172-Q215 HydrophobicContact CD1-CB 4.17Å; F172-Q215 HydrophobicContact CD2-CB 4.37Å; F172-Q215 HydrophobicContact CE1-CB 3.67Å; F172-Q215 HydrophobicContact CE2-CB 3.88Å; F172-Q215 VanDerWaalsContact CZ-C 3.41Å; F172-Q215 HydrophobicContact CZ-CB 3.52Å; F172-Q215 WeakPolarHBondContact CZ-O 3.27Å; V211-Q215 HydrophobicContact CG1-CG 4.11Å; V211-Q215 WeakPolarHBondContact O-CB 3.5Å; V211-Q215 WeakPolarHBondContact O-CG 3.43Å; V211-Q215 PolarHBondContact O-N 3.15Å; T212-Q215 PolarHBondContact O-N 2.9Å; Q215-L217 VanDerWaalsContact C-N 3.35Å; Q215-K218 PolarHBondContact O-N 3.04Å; Q215-L219 WeakPolarHBondContact O-CB 3.41Å; Q215-L219 PolarHBondContact O-N 3.02Å
216	S	97.8	Very high	96.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.6	-39.6	176.1	-57.5	0	0	0	0	111.8	Y201 L204 T212 L219 L220	Y201-S216 WeakPolarHBondContact CE1-O 3.47Å; Y201-S216 PolarHBondContact OH-O 3.43Å; L204-S216 WeakPolarHBondContact CB-OG 3.48Å; T212-S216 WeakPolarHBondContact O-CB 3.39Å; T212-S216 PolarHBondContact O-N 3.44Å; T212-S216 PolarHBondContact O-OG 2.91Å; S216-L219 PolarHBondContact O-N 3.46Å; S216-L220 WeakPolarHBondContact O-CB 3.36Å; S216-L220 PolarHBondContact O-N 3.28Å
217	L	97.8	Very high	96.4	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-42.2	176.7	-172	57	0	0	0	112.1	L205 R213 R214 Q215 L220 G221 M246 L249 I257 E260 A261 V264	L205-L217 HydrophobicContact CD2-CB 4.2Å; L205-L217 HydrophobicContact CD2-CD1 4.13Å; R213-L217 WeakPolarHBondContact O-CB 3.37Å; R213-L217 PolarHBondContact O-N 3.22Å; R214-L217 PolarHBondContact O-N 3.08Å; Q215-L217 VanDerWaalsContact C-N 3.35Å; L217-L220 HydrophobicContact CD1-CD2 4.38Å; L217-L220 WeakPolarHBondContact O-CB 3.46Å; L217-L220 PolarHBondContact O-N 3.33Å; L217-G221 PolarHBondContact O-N 3.06Å; L217-G221 VanDerWaalsContact O-N 3.1Å; L217-M246 HydrophobicContact CD1-CE 3.98Å; L217-M246 HydrophobicContact CD1-SD 3.8Å; L217-L249 HydrophobicContact CD1-CD1 4.09Å; L217-L249 HydrophobicContact CD2-CD1 4.12Å; L217-I257 HydrophobicContact CD2-CG2 3.99Å; L217-I257 WeakPolarHBondContact CD2-O 3.3Å; L217-E260 HydrophobicContact CB-CB 4.25Å; L217-E260 HydrophobicContact CD2-CB 3.85Å; L217-E260 HydrophobicContact CG-CB 3.78Å; L217-A261 HydrophobicContact CD2-CB 3.92Å; L217-V264 HydrophobicContact CD1-CG2 4.03Å
218	K	97.8	Very high	96.6	Very high	80 Å²	80	55.2 Å²	55.2	35%	0.348	25%	0.25	S	C	.	.	H	α-helix	trans	-59.5	-48.2	172.9	-177.3	174.8	-177.5	174.3	0	111.8	R214 Q215 L220 G221 E222 E260	R214-K218 PolarHBondContact O-N 3.4Å; Q215-K218 PolarHBondContact O-N 3.04Å; K218-L220 VanDerWaalsContact C-N 3.3Å; K218-L220 PolarHBondContact O-N 3.39Å; K218-G221 PolarHBondContact O-N 3.1Å; K218-E222 PolarHBondContact O-N 3.46Å; K218-E260 HydrophobicContact CB-CG 4.33Å
219	L	98.3	Very high	96.8	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-36.4	178.6	177	58.3	0	0	0	111.9	F172 K176 I179 T180 Y201 Q215 S216 G221 E222 L223	F172-L219 HydrophobicContact CE1-CD2 4.2Å; F172-L219 HydrophobicContact CE2-CD2 4.37Å; F172-L219 HydrophobicContact CZ-CB 4.02Å; F172-L219 HydrophobicContact CZ-CD2 3.68Å; K176-L219 HydrophobicContact CB-CD1 4.5Å; K176-L219 HydrophobicContact CB-CD2 4.15Å; K176-L219 HydrophobicContact CD-CD1 4.22Å; K176-L219 HydrophobicContact CG-CD1 3.9Å; K176-L219 HydrophobicContact CG-CD2 4.42Å; I179-L219 HydrophobicContact CD1-CD2 3.99Å; I179-L219 HydrophobicContact CD1-CG 4.46Å; T180-L219 HydrophobicContact CG2-CD1 3.76Å; Y201-L219 VanDerWaalsContact OH-CB 3.32Å; Y201-L219 WeakPolarHBondContact OH-CB 3.5Å; Y201-L219 WeakPolarHBondContact OH-CG 2.91Å; Q215-L219 WeakPolarHBondContact O-CB 3.41Å; Q215-L219 PolarHBondContact O-N 3.02Å; S216-L219 PolarHBondContact O-N 3.46Å; L219-G221 VanDerWaalsContact C-N 3.35Å; L219-G221 PolarHBondContact O-N 2.9Å; L219-E222 PolarHBondContact O-N 3.39Å; L219-L223 HydrophobicContact CD1-CG 4.25Å; L219-L223 HydrophobicContact CG-CD1 4.34Å; L219-L223 HydrophobicContact CG-CG 4.46Å; L219-L223 VanDerWaalsContact O-CG 3.3Å; L219-L223 WeakPolarHBondContact O-CG 3.4Å; L219-L223 PolarHBondContact O-N 3.26Å
220	L	98.5	Very high	97	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-46.3	173.2	177.6	65.9	0	0	0	111.1	F198 Y201 L205 S216 L217 K218 E222 L223 L224 Y236 M246 V264	F198-L220 HydrophobicContact CE1-CD1 3.84Å; Y201-L220 HydrophobicContact CE1-CB 3.93Å; Y201-L220 HydrophobicContact CE1-CD1 4.44Å; Y201-L220 PolarHBondContact OH-N 2.83Å; L205-L220 HydrophobicContact CD1-CD2 3.9Å; L205-L220 HydrophobicContact CD2-CD2 4.34Å; S216-L220 WeakPolarHBondContact O-CB 3.36Å; S216-L220 PolarHBondContact O-N 3.28Å; L217-L220 HydrophobicContact CD1-CD2 4.38Å; L217-L220 WeakPolarHBondContact O-CB 3.46Å; L217-L220 PolarHBondContact O-N 3.33Å; K218-L220 VanDerWaalsContact C-N 3.3Å; K218-L220 PolarHBondContact O-N 3.39Å; L220-E222 VanDerWaalsContact C-N 3.34Å; L220-E222 PolarHBondContact O-N 2.9Å; L220-L223 PolarHBondContact O-N 3.48Å; L220-L224 HydrophobicContact CD1-CD1 3.84Å; L220-L224 HydrophobicContact CD1-CD2 4.46Å; L220-L224 HydrophobicContact CD1-CG 4Å; L220-L224 HydrophobicContact CG-CD1 3.84Å; L220-L224 HydrophobicContact CG-CG 4.35Å; L220-L224 VanDerWaalsContact O-CG 3.27Å; L220-L224 WeakPolarHBondContact O-CG 3.39Å; L220-L224 PolarHBondContact O-N 3.43Å; L220-Y236 HydrophobicContact CD1-CE2 4.03Å; L220-Y236 HydrophobicContact CD2-CE1 4.26Å; L220-Y236 HydrophobicContact CD2-CE2 4.48Å; L220-Y236 WeakPolarHBondContact CD2-OH 3.18Å; L220-M246 HydrophobicContact CD2-CE 4.04Å; L220-V264 HydrophobicContact CD2-CG1 4.06Å; L220-V264 HydrophobicContact CD2-CG2 4.15Å; L220-V264 HydrophobicContact CG-CG1 4.47Å; L220-V264 HydrophobicContact CG-CG2 4.21Å
221	G	97.8	Very high	97.2	Very high	6 Å²	6	49.1 Å²	49.1	6%	0.062	22%	0.224	C	C	.	.	H	α-helix	trans	-57.9	-45.4	174.4	0	0	0	0	0	112.5	L217 K218 L219 L223 L224 L225	L217-G221 PolarHBondContact O-N 3.06Å; L217-G221 VanDerWaalsContact O-N 3.1Å; K218-G221 PolarHBondContact O-N 3.1Å; L219-G221 VanDerWaalsContact C-N 3.35Å; L219-G221 PolarHBondContact O-N 2.9Å; G221-L223 PolarHBondContact O-N 3.48Å; G221-L224 PolarHBondContact O-N 3.19Å; G221-L225 WeakPolarHBondContact O-CB 3.11Å; G221-L225 VanDerWaalsContact O-CG 3.28Å; G221-L225 WeakPolarHBondContact O-CG 3.35Å; G221-L225 PolarHBondContact O-N 3.03Å; G221-L225 VanDerWaalsContact O-N 3.09Å
222	E	97.4	Very high	97.4	Very high	73 Å²	73	46.9 Å²	46.9	34%	0.341	21%	0.211	S	C	.	.	H	α-helix	trans	-60.3	-41.7	175.9	-68.1	176.9	-159.6	0	0	112.4	K176 K218 L219 L220 D226	K176-E222 WeakPolarHBondContact CE-OE2 3.41Å; K176-E222 IonicContact NZ-OE1 3.83Å; K176-E222 PolarHBondContact NZ-OE1 2.83Å; K176-E222 IonicContact NZ-OE2 2.74Å; K176-E222 PolarHBondContact NZ-OE2 3.31Å; K218-E222 PolarHBondContact O-N 3.46Å; L219-E222 PolarHBondContact O-N 3.39Å; L220-E222 VanDerWaalsContact C-N 3.34Å; L220-E222 PolarHBondContact O-N 2.9Å; E222-D226 PolarHBondContact O-N 3.46Å
223	L	98.2	Very high	97.5	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-46.1	178.9	-71.2	174.4	0	0	0	112	I179 T180 L190 Y201 L219 L220 G221 L225 D226 N229	I179-L223 HydrophobicContact CD1-CD1 3.88Å; I179-L223 HydrophobicContact CD1-CD2 4.43Å; I179-L223 HydrophobicContact CG1-CD2 4.39Å; T180-L223 HydrophobicContact CG2-CD2 3.88Å; L190-L223 HydrophobicContact CD1-CD2 4.05Å; Y201-L223 HydrophobicContact CE2-CD1 4.46Å; L219-L223 HydrophobicContact CD1-CG 4.25Å; L219-L223 HydrophobicContact CG-CD1 4.34Å; L219-L223 HydrophobicContact CG-CG 4.46Å; L219-L223 VanDerWaalsContact O-CG 3.3Å; L219-L223 WeakPolarHBondContact O-CG 3.4Å; L219-L223 PolarHBondContact O-N 3.26Å; L220-L223 PolarHBondContact O-N 3.48Å; G221-L223 PolarHBondContact O-N 3.48Å; L223-L225 VanDerWaalsContact C-N 3.34Å; L223-L225 PolarHBondContact O-N 3.36Å; L223-D226 PolarHBondContact O-N 2.88Å; L223-N229 VanDerWaalsContact O-CB 3.24Å; L223-N229 WeakPolarHBondContact O-CB 3.01Å; L223-N229 PolarHBondContact O-ND2 3.49Å
224	L	97.9	Very high	97.6	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-71.1	-29.8	-176.1	-65	174.7	0	0	0	112.7	L220 G221 M233 Y236 V264	L220-L224 HydrophobicContact CD1-CD1 3.84Å; L220-L224 HydrophobicContact CD1-CD2 4.46Å; L220-L224 HydrophobicContact CD1-CG 4Å; L220-L224 HydrophobicContact CG-CD1 3.84Å; L220-L224 HydrophobicContact CG-CG 4.35Å; L220-L224 VanDerWaalsContact O-CG 3.27Å; L220-L224 WeakPolarHBondContact O-CG 3.39Å; L220-L224 PolarHBondContact O-N 3.43Å; G221-L224 PolarHBondContact O-N 3.19Å; L224-M233 HydrophobicContact CB-CG 4.27Å; L224-M233 HydrophobicContact CD2-CB 4.23Å; L224-M233 HydrophobicContact CD2-CG 4.43Å; L224-M233 WeakPolarHBondContact O-CG 3.22Å; L224-Y236 HydrophobicContact CD1-CD1 3.64Å; L224-Y236 HydrophobicContact CD1-CE1 3.89Å; L224-Y236 HydrophobicContact CD1-CG 4.22Å; L224-Y236 HydrophobicContact CD2-CD1 4.03Å; L224-Y236 HydrophobicContact CD2-CD2 4.45Å; L224-Y236 HydrophobicContact CD2-CG 3.79Å; L224-V264 HydrophobicContact CD1-CG1 3.8Å
225	L	96.2	Very high	97.7	Very high	96 Å²	96	50.2 Å²	50.2	50%	0.503	23%	0.23	S	C	.	.	H	α-helix	trans	-85.5	-8.1	179.1	-67.2	172.8	0	0	0	113.5	G221 L223 R227 V267	G221-L225 WeakPolarHBondContact O-CB 3.11Å; G221-L225 VanDerWaalsContact O-CG 3.28Å; G221-L225 WeakPolarHBondContact O-CG 3.35Å; G221-L225 PolarHBondContact O-N 3.03Å; G221-L225 VanDerWaalsContact O-N 3.09Å; L223-L225 VanDerWaalsContact C-N 3.34Å; L223-L225 PolarHBondContact O-N 3.36Å; L225-R227 PolarHBondContact O-N 3.42Å; L225-V267 HydrophobicContact CD2-CG2 3.79Å; L225-V267 HydrophobicContact CG-CG2 4.39Å
226	D	97.4	Very high	97.8	Very high	28 Å²	28	47.6 Å²	47.6	15%	0.15	22%	0.218	C	C	.	.	S	Bend	trans	-73.8	126.4	176.2	-162.4	-58.8	0	0	0	110.8	K183 E222 L223 H228 N229	K183-D226 VanDerWaalsContact CD-OD2 3.27Å; K183-D226 WeakPolarHBondContact CD-OD2 3.37Å; K183-D226 WeakPolarHBondContact CE-OD2 3.39Å; K183-D226 IonicContact NZ-OD2 3.58Å; K183-D226 PolarHBondContact NZ-OD2 2.93Å; E222-D226 PolarHBondContact O-N 3.46Å; L223-D226 PolarHBondContact O-N 2.88Å; D226-H228 PolarHBondContact O-N 2.83Å; D226-H228 VanDerWaalsContact O-N 3.07Å; D226-H228 IonicContact OD1-CE1 3.87Å; D226-H228 IonicContact OD1-CG 2.79Å; D226-H228 PolarHBondContact OD1-N 2.97Å; D226-H228 IonicContact OD1-ND1 3.04Å; D226-H228 PolarHBondContact OD1-ND1 3.38Å; D226-N229 PolarHBondContact O-N 3.33Å
227	R	97.2	Very high	97.8	Very high	209 Å²	209	47.7 Å²	47.7	79%	0.789	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-56.5	-27.6	-177.9	69.8	-178.4	-174.8	-169	-1.6	114.3	L225 N229	L225-R227 PolarHBondContact O-N 3.42Å; R227-N229 VanDerWaalsContact C-N 3.28Å
