A0A077ZGT6_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077ZGT6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 744 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	38.6	Very low	35.8	Very low	222 Å²	222	165.9 Å²	165.9	100%	1.094	83%	0.828	S	S	*	*				0	-28.3	0	-66.4	177.1	-175.3	0	0	115.4	K3	M1-K3 PolarHBondContact O-N 3.31Å
2	R	34.1	Very low	35.9	Very low	258 Å²	258	159.9 Å²	159.9	97%	0.974	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	20.7	-178.7	-62.9	-173.9	-177.4	156.8	1.6	118.4
3	K	35.5	Very low	35.5	Very low	205 Å²	205	152.2 Å²	152.2	89%	0.891	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.9	5.2	-171.4	-111.6	-175	-179.2	-178.2	0	116.5	M1	M1-K3 PolarHBondContact O-N 3.31Å
4	I	41.6	Very low	35.2	Very low	151 Å²	151	147.6 Å²	147.6	77%	0.774	79%	0.794	S	S	*	*	S	Bend	trans	-113.6	-25.7	-174.7	-62.1	177.4	0	0	0	112.4
5	F	42	Very low	35.1	Very low	181 Å²	181	144.5 Å²	144.5	79%	0.794	80%	0.796	S	S	*	*	S	Bend	trans	-83.4	138.2	173.5	-75.1	-86.2	0	0	0	111.6
6	G	34.5	Very low	35.9	Very low	67 Å²	67	141 Å²	141	69%	0.691	77%	0.773	S	S	*	*			trans	-63.9	166.1	-170.3	0	0	0	0	0	114.6	Q8	G6-Q8 PolarHBondContact O-N 3.05Å
7	K	34.1	Very low	37	Very low	218 Å²	218	143.8 Å²	143.8	95%	0.948	78%	0.775	S	S	*	*			trans	-24.6	103.2	-179.8	-68.5	176.5	177	176.8	0	113.9	H9	K7-H9 PolarHBondContact O-N 3.25Å
8	Q	34.4	Very low	38.6	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	77%	0.77	S	S	*	*			trans	-60.3	129.5	165.8	-70.5	178.7	-37.5	0	0	109.3	G6	G6-Q8 PolarHBondContact O-N 3.05Å
9	H	33	Very low	40.8	Very low	156 Å²	156	136.1 Å²	136.1	72%	0.722	73%	0.734	S	S	*	*			trans	-67.7	129.4	160.2	-128.6	-107.6	0	0	0	107.3	K7 A11	K7-H9 PolarHBondContact O-N 3.25Å; H9-A11 PolarHBondContact O-N 3.38Å
10	P	30.7	Very low	43.2	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-69.1	-2.9	-170.4	25.8	-34	0	0	0	114.8	A12	P10-A12 PolarHBondContact O-N 3.49Å
11	A	34.7	Very low	45.5	Very low	86 Å²	86	131.3 Å²	131.3	71%	0.711	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-70.5	-24.6	-179.4	0	0	0	0	0	114.7	H9	H9-A11 PolarHBondContact O-N 3.38Å
12	A	37.2	Very low	48.2	Very low	94 Å²	94	124.7 Å²	124.7	78%	0.777	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-102.9	8	-179.5	0	0	0	0	0	113.8	P10	P10-A12 PolarHBondContact O-N 3.49Å
13	G	30.7	Very low	51.1	Low	60 Å²	60	115.9 Å²	115.9	62%	0.619	66%	0.656	S	S	*	*	S	Bend	trans	-120.4	-5.4	-172.3	0	0	0	0	0	115.6
14	S	31.5	Very low	53.9	Low	87 Å²	87	106.7 Å²	106.7	61%	0.608	62%	0.616	S	S	*	*	S	Bend	trans	-81.6	121.5	169.6	54.4	0	0	0	0	109.2	E16	S14-E16 PolarHBondContact O-N 2.99Å
15	A	34.5	Very low	56.5	Low	101 Å²	101	102.9 Å²	102.9	84%	0.835	60%	0.6	S	S	*	*			trans	-31.1	106.6	179.6	0	0	0	0	0	112.5	K17	A15-K17 PolarHBondContact O-N 2.99Å; A15-K17 VanDerWaalsContact O-N 3.11Å