228	H	98.3	Very high	97.8	Very high	70 Å²	70	49.7 Å²	49.7	32%	0.324	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-75.7	-22.3	179.7	-52.9	85.6	0	0	0	111.6	K183 A187 D226 F230	K183-H228 HydrophobicContact CB-CB 4.39Å; K183-H228 WeakPolarHBondContact CB-ND1 3.35Å; A187-H228 HydrophobicContact CB-CB 4.03Å; A187-H228 WeakPolarHBondContact CB-O 3.44Å; D226-H228 PolarHBondContact O-N 2.83Å; D226-H228 VanDerWaalsContact O-N 3.07Å; D226-H228 IonicContact OD1-CE1 3.87Å; D226-H228 IonicContact OD1-CG 2.79Å; D226-H228 PolarHBondContact OD1-N 2.97Å; D226-H228 IonicContact OD1-ND1 3.04Å; D226-H228 PolarHBondContact OD1-ND1 3.38Å; H228-F230 VanDerWaalsContact C-N 3.3Å; H228-F230 PolarHBondContact O-N 3.4Å
229	N	98.2	Very high	97.8	Very high	7 Å²	7	49 Å²	49	4%	0.037	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-92.3	22.6	-178.8	-68	-23.7	0	0	0	112.5	A187 L223 D226 R227 N231 V232 M233	A187-N229 VanDerWaalsContact CA-OD1 3.31Å; A187-N229 WeakPolarHBondContact CA-OD1 3.42Å; A187-N229 VanDerWaalsContact CB-OD1 3.3Å; A187-N229 WeakPolarHBondContact CB-OD1 3.39Å; L223-N229 VanDerWaalsContact O-CB 3.24Å; L223-N229 WeakPolarHBondContact O-CB 3.01Å; L223-N229 PolarHBondContact O-ND2 3.49Å; D226-N229 PolarHBondContact O-N 3.33Å; R227-N229 VanDerWaalsContact C-N 3.28Å; N229-N231 VanDerWaalsContact C-N 3.33Å; N229-N231 PolarHBondContact O-N 3.11Å; N229-V232 HydrophobicContact CB-CB 4.28Å; N229-V232 WeakPolarHBondContact O-CB 3.21Å; N229-V232 PolarHBondContact O-N 3.23Å; N229-V232 VanDerWaalsContact O-N 3.14Å; N229-M233 WeakPolarHBondContact O-CB 3.39Å; N229-M233 PolarHBondContact O-N 3.33Å
230	F	97.2	Very high	97.8	Very high	125 Å²	125	50.7 Å²	50.7	55%	0.548	24%	0.244	S	C	.	.	H	α-helix	trans	-55.3	-43.7	-176.1	178.6	-97.1	0	0	0	113.4	H228 M233 T234	H228-F230 VanDerWaalsContact C-N 3.3Å; H228-F230 PolarHBondContact O-N 3.4Å; F230-M233 HydrophobicContact CD2-CE 3.72Å; F230-M233 HydrophobicContact CE2-CE 3.88Å; F230-M233 PolarHBondContact O-N 3.08Å; F230-T234 WeakPolarHBondContact O-CB 3.45Å; F230-T234 PolarHBondContact O-N 3.47Å; F230-T234 PolarHBondContact O-OG1 2.71Å
231	N	97.4	Very high	97.7	Very high	87 Å²	87	55.5 Å²	55.5	47%	0.465	27%	0.266	S	S	.	.	H	α-helix	trans	-65	-44.3	178.2	-68.7	-10.3	0	0	0	111.4	E191 N229 T234 R235	E191-N231 PolarHBondContact OE1-ND2 3.21Å; E191-N231 PolarHBondContact OE2-ND2 2.97Å; N229-N231 VanDerWaalsContact C-N 3.33Å; N229-N231 PolarHBondContact O-N 3.11Å; N231-T234 PolarHBondContact O-N 2.92Å; N231-R235 PolarHBondContact O-N 2.99Å
232	V	98.4	Very high	97.8	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-48.4	176.2	175	0	0	0	0	110.5	L190 E191 Y194 F198 N229 T234 R235 Y236	L190-V232 HydrophobicContact CB-CG2 3.8Å; E191-V232 HydrophobicContact CB-CG2 4.22Å; Y194-V232 HydrophobicContact CD2-CG1 4.17Å; Y194-V232 HydrophobicContact CE2-CG1 4.03Å; F198-V232 HydrophobicContact CE2-CG1 3.53Å; F198-V232 HydrophobicContact CZ-CG1 3.62Å; N229-V232 HydrophobicContact CB-CB 4.28Å; N229-V232 WeakPolarHBondContact O-CB 3.21Å; N229-V232 PolarHBondContact O-N 3.23Å; N229-V232 VanDerWaalsContact O-N 3.14Å; V232-T234 PolarHBondContact O-N 3.16Å; V232-R235 PolarHBondContact O-N 2.98Å; V232-Y236 WeakPolarHBondContact O-CB 3.34Å; V232-Y236 PolarHBondContact O-N 3.44Å
233	M	98.1	Very high	97.8	Very high	33 Å²	33	52.2 Å²	52.2	16%	0.163	25%	0.25	C	C	.	.	H	α-helix	trans	-58.1	-49	176.9	179.8	-159.3	66.8	0	0	111.2	L224 N229 F230 R235 Y236 I237 V267	L224-M233 HydrophobicContact CB-CG 4.27Å; L224-M233 HydrophobicContact CD2-CB 4.23Å; L224-M233 HydrophobicContact CD2-CG 4.43Å; L224-M233 WeakPolarHBondContact O-CG 3.22Å; N229-M233 WeakPolarHBondContact O-CB 3.39Å; N229-M233 PolarHBondContact O-N 3.33Å; F230-M233 HydrophobicContact CD2-CE 3.72Å; F230-M233 HydrophobicContact CE2-CE 3.88Å; F230-M233 PolarHBondContact O-N 3.08Å; M233-R235 VanDerWaalsContact C-N 3.31Å; M233-R235 PolarHBondContact O-N 3.24Å; M233-Y236 PolarHBondContact O-N 3.49Å; M233-Y236 VanDerWaalsContact O-N 3.13Å; M233-I237 HydrophobicContact CE-CD1 4.47Å; M233-I237 HydrophobicContact CG-CD1 4.4Å; M233-I237 HydrophobicContact CG-CG2 4.43Å; M233-I237 WeakPolarHBondContact O-CG1 3.26Å; M233-I237 PolarHBondContact O-N 3.17Å; M233-V267 HydrophobicContact CG-CG1 3.86Å; M233-V267 HydrophobicContact SD-CG1 3.67Å
234	T	97.5	Very high	97.8	Very high	52 Å²	52	56.3 Å²	56.3	32%	0.319	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-43	-179.4	-59.9	0	0	0	0	111.4	F230 N231 V232 S238	F230-T234 WeakPolarHBondContact O-CB 3.45Å; F230-T234 PolarHBondContact O-N 3.47Å; F230-T234 PolarHBondContact O-OG1 2.71Å; N231-T234 PolarHBondContact O-N 2.92Å; V232-T234 PolarHBondContact O-N 3.16Å; T234-S238 WeakPolarHBondContact O-CB 3.17Å; T234-S238 PolarHBondContact O-N 3.06Å; T234-S238 PolarHBondContact O-OG 3.23Å
235	R	97.9	Very high	97.8	Very high	116 Å²	116	57.4 Å²	57.4	44%	0.438	27%	0.273	S	S	.	.	H	α-helix	trans	-66.5	-40.7	175.8	-168.6	174.6	174.8	-179.8	0.3	111.7	Y194 D195 N231 V232 M233 S238	Y194-R235 VanDerWaalsContact CD1-CD 3.49Å; Y194-R235 HydrophobicContact CD1-CG 4.24Å; Y194-R235 HydrophobicContact CD2-CB 4.38Å; Y194-R235 HydrophobicContact CD2-CG 4.37Å; Y194-R235 HydrophobicContact CE1-CB 4.48Å; Y194-R235 VanDerWaalsContact CE1-CD 3.5Å; Y194-R235 HydrophobicContact CE1-CG 3.71Å; Y194-R235 HydrophobicContact CE2-CB 3.7Å; Y194-R235 HydrophobicContact CE2-CG 3.83Å; Y194-R235 VanDerWaalsContact CZ-CG 3.49Å; Y194-R235 VanDerWaalsContact OH-C 3.29Å; D195-R235 IonicContact OD1-CZ 2.72Å; D195-R235 IonicContact OD1-NH2 3.96Å; D195-R235 PolarHBondContact OD1-NH2 3.24Å; D195-R235 IonicContact OD2-CZ 3.69Å; D195-R235 IonicContact OD2-NH1 2.88Å; D195-R235 IonicContact OD2-NH2 3.29Å; D195-R235 PolarHBondContact OD2-NH2 2.84Å; N231-R235 PolarHBondContact O-N 2.99Å; V232-R235 PolarHBondContact O-N 2.98Å; M233-R235 VanDerWaalsContact C-N 3.31Å; M233-R235 PolarHBondContact O-N 3.24Å; R235-S238 PolarHBondContact O-N 3.1Å
236	Y	98.4	Very high	97.9	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-48	-179.7	-169.4	-86.9	0	0	0	112.6	Y194 F198 L220 L224 V232 M233 S238 N239 N242 V264 F268	Y194-Y236 WeakPolarHBondContact OH-CA 3.47Å; Y194-Y236 PolarHBondContact OH-N 3.26Å; F198-Y236 AromaticContact CD1-CD2 3.66Å; F198-Y236 HydrophobicContact CD1-CD2 3.66Å; F198-Y236 AromaticContact CD1-CE2 3.66Å; F198-Y236 HydrophobicContact CD1-CE2 3.66Å; F198-Y236 AromaticContact CE1-CD2 3.57Å; F198-Y236 HydrophobicContact CE1-CD2 3.57Å; F198-Y236 AromaticContact CE1-CE2 3.8Å; F198-Y236 HydrophobicContact CE1-CE2 3.8Å; F198-Y236 HydrophobicContact CG-CD2 4.34Å; F198-Y236 HydrophobicContact CZ-CD2 4.2Å; L220-Y236 HydrophobicContact CD1-CE2 4.03Å; L220-Y236 HydrophobicContact CD2-CE1 4.26Å; L220-Y236 HydrophobicContact CD2-CE2 4.48Å; L220-Y236 WeakPolarHBondContact CD2-OH 3.18Å; L224-Y236 HydrophobicContact CD1-CD1 3.64Å; L224-Y236 HydrophobicContact CD1-CE1 3.89Å; L224-Y236 HydrophobicContact CD1-CG 4.22Å; L224-Y236 HydrophobicContact CD2-CD1 4.03Å; L224-Y236 HydrophobicContact CD2-CD2 4.45Å; L224-Y236 HydrophobicContact CD2-CG 3.79Å; V232-Y236 WeakPolarHBondContact O-CB 3.34Å; V232-Y236 PolarHBondContact O-N 3.44Å; M233-Y236 PolarHBondContact O-N 3.49Å; M233-Y236 VanDerWaalsContact O-N 3.13Å; Y236-S238 PolarHBondContact O-N 3.49Å; Y236-N239 PolarHBondContact O-N 2.86Å; Y236-N242 HydrophobicContact CD1-CB 4.29Å; Y236-N242 WeakPolarHBondContact CD2-ND2 3.29Å; Y236-N242 HydrophobicContact CE1-CB 3.79Å; Y236-N242 HydrophobicContact CE2-CB 4.45Å; Y236-N242 WeakPolarHBondContact CE2-ND2 3.33Å; Y236-N242 PolarHBondContact O-ND2 3.37Å; Y236-V264 HydrophobicContact CE1-CG1 4.26Å; Y236-F268 HydrophobicContact CD1-CE2 4.24Å; Y236-F268 AromaticContact CD1-CZ 3.95Å; Y236-F268 HydrophobicContact CD1-CZ 3.95Å; Y236-F268 HydrophobicContact CE1-CE2 4.05Å; Y236-F268 AromaticContact CE1-CZ 3.87Å; Y236-F268 HydrophobicContact CE1-CZ 3.87Å
237	I	97.8	Very high	97.9	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-77.1	-6.1	-177.6	71.2	-172.2	0	0	0	113.7	M233 V267 F268 N271 I278	M233-I237 HydrophobicContact CE-CD1 4.47Å; M233-I237 HydrophobicContact CG-CD1 4.4Å; M233-I237 HydrophobicContact CG-CG2 4.43Å; M233-I237 WeakPolarHBondContact O-CG1 3.26Å; M233-I237 PolarHBondContact O-N 3.17Å; I237-V267 HydrophobicContact CD1-CG1 4.38Å; I237-V267 HydrophobicContact CG2-CB 4.26Å; I237-V267 HydrophobicContact CG2-CG1 3.88Å; I237-F268 HydrophobicContact CB-CD1 3.91Å; I237-F268 HydrophobicContact CB-CE1 4.01Å; I237-F268 HydrophobicContact CB-CG 4.2Å; I237-F268 HydrophobicContact CB-CZ 4.32Å; I237-F268 HydrophobicContact CG2-CD1 4.36Å; I237-F268 HydrophobicContact CG2-CD2 4.12Å; I237-F268 HydrophobicContact CG2-CE1 4.36Å; I237-F268 HydrophobicContact CG2-CE2 4.07Å; I237-F268 HydrophobicContact CG2-CG 4.25Å; I237-F268 HydrophobicContact CG2-CZ 4.19Å; I237-F268 WeakPolarHBondContact O-CD1 3.38Å; I237-F268 WeakPolarHBondContact O-CE1 3.33Å; I237-N271 HydrophobicContact CD1-CB 3.85Å; I237-I278 WeakPolarHBondContact O-CG1 3.49Å
238	S	97.8	Very high	97.9	Very high	43 Å²	43	48 Å²	48	30%	0.301	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-12.5	175.1	-63.4	0	0	0	0	113.5	T234 R235 Y236 P275	T234-S238 WeakPolarHBondContact O-CB 3.17Å; T234-S238 PolarHBondContact O-N 3.06Å; T234-S238 PolarHBondContact O-OG 3.23Å; R235-S238 PolarHBondContact O-N 3.1Å; Y236-S238 PolarHBondContact O-N 3.49Å; S238-P275 WeakPolarHBondContact OG-CG 3.27Å
239	N	97.7	Very high	97.8	Very high	64 Å²	64	45 Å²	45	34%	0.342	22%	0.224	S	C	.	.			trans	-90	119.6	-179.3	-174.7	-14.8	0	0	0	111.4	Y236 E241 N242 L243	Y236-N239 PolarHBondContact O-N 2.86Å; N239-E241 VanDerWaalsContact C-N 3.28Å; N239-E241 PolarHBondContact O-N 2.91Å; N239-E241 PolarHBondContact OD1-N 3.45Å; N239-N242 HydrophobicContact CB-CB 4.36Å; N239-N242 PolarHBondContact O-N 3.14Å; N239-L243 PolarHBondContact O-N 2.95Å
240	P	98.1	Very high	97.8	Very high	38 Å²	38	44.7 Å²	44.7	25%	0.247	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-27.8	179.6	25.3	-34	0	0	0	114.1	N242 L243 K244 P277 I278 I281	P240-N242 VanDerWaalsContact C-N 3.34Å; P240-L243 PolarHBondContact O-N 3.22Å; P240-K244 WeakPolarHBondContact O-CG 3.36Å; P240-K244 PolarHBondContact O-N 2.77Å; P240-P277 HydrophobicContact CB-CB 4.37Å; P240-P277 HydrophobicContact CG-CB 4.35Å; P240-I278 HydrophobicContact CB-CD1 4.3Å; P240-I281 HydrophobicContact CB-CD1 3.61Å