16	E	46.9	Very low	59.1	Low	89 Å²	89	94.3 Å²	94.3	42%	0.416	56%	0.563	S	S	.	*			trans	-59.6	120.6	-179.5	-158.9	-179.8	-155.3	0	0	107.1	S14 D18 C19 Y46 R61	S14-E16 PolarHBondContact O-N 2.99Å; E16-D18 PolarHBondContact O-N 3.11Å; E16-C19 VanDerWaalsContact CD-SG 3.57Å; E16-Y46 PolarHBondContact OE2-OH 2.88Å; E16-Y46 VanDerWaalsContact OE2-OH 3.09Å; E16-R61 IonicContact OE1-NH1 3.9Å; E16-R61 PolarHBondContact OE1-NH1 3.39Å
17	K	54.8	Low	61.8	Low	189 Å²	189	93.7 Å²	93.7	82%	0.822	56%	0.557	S	S	*	*			trans	-53.7	142.9	176	-77.3	177.5	174.5	176.7	0	108	A15 C19	A15-K17 PolarHBondContact O-N 2.99Å; A15-K17 VanDerWaalsContact O-N 3.11Å; K17-C19 PolarHBondContact O-N 2.98Å; K17-C19 PolarHBondContact O-SG 2.8Å
18	D	66	Low	64.6	Low	126 Å²	126	89 Å²	89	67%	0.674	55%	0.551	S	S	*	*			trans	-43.5	108	175	-176.7	10	0	0	0	110.2	E16 K20	E16-D18 PolarHBondContact O-N 3.11Å; D18-K20 PolarHBondContact O-N 2.97Å; D18-K20 VanDerWaalsContact O-N 3.14Å; D18-K20 WeakPolarHBondContact OD1-CB 3.49Å; D18-K20 PolarHBondContact OD1-N 3.22Å
19	C	80.8	Confident	67.6	Low	14 Å²	14	82.5 Å²	82.5	10%	0.095	52%	0.522	C	S	.	.			trans	-74.7	1.3	-174.3	-50.9	0	0	0	0	111.7	E16 K17 G21 Q22 I33 Y46	E16-C19 VanDerWaalsContact CD-SG 3.57Å; K17-C19 PolarHBondContact O-N 2.98Å; K17-C19 PolarHBondContact O-SG 2.8Å; C19-G21 PolarHBondContact O-N 3.48Å; C19-Q22 WeakPolarHBondContact O-CB 3.35Å; C19-Q22 PolarHBondContact O-N 2.78Å; C19-I33 HydrophobicContact CB-CD1 3.87Å; C19-I33 HydrophobicContact CB-CG2 4.28Å; C19-I33 WeakPolarHBondContact O-CB 3.38Å; C19-Y46 HydrophobicContact CB-CE1 4.25Å
20	K	88.7	Confident	70.6	Confident	122 Å²	122	76.7 Å²	76.7	53%	0.53	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	130.2	176.4	-174.8	170.1	-173.3	129.9	0	111.6	D18 Q22 I33 E34	D18-K20 PolarHBondContact O-N 2.97Å; D18-K20 VanDerWaalsContact O-N 3.14Å; D18-K20 WeakPolarHBondContact OD1-CB 3.49Å; D18-K20 PolarHBondContact OD1-N 3.22Å; K20-Q22 VanDerWaalsContact C-N 3.32Å; K20-I33 CarbonylContact C-O 3.58Å; K20-I33 WeakPolarHBondContact CA-O 3.4Å; K20-E34 VanDerWaalsContact CD-O 3.29Å; K20-E34 WeakPolarHBondContact CD-O 3.44Å; K20-E34 VanDerWaalsContact CE-O 3.25Å; K20-E34 WeakPolarHBondContact CE-O 3.39Å; K20-E34 PolarHBondContact NZ-O 2.73Å
21	G	91.5	Very high	73.8	Confident	50 Å²	50	71.6 Å²	71.6	52%	0.515	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	-10.7	-173.9	0	0	0	0	0	114.9	C19 I33	C19-G21 PolarHBondContact O-N 3.48Å; G21-I33 PolarHBondContact N-O 3.26Å
22	Q	94.3	Very high	76.8	Confident	83 Å²	83	69.2 Å²	69.2	39%	0.388	44%	0.442	S	S	.	.			trans	-66.6	135.4	172.8	-177.5	177.7	-9.5	0	0	110.5	C19 K20 V24 T32 I33	C19-Q22 WeakPolarHBondContact O-CB 3.35Å; C19-Q22 PolarHBondContact O-N 2.78Å; K20-Q22 VanDerWaalsContact C-N 3.32Å; Q22-V24 HydrophobicContact CG-CG2 4.33Å; Q22-T32 WeakPolarHBondContact O-CA 3.11Å; Q22-I33 HydrophobicContact CB-CD1 4.34Å; Q22-I33 PolarHBondContact O-N 2.87Å
23	V	95.5	Very high	79.7	Confident	74 Å²	74	64.8 Å²	64.8	45%	0.448	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.5	170.4	-174.6	0	0	0	0	109.3	V31	V23-V31 CarbonylContact C-O 3.59Å; V23-V31 WeakPolarHBondContact CA-O 3.45Å
24	V	95.4	Very high	82.8	Confident	11 Å²	11	64.4 Å²	64.4	7%	0.067	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.9	175	-178.2	0	0	0	0	108	Q22 V26 V31 I33 L59 L108	Q22-V24 HydrophobicContact CG-CG2 4.33Å; V24-V26 HydrophobicContact CG1-CG2 4.28Å; V24-V31 HydrophobicContact CB-CG2 4.19Å; V24-V31 PolarHBondContact N-O 3.14Å; V24-V31 WeakPolarHBondContact O-CG2 3.25Å; V24-V31 PolarHBondContact O-N 2.82Å; V24-I33 HydrophobicContact CG2-CD1 4Å; V24-I33 HydrophobicContact CG2-CG1 4.36Å; V24-L59 HydrophobicContact CB-CD2 4.28Å; V24-L59 HydrophobicContact CG1-CD2 4.18Å; V24-L59 HydrophobicContact CG2-CD2 4.43Å; V24-L108 HydrophobicContact CG1-CD1 3.68Å; V24-L108 HydrophobicContact CG1-CD2 4.24Å
25	T	96.2	Very high	85.8	Confident	72 Å²	72	61.3 Å²	61.3	44%	0.442	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.1	176	-55	0	0	0	0	109.2	I29	T25-I29 WeakPolarHBondContact CA-O 3.42Å
26	V	96.3	Very high	88.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	106.8	178	-170.8	0	0	0	0	108	V24 S28 I29 L59 A94 L108 L110	V24-V26 HydrophobicContact CG1-CG2 4.28Å; V26-S28 PolarHBondContact O-N 3.23Å; V26-I29 PolarHBondContact N-O 2.81Å; V26-I29 PolarHBondContact O-N 2.68Å; V26-L59 HydrophobicContact CG2-CD1 3.82Å; V26-A94 HydrophobicContact CB-CB 4.38Å; V26-A94 HydrophobicContact CG1-CB 3.81Å; V26-L108 HydrophobicContact CG1-CB 4.3Å; V26-L108 HydrophobicContact CG2-CB 4.12Å; V26-L108 HydrophobicContact CG2-CD1 4.27Å; V26-L110 HydrophobicContact CB-CB 4.46Å; V26-L110 HydrophobicContact CB-CD2 4.48Å; V26-L110 HydrophobicContact CG1-CB 4.16Å
27	G	91.1	Very high	90.8	Very high	55 Å²	55	60.5 Å²	60.5	57%	0.567	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-117.9	-169.3	0	0	0	0	0	111.1
28	S	92.7	Very high	92.5	Very high	118 Å²	118	52.4 Å²	52.4	83%	0.825	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	1.1	176.6	55	0	0	0	0	114.5	V26	V26-S28 PolarHBondContact O-N 3.23Å
29	I	96.4	Very high	93.6	Very high	39 Å²	39	51.9 Å²	51.9	20%	0.2	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	117.5	-170.5	-54.1	175.8	0	0	0	110.5	T25 V26 V31 M57 I93 A94 L110	T25-I29 WeakPolarHBondContact CA-O 3.42Å; V26-I29 PolarHBondContact N-O 2.81Å; V26-I29 PolarHBondContact O-N 2.68Å; I29-V31 HydrophobicContact CG2-CG1 3.81Å; I29-M57 HydrophobicContact CG2-CE 4.41Å; I29-I93 HydrophobicContact CD1-CG2 3.55Å; I29-A94 HydrophobicContact CD1-CB 4.19Å; I29-L110 HydrophobicContact CB-CD2 4.37Å; I29-L110 HydrophobicContact CD1-CD2 4.26Å; I29-L110 HydrophobicContact CG2-CD2 4.12Å