241	E	97.7	Very high	97.7	Very high	102 Å²	102	44.2 Å²	44.2	48%	0.477	23%	0.225	S	C	.	.	H	α-helix	trans	-68	-36.4	176.8	-63.2	-51.6	126.9	0	0	111.6	N239 L243 K244 L245	N239-E241 VanDerWaalsContact C-N 3.28Å; N239-E241 PolarHBondContact O-N 2.91Å; N239-E241 PolarHBondContact OD1-N 3.45Å; E241-L243 PolarHBondContact O-N 3.45Å; E241-K244 PolarHBondContact O-N 2.86Å; E241-K244 IonicContact OE1-NZ 2.69Å; E241-K244 PolarHBondContact OE1-NZ 2.93Å; E241-K244 IonicContact OE2-NZ 3.72Å; E241-L245 WeakPolarHBondContact O-CB 3.42Å; E241-L245 PolarHBondContact O-N 3.43Å
242	N	98.3	Very high	97.6	Very high	10 Å²	10	42.6 Å²	42.6	5%	0.053	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-40.6	174.7	-67.3	-17.7	0	0	0	111.4	Y236 N239 P240 L245 M246 F268	Y236-N242 HydrophobicContact CD1-CB 4.29Å; Y236-N242 WeakPolarHBondContact CD2-ND2 3.29Å; Y236-N242 HydrophobicContact CE1-CB 3.79Å; Y236-N242 HydrophobicContact CE2-CB 4.45Å; Y236-N242 WeakPolarHBondContact CE2-ND2 3.33Å; Y236-N242 PolarHBondContact O-ND2 3.37Å; N239-N242 HydrophobicContact CB-CB 4.36Å; N239-N242 PolarHBondContact O-N 3.14Å; P240-N242 VanDerWaalsContact C-N 3.34Å; N242-L245 PolarHBondContact O-N 3.42Å; N242-M246 WeakPolarHBondContact O-CG 3.38Å; N242-M246 PolarHBondContact O-N 2.94Å; N242-F268 HydrophobicContact CB-CE1 4.24Å; N242-F268 HydrophobicContact CB-CZ 3.71Å
243	L	98.3	Very high	97.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-47.1	174.9	176	60.7	0	0	0	111.2	N239 P240 E241 L245 M246 M247 F265 F268 I278 I281 L282	N239-L243 PolarHBondContact O-N 2.95Å; P240-L243 PolarHBondContact O-N 3.22Å; E241-L243 PolarHBondContact O-N 3.45Å; L243-L245 VanDerWaalsContact C-N 3.31Å; L243-L245 PolarHBondContact O-N 3.08Å; L243-M246 PolarHBondContact O-N 2.97Å; L243-M247 HydrophobicContact CD1-CG 4.11Å; L243-M247 HydrophobicContact CD1-SD 4.07Å; L243-M247 HydrophobicContact CD2-SD 4.43Å; L243-M247 HydrophobicContact CG-CG 4.42Å; L243-M247 HydrophobicContact CG-SD 3.95Å; L243-M247 WeakPolarHBondContact O-CG 3.16Å; L243-M247 PolarHBondContact O-N 3.29Å; L243-F265 HydrophobicContact CD1-CD2 3.97Å; L243-F265 HydrophobicContact CD1-CE2 3.95Å; L243-F268 HydrophobicContact CB-CD1 3.82Å; L243-F268 HydrophobicContact CB-CE1 3.73Å; L243-F268 HydrophobicContact CB-CZ 4.44Å; L243-F268 HydrophobicContact CD1-CB 4.05Å; L243-F268 HydrophobicContact CD1-CD1 4Å; L243-F268 HydrophobicContact CD1-CG 3.95Å; L243-F268 HydrophobicContact CG-CD1 4.39Å; L243-I278 HydrophobicContact CB-CD1 4.25Å; L243-I278 HydrophobicContact CD2-CD1 4.34Å; L243-I278 HydrophobicContact CD2-CG2 4.04Å; L243-I281 HydrophobicContact CD2-CB 3.84Å; L243-I281 HydrophobicContact CD2-CD1 4.22Å; L243-I281 HydrophobicContact CD2-CG2 3.59Å; L243-I281 HydrophobicContact CG-CG2 4.27Å; L243-L282 HydrophobicContact CD1-CD2 4.42Å; L243-L282 HydrophobicContact CD2-CD2 4.29Å; L243-L282 HydrophobicContact CD2-CG 4.23Å
244	K	97.8	Very high	97.3	Very high	90 Å²	90	53.8 Å²	53.8	39%	0.391	26%	0.258	S	S	.	.	H	α-helix	trans	-59.1	-43.1	177.7	-70.8	172.5	-171.6	169.4	0	111.5	P240 E241 M247 N248 I281	P240-K244 WeakPolarHBondContact O-CG 3.36Å; P240-K244 PolarHBondContact O-N 2.77Å; E241-K244 PolarHBondContact O-N 2.86Å; E241-K244 IonicContact OE1-NZ 2.69Å; E241-K244 PolarHBondContact OE1-NZ 2.93Å; E241-K244 IonicContact OE2-NZ 3.72Å; K244-M247 PolarHBondContact O-N 3.45Å; K244-N248 VanDerWaalsContact O-CG 3.31Å; K244-N248 PolarHBondContact O-N 3.19Å; K244-N248 PolarHBondContact O-ND2 3.3Å; K244-I281 HydrophobicContact CG-CD1 4.47Å
245	L	97.5	Very high	97.2	Very high	24 Å²	24	57.3 Å²	57.3	13%	0.126	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-50.3	175.7	178.6	63	0	0	0	111	L205 E241 N242 L243 M247 N248 L249	L205-L245 HydrophobicContact CB-CD2 4.15Å; L205-L245 HydrophobicContact CD1-CD2 3.71Å; E241-L245 WeakPolarHBondContact O-CB 3.42Å; E241-L245 PolarHBondContact O-N 3.43Å; N242-L245 PolarHBondContact O-N 3.42Å; L243-L245 VanDerWaalsContact C-N 3.31Å; L243-L245 PolarHBondContact O-N 3.08Å; L245-M247 VanDerWaalsContact C-N 3.34Å; L245-M247 PolarHBondContact O-N 3.12Å; L245-N248 PolarHBondContact O-N 3.27Å; L245-L249 HydrophobicContact CD1-CD1 4.24Å; L245-L249 HydrophobicContact CD1-CG 4.38Å; L245-L249 HydrophobicContact CG-CD1 4.07Å; L245-L249 WeakPolarHBondContact O-CG 3.22Å; L245-L249 PolarHBondContact O-N 2.82Å
246	M	98.2	Very high	97	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.5	-41.8	178.4	-66.2	-55.1	117.9	0	0	112.3	L205 L217 L220 N242 L243 N248 L249 L250 V264 F265 F268	L205-M246 HydrophobicContact CD1-CE 4.2Å; L217-M246 HydrophobicContact CD1-CE 3.98Å; L217-M246 HydrophobicContact CD1-SD 3.8Å; L220-M246 HydrophobicContact CD2-CE 4.04Å; N242-M246 WeakPolarHBondContact O-CG 3.38Å; N242-M246 PolarHBondContact O-N 2.94Å; L243-M246 PolarHBondContact O-N 2.97Å; M246-N248 VanDerWaalsContact C-N 3.34Å; M246-N248 PolarHBondContact O-N 3.37Å; M246-L249 HydrophobicContact CE-CD1 3.8Å; M246-L249 PolarHBondContact O-N 3.16Å; M246-L249 HydrophobicContact SD-CD1 4.23Å; M246-L250 WeakPolarHBondContact O-CG 3.4Å; M246-L250 PolarHBondContact O-N 2.87Å; M246-V264 HydrophobicContact CE-CG1 4.37Å; M246-V264 HydrophobicContact CG-CB 4.18Å; M246-V264 HydrophobicContact CG-CG1 3.71Å; M246-V264 HydrophobicContact SD-CB 3.54Å; M246-V264 VanDerWaalsContact SD-CB 3.54Å; M246-V264 HydrophobicContact SD-CG1 3.44Å; M246-V264 WeakPolarHBondContact SD-CG1 3.27Å; M246-V264 HydrophobicContact SD-CG2 4.22Å; M246-F265 HydrophobicContact CB-CB 4.38Å; M246-F268 HydrophobicContact CG-CE2 4.11Å
247	M	97.8	Very high	97	Very high	34 Å²	34	53.7 Å²	53.7	17%	0.167	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-37.7	176.5	-71.7	177.9	63.3	0	0	112.7	L243 K244 L245 L250 F265 I281 N285 L289	L243-M247 HydrophobicContact CD1-CG 4.11Å; L243-M247 HydrophobicContact CD1-SD 4.07Å; L243-M247 HydrophobicContact CD2-SD 4.43Å; L243-M247 HydrophobicContact CG-CG 4.42Å; L243-M247 HydrophobicContact CG-SD 3.95Å; L243-M247 WeakPolarHBondContact O-CG 3.16Å; L243-M247 PolarHBondContact O-N 3.29Å; K244-M247 PolarHBondContact O-N 3.45Å; L245-M247 VanDerWaalsContact C-N 3.34Å; L245-M247 PolarHBondContact O-N 3.12Å; M247-L250 WeakPolarHBondContact O-CB 3.39Å; M247-L250 PolarHBondContact O-N 3.41Å; M247-F265 HydrophobicContact CG-CD2 4.18Å; M247-F265 HydrophobicContact CG-CE2 3.94Å; M247-I281 HydrophobicContact SD-CG2 3.88Å; M247-N285 HydrophobicContact CE-CB 4.16Å; M247-L289 HydrophobicContact CE-CD1 4.24Å; M247-L289 HydrophobicContact CE-CD2 4.11Å; M247-L289 HydrophobicContact CE-CG 4.38Å
248	N	97	Very high	96.9	Very high	102 Å²	102	55.1 Å²	55.1	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-68	-38.7	173.9	-71.1	-26	0	0	0	111.7	K244 L245 M246 L250 I251 E252	K244-N248 VanDerWaalsContact O-CG 3.31Å; K244-N248 PolarHBondContact O-N 3.19Å; K244-N248 PolarHBondContact O-ND2 3.3Å; L245-N248 PolarHBondContact O-N 3.27Å; M246-N248 VanDerWaalsContact C-N 3.34Å; M246-N248 PolarHBondContact O-N 3.37Å; N248-L250 VanDerWaalsContact C-N 3.26Å; N248-L250 PolarHBondContact O-N 2.73Å; N248-I251 WeakPolarHBondContact O-CG1 3.43Å; N248-I251 PolarHBondContact O-N 3.45Å; N248-E252 PolarHBondContact O-N 3.39Å
249	L	97.2	Very high	96.9	Very high	6 Å²	6	54.2 Å²	54.2	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-68.2	-23.3	176.5	-67.9	170.5	0	0	0	112.9	L217 L245 M246 I251 E252 I257 A261	L217-L249 HydrophobicContact CD1-CD1 4.09Å; L217-L249 HydrophobicContact CD2-CD1 4.12Å; L245-L249 HydrophobicContact CD1-CD1 4.24Å; L245-L249 HydrophobicContact CD1-CG 4.38Å; L245-L249 HydrophobicContact CG-CD1 4.07Å; L245-L249 WeakPolarHBondContact O-CG 3.22Å; L245-L249 PolarHBondContact O-N 2.82Å; M246-L249 HydrophobicContact CE-CD1 3.8Å; M246-L249 PolarHBondContact O-N 3.16Å; M246-L249 HydrophobicContact SD-CD1 4.23Å; L249-I251 VanDerWaalsContact C-N 3.26Å; L249-I251 PolarHBondContact O-N 2.89Å; L249-E252 HydrophobicContact CD2-CG 4.03Å; L249-E252 WeakPolarHBondContact O-CB 3.24Å; L249-E252 PolarHBondContact O-N 3.27Å; L249-I257 HydrophobicContact CB-CG2 4.43Å; L249-I257 HydrophobicContact CD2-CG2 3.99Å; L249-A261 HydrophobicContact CB-CB 3.61Å
250	L	97.5	Very high	96.9	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-25.3	172.2	-72	174.7	0	0	0	113.2	M246 M247 N248 Q258 A261 F262 F265 F292 F296	M246-L250 WeakPolarHBondContact O-CG 3.4Å; M246-L250 PolarHBondContact O-N 2.87Å; M247-L250 WeakPolarHBondContact O-CB 3.39Å; M247-L250 PolarHBondContact O-N 3.41Å; N248-L250 VanDerWaalsContact C-N 3.26Å; N248-L250 PolarHBondContact O-N 2.73Å; L250-Q258 VanDerWaalsContact O-CG 3.32Å; L250-Q258 WeakPolarHBondContact O-CG 3.31Å; L250-A261 HydrophobicContact CD2-CB 4.09Å; L250-A261 HydrophobicContact CG-CB 4.4Å; L250-F262 HydrophobicContact CD2-CB 3.93Å; L250-F265 HydrophobicContact CD1-CB 4.25Å; L250-F265 HydrophobicContact CD1-CD1 4.08Å; L250-F265 HydrophobicContact CD1-CD2 4.05Å; L250-F265 HydrophobicContact CD1-CE1 4.46Å; L250-F265 HydrophobicContact CD1-CE2 4.44Å; L250-F265 HydrophobicContact CD1-CG 3.85Å; L250-F292 HydrophobicContact CB-CE1 4.04Å; L250-F292 HydrophobicContact CB-CZ 4.12Å; L250-F292 HydrophobicContact CD1-CE1 4.47Å; L250-F292 WeakPolarHBondContact O-CZ 3.38Å; L250-F296 HydrophobicContact CD2-CE1 4.47Å; L250-F296 HydrophobicContact CD2-CE2 4.21Å; L250-F296 HydrophobicContact CD2-CZ 3.83Å
251	I	96.2	Very high	96.9	Very high	114 Å²	114	50.4 Å²	50.4	59%	0.585	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	10.4	179.7	63.1	167.8	0	0	0	113.1	N248 L249 F292	N248-I251 WeakPolarHBondContact O-CG1 3.43Å; N248-I251 PolarHBondContact O-N 3.45Å; L249-I251 VanDerWaalsContact C-N 3.26Å; L249-I251 PolarHBondContact O-N 2.89Å; I251-F292 HydrophobicContact CG2-CD2 4.5Å; I251-F292 HydrophobicContact CG2-CE2 3.83Å; I251-F292 HydrophobicContact CG2-CZ 4.16Å
252	E	94	Very high	96.9	Very high	54 Å²	54	45.6 Å²	45.6	25%	0.252	21%	0.211	S	C	.	.	S	Bend	trans	-61.1	159.7	177.9	-97.1	-71.7	-177.2	0	0	113	R213 N248 L249 S254 I257 Q258	R213-E252 IonicContact CZ-OE1 3.47Å; R213-E252 IonicContact NH1-OE1 2.86Å; R213-E252 PolarHBondContact NH1-OE1 3.36Å; R213-E252 IonicContact NH2-OE1 3.13Å; R213-E252 IonicContact NH2-OE2 2.72Å; N248-E252 PolarHBondContact O-N 3.39Å; L249-E252 HydrophobicContact CD2-CG 4.03Å; L249-E252 WeakPolarHBondContact O-CB 3.24Å; L249-E252 PolarHBondContact O-N 3.27Å; E252-S254 VanDerWaalsContact C-N 3.26Å; E252-S254 PolarHBondContact O-N 2.79Å; E252-I257 HydrophobicContact CB-CG2 4.15Å; E252-I257 HydrophobicContact CG-CG2 4.25Å; E252-Q258 PolarHBondContact O-NE2 2.89Å