30	S	97.3	Very high	93.5	Very high	33 Å²	33	53 Å²	53	23%	0.231	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128.2	169.7	-60.1	0	0	0	0	111	Q51	S30-Q51 PolarHBondContact O-N 2.77Å
31	V	97.8	Very high	92.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.6	-178.8	-51.8	0	0	0	0	111	V23 V24 I29 V48 R49 M57 L59 L110	V23-V31 CarbonylContact C-O 3.59Å; V23-V31 WeakPolarHBondContact CA-O 3.45Å; V24-V31 HydrophobicContact CB-CG2 4.19Å; V24-V31 PolarHBondContact N-O 3.14Å; V24-V31 WeakPolarHBondContact O-CG2 3.25Å; V24-V31 PolarHBondContact O-N 2.82Å; I29-V31 HydrophobicContact CG2-CG1 3.81Å; V31-V48 HydrophobicContact CB-CB 3.95Å; V31-V48 HydrophobicContact CB-CG2 3.81Å; V31-V48 HydrophobicContact CG1-CG2 4.16Å; V31-V48 HydrophobicContact CG2-CB 3.89Å; V31-V48 HydrophobicContact CG2-CG1 4.2Å; V31-V48 HydrophobicContact CG2-CG2 3.82Å; V31-R49 CarbonylContact C-O 3.57Å; V31-R49 VanDerWaalsContact CA-O 3.25Å; V31-R49 WeakPolarHBondContact CA-O 3.21Å; V31-M57 HydrophobicContact CB-CE 4.42Å; V31-M57 HydrophobicContact CG1-CE 3.43Å; V31-M57 VanDerWaalsContact CG1-CE 3.43Å; V31-L59 HydrophobicContact CG2-CD2 4.3Å; V31-L110 HydrophobicContact CG1-CD1 4.22Å; V31-L110 HydrophobicContact CG1-CD2 4Å
32	T	97.8	Very high	92.3	Very high	37 Å²	37	55.3 Å²	55.3	23%	0.227	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131	174	-55.5	0	0	0	0	109.6	Q22 E34 V48 R49 Q51	Q22-T32 WeakPolarHBondContact O-CA 3.11Å; T32-E34 PolarHBondContact O-N 2.73Å; T32-V48 CarbonylContact O-C 3.57Å; T32-V48 VanDerWaalsContact O-CA 3.25Å; T32-V48 WeakPolarHBondContact O-CA 3.29Å; T32-R49 PolarHBondContact N-O 2.75Å; T32-R49 PolarHBondContact O-N 2.78Å; T32-Q51 PolarHBondContact OG1-NE2 2.99Å; T32-Q51 VanDerWaalsContact OG1-NE2 3.12Å
33	I	97.4	Very high	92.1	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.7	176.9	-63.8	177.4	0	0	0	110.3	C19 K20 G21 Q22 V24 Y46 V48	C19-I33 HydrophobicContact CB-CD1 3.87Å; C19-I33 HydrophobicContact CB-CG2 4.28Å; C19-I33 WeakPolarHBondContact O-CB 3.38Å; K20-I33 CarbonylContact C-O 3.58Å; K20-I33 WeakPolarHBondContact CA-O 3.4Å; G21-I33 PolarHBondContact N-O 3.26Å; Q22-I33 HydrophobicContact CB-CD1 4.34Å; Q22-I33 PolarHBondContact O-N 2.87Å; V24-I33 HydrophobicContact CG2-CD1 4Å; V24-I33 HydrophobicContact CG2-CG1 4.36Å; I33-Y46 HydrophobicContact CD1-CD1 4.42Å; I33-Y46 HydrophobicContact CD1-CD2 4.49Å; I33-Y46 HydrophobicContact CD1-CG 4.33Å; I33-Y46 HydrophobicContact CG2-CD1 3.81Å; I33-Y46 HydrophobicContact CG2-CG 4.19Å; I33-V48 HydrophobicContact CG1-CG1 4.02Å