253	R	94	Very high	96.8	Very high	245 Å²	245	47.1 Å²	47.1	93%	0.925	22%	0.217	S	C	*	.	S	Bend	trans	-66.3	-31.3	-179.7	-64.1	-177.7	-177.1	-179.3	1.7	112.6	R255	R253-R255 PolarHBondContact O-N 3.04Å
254	S	95.9	Very high	96.8	Very high	26 Å²	26	47.1 Å²	47.1	18%	0.182	22%	0.217	C	C	.	.			trans	-86.4	113.6	-175.8	177.9	0	0	0	0	111.8	Y210 E252 S256 I257 Q258	Y210-S254 VanDerWaalsContact CE2-OG 3.32Å; Y210-S254 WeakPolarHBondContact CE2-OG 3.11Å; E252-S254 VanDerWaalsContact C-N 3.26Å; E252-S254 PolarHBondContact O-N 2.79Å; S254-S256 PolarHBondContact O-N 3.01Å; S254-S256 VanDerWaalsContact O-N 3.13Å; S254-S256 PolarHBondContact OG-N 3.43Å; S254-I257 PolarHBondContact O-N 3.31Å; S254-Q258 WeakPolarHBondContact O-CG 3.46Å; S254-Q258 PolarHBondContact O-N 3.38Å
255	R	95.2	Very high	96.8	Very high	126 Å²	126	42.8 Å²	42.8	48%	0.475	20%	0.199	S	C	.	.	H	α-helix	trans	-52.7	-32.8	172.7	-62.6	-154.8	81.7	156.5	9.2	113.4	R253 F259 H297 E299	R253-R255 PolarHBondContact O-N 3.04Å; R255-F259 WeakPolarHBondContact O-CB 3.46Å; R255-F259 PolarHBondContact O-N 3.34Å; R255-F259 VanDerWaalsContact O-N 3.16Å; R255-H297 PolarHBondContact O-CE1 2.7Å; R255-H297 VanDerWaalsContact O-CE1 3.29Å; R255-H297 PolarHBondContact O-NE2 3.34Å; R255-E299 IonicContact CZ-OE1 3.18Å; R255-E299 IonicContact CZ-OE2 3.71Å; R255-E299 VanDerWaalsContact CZ-OE2 3.32Å; R255-E299 IonicContact NE-OE1 2.71Å; R255-E299 IonicContact NH1-OE1 4Å; R255-E299 PolarHBondContact NH1-OE1 3.38Å; R255-E299 IonicContact NH1-OE2 2.78Å; R255-E299 PolarHBondContact NH1-OE2 2.73Å; R255-E299 IonicContact NH2-OE1 2.78Å; R255-E299 PolarHBondContact NH2-OE1 2.71Å; R255-E299 IonicContact NH2-OE2 3.86Å; R255-E299 PolarHBondContact NH2-OE2 3.06Å
256	S	95.3	Very high	96.7	Very high	45 Å²	45	43.1 Å²	43.1	32%	0.315	20%	0.199	S	C	.	.	H	α-helix	trans	-72.6	-37.4	176.9	-60.2	0	0	0	0	112.6	Y210 S254 E260	Y210-S256 WeakPolarHBondContact OH-CB 3.42Å; S254-S256 PolarHBondContact O-N 3.01Å; S254-S256 VanDerWaalsContact O-N 3.13Å; S254-S256 PolarHBondContact OG-N 3.43Å; S256-E260 WeakPolarHBondContact O-CG 3.4Å; S256-E260 PolarHBondContact O-N 3.14Å
257	I	97.2	Very high	96.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.9	-44.2	175.1	-69.6	177.1	0	0	0	110.1	Y210 R213 R214 L217 L249 E252 S254 F259 E260 A261	Y210-I257 HydrophobicContact CD2-CD1 3.96Å; Y210-I257 HydrophobicContact CD2-CG1 4.4Å; Y210-I257 HydrophobicContact CE2-CD1 4.15Å; Y210-I257 HydrophobicContact CE2-CG1 4.11Å; R213-I257 HydrophobicContact CG-CD1 4.17Å; R214-I257 HydrophobicContact CB-CG1 4.38Å; L217-I257 HydrophobicContact CD2-CG2 3.99Å; L217-I257 WeakPolarHBondContact CD2-O 3.3Å; L249-I257 HydrophobicContact CB-CG2 4.43Å; L249-I257 HydrophobicContact CD2-CG2 3.99Å; E252-I257 HydrophobicContact CB-CG2 4.15Å; E252-I257 HydrophobicContact CG-CG2 4.25Å; S254-I257 PolarHBondContact O-N 3.31Å; I257-F259 VanDerWaalsContact C-N 3.27Å; I257-F259 PolarHBondContact O-N 3.23Å; I257-E260 PolarHBondContact O-N 3.32Å; I257-A261 WeakPolarHBondContact O-CB 3.34Å; I257-A261 PolarHBondContact O-N 3.09Å
258	Q	97.4	Very high	96.7	Very high	32 Å²	32	42.1 Å²	42.1	15%	0.15	20%	0.195	C	C	.	.	H	α-helix	trans	-52.3	-47.4	175.6	-66.2	177.9	-16.5	0	0	111.3	L250 E252 S254 A261 F262 F296	L250-Q258 VanDerWaalsContact O-CG 3.32Å; L250-Q258 WeakPolarHBondContact O-CG 3.31Å; E252-Q258 PolarHBondContact O-NE2 2.89Å; S254-Q258 WeakPolarHBondContact O-CG 3.46Å; S254-Q258 PolarHBondContact O-N 3.38Å; Q258-A261 WeakPolarHBondContact O-CB 3.28Å; Q258-A261 PolarHBondContact O-N 3.29Å; Q258-F262 PolarHBondContact O-N 3.01Å; Q258-F296 HydrophobicContact CB-CE2 3.88Å; Q258-F296 HydrophobicContact CB-CZ 3.91Å
259	F	96.5	Very high	96.7	Very high	25 Å²	25	37.2 Å²	37.2	11%	0.11	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-43.5	-179.2	-167	-99.7	0	0	0	113	R255 I257 F262 H263 F306	R255-F259 WeakPolarHBondContact O-CB 3.46Å; R255-F259 PolarHBondContact O-N 3.34Å; R255-F259 VanDerWaalsContact O-N 3.16Å; I257-F259 VanDerWaalsContact C-N 3.27Å; I257-F259 PolarHBondContact O-N 3.23Å; F259-F262 WeakPolarHBondContact O-CB 3.32Å; F259-F262 PolarHBondContact O-N 3.3Å; F259-H263 AromaticContact CD1-NE2 3.8Å; F259-H263 AromaticContact CE1-NE2 3.24Å; F259-H263 WeakPolarHBondContact CE1-NE2 3.39Å; F259-H263 AromaticContact CZ-NE2 3.77Å; F259-H263 PolarHBondContact O-N 3.11Å; F259-F306 HydrophobicContact CD2-CD2 4.47Å; F259-F306 HydrophobicContact CD2-CE2 4.27Å; F259-F306 HydrophobicContact CE2-CD1 4.46Å; F259-F306 AromaticContact CE2-CD2 3.66Å; F259-F306 HydrophobicContact CE2-CD2 3.66Å; F259-F306 AromaticContact CE2-CE2 3.88Å; F259-F306 HydrophobicContact CE2-CE2 3.88Å; F259-F306 AromaticContact CE2-CG 3.98Å; F259-F306 HydrophobicContact CE2-CG 3.98Å; F259-F306 HydrophobicContact CE2-CZ 4.37Å; F259-F306 HydrophobicContact CZ-CD2 4.31Å
260	E	97.2	Very high	96.6	Very high	22 Å²	22	38.9 Å²	38.9	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-69.3	-35.7	175.8	-57.3	-66.5	175.2	0	0	111.5	R214 L217 K218 S256 I257 F262 H263 V264	R214-E260 HydrophobicContact CG-CG 4.43Å; L217-E260 HydrophobicContact CB-CB 4.25Å; L217-E260 HydrophobicContact CD2-CB 3.85Å; L217-E260 HydrophobicContact CG-CB 3.78Å; K218-E260 HydrophobicContact CB-CG 4.33Å; S256-E260 WeakPolarHBondContact O-CG 3.4Å; S256-E260 PolarHBondContact O-N 3.14Å; I257-E260 PolarHBondContact O-N 3.32Å; E260-F262 VanDerWaalsContact C-N 3.27Å; E260-F262 PolarHBondContact O-N 3.04Å; E260-H263 PolarHBondContact O-N 3Å; E260-H263 IonicContact OE2-CD2 3.01Å; E260-V264 PolarHBondContact O-N 3.43Å
261	A	98	Very high	96.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-37.6	175.1	0	0	0	0	0	111.7	L217 L249 L250 I257 Q258 H263 V264 F265	L217-A261 HydrophobicContact CD2-CB 3.92Å; L249-A261 HydrophobicContact CB-CB 3.61Å; L250-A261 HydrophobicContact CD2-CB 4.09Å; L250-A261 HydrophobicContact CG-CB 4.4Å; I257-A261 WeakPolarHBondContact O-CB 3.34Å; I257-A261 PolarHBondContact O-N 3.09Å; Q258-A261 WeakPolarHBondContact O-CB 3.28Å; Q258-A261 PolarHBondContact O-N 3.29Å; A261-H263 VanDerWaalsContact C-N 3.31Å; A261-H263 PolarHBondContact O-N 3.28Å; A261-V264 PolarHBondContact O-N 3.16Å; A261-F265 WeakPolarHBondContact O-CB 3.47Å; A261-F265 PolarHBondContact O-N 2.8Å
262	F	97.9	Very high	96.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.8	-41.8	175	174.7	-90	0	0	0	112.1	L250 Q258 F259 E260 V264 F265 K266 L293 F296 F306 E309 K310 L313	L250-F262 HydrophobicContact CD2-CB 3.93Å; Q258-F262 PolarHBondContact O-N 3.01Å; F259-F262 WeakPolarHBondContact O-CB 3.32Å; F259-F262 PolarHBondContact O-N 3.3Å; E260-F262 VanDerWaalsContact C-N 3.27Å; E260-F262 PolarHBondContact O-N 3.04Å; F262-V264 PolarHBondContact O-N 2.93Å; F262-F265 PolarHBondContact O-N 3.27Å; F262-K266 WeakPolarHBondContact O-CB 3.07Å; F262-K266 PolarHBondContact O-N 2.96Å; F262-L293 HydrophobicContact CD2-CD2 4.27Å; F262-L293 HydrophobicContact CE2-CD2 4.12Å; F262-F296 HydrophobicContact CB-CE1 3.71Å; F262-F296 HydrophobicContact CB-CZ 4.09Å; F262-F296 HydrophobicContact CD2-CD1 4.03Å; F262-F296 AromaticContact CD2-CE1 3.7Å; F262-F296 HydrophobicContact CD2-CE1 3.7Å; F262-F296 AromaticContact CG-CE1 3.88Å; F262-F296 HydrophobicContact CG-CE1 3.88Å; F262-F306 HydrophobicContact CD1-CD2 4.09Å; F262-F306 AromaticContact CD1-CE2 3.8Å; F262-F306 HydrophobicContact CD1-CE2 3.8Å; F262-F306 HydrophobicContact CD2-CE2 4.37Å; F262-F306 AromaticContact CE1-CD2 3.75Å; F262-F306 HydrophobicContact CE1-CD2 3.75Å; F262-F306 AromaticContact CE1-CE2 3.69Å; F262-F306 HydrophobicContact CE1-CE2 3.69Å; F262-F306 HydrophobicContact CE2-CE2 4.26Å; F262-F306 HydrophobicContact CG-CE2 4.16Å; F262-F306 HydrophobicContact CZ-CD2 4.25Å; F262-F306 AromaticContact CZ-CE2 3.93Å; F262-F306 HydrophobicContact CZ-CE2 3.93Å; F262-E309 HydrophobicContact CE1-CB 4.28Å; F262-E309 HydrophobicContact CZ-CB 4.32Å; F262-K310 HydrophobicContact CE2-CB 4.45Å; F262-K310 HydrophobicContact CZ-CB 4.16Å; F262-L313 HydrophobicContact CD2-CD1 4.41Å; F262-L313 HydrophobicContact CE2-CD1 3.6Å; F262-L313 HydrophobicContact CZ-CD1 3.74Å
263	H	96.4	Very high	96.3	Very high	42 Å²	42	42 Å²	42	19%	0.194	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-23.1	178.1	-68.4	-43.7	0	0	0	114.2	F259 E260 A261 K266 E309	F259-H263 AromaticContact CD1-NE2 3.8Å; F259-H263 AromaticContact CE1-NE2 3.24Å; F259-H263 WeakPolarHBondContact CE1-NE2 3.39Å; F259-H263 AromaticContact CZ-NE2 3.77Å; F259-H263 PolarHBondContact O-N 3.11Å; E260-H263 PolarHBondContact O-N 3Å; E260-H263 IonicContact OE2-CD2 3.01Å; A261-H263 VanDerWaalsContact C-N 3.31Å; A261-H263 PolarHBondContact O-N 3.28Å; H263-K266 VanDerWaalsContact O-CG 3.29Å; H263-K266 WeakPolarHBondContact O-CG 3.1Å; H263-E309 IonicContact ND1-OE2 3.62Å
264	V	98	Very high	96.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-87	-44.3	171.6	-178.3	0	0	0	0	110.6	L217 L220 L224 Y236 M246 E260 A261 F262 K266 V267 F268	L217-V264 HydrophobicContact CD1-CG2 4.03Å; L220-V264 HydrophobicContact CD2-CG1 4.06Å; L220-V264 HydrophobicContact CD2-CG2 4.15Å; L220-V264 HydrophobicContact CG-CG1 4.47Å; L220-V264 HydrophobicContact CG-CG2 4.21Å; L224-V264 HydrophobicContact CD1-CG1 3.8Å; Y236-V264 HydrophobicContact CE1-CG1 4.26Å; M246-V264 HydrophobicContact CE-CG1 4.37Å; M246-V264 HydrophobicContact CG-CB 4.18Å; M246-V264 HydrophobicContact CG-CG1 3.71Å; M246-V264 HydrophobicContact SD-CB 3.54Å; M246-V264 VanDerWaalsContact SD-CB 3.54Å; M246-V264 HydrophobicContact SD-CG1 3.44Å; M246-V264 WeakPolarHBondContact SD-CG1 3.27Å; M246-V264 HydrophobicContact SD-CG2 4.22Å; E260-V264 PolarHBondContact O-N 3.43Å; A261-V264 PolarHBondContact O-N 3.16Å; F262-V264 PolarHBondContact O-N 2.93Å; V264-K266 VanDerWaalsContact C-N 3.28Å; V264-K266 PolarHBondContact O-N 3.23Å; V264-V267 WeakPolarHBondContact O-CB 3.45Å; V264-V267 PolarHBondContact O-N 3.29Å; V264-V267 VanDerWaalsContact O-N 3.07Å; V264-F268 HydrophobicContact CG1-CE2 4.18Å; V264-F268 WeakPolarHBondContact O-CD2 3.46Å
265	F	98.2	Very high	96.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-55.6	-40.8	177.1	173.7	-101.3	0	0	0	112.4	L243 M246 M247 L250 A261 F262 V267 F268 V269 L282 L289 L293 L313 I317	L243-F265 HydrophobicContact CD1-CD2 3.97Å; L243-F265 HydrophobicContact CD1-CE2 3.95Å; M246-F265 HydrophobicContact CB-CB 4.38Å; M247-F265 HydrophobicContact CG-CD2 4.18Å; M247-F265 HydrophobicContact CG-CE2 3.94Å; L250-F265 HydrophobicContact CD1-CB 4.25Å; L250-F265 HydrophobicContact CD1-CD1 4.08Å; L250-F265 HydrophobicContact CD1-CD2 4.05Å; L250-F265 HydrophobicContact CD1-CE1 4.46Å; L250-F265 HydrophobicContact CD1-CE2 4.44Å; L250-F265 HydrophobicContact CD1-CG 3.85Å; A261-F265 WeakPolarHBondContact O-CB 3.47Å; A261-F265 PolarHBondContact O-N 2.8Å; F262-F265 PolarHBondContact O-N 3.27Å; F265-V267 PolarHBondContact O-N 3.47Å; F265-V267 VanDerWaalsContact O-N 3.13Å; F265-F268 WeakPolarHBondContact O-CB 3.4Å; F265-F268 PolarHBondContact O-N 2.96Å; F265-V269 HydrophobicContact CD1-CG2 4.25Å; F265-V269 HydrophobicContact CE1-CG2 3.62Å; F265-V269 HydrophobicContact CE2-CG2 4.01Å; F265-V269 HydrophobicContact CZ-CG2 3.48Å; F265-V269 VanDerWaalsContact CZ-CG2 3.48Å; F265-V269 PolarHBondContact O-N 2.95Å; F265-L282 HydrophobicContact CE2-CD2 4.14Å; F265-L282 HydrophobicContact CZ-CD2 4.25Å; F265-L289 HydrophobicContact CZ-CD2 4.13Å; F265-L293 HydrophobicContact CE1-CD1 4.31Å; F265-L313 HydrophobicContact CD1-CD1 4.16Å; F265-L313 HydrophobicContact CE1-CD1 4.26Å; F265-I317 HydrophobicContact CE1-CD1 4.36Å; F265-I317 HydrophobicContact CZ-CD1 4.19Å
266	K	96.9	Very high	96.5	Very high	30 Å²	30	34.4 Å²	34.4	13%	0.13	20%	0.198	C	C	.	.	H	α-helix	trans	-56.3	-32.1	178.7	74.8	178.4	177.6	178.5	0	112.6	F262 H263 V264 V269 A270 E309 L313	F262-K266 WeakPolarHBondContact O-CB 3.07Å; F262-K266 PolarHBondContact O-N 2.96Å; H263-K266 VanDerWaalsContact O-CG 3.29Å; H263-K266 WeakPolarHBondContact O-CG 3.1Å; V264-K266 VanDerWaalsContact C-N 3.28Å; V264-K266 PolarHBondContact O-N 3.23Å; K266-V269 PolarHBondContact O-N 3.49Å; K266-A270 WeakPolarHBondContact O-CB 3.37Å; K266-A270 PolarHBondContact O-N 3.41Å; K266-E309 WeakPolarHBondContact CD-OE2 3.3Å; K266-E309 IonicContact NZ-OE1 3.61Å; K266-E309 PolarHBondContact NZ-OE1 2.87Å; K266-E309 IonicContact NZ-OE2 2.82Å; K266-E309 PolarHBondContact NZ-OE2 2.93Å; K266-L313 HydrophobicContact CB-CD1 3.65Å; K266-L313 HydrophobicContact CB-CD2 4.03Å; K266-L313 HydrophobicContact CB-CG 4.3Å
267	V	97.1	Very high	96.6	Very high	12 Å²	12	35.3 Å²	35.3	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-67.7	-37.2	-179.6	-167.4	0	0	0	0	111.2	L225 M233 I237 V264 F265 N271	L225-V267 HydrophobicContact CD2-CG2 3.79Å; L225-V267 HydrophobicContact CG-CG2 4.39Å; M233-V267 HydrophobicContact CG-CG1 3.86Å; M233-V267 HydrophobicContact SD-CG1 3.67Å; I237-V267 HydrophobicContact CD1-CG1 4.38Å; I237-V267 HydrophobicContact CG2-CB 4.26Å; I237-V267 HydrophobicContact CG2-CG1 3.88Å; V264-V267 WeakPolarHBondContact O-CB 3.45Å; V264-V267 PolarHBondContact O-N 3.29Å; V264-V267 VanDerWaalsContact O-N 3.07Å; F265-V267 PolarHBondContact O-N 3.47Å; F265-V267 VanDerWaalsContact O-N 3.13Å; V267-N271 PolarHBondContact O-N 2.94Å
268	F	98.1	Very high	96.7	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-44.5	174.7	-72.3	-99.8	0	0	0	111.7	Y236 I237 N242 L243 M246 V264 F265 K274 I278	Y236-F268 HydrophobicContact CD1-CE2 4.24Å; Y236-F268 AromaticContact CD1-CZ 3.95Å; Y236-F268 HydrophobicContact CD1-CZ 3.95Å; Y236-F268 HydrophobicContact CE1-CE2 4.05Å; Y236-F268 AromaticContact CE1-CZ 3.87Å; Y236-F268 HydrophobicContact CE1-CZ 3.87Å; I237-F268 HydrophobicContact CB-CD1 3.91Å; I237-F268 HydrophobicContact CB-CE1 4.01Å; I237-F268 HydrophobicContact CB-CG 4.2Å; I237-F268 HydrophobicContact CB-CZ 4.32Å; I237-F268 HydrophobicContact CG2-CD1 4.36Å; I237-F268 HydrophobicContact CG2-CD2 4.12Å; I237-F268 HydrophobicContact CG2-CE1 4.36Å; I237-F268 HydrophobicContact CG2-CE2 4.07Å; I237-F268 HydrophobicContact CG2-CG 4.25Å; I237-F268 HydrophobicContact CG2-CZ 4.19Å; I237-F268 WeakPolarHBondContact O-CD1 3.38Å; I237-F268 WeakPolarHBondContact O-CE1 3.33Å; N242-F268 HydrophobicContact CB-CE1 4.24Å; N242-F268 HydrophobicContact CB-CZ 3.71Å; L243-F268 HydrophobicContact CB-CD1 3.82Å; L243-F268 HydrophobicContact CB-CE1 3.73Å; L243-F268 HydrophobicContact CB-CZ 4.44Å; L243-F268 HydrophobicContact CD1-CB 4.05Å; L243-F268 HydrophobicContact CD1-CD1 4Å; L243-F268 HydrophobicContact CD1-CG 3.95Å; L243-F268 HydrophobicContact CG-CD1 4.39Å; M246-F268 HydrophobicContact CG-CE2 4.11Å; V264-F268 HydrophobicContact CG1-CE2 4.18Å; V264-F268 WeakPolarHBondContact O-CD2 3.46Å; F265-F268 WeakPolarHBondContact O-CB 3.4Å; F265-F268 PolarHBondContact O-N 2.96Å; F268-K274 WeakPolarHBondContact O-CE 3.47Å; F268-I278 HydrophobicContact CD1-CD1 4.43Å; F268-I278 HydrophobicContact CD1-CG2 4.41Å; F268-I278 HydrophobicContact CE1-CD1 4.5Å
269	V	97.1	Very high	96.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-76.6	-34.5	-176.5	179	0	0	0	0	111.7	F265 K266 N271 K274 L282 L313 Q316 I317	F265-V269 HydrophobicContact CD1-CG2 4.25Å; F265-V269 HydrophobicContact CE1-CG2 3.62Å; F265-V269 HydrophobicContact CE2-CG2 4.01Å; F265-V269 HydrophobicContact CZ-CG2 3.48Å; F265-V269 VanDerWaalsContact CZ-CG2 3.48Å; F265-V269 PolarHBondContact O-N 2.95Å; K266-V269 PolarHBondContact O-N 3.49Å; V269-N271 VanDerWaalsContact C-N 3.28Å; V269-N271 PolarHBondContact O-N 3.44Å; V269-K274 WeakPolarHBondContact O-CE 3.5Å; V269-K274 PolarHBondContact O-NZ 3.23Å; V269-L282 HydrophobicContact CG2-CD1 4.25Å; V269-L282 HydrophobicContact CG2-CD2 4.12Å; V269-L313 HydrophobicContact CB-CD2 3.79Å; V269-L313 HydrophobicContact CG1-CB 4.46Å; V269-L313 HydrophobicContact CG1-CD2 3.72Å; V269-Q316 HydrophobicContact CG1-CB 3.87Å; V269-I317 HydrophobicContact CG1-CD1 4.19Å; V269-I317 HydrophobicContact CG1-CG1 3.75Å; V269-I317 HydrophobicContact CG2-CD1 4.2Å; V269-I317 HydrophobicContact CG2-CG1 4.35Å
270	A	95.5	Very high	96.7	Very high	41 Å²	41	36.9 Å²	36.9	34%	0.339	22%	0.217	S	C	.	.	H	α-helix	trans	-75.5	-14.2	178	0	0	0	0	0	113.5	K266 P272 Y312	K266-A270 WeakPolarHBondContact O-CB 3.37Å; K266-A270 PolarHBondContact O-N 3.41Å; A270-P272 VanDerWaalsContact O-CD 3.27Å; A270-P272 WeakPolarHBondContact O-CD 3.49Å; A270-Y312 HydrophobicContact CB-CE1 4.22Å
271	N	95.1	Very high	96.7	Very high	26 Å²	26	37 Å²	37	14%	0.139	22%	0.217	C	C	.	.			trans	-60.7	118	177.3	179.1	10.1	0	0	0	110.7	I237 V267 V269 A273 K274	I237-N271 HydrophobicContact CD1-CB 3.85Å; V267-N271 PolarHBondContact O-N 2.94Å; V269-N271 VanDerWaalsContact C-N 3.28Å; V269-N271 PolarHBondContact O-N 3.44Å; N271-A273 VanDerWaalsContact C-N 3.3Å; N271-A273 PolarHBondContact ND2-O 2.86Å; N271-A273 VanDerWaalsContact ND2-O 3.1Å; N271-A273 PolarHBondContact O-N 3.49Å; N271-A273 PolarHBondContact OD1-N 3.3Å; N271-K274 HydrophobicContact CB-CG 4.24Å; N271-K274 WeakPolarHBondContact O-CE 3.44Å; N271-K274 WeakPolarHBondContact O-CG 3.07Å; N271-K274 PolarHBondContact O-NZ 3.2Å
272	P	92.8	Very high	96.7	Very high	132 Å²	132	37 Å²	37	86%	0.857	22%	0.217	S	C	*	.	S	Bend	trans	-68.5	-30.4	178.4	26.9	-34.2	0	0	0	112.5	A270	A270-P272 VanDerWaalsContact O-CD 3.27Å; A270-P272 WeakPolarHBondContact O-CD 3.49Å
273	A	93.5	Very high	96.7	Very high	77 Å²	77	39.3 Å²	39.3	64%	0.636	23%	0.23	S	C	*	.	S	Bend	trans	-107.7	63.1	-178.2	0	0	0	0	0	110.7	N271 P275	N271-A273 VanDerWaalsContact C-N 3.3Å; N271-A273 PolarHBondContact ND2-O 2.86Å; N271-A273 VanDerWaalsContact ND2-O 3.1Å; N271-A273 PolarHBondContact O-N 3.49Å; N271-A273 PolarHBondContact OD1-N 3.3Å; A273-P275 WeakPolarHBondContact O-CD 3.42Å
274	K	95.5	Very high	96.7	Very high	43 Å²	43	47.1 Å²	47.1	19%	0.187	26%	0.257	C	S	.	.			trans	-66.1	127.6	-179.7	-56.6	-176.6	179.6	62.1	0	110.5	F268 V269 N271 L282 M320	F268-K274 WeakPolarHBondContact O-CE 3.47Å; V269-K274 WeakPolarHBondContact O-CE 3.5Å; V269-K274 PolarHBondContact O-NZ 3.23Å; N271-K274 HydrophobicContact CB-CG 4.24Å; N271-K274 WeakPolarHBondContact O-CE 3.44Å; N271-K274 WeakPolarHBondContact O-CG 3.07Å; N271-K274 PolarHBondContact O-NZ 3.2Å; K274-L282 HydrophobicContact CD-CD1 4.02Å; K274-M320 HydrophobicContact CD-CE 3.76Å
275	P	96.2	Very high	96.7	Very high	39 Å²	39	49.4 Å²	49.4	25%	0.253	27%	0.269	S	S	.	.			trans	-60.7	148	169.8	-25.6	37.1	0	0	0	111.4	S238 A273 P277 I278 A279	S238-P275 WeakPolarHBondContact OG-CG 3.27Å; A273-P275 WeakPolarHBondContact O-CD 3.42Å; P275-P277 VanDerWaalsContact C-CD 3.49Å; P275-I278 HydrophobicContact CB-CG1 4.27Å; P275-I278 HydrophobicContact CG-CG1 4.39Å; P275-I278 WeakPolarHBondContact O-CB 3.49Å; P275-I278 PolarHBondContact O-N 3.41Å; P275-A279 PolarHBondContact O-N 2.8Å
276	K	96.6	Very high	96.6	Very high	155 Å²	155	53.8 Å²	53.8	67%	0.674	29%	0.286	S	S	*	.	H	α-helix	trans	-50.5	-45.7	-177.8	-177.5	175.2	-178.4	175.1	0	113.9	I278 A279 D280	K276-I278 VanDerWaalsContact C-N 3.26Å; K276-I278 PolarHBondContact O-N 2.86Å; K276-A279 PolarHBondContact O-N 2.72Å; K276-D280 WeakPolarHBondContact O-CB 3.32Å; K276-D280 PolarHBondContact O-N 2.89Å
277	P	97.5	Very high	96.6	Very high	65 Å²	65	59.7 Å²	59.7	42%	0.422	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-32.8	178.1	-24.6	35.5	0	0	0	114.2	P240 P275 I281	P240-P277 HydrophobicContact CB-CB 4.37Å; P240-P277 HydrophobicContact CG-CB 4.35Å; P275-P277 VanDerWaalsContact C-CD 3.49Å; P277-I281 WeakPolarHBondContact O-CD1 3.47Å; P277-I281 VanDerWaalsContact O-CG1 3.3Å; P277-I281 WeakPolarHBondContact O-CG1 3.22Å; P277-I281 PolarHBondContact O-N 3.28Å
278	I	98.2	Very high	96.6	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-72	-47.4	177	-57.5	-56.1	0	0	0	109.7	I237 P240 L243 F268 P275 K276 D280 I281 L282	I237-I278 WeakPolarHBondContact O-CG1 3.49Å; P240-I278 HydrophobicContact CB-CD1 4.3Å; L243-I278 HydrophobicContact CB-CD1 4.25Å; L243-I278 HydrophobicContact CD2-CD1 4.34Å; L243-I278 HydrophobicContact CD2-CG2 4.04Å; F268-I278 HydrophobicContact CD1-CD1 4.43Å; F268-I278 HydrophobicContact CD1-CG2 4.41Å; F268-I278 HydrophobicContact CE1-CD1 4.5Å; P275-I278 HydrophobicContact CB-CG1 4.27Å; P275-I278 HydrophobicContact CG-CG1 4.39Å; P275-I278 WeakPolarHBondContact O-CB 3.49Å; P275-I278 PolarHBondContact O-N 3.41Å; K276-I278 VanDerWaalsContact C-N 3.26Å; K276-I278 PolarHBondContact O-N 2.86Å; I278-D280 PolarHBondContact O-N 2.91Å; I278-I281 PolarHBondContact O-N 3.42Å; I278-L282 HydrophobicContact CG2-CD1 4.25Å; I278-L282 WeakPolarHBondContact O-CG 3.48Å; I278-L282 PolarHBondContact O-N 2.97Å; I278-L282 VanDerWaalsContact O-N 3.11Å
279	A	97.4	Very high	96.5	Very high	19 Å²	19	69 Å²	69	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-45.1	177.2	0	0	0	0	0	111.7	P275 K276 I281 L282 I283 M320	P275-A279 PolarHBondContact O-N 2.8Å; K276-A279 PolarHBondContact O-N 2.72Å; A279-I281 VanDerWaalsContact C-N 3.31Å; A279-I281 PolarHBondContact O-N 3.41Å; A279-L282 PolarHBondContact O-N 3.44Å; A279-I283 WeakPolarHBondContact O-CB 3.32Å; A279-I283 VanDerWaalsContact O-CG1 3.31Å; A279-I283 WeakPolarHBondContact O-CG1 3.38Å; A279-I283 PolarHBondContact O-N 3.25Å; A279-M320 HydrophobicContact CB-CE 4.09Å