34	E	96	Very high	92.1	Very high	52 Å²	52	50.9 Å²	50.9	24%	0.243	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-28.3	179.2	-72.2	-80.6	-155.7	0	0	112.6	K20 T32 L47 R49	K20-E34 VanDerWaalsContact CD-O 3.29Å; K20-E34 WeakPolarHBondContact CD-O 3.44Å; K20-E34 VanDerWaalsContact CE-O 3.25Å; K20-E34 WeakPolarHBondContact CE-O 3.39Å; K20-E34 PolarHBondContact NZ-O 2.73Å; T32-E34 PolarHBondContact O-N 2.73Å; E34-L47 HydrophobicContact CB-CB 4.35Å; E34-L47 HydrophobicContact CB-CD2 4.2Å; E34-L47 HydrophobicContact CB-CG 4.11Å; E34-L47 PolarHBondContact N-O 3.35Å; E34-R49 HydrophobicContact CG-CB 4.13Å; E34-R49 IonicContact OE1-CZ 3.2Å; E34-R49 IonicContact OE1-NE 2.75Å; E34-R49 PolarHBondContact OE1-NE 2.98Å; E34-R49 IonicContact OE1-NH2 2.83Å; E34-R49 PolarHBondContact OE1-NH2 3.5Å
35	G	94.1	Very high	92.1	Very high	21 Å²	21	52.2 Å²	52.2	22%	0.216	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.3	170	178.8	0	0	0	0	0	112.3	Y46 L47	G35-Y46 CarbonylContact O-C 3.57Å; G35-Y46 VanDerWaalsContact O-CA 3.3Å; G35-Y46 WeakPolarHBondContact O-CA 3.46Å; G35-Y46 WeakPolarHBondContact O-CB 3.38Å; G35-L47 PolarHBondContact N-O 3.15Å; G35-L47 PolarHBondContact O-N 3.09Å
36	K	94.2	Very high	92.2	Very high	112 Å²	112	49.1 Å²	49.1	49%	0.487	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.8	176.4	-175	173.1	61.9	-179.2	0	110.3	A38 E39 Y44 Y46	K36-A38 WeakPolarHBondContact CG-O 3.5Å; K36-E39 HydrophobicContact CD-CB 4.28Å; K36-E39 IonicContact NZ-OE2 2.71Å; K36-E39 PolarHBondContact NZ-OE2 3.09Å; K36-Y44 HydrophobicContact CD-CD1 4.04Å; K36-Y46 HydrophobicContact CB-CD1 4.12Å; K36-Y46 HydrophobicContact CB-CE1 4.34Å; K36-Y46 HydrophobicContact CG-CD1 4.47Å; K36-Y46 HydrophobicContact CG-CE1 4.49Å
37	I	92.6	Very high	92.2	Very high	62 Å²	62	50.8 Å²	50.8	32%	0.318	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-44.9	174.6	-58.9	162	0	0	0	110.2	V45 L47 Y113	I37-V45 WeakPolarHBondContact CA-O 3.47Å; I37-V45 HydrophobicContact CD1-CG1 4.38Å; I37-V45 PolarHBondContact N-O 2.84Å; I37-L47 HydrophobicContact CD1-CB 3.82Å; I37-L47 HydrophobicContact CD1-CD1 4.44Å; I37-L47 HydrophobicContact CG1-CB 3.87Å; I37-Y113 HydrophobicContact CD1-CD2 3.78Å; I37-Y113 HydrophobicContact CD1-CE2 3.58Å; I37-Y113 HydrophobicContact CG1-CE2 4.34Å
38	A	90.3	Very high	92.6	Very high	19 Å²	19	48.1 Å²	48.1	16%	0.157	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	156.6	-175.9	0	0	0	0	0	112.9	K36 V45 Y474	K36-A38 WeakPolarHBondContact CG-O 3.5Å; A38-V45 HydrophobicContact CB-CB 4.05Å; A38-V45 HydrophobicContact CB-CG2 4.23Å; A38-V45 PolarHBondContact N-O 3.21Å; A38-V45 VanDerWaalsContact N-O 3.08Å; A38-V45 PolarHBondContact O-N 2.82Å; A38-Y474 VanDerWaalsContact CB-OH 3.3Å; A38-Y474 WeakPolarHBondContact CB-OH 3.42Å