280	D	97.4	Very high	96.5	Very high	71 Å²	71	70 Å²	70	38%	0.38	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-40	178.8	-69.8	-15.9	0	0	0	112	K276 I278 R284	K276-D280 WeakPolarHBondContact O-CB 3.32Å; K276-D280 PolarHBondContact O-N 2.89Å; I278-D280 PolarHBondContact O-N 2.91Å; D280-R284 WeakPolarHBondContact O-CB 3.47Å; D280-R284 PolarHBondContact O-N 3.45Å
281	I	97.8	Very high	96.6	Very high	23 Å²	23	72.1 Å²	72.1	12%	0.118	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-46.1	176.2	-69.6	167.5	0	0	0	110.9	P240 L243 K244 M247 P277 I278 A279 N285	P240-I281 HydrophobicContact CB-CD1 3.61Å; L243-I281 HydrophobicContact CD2-CB 3.84Å; L243-I281 HydrophobicContact CD2-CD1 4.22Å; L243-I281 HydrophobicContact CD2-CG2 3.59Å; L243-I281 HydrophobicContact CG-CG2 4.27Å; K244-I281 HydrophobicContact CG-CD1 4.47Å; M247-I281 HydrophobicContact SD-CG2 3.88Å; P277-I281 WeakPolarHBondContact O-CD1 3.47Å; P277-I281 VanDerWaalsContact O-CG1 3.3Å; P277-I281 WeakPolarHBondContact O-CG1 3.22Å; P277-I281 PolarHBondContact O-N 3.28Å; I278-I281 PolarHBondContact O-N 3.42Å; A279-I281 VanDerWaalsContact C-N 3.31Å; A279-I281 PolarHBondContact O-N 3.41Å; I281-N285 PolarHBondContact O-N 3.34Å; I281-N285 PolarHBondContact O-ND2 3.47Å
282	L	97.7	Very high	96.7	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.6	-44.6	-179.2	-67.9	173.8	0	0	0	111.6	L243 F265 V269 K274 I278 A279 N285 R286 L289 M320	L243-L282 HydrophobicContact CD1-CD2 4.42Å; L243-L282 HydrophobicContact CD2-CD2 4.29Å; L243-L282 HydrophobicContact CD2-CG 4.23Å; F265-L282 HydrophobicContact CE2-CD2 4.14Å; F265-L282 HydrophobicContact CZ-CD2 4.25Å; V269-L282 HydrophobicContact CG2-CD1 4.25Å; V269-L282 HydrophobicContact CG2-CD2 4.12Å; K274-L282 HydrophobicContact CD-CD1 4.02Å; I278-L282 HydrophobicContact CG2-CD1 4.25Å; I278-L282 WeakPolarHBondContact O-CG 3.48Å; I278-L282 PolarHBondContact O-N 2.97Å; I278-L282 VanDerWaalsContact O-N 3.11Å; A279-L282 PolarHBondContact O-N 3.44Å; L282-N285 CarbonylContact O-C 3.48Å; L282-N285 PolarHBondContact O-N 3.1Å; L282-R286 WeakPolarHBondContact O-CA 3.38Å; L282-R286 PolarHBondContact O-N 2.93Å; L282-L289 HydrophobicContact CD2-CD1 3.95Å; L282-M320 HydrophobicContact CB-CE 3.82Å; L282-M320 HydrophobicContact CB-SD 3.71Å; L282-M320 HydrophobicContact CD1-CE 3.86Å; L282-M320 HydrophobicContact CD1-SD 3.84Å; L282-M320 HydrophobicContact CG-CE 4.5Å; L282-M320 HydrophobicContact CG-SD 4.42Å
283	I	97.3	Very high	96.9	Very high	50 Å²	50	67.5 Å²	67.5	26%	0.256	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-46.1	178.2	-68.5	165.1	0	0	0	110.6	A279 N285 R286 M320 K321	A279-I283 WeakPolarHBondContact O-CB 3.32Å; A279-I283 VanDerWaalsContact O-CG1 3.31Å; A279-I283 WeakPolarHBondContact O-CG1 3.38Å; A279-I283 PolarHBondContact O-N 3.25Å; I283-N285 PolarHBondContact O-N 3.35Å; I283-R286 VanDerWaalsContact O-CB 3.26Å; I283-R286 WeakPolarHBondContact O-CB 3.42Å; I283-R286 PolarHBondContact O-N 3.16Å; I283-R286 VanDerWaalsContact O-N 3.15Å; I283-M320 HydrophobicContact CG1-CB 3.99Å; I283-M320 HydrophobicContact CG1-CE 4.31Å; I283-K321 WeakPolarHBondContact CD1-O 3.22Å
284	R	97.3	Very high	97	Very high	206 Å²	206	66.9 Å²	66.9	78%	0.777	32%	0.317	S	S	*	.	H	α-helix	trans	-58.9	-31.1	178.4	-174.2	-177.1	-59.7	177.6	2.2	112.8	D280	D280-R284 WeakPolarHBondContact O-CB 3.47Å; D280-R284 PolarHBondContact O-N 3.45Å
285	N	96.9	Very high	97	Very high	47 Å²	47	71.1 Å²	71.1	25%	0.251	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	9.6	-178.7	-66.6	-81.1	0	0	0	113.4	M247 I281 L282 I283 E287 R288 L289	M247-N285 HydrophobicContact CE-CB 4.16Å; I281-N285 PolarHBondContact O-N 3.34Å; I281-N285 PolarHBondContact O-ND2 3.47Å; L282-N285 CarbonylContact O-C 3.48Å; L282-N285 PolarHBondContact O-N 3.1Å; I283-N285 PolarHBondContact O-N 3.35Å; N285-E287 PolarHBondContact O-N 3.02Å; N285-R288 PolarHBondContact O-N 3.19Å; N285-L289 HydrophobicContact CB-CD1 3.9Å; N285-L289 HydrophobicContact CB-CG 4.09Å; N285-L289 WeakPolarHBondContact O-CB 3.41Å; N285-L289 WeakPolarHBondContact O-CG 3.37Å; N285-L289 PolarHBondContact O-N 2.91Å
286	R	96.7	Very high	97	Very high	92 Å²	92	69.8 Å²	69.8	35%	0.347	33%	0.325	S	S	.	.	H	α-helix	trans	-51.5	-56	-167.7	-178.8	177.3	65.2	-168.1	-1.9	113.6	L282 I283 R288 L289 V290 I317 M320	L282-R286 WeakPolarHBondContact O-CA 3.38Å; L282-R286 PolarHBondContact O-N 2.93Å; I283-R286 VanDerWaalsContact O-CB 3.26Å; I283-R286 WeakPolarHBondContact O-CB 3.42Å; I283-R286 PolarHBondContact O-N 3.16Å; I283-R286 VanDerWaalsContact O-N 3.15Å; R286-R288 VanDerWaalsContact C-N 3.35Å; R286-R288 PolarHBondContact O-N 3.36Å; R286-L289 PolarHBondContact O-N 2.95Å; R286-V290 VanDerWaalsContact O-CG2 3.29Å; R286-V290 WeakPolarHBondContact O-CG2 3.48Å; R286-V290 PolarHBondContact O-N 2.91Å; R286-I317 HydrophobicContact CB-CG2 4.38Å; R286-I317 WeakPolarHBondContact CD-O 3.39Å; R286-I317 HydrophobicContact CG-CG2 3.87Å; R286-I317 WeakPolarHBondContact CG-O 3.49Å; R286-M320 PolarHBondContact NH1-O 2.9Å
287	E	96.4	Very high	96.9	Very high	154 Å²	154	62.5 Å²	62.5	72%	0.72	29%	0.294	S	S	*	.	H	α-helix	trans	-61.9	-43.7	-176.1	-66.4	178.2	-178.1	0	0	111.8	N285 V290 D291	N285-E287 PolarHBondContact O-N 3.02Å; E287-V290 PolarHBondContact O-N 2.64Å; E287-D291 PolarHBondContact O-N 2.93Å
288	R	96.7	Very high	96.6	Very high	197 Å²	197	62.1 Å²	62.1	74%	0.743	30%	0.296	S	S	*	.	H	α-helix	trans	-65.6	-41.8	178.2	-68.2	-177.6	174.1	-175.1	-2.6	111.9	N285 R286 F292	N285-R288 PolarHBondContact O-N 3.19Å; R286-R288 VanDerWaalsContact C-N 3.35Å; R286-R288 PolarHBondContact O-N 3.36Å; R288-F292 WeakPolarHBondContact O-CB 3.26Å; R288-F292 PolarHBondContact O-N 3.27Å
289	L	97.2	Very high	96.3	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-42.8	177.9	-81.4	171.7	0	0	0	111.6	M247 F265 L282 N285 R286 F292 L293 I317	M247-L289 HydrophobicContact CE-CD1 4.24Å; M247-L289 HydrophobicContact CE-CD2 4.11Å; M247-L289 HydrophobicContact CE-CG 4.38Å; F265-L289 HydrophobicContact CZ-CD2 4.13Å; L282-L289 HydrophobicContact CD2-CD1 3.95Å; N285-L289 HydrophobicContact CB-CD1 3.9Å; N285-L289 HydrophobicContact CB-CG 4.09Å; N285-L289 WeakPolarHBondContact O-CB 3.41Å; N285-L289 WeakPolarHBondContact O-CG 3.37Å; N285-L289 PolarHBondContact O-N 2.91Å; R286-L289 PolarHBondContact O-N 2.95Å; L289-F292 PolarHBondContact O-N 2.83Å; L289-L293 VanDerWaalsContact O-CB 3.3Å; L289-L293 WeakPolarHBondContact O-CB 3.38Å; L289-L293 VanDerWaalsContact O-CG 3.25Å; L289-L293 WeakPolarHBondContact O-CG 2.89Å; L289-L293 PolarHBondContact O-N 2.97Å; L289-I317 HydrophobicContact CB-CD1 4.38Å; L289-I317 HydrophobicContact CB-CG2 4.38Å; L289-I317 HydrophobicContact CD1-CD1 4.48Å
290	V	96.9	Very high	96.1	Very high	23 Å²	23	70.4 Å²	70.4	14%	0.139	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-48.1	177.9	167.9	0	0	0	0	111.1	R286 E287 F292 S294 I314 I317 Q318	R286-V290 VanDerWaalsContact O-CG2 3.29Å; R286-V290 WeakPolarHBondContact O-CG2 3.48Å; R286-V290 PolarHBondContact O-N 2.91Å; E287-V290 PolarHBondContact O-N 2.64Å; V290-F292 VanDerWaalsContact C-N 3.35Å; V290-F292 PolarHBondContact O-N 3.28Å; V290-S294 WeakPolarHBondContact O-CB 3.29Å; V290-S294 PolarHBondContact O-N 2.92Å; V290-S294 PolarHBondContact O-OG 3.23Å; V290-I314 HydrophobicContact CG1-CG2 4.11Å; V290-I317 HydrophobicContact CG2-CG2 3.96Å; V290-Q318 HydrophobicContact CG1-CG 4.35Å; V290-Q318 HydrophobicContact CG2-CG 3.64Å
291	D	97.2	Very high	95.7	Very high	85 Å²	85	72 Å²	72	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-62.1	-43.8	176.9	-177.1	65.1	0	0	0	111.6	E287 S294 K295	E287-D291 PolarHBondContact O-N 2.93Å; D291-S294 PolarHBondContact O-N 3.39Å; D291-K295 PolarHBondContact O-N 2.7Å; D291-K295 VanDerWaalsContact OD1-CE 3.28Å; D291-K295 WeakPolarHBondContact OD1-CE 3.38Å; D291-K295 IonicContact OD1-NZ 2.74Å; D291-K295 PolarHBondContact OD1-NZ 2.9Å; D291-K295 IonicContact OD2-NZ 2.77Å; D291-K295 PolarHBondContact OD2-NZ 3.32Å
292	F	97.2	Very high	95.4	Very high	60 Å²	60	79.8 Å²	79.8	26%	0.263	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-53.8	177.9	176.7	-93.5	0	0	0	111.9	L250 I251 R288 L289 V290 S294 K295 F296	L250-F292 HydrophobicContact CB-CE1 4.04Å; L250-F292 HydrophobicContact CB-CZ 4.12Å; L250-F292 HydrophobicContact CD1-CE1 4.47Å; L250-F292 WeakPolarHBondContact O-CZ 3.38Å; I251-F292 HydrophobicContact CG2-CD2 4.5Å; I251-F292 HydrophobicContact CG2-CE2 3.83Å; I251-F292 HydrophobicContact CG2-CZ 4.16Å; R288-F292 WeakPolarHBondContact O-CB 3.26Å; R288-F292 PolarHBondContact O-N 3.27Å; L289-F292 PolarHBondContact O-N 2.83Å; V290-F292 VanDerWaalsContact C-N 3.35Å; V290-F292 PolarHBondContact O-N 3.28Å; F292-S294 VanDerWaalsContact C-N 3.26Å; F292-S294 PolarHBondContact O-N 3.31Å; F292-K295 PolarHBondContact O-N 3.39Å; F292-K295 VanDerWaalsContact O-N 3.1Å; F292-F296 HydrophobicContact CD1-CD2 4.41Å; F292-F296 HydrophobicContact CE1-CB 4.3Å; F292-F296 AromaticContact CE1-CD2 3.41Å; F292-F296 HydrophobicContact CE1-CD2 3.41Å; F292-F296 VanDerWaalsContact CE1-CD2 3.41Å; F292-F296 AromaticContact CE1-CE2 3.89Å; F292-F296 HydrophobicContact CE1-CE2 3.89Å; F292-F296 HydrophobicContact CE1-CG 4.04Å; F292-F296 HydrophobicContact CE2-CD2 4.44Å; F292-F296 AromaticContact CZ-CD2 3.43Å; F292-F296 HydrophobicContact CZ-CD2 3.43Å; F292-F296 VanDerWaalsContact CZ-CD2 3.43Å; F292-F296 AromaticContact CZ-CE2 3.79Å; F292-F296 HydrophobicContact CZ-CE2 3.79Å; F292-F296 HydrophobicContact CZ-CG 4.43Å; F292-F296 WeakPolarHBondContact O-CB 3.48Å; F292-F296 PolarHBondContact O-N 3.48Å
293	L	97.2	Very high	95.3	Very high	0 Å²	0	82.3 Å²	82.3	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-63.3	-32	-178.3	-72.1	173.3	0	0	0	112.1	F262 F265 L289 K295 F296 K310 L313 I314 I317	F262-L293 HydrophobicContact CD2-CD2 4.27Å; F262-L293 HydrophobicContact CE2-CD2 4.12Å; F265-L293 HydrophobicContact CE1-CD1 4.31Å; L289-L293 VanDerWaalsContact O-CB 3.3Å; L289-L293 WeakPolarHBondContact O-CB 3.38Å; L289-L293 VanDerWaalsContact O-CG 3.25Å; L289-L293 WeakPolarHBondContact O-CG 2.89Å; L289-L293 PolarHBondContact O-N 2.97Å; L293-K295 PolarHBondContact O-N 3.23Å; L293-F296 PolarHBondContact O-N 2.93Å; L293-K310 VanDerWaalsContact O-CD 3.27Å; L293-K310 WeakPolarHBondContact O-CD 3.3Å; L293-L313 HydrophobicContact CD1-CB 4.4Å; L293-I314 HydrophobicContact CB-CD1 3.97Å; L293-I314 HydrophobicContact CB-CG1 3.66Å; L293-I314 HydrophobicContact CD1-CG1 4.19Å; L293-I317 HydrophobicContact CD1-CD1 3.67Å
294	S	95.2	Very high	95.1	Very high	64 Å²	64	87.1 Å²	87.1	45%	0.448	41%	0.411	S	S	.	.	H	α-helix	trans	-63.4	-30	176.8	-59.3	0	0	0	0	112.5	V290 D291 F292	V290-S294 WeakPolarHBondContact O-CB 3.29Å; V290-S294 PolarHBondContact O-N 2.92Å; V290-S294 PolarHBondContact O-OG 3.23Å; D291-S294 PolarHBondContact O-N 3.39Å; F292-S294 VanDerWaalsContact C-N 3.26Å; F292-S294 PolarHBondContact O-N 3.31Å
295	K	95.6	Very high	95	Very high	133 Å²	133	83.7 Å²	83.7	58%	0.578	40%	0.403	S	S	*	.	H	α-helix	trans	-99	-11.5	179.2	-62.4	165.2	-171.6	162	0	112.8	D291 F292 L293 H297 A298	D291-K295 PolarHBondContact O-N 2.7Å; D291-K295 VanDerWaalsContact OD1-CE 3.28Å; D291-K295 WeakPolarHBondContact OD1-CE 3.38Å; D291-K295 IonicContact OD1-NZ 2.74Å; D291-K295 PolarHBondContact OD1-NZ 2.9Å; D291-K295 IonicContact OD2-NZ 2.77Å; D291-K295 PolarHBondContact OD2-NZ 3.32Å; F292-K295 PolarHBondContact O-N 3.39Å; F292-K295 VanDerWaalsContact O-N 3.1Å; L293-K295 PolarHBondContact O-N 3.23Å; K295-H297 PolarHBondContact O-N 2.86Å; K295-A298 PolarHBondContact O-N 3.48Å
296	F	96.3	Very high	95	Very high	10 Å²	10	81.6 Å²	81.6	4%	0.044	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	119	-173.8	-172.1	-109.9	0	0	0	111.4	L250 Q258 F262 F292 L293 A298 F306 K310	L250-F296 HydrophobicContact CD2-CE1 4.47Å; L250-F296 HydrophobicContact CD2-CE2 4.21Å; L250-F296 HydrophobicContact CD2-CZ 3.83Å; Q258-F296 HydrophobicContact CB-CE2 3.88Å; Q258-F296 HydrophobicContact CB-CZ 3.91Å; F262-F296 HydrophobicContact CB-CE1 3.71Å; F262-F296 HydrophobicContact CB-CZ 4.09Å; F262-F296 HydrophobicContact CD2-CD1 4.03Å; F262-F296 AromaticContact CD2-CE1 3.7Å; F262-F296 HydrophobicContact CD2-CE1 3.7Å; F262-F296 AromaticContact CG-CE1 3.88Å; F262-F296 HydrophobicContact CG-CE1 3.88Å; F292-F296 HydrophobicContact CD1-CD2 4.41Å; F292-F296 HydrophobicContact CE1-CB 4.3Å; F292-F296 AromaticContact CE1-CD2 3.41Å; F292-F296 HydrophobicContact CE1-CD2 3.41Å; F292-F296 VanDerWaalsContact CE1-CD2 3.41Å; F292-F296 AromaticContact CE1-CE2 3.89Å; F292-F296 HydrophobicContact CE1-CE2 3.89Å; F292-F296 HydrophobicContact CE1-CG 4.04Å; F292-F296 HydrophobicContact CE2-CD2 4.44Å; F292-F296 AromaticContact CZ-CD2 3.43Å; F292-F296 HydrophobicContact CZ-CD2 3.43Å; F292-F296 VanDerWaalsContact CZ-CD2 3.43Å; F292-F296 AromaticContact CZ-CE2 3.79Å; F292-F296 HydrophobicContact CZ-CE2 3.79Å; F292-F296 HydrophobicContact CZ-CG 4.43Å; F292-F296 WeakPolarHBondContact O-CB 3.48Å; F292-F296 PolarHBondContact O-N 3.48Å; L293-F296 PolarHBondContact O-N 2.93Å; F296-A298 PolarHBondContact O-N 2.92Å; F296-A298 VanDerWaalsContact O-N 3.16Å; F296-F306 HydrophobicContact CD1-CE2 4.28Å; F296-F306 AromaticContact CD1-CZ 3.85Å; F296-F306 HydrophobicContact CD1-CZ 3.85Å; F296-F306 HydrophobicContact CE1-CE2 4.25Å; F296-F306 HydrophobicContact CE1-CZ 4.16Å; F296-K310 PolarHBondContact O-NZ 2.94Å
297	H	94.1	Very high	94.9	Very high	3 Å²	3	79.2 Å²	79.2	1%	0.014	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.6	42.9	-178.8	-76	-85.9	0	0	0	114.2	R255 K295 E299 R300 F306	R255-H297 PolarHBondContact O-CE1 2.7Å; R255-H297 VanDerWaalsContact O-CE1 3.29Å; R255-H297 PolarHBondContact O-NE2 3.34Å; K295-H297 PolarHBondContact O-N 2.86Å; H297-E299 VanDerWaalsContact C-OE2 3.31Å; H297-E299 WeakPolarHBondContact CA-OE2 3.46Å; H297-E299 IonicContact CE1-OE1 2.79Å; H297-E299 IonicContact CG-OE1 3.19Å; H297-E299 IonicContact ND1-OE1 3.06Å; H297-E299 PolarHBondContact ND1-OE1 2.93Å; H297-E299 PolarHBondContact O-N 3.2Å; H297-E299 VanDerWaalsContact O-N 3.08Å; H297-R300 HydrophobicContact CB-CG 4.34Å; H297-R300 PolarHBondContact O-N 3.49Å; H297-F306 HydrophobicContact CB-CE1 3.77Å; H297-F306 HydrophobicContact CB-CZ 3.77Å
298	A	91.6	Very high	94.9	Very high	56 Å²	56	77.4 Å²	77.4	46%	0.463	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.4	-179.3	0	0	0	0	0	113.7	K295 F296 R300	K295-A298 PolarHBondContact O-N 3.48Å; F296-A298 PolarHBondContact O-N 2.92Å; F296-A298 VanDerWaalsContact O-N 3.16Å; A298-R300 VanDerWaalsContact C-N 3.26Å; A298-R300 PolarHBondContact O-N 3.39Å
299	E	92.5	Very high	94.9	Very high	97 Å²	97	69.9 Å²	69.9	45%	0.453	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-15.7	175.2	74.3	-71.9	168.3	0	0	114.6	R255 H297 T301	R255-E299 IonicContact CZ-OE1 3.18Å; R255-E299 IonicContact CZ-OE2 3.71Å; R255-E299 VanDerWaalsContact CZ-OE2 3.32Å; R255-E299 IonicContact NE-OE1 2.71Å; R255-E299 IonicContact NH1-OE1 4Å; R255-E299 PolarHBondContact NH1-OE1 3.38Å; R255-E299 IonicContact NH1-OE2 2.78Å; R255-E299 PolarHBondContact NH1-OE2 2.73Å; R255-E299 IonicContact NH2-OE1 2.78Å; R255-E299 PolarHBondContact NH2-OE1 2.71Å; R255-E299 IonicContact NH2-OE2 3.86Å; R255-E299 PolarHBondContact NH2-OE2 3.06Å; H297-E299 VanDerWaalsContact C-OE2 3.31Å; H297-E299 WeakPolarHBondContact CA-OE2 3.46Å; H297-E299 IonicContact CE1-OE1 2.79Å; H297-E299 IonicContact CG-OE1 3.19Å; H297-E299 IonicContact ND1-OE1 3.06Å; H297-E299 PolarHBondContact ND1-OE1 2.93Å; H297-E299 PolarHBondContact O-N 3.2Å; H297-E299 VanDerWaalsContact O-N 3.08Å; E299-T301 PolarHBondContact O-N 3.35Å
300	R	92.8	Very high	94.8	Very high	96 Å²	96	70.4 Å²	70.4	36%	0.362	36%	0.356	S	S	.	.			trans	-84.9	59.6	-179.1	-68.9	-175.9	168.8	-97.4	-4.6	111.7	H297 A298 E302 D303 F306 N307	H297-R300 HydrophobicContact CB-CG 4.34Å; H297-R300 PolarHBondContact O-N 3.49Å; A298-R300 VanDerWaalsContact C-N 3.26Å; A298-R300 PolarHBondContact O-N 3.39Å; R300-E302 VanDerWaalsContact C-N 3.33Å; R300-E302 PolarHBondContact O-N 3.41Å; R300-D303 HydrophobicContact CB-CB 4.47Å; R300-F306 HydrophobicContact CB-CD1 4.11Å; R300-F306 HydrophobicContact CB-CE1 4.28Å; R300-N307 PolarHBondContact O-ND2 3.2Å
301	T	88.4	Confident	94.8	Very high	105 Å²	105	72 Å²	72	64%	0.644	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.6	-177	52.5	0	0	0	0	113.6	E299	E299-T301 PolarHBondContact O-N 3.35Å
302	E	93.3	Very high	94.8	Very high	187 Å²	187	73.1 Å²	73.1	87%	0.874	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-13.4	-178.8	-60.8	177.1	-179.3	0	0	113.5	R300 E304	R300-E302 VanDerWaalsContact C-N 3.33Å; R300-E302 PolarHBondContact O-N 3.41Å; E302-E304 PolarHBondContact O-N 2.88Å
303	D	94	Very high	94.8	Very high	52 Å²	52	70.3 Å²	70.3	28%	0.278	36%	0.358	S	S	.	.			trans	-92.1	80.1	179.7	-167.2	-22	0	0	0	109.5	R300 Q305 F306 N307	R300-D303 HydrophobicContact CB-CB 4.47Å; D303-Q305 VanDerWaalsContact C-N 3.31Å; D303-Q305 PolarHBondContact O-N 3.49Å; D303-F306 HydrophobicContact CB-CB 3.94Å; D303-F306 PolarHBondContact O-N 3.37Å; D303-F306 WeakPolarHBondContact OD1-CB 3.32Å; D303-F306 PolarHBondContact OD1-N 2.91Å; D303-N307 PolarHBondContact O-N 3.29Å; D303-N307 VanDerWaalsContact O-N 3.11Å; D303-N307 PolarHBondContact O-ND2 3.25Å
304	E	94.6	Very high	94.7	Very high	152 Å²	152	71.5 Å²	71.5	71%	0.71	36%	0.364	S	S	*	.	H	α-helix	trans	-56	-45.2	-177.4	-68.4	-175.9	170.9	0	0	111.7	E302 F306 N307 D308	E302-E304 PolarHBondContact O-N 2.88Å; E304-F306 PolarHBondContact O-N 3.34Å; E304-N307 PolarHBondContact O-N 3.48Å; E304-N307 VanDerWaalsContact O-N 3.15Å; E304-D308 PolarHBondContact O-N 2.98Å
305	Q	94.8	Very high	94.8	Very high	133 Å²	133	73.8 Å²	73.8	62%	0.621	37%	0.366	S	S	*	.	H	α-helix	trans	-58.6	-46.5	178.9	-177.7	-177.8	-11.7	0	0	111.7	D303 N307 D308 E309	D303-Q305 VanDerWaalsContact C-N 3.31Å; D303-Q305 PolarHBondContact O-N 3.49Å; Q305-N307 VanDerWaalsContact C-N 3.32Å; Q305-N307 PolarHBondContact O-N 3.36Å; Q305-D308 PolarHBondContact O-N 3.39Å; Q305-E309 PolarHBondContact NE2-OE1 2.89Å; Q305-E309 WeakPolarHBondContact O-CB 3.45Å; Q305-E309 WeakPolarHBondContact O-CG 3.39Å; Q305-E309 PolarHBondContact O-N 3.27Å
306	F	95.5	Very high	94.8	Very high	3 Å²	3	69.8 Å²	69.8	1%	0.013	35%	0.349	C	S	.	.	H	α-helix	trans	-61	-42.1	177.3	169.1	-110.8	0	0	0	112.1	F259 F262 F296 H297 R300 D303 E304 E309 K310	F259-F306 HydrophobicContact CD2-CD2 4.47Å; F259-F306 HydrophobicContact CD2-CE2 4.27Å; F259-F306 HydrophobicContact CE2-CD1 4.46Å; F259-F306 AromaticContact CE2-CD2 3.66Å; F259-F306 HydrophobicContact CE2-CD2 3.66Å; F259-F306 AromaticContact CE2-CE2 3.88Å; F259-F306 HydrophobicContact CE2-CE2 3.88Å; F259-F306 AromaticContact CE2-CG 3.98Å; F259-F306 HydrophobicContact CE2-CG 3.98Å; F259-F306 HydrophobicContact CE2-CZ 4.37Å; F259-F306 HydrophobicContact CZ-CD2 4.31Å; F262-F306 HydrophobicContact CD1-CD2 4.09Å; F262-F306 AromaticContact CD1-CE2 3.8Å; F262-F306 HydrophobicContact CD1-CE2 3.8Å; F262-F306 HydrophobicContact CD2-CE2 4.37Å; F262-F306 AromaticContact CE1-CD2 3.75Å; F262-F306 HydrophobicContact CE1-CD2 3.75Å; F262-F306 AromaticContact CE1-CE2 3.69Å; F262-F306 HydrophobicContact CE1-CE2 3.69Å; F262-F306 HydrophobicContact CE2-CE2 4.26Å; F262-F306 HydrophobicContact CG-CE2 4.16Å; F262-F306 HydrophobicContact CZ-CD2 4.25Å; F262-F306 AromaticContact CZ-CE2 3.93Å; F262-F306 HydrophobicContact CZ-CE2 3.93Å; F296-F306 HydrophobicContact CD1-CE2 4.28Å; F296-F306 AromaticContact CD1-CZ 3.85Å; F296-F306 HydrophobicContact CD1-CZ 3.85Å; F296-F306 HydrophobicContact CE1-CE2 4.25Å; F296-F306 HydrophobicContact CE1-CZ 4.16Å; H297-F306 HydrophobicContact CB-CE1 3.77Å; H297-F306 HydrophobicContact CB-CZ 3.77Å; R300-F306 HydrophobicContact CB-CD1 4.11Å; R300-F306 HydrophobicContact CB-CE1 4.28Å; D303-F306 HydrophobicContact CB-CB 3.94Å; D303-F306 PolarHBondContact O-N 3.37Å; D303-F306 WeakPolarHBondContact OD1-CB 3.32Å; D303-F306 PolarHBondContact OD1-N 2.91Å; E304-F306 PolarHBondContact O-N 3.34Å; F306-E309 PolarHBondContact O-N 3.09Å; F306-K310 HydrophobicContact CE1-CD 4.2Å; F306-K310 HydrophobicContact CZ-CD 4Å; F306-K310 VanDerWaalsContact O-CB 3.27Å; F306-K310 WeakPolarHBondContact O-CB 3.43Å; F306-K310 PolarHBondContact O-N 2.95Å
307	N	95.3	Very high	94.8	Very high	42 Å²	42	69.3 Å²	69.3	23%	0.225	35%	0.348	C	S	.	.	H	α-helix	trans	-68	-38.2	-179.6	-70.7	-51.6	0	0	0	112.4	R300 D303 E304 Q305 K310 A311	R300-N307 PolarHBondContact O-ND2 3.2Å; D303-N307 PolarHBondContact O-N 3.29Å; D303-N307 VanDerWaalsContact O-N 3.11Å; D303-N307 PolarHBondContact O-ND2 3.25Å; E304-N307 PolarHBondContact O-N 3.48Å; E304-N307 VanDerWaalsContact O-N 3.15Å; Q305-N307 VanDerWaalsContact C-N 3.32Å; Q305-N307 PolarHBondContact O-N 3.36Å; N307-K310 PolarHBondContact O-N 3.11Å; N307-K310 PolarHBondContact OD1-NZ 2.88Å; N307-K310 VanDerWaalsContact OD1-NZ 3.14Å; N307-A311 WeakPolarHBondContact O-CB 3.45Å; N307-A311 PolarHBondContact O-N 3.11Å