39	E	89	Confident	92.8	Very high	114 Å²	114	47 Å²	47	53%	0.533	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	118.9	174.9	176.8	168.8	171	0	0	109.7	K36 Y44	K36-E39 HydrophobicContact CD-CB 4.28Å; K36-E39 IonicContact NZ-OE2 2.71Å; K36-E39 PolarHBondContact NZ-OE2 3.09Å; E39-Y44 HydrophobicContact CB-CD1 4.23Å; E39-Y44 HydrophobicContact CB-CE1 4.41Å; E39-Y44 HydrophobicContact CG-CD1 3.93Å; E39-Y44 HydrophobicContact CG-CE1 3.64Å
40	G	78.1	Confident	92.9	Very high	39 Å²	39	45.7 Å²	45.7	40%	0.402	26%	0.256	S	S	.	.			trans	-101.3	-176.4	167.6	0	0	0	0	0	111.4	F42 S43	G40-F42 VanDerWaalsContact C-N 3.26Å; G40-F42 PolarHBondContact O-N 3.37Å; G40-S43 WeakPolarHBondContact CA-O 3.48Å; G40-S43 PolarHBondContact N-O 2.64Å
41	G	75.7	Confident	92.8	Very high	71 Å²	71	48.6 Å²	48.6	73%	0.732	27%	0.266	S	S	*	.	S	Bend	trans	-64.9	-24.2	-176.7	0	0	0	0	0	115.6
42	F	80.9	Confident	92.5	Very high	148 Å²	148	55.1 Å²	55.1	65%	0.649	30%	0.301	S	S	*	.	S	Bend	trans	-143.4	-0.6	-178.6	-57.1	-76.8	0	0	0	113.6	G40 Q62	G40-F42 VanDerWaalsContact C-N 3.26Å; G40-F42 PolarHBondContact O-N 3.37Å; F42-Q62 WeakPolarHBondContact O-CG 3.49Å
43	S	90.3	Very high	92.4	Very high	18 Å²	18	58.1 Å²	58.1	13%	0.126	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140	-170.6	173.8	0	0	0	0	109.4	G40 K60 R61	G40-S43 WeakPolarHBondContact CA-O 3.48Å; G40-S43 PolarHBondContact N-O 2.64Å; S43-K60 WeakPolarHBondContact OG-CG 3.39Å; S43-R61 WeakPolarHBondContact CA-O 3.3Å
44	Y	94.4	Very high	92.3	Very high	46 Å²	46	59.6 Å²	59.6	18%	0.18	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.2	175	-58	-80.7	0	0	0	109.2	K36 E39 Y46 K60 R61	K36-Y44 HydrophobicContact CD-CD1 4.04Å; E39-Y44 HydrophobicContact CB-CD1 4.23Å; E39-Y44 HydrophobicContact CB-CE1 4.41Å; E39-Y44 HydrophobicContact CG-CD1 3.93Å; E39-Y44 HydrophobicContact CG-CE1 3.64Å; Y44-Y46 VanDerWaalsContact CB-CE2 3.49Å; Y44-Y46 HydrophobicContact CG-CE2 4.46Å; Y44-K60 CarbonylContact O-C 3.54Å; Y44-K60 WeakPolarHBondContact O-CA 3.46Å; Y44-R61 PolarHBondContact N-O 3.24Å; Y44-R61 PolarHBondContact O-N 2.94Å
45	V	96.2	Very high	92.2	Very high	39 Å²	39	63.8 Å²	63.8	24%	0.236	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.3	170.9	-172.4	0	0	0	0	108.1	I37 A38 A58 L59 K60	I37-V45 WeakPolarHBondContact CA-O 3.47Å; I37-V45 HydrophobicContact CD1-CG1 4.38Å; I37-V45 PolarHBondContact N-O 2.84Å; A38-V45 HydrophobicContact CB-CB 4.05Å; A38-V45 HydrophobicContact CB-CG2 4.23Å; A38-V45 PolarHBondContact N-O 3.21Å; A38-V45 VanDerWaalsContact N-O 3.08Å; A38-V45 PolarHBondContact O-N 2.82Å; V45-A58 HydrophobicContact CG1-CB 4.34Å; V45-L59 CarbonylContact C-O 3.59Å; V45-L59 WeakPolarHBondContact CA-O 3.24Å; V45-K60 HydrophobicContact CG2-CB 4.44Å; V45-K60 HydrophobicContact CG2-CG 4.47Å