308	D	96.2	Very high	94.9	Very high	116 Å²	116	74.3 Å²	74.3	62%	0.62	37%	0.371	S	S	*	.	H	α-helix	trans	-64.8	-46.9	173.7	-75.9	-12.2	0	0	0	111.8	E304 Q305 K310 A311 Y312	E304-D308 PolarHBondContact O-N 2.98Å; Q305-D308 PolarHBondContact O-N 3.39Å; D308-K310 VanDerWaalsContact C-N 3.31Å; D308-K310 PolarHBondContact O-N 3.05Å; D308-A311 PolarHBondContact O-N 2.65Å; D308-Y312 WeakPolarHBondContact O-CB 3.48Å; D308-Y312 PolarHBondContact O-N 3.35Å
309	E	96.1	Very high	95	Very high	39 Å²	39	76.9 Å²	76.9	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-57.9	-45.9	175.4	-74.7	-176.5	176.4	0	0	110.5	F262 H263 K266 Q305 F306 Y312 L313	F262-E309 HydrophobicContact CE1-CB 4.28Å; F262-E309 HydrophobicContact CZ-CB 4.32Å; H263-E309 IonicContact ND1-OE2 3.62Å; K266-E309 WeakPolarHBondContact CD-OE2 3.3Å; K266-E309 IonicContact NZ-OE1 3.61Å; K266-E309 PolarHBondContact NZ-OE1 2.87Å; K266-E309 IonicContact NZ-OE2 2.82Å; K266-E309 PolarHBondContact NZ-OE2 2.93Å; Q305-E309 PolarHBondContact NE2-OE1 2.89Å; Q305-E309 WeakPolarHBondContact O-CB 3.45Å; Q305-E309 WeakPolarHBondContact O-CG 3.39Å; Q305-E309 PolarHBondContact O-N 3.27Å; F306-E309 PolarHBondContact O-N 3.09Å; E309-Y312 WeakPolarHBondContact O-CB 3.28Å; E309-Y312 PolarHBondContact O-N 3.13Å; E309-L313 VanDerWaalsContact O-CG 3.29Å; E309-L313 WeakPolarHBondContact O-CG 3.3Å; E309-L313 PolarHBondContact O-N 3.08Å
310	K	96.5	Very high	95	Very high	22 Å²	22	73.3 Å²	73.3	10%	0.096	36%	0.357	C	S	.	.	H	α-helix	trans	-61.7	-46.5	178.7	-170.9	176.6	79.4	-165.3	0	112.2	F262 L293 F296 F306 N307 D308 L313 I314	F262-K310 HydrophobicContact CE2-CB 4.45Å; F262-K310 HydrophobicContact CZ-CB 4.16Å; L293-K310 VanDerWaalsContact O-CD 3.27Å; L293-K310 WeakPolarHBondContact O-CD 3.3Å; F296-K310 PolarHBondContact O-NZ 2.94Å; F306-K310 HydrophobicContact CE1-CD 4.2Å; F306-K310 HydrophobicContact CZ-CD 4Å; F306-K310 VanDerWaalsContact O-CB 3.27Å; F306-K310 WeakPolarHBondContact O-CB 3.43Å; F306-K310 PolarHBondContact O-N 2.95Å; N307-K310 PolarHBondContact O-N 3.11Å; N307-K310 PolarHBondContact OD1-NZ 2.88Å; N307-K310 VanDerWaalsContact OD1-NZ 3.14Å; D308-K310 VanDerWaalsContact C-N 3.31Å; D308-K310 PolarHBondContact O-N 3.05Å; K310-L313 PolarHBondContact O-N 3.29Å; K310-I314 HydrophobicContact CG-CD1 4.32Å; K310-I314 WeakPolarHBondContact O-CG1 3.43Å; K310-I314 PolarHBondContact O-N 3.27Å
311	A	96.4	Very high	94.5	Very high	56 Å²	56	80.3 Å²	80.3	46%	0.463	39%	0.39	S	S	.	.	H	α-helix	trans	-62.6	-42.2	177.1	0	0	0	0	0	111.8	N307 D308 I314 K315	N307-A311 WeakPolarHBondContact O-CB 3.45Å; N307-A311 PolarHBondContact O-N 3.11Å; D308-A311 PolarHBondContact O-N 2.65Å; A311-I314 PolarHBondContact O-N 3.05Å; A311-K315 PolarHBondContact O-N 3.48Å
312	Y	96.7	Very high	94.8	Very high	109 Å²	109	79.1 Å²	79.1	43%	0.427	38%	0.377	S	S	.	.	H	α-helix	trans	-59.2	-46.2	174.4	171.2	-99.3	0	0	0	111.9	A270 D308 E309 K315 Q316	A270-Y312 HydrophobicContact CB-CE1 4.22Å; D308-Y312 WeakPolarHBondContact O-CB 3.48Å; D308-Y312 PolarHBondContact O-N 3.35Å; E309-Y312 WeakPolarHBondContact O-CB 3.28Å; E309-Y312 PolarHBondContact O-N 3.13Å; Y312-K315 PolarHBondContact O-N 3.35Å; Y312-Q316 HydrophobicContact CD1-CG 4.26Å; Y312-Q316 HydrophobicContact CD2-CG 4.32Å; Y312-Q316 HydrophobicContact CE1-CG 3.76Å; Y312-Q316 HydrophobicContact CE2-CG 3.84Å; Y312-Q316 WeakPolarHBondContact O-CG 3.19Å; Y312-Q316 PolarHBondContact O-N 2.84Å
313	L	96.8	Very high	94.8	Very high	2 Å²	2	73.4 Å²	73.4	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-42.5	178.1	-66.6	-169.8	0	0	0	112.7	F262 F265 K266 V269 L293 E309 K310 K315 Q316 I317	F262-L313 HydrophobicContact CD2-CD1 4.41Å; F262-L313 HydrophobicContact CE2-CD1 3.6Å; F262-L313 HydrophobicContact CZ-CD1 3.74Å; F265-L313 HydrophobicContact CD1-CD1 4.16Å; F265-L313 HydrophobicContact CE1-CD1 4.26Å; K266-L313 HydrophobicContact CB-CD1 3.65Å; K266-L313 HydrophobicContact CB-CD2 4.03Å; K266-L313 HydrophobicContact CB-CG 4.3Å; V269-L313 HydrophobicContact CB-CD2 3.79Å; V269-L313 HydrophobicContact CG1-CB 4.46Å; V269-L313 HydrophobicContact CG1-CD2 3.72Å; L293-L313 HydrophobicContact CD1-CB 4.4Å; E309-L313 VanDerWaalsContact O-CG 3.29Å; E309-L313 WeakPolarHBondContact O-CG 3.3Å; E309-L313 PolarHBondContact O-N 3.08Å; K310-L313 PolarHBondContact O-N 3.29Å; L313-K315 VanDerWaalsContact C-N 3.33Å; L313-K315 PolarHBondContact O-N 2.77Å; L313-Q316 PolarHBondContact O-N 3.01Å; L313-I317 WeakPolarHBondContact O-CB 3.25Å; L313-I317 VanDerWaalsContact O-CG1 3.31Å; L313-I317 WeakPolarHBondContact O-CG1 3.31Å; L313-I317 PolarHBondContact O-N 3.25Å
314	I	96.8	Very high	94.9	Very high	24 Å²	24	74.6 Å²	74.6	12%	0.123	36%	0.355	C	S	.	.	H	α-helix	trans	-57.8	-49.1	176.3	-71.2	165.4	0	0	0	109.9	V290 L293 K310 A311 Q316 I317 Q318	V290-I314 HydrophobicContact CG1-CG2 4.11Å; L293-I314 HydrophobicContact CB-CD1 3.97Å; L293-I314 HydrophobicContact CB-CG1 3.66Å; L293-I314 HydrophobicContact CD1-CG1 4.19Å; K310-I314 HydrophobicContact CG-CD1 4.32Å; K310-I314 WeakPolarHBondContact O-CG1 3.43Å; K310-I314 PolarHBondContact O-N 3.27Å; A311-I314 PolarHBondContact O-N 3.05Å; I314-Q316 PolarHBondContact O-N 3.39Å; I314-I317 PolarHBondContact O-N 3.01Å; I314-Q318 HydrophobicContact CG2-CG 4.46Å; I314-Q318 VanDerWaalsContact O-CG 3.31Å; I314-Q318 WeakPolarHBondContact O-CG 3.35Å; I314-Q318 PolarHBondContact O-N 2.84Å
315	K	96.7	Very high	94.9	Very high	113 Å²	113	70.1 Å²	70.1	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-58.7	-48.6	177.3	-178.5	-179.7	176.2	-178.9	0	111.6	A311 Y312 L313 I317 Q318 E319	A311-K315 PolarHBondContact O-N 3.48Å; Y312-K315 PolarHBondContact O-N 3.35Å; L313-K315 VanDerWaalsContact C-N 3.33Å; L313-K315 PolarHBondContact O-N 2.77Å; K315-I317 VanDerWaalsContact C-N 3.33Å; K315-I317 PolarHBondContact O-N 3.46Å; K315-Q318 PolarHBondContact O-N 2.96Å; K315-E319 WeakPolarHBondContact CE-OE1 3.37Å; K315-E319 HydrophobicContact CG-CG 4.43Å; K315-E319 WeakPolarHBondContact CG-OE1 3.43Å; K315-E319 IonicContact NZ-OE1 3.36Å; K315-E319 WeakPolarHBondContact O-CB 3.43Å; K315-E319 WeakPolarHBondContact O-CG 3.34Å; K315-E319 PolarHBondContact O-N 3.38Å
316	Q	96	Very high	94.9	Very high	48 Å²	48	66.1 Å²	66.1	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-57.4	-45	178.7	-75.9	-62.9	-60.3	0	0	112.1	V269 Y312 L313 I314 E319 M320	V269-Q316 HydrophobicContact CG1-CB 3.87Å; Y312-Q316 HydrophobicContact CD1-CG 4.26Å; Y312-Q316 HydrophobicContact CD2-CG 4.32Å; Y312-Q316 HydrophobicContact CE1-CG 3.76Å; Y312-Q316 HydrophobicContact CE2-CG 3.84Å; Y312-Q316 WeakPolarHBondContact O-CG 3.19Å; Y312-Q316 PolarHBondContact O-N 2.84Å; L313-Q316 PolarHBondContact O-N 3.01Å; I314-Q316 PolarHBondContact O-N 3.39Å; Q316-E319 PolarHBondContact O-N 3.41Å; Q316-M320 WeakPolarHBondContact O-CG 3.42Å; Q316-M320 PolarHBondContact O-N 3.17Å
317	I	96.3	Very high	94.9	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-67.1	-38.5	179.7	-69.2	166	0	0	0	111.4	F265 V269 R286 L289 V290 L293 L313 I314 K315 M320	F265-I317 HydrophobicContact CE1-CD1 4.36Å; F265-I317 HydrophobicContact CZ-CD1 4.19Å; V269-I317 HydrophobicContact CG1-CD1 4.19Å; V269-I317 HydrophobicContact CG1-CG1 3.75Å; V269-I317 HydrophobicContact CG2-CD1 4.2Å; V269-I317 HydrophobicContact CG2-CG1 4.35Å; R286-I317 HydrophobicContact CB-CG2 4.38Å; R286-I317 WeakPolarHBondContact CD-O 3.39Å; R286-I317 HydrophobicContact CG-CG2 3.87Å; R286-I317 WeakPolarHBondContact CG-O 3.49Å; L289-I317 HydrophobicContact CB-CD1 4.38Å; L289-I317 HydrophobicContact CB-CG2 4.38Å; L289-I317 HydrophobicContact CD1-CD1 4.48Å; V290-I317 HydrophobicContact CG2-CG2 3.96Å; L293-I317 HydrophobicContact CD1-CD1 3.67Å; L313-I317 WeakPolarHBondContact O-CB 3.25Å; L313-I317 VanDerWaalsContact O-CG1 3.31Å; L313-I317 WeakPolarHBondContact O-CG1 3.31Å; L313-I317 PolarHBondContact O-N 3.25Å; I314-I317 PolarHBondContact O-N 3.01Å; K315-I317 VanDerWaalsContact C-N 3.33Å; K315-I317 PolarHBondContact O-N 3.46Å; I317-M320 PolarHBondContact O-N 3.44Å
318	Q	95.9	Very high	94.8	Very high	107 Å²	107	72.4 Å²	72.4	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-65.2	-38.3	176.3	-74.7	174.6	-26	0	0	112.6	V290 I314 K315 M320	V290-Q318 HydrophobicContact CG1-CG 4.35Å; V290-Q318 HydrophobicContact CG2-CG 3.64Å; I314-Q318 HydrophobicContact CG2-CG 4.46Å; I314-Q318 VanDerWaalsContact O-CG 3.31Å; I314-Q318 WeakPolarHBondContact O-CG 3.35Å; I314-Q318 PolarHBondContact O-N 2.84Å; K315-Q318 PolarHBondContact O-N 2.96Å; Q318-M320 VanDerWaalsContact C-N 3.29Å; Q318-M320 PolarHBondContact O-N 2.77Å
319	E	94.2	Very high	94.7	Very high	111 Å²	111	69 Å²	69	52%	0.519	32%	0.324	S	S	.	.	H	α-helix	trans	-78.7	-7.7	-178	-70.2	174.5	169.4	0	0	113.7	K315 Q316 K321	K315-E319 WeakPolarHBondContact CE-OE1 3.37Å; K315-E319 HydrophobicContact CG-CG 4.43Å; K315-E319 WeakPolarHBondContact CG-OE1 3.43Å; K315-E319 IonicContact NZ-OE1 3.36Å; K315-E319 WeakPolarHBondContact O-CB 3.43Å; K315-E319 WeakPolarHBondContact O-CG 3.34Å; K315-E319 PolarHBondContact O-N 3.38Å; Q316-E319 PolarHBondContact O-N 3.41Å; E319-K321 PolarHBondContact O-N 2.77Å
320	M	91.3	Very high	94.6	Very high	22 Å²	22	71.5 Å²	71.5	11%	0.108	34%	0.335	C	S	.	.			trans	-65.4	132.3	177.8	-58.8	-171.6	64.1	0	0	111.5	K274 A279 L282 I283 R286 Q316 I317 Q318	K274-M320 HydrophobicContact CD-CE 3.76Å; A279-M320 HydrophobicContact CB-CE 4.09Å; L282-M320 HydrophobicContact CB-CE 3.82Å; L282-M320 HydrophobicContact CB-SD 3.71Å; L282-M320 HydrophobicContact CD1-CE 3.86Å; L282-M320 HydrophobicContact CD1-SD 3.84Å; L282-M320 HydrophobicContact CG-CE 4.5Å; L282-M320 HydrophobicContact CG-SD 4.42Å; I283-M320 HydrophobicContact CG1-CB 3.99Å; I283-M320 HydrophobicContact CG1-CE 4.31Å; R286-M320 PolarHBondContact NH1-O 2.9Å; Q316-M320 WeakPolarHBondContact O-CG 3.42Å; Q316-M320 PolarHBondContact O-N 3.17Å; I317-M320 PolarHBondContact O-N 3.44Å; Q318-M320 VanDerWaalsContact C-N 3.29Å; Q318-M320 PolarHBondContact O-N 2.77Å
321	K	81.8	Confident	94.4	Very high	243 Å²	243	76 Å²	76	100%	1.057	36%	0.357	S	S	*	.			trans	-112	0	178.4	-67.6	-175	-179.8	179.3	0	111.6	I283 E319	I283-K321 WeakPolarHBondContact CD1-O 3.22Å; E319-K321 PolarHBondContact O-N 2.77Å

Retrieved 321 of 321 residues in 109.3 ms (Link to these results)

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