46	Y	97.2	Very high	92.4	Very high	7 Å²	7	65.6 Å²	65.6	3%	0.027	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	145.8	-179.6	-55.1	-89.6	0	0	0	111.2	E16 C19 I33 G35 K36 Y44 A58 L59 R61	E16-Y46 PolarHBondContact OE2-OH 2.88Å; E16-Y46 VanDerWaalsContact OE2-OH 3.09Å; C19-Y46 HydrophobicContact CB-CE1 4.25Å; I33-Y46 HydrophobicContact CD1-CD1 4.42Å; I33-Y46 HydrophobicContact CD1-CD2 4.49Å; I33-Y46 HydrophobicContact CD1-CG 4.33Å; I33-Y46 HydrophobicContact CG2-CD1 3.81Å; I33-Y46 HydrophobicContact CG2-CG 4.19Å; G35-Y46 CarbonylContact O-C 3.57Å; G35-Y46 VanDerWaalsContact O-CA 3.3Å; G35-Y46 WeakPolarHBondContact O-CA 3.46Å; G35-Y46 WeakPolarHBondContact O-CB 3.38Å; K36-Y46 HydrophobicContact CB-CD1 4.12Å; K36-Y46 HydrophobicContact CB-CE1 4.34Å; K36-Y46 HydrophobicContact CG-CD1 4.47Å; K36-Y46 HydrophobicContact CG-CE1 4.49Å; Y44-Y46 VanDerWaalsContact CB-CE2 3.49Å; Y44-Y46 HydrophobicContact CG-CE2 4.46Å; Y46-A58 WeakPolarHBondContact O-CA 3.25Å; Y46-L59 PolarHBondContact N-O 2.93Å; Y46-L59 PolarHBondContact O-N 3.12Å; Y46-R61 HydrophobicContact CD2-CB 4.32Å; Y46-R61 HydrophobicContact CE2-CB 3.88Å; Y46-R61 HydrophobicContact CE2-CG 4.44Å
47	L	97.7	Very high	92.6	Very high	35 Å²	35	60.6 Å²	60.6	18%	0.183	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	126.9	160.1	-177.9	62.9	0	0	0	106.9	E34 G35 I37 L56 Y113	E34-L47 HydrophobicContact CB-CB 4.35Å; E34-L47 HydrophobicContact CB-CD2 4.2Å; E34-L47 HydrophobicContact CB-CG 4.11Å; E34-L47 PolarHBondContact N-O 3.35Å; G35-L47 PolarHBondContact N-O 3.15Å; G35-L47 PolarHBondContact O-N 3.09Å; I37-L47 HydrophobicContact CD1-CB 3.82Å; I37-L47 HydrophobicContact CD1-CD1 4.44Å; I37-L47 HydrophobicContact CG1-CB 3.87Å; L47-L56 HydrophobicContact CD1-CB 4.13Å; L47-L56 HydrophobicContact CD1-CD1 4.38Å; L47-L56 HydrophobicContact CD1-CD2 4.08Å; L47-L56 HydrophobicContact CD1-CG 4.43Å; L47-L56 HydrophobicContact CD2-CD2 4.39Å; L47-L56 HydrophobicContact CG-CD2 4.19Å; L47-Y113 HydrophobicContact CD1-CD1 3.74Å; L47-Y113 HydrophobicContact CD1-CD2 3.74Å; L47-Y113 HydrophobicContact CD1-CE1 3.83Å; L47-Y113 HydrophobicContact CD1-CE2 3.85Å; L47-Y113 HydrophobicContact CD1-CG 3.68Å
48	V	98.2	Very high	92.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151.4	179.4	-51.8	0	0	0	0	111	V31 T32 I33 L56 M57 L59 L110	V31-V48 HydrophobicContact CB-CB 3.95Å; V31-V48 HydrophobicContact CB-CG2 3.81Å; V31-V48 HydrophobicContact CG1-CG2 4.16Å; V31-V48 HydrophobicContact CG2-CB 3.89Å; V31-V48 HydrophobicContact CG2-CG1 4.2Å; V31-V48 HydrophobicContact CG2-CG2 3.82Å; T32-V48 CarbonylContact O-C 3.57Å; T32-V48 VanDerWaalsContact O-CA 3.25Å; T32-V48 WeakPolarHBondContact O-CA 3.29Å; I33-V48 HydrophobicContact CG1-CG1 4.02Å; V48-L56 CarbonylContact O-C 3.53Å; V48-L56 WeakPolarHBondContact O-CA 3.5Å; V48-M57 HydrophobicContact CG2-CB 3.89Å; V48-M57 HydrophobicContact CG2-CE 4.37Å; V48-M57 PolarHBondContact N-O 2.75Å; V48-M57 PolarHBondContact O-N 3.1Å; V48-L59 HydrophobicContact CB-CB 4.47Å; V48-L59 HydrophobicContact CG1-CB 3.51Å; V48-L59 HydrophobicContact CG1-CD2 3.93Å; V48-L59 HydrophobicContact CG1-CG 4.38Å; V48-L59 HydrophobicContact CG2-CB 4.07Å; V48-L110 HydrophobicContact CG2-CD1 3.61Å
49	R	97.9	Very high	93.2	Very high	95 Å²	95	57.3 Å²	57.3	36%	0.358	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.7	176	-170.5	178.4	-56.2	-79.8	-0.4	110.4	V31 T32 E34 Q51 G54 R55 L56	V31-R49 CarbonylContact C-O 3.57Å; V31-R49 VanDerWaalsContact CA-O 3.25Å; V31-R49 WeakPolarHBondContact CA-O 3.21Å; T32-R49 PolarHBondContact N-O 2.75Å; T32-R49 PolarHBondContact O-N 2.78Å; E34-R49 HydrophobicContact CG-CB 4.13Å; E34-R49 IonicContact OE1-CZ 3.2Å; E34-R49 IonicContact OE1-NE 2.75Å; E34-R49 PolarHBondContact OE1-NE 2.98Å; E34-R49 IonicContact OE1-NH2 2.83Å; E34-R49 PolarHBondContact OE1-NH2 3.5Å; R49-Q51 PolarHBondContact O-N 3.19Å; R49-G54 VanDerWaalsContact CG-O 3.3Å; R49-G54 WeakPolarHBondContact CG-O 3.44Å; R49-G54 PolarHBondContact NH1-O 3.42Å; R49-R55 WeakPolarHBondContact CA-O 3.36Å; R49-L56 HydrophobicContact CB-CD2 4.34Å
50	C	97.4	Very high	93.6	Very high	10 Å²	10	53 Å²	53	7%	0.068	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	128.2	169.1	-175.1	0	0	0	0	109.9	N52 T53 G54 R55 M57	C50-N52 VanDerWaalsContact C-N 3.34Å; C50-N52 PolarHBondContact O-N 3.2Å; C50-T53 WeakPolarHBondContact CB-OG1 3.45Å; C50-T53 PolarHBondContact SG-OG1 2.79Å; C50-G54 WeakPolarHBondContact O-CA 3.47Å; C50-G54 PolarHBondContact O-N 3.01Å; C50-R55 PolarHBondContact N-O 2.72Å; C50-M57 HydrophobicContact CB-CE 3.51Å
51	Q	94.8	Very high	94.4	Very high	94 Å²	94	52 Å²	52	44%	0.439	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.9	178.7	-67.3	-170.4	-24.1	0	0	112.4	S30 T32 R49	S30-Q51 PolarHBondContact O-N 2.77Å; T32-Q51 PolarHBondContact OG1-NE2 2.99Å; T32-Q51 VanDerWaalsContact OG1-NE2 3.12Å; R49-Q51 PolarHBondContact O-N 3.19Å
52	N	92.4	Very high	95.3	Very high	137 Å²	137	49.8 Å²	49.8	73%	0.733	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-27.8	-173.7	-61.8	1.3	0	0	0	113.2	C50	C50-N52 VanDerWaalsContact C-N 3.34Å; C50-N52 PolarHBondContact O-N 3.2Å
53	T	94.9	Very high	96	Very high	100 Å²	100	46.2 Å²	46.2	61%	0.613	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-6.9	-172.9	66.4	0	0	0	0	114.4	C50 R55	C50-T53 WeakPolarHBondContact CB-OG1 3.45Å; C50-T53 PolarHBondContact SG-OG1 2.79Å; T53-R55 PolarHBondContact O-N 3.26Å; T53-R55 WeakPolarHBondContact OG1-CB 3.43Å
54	G	95	Very high	96.2	Very high	32 Å²	32	45.4 Å²	45.4	33%	0.33	23%	0.226	S	C	.	.			trans	66.9	-3.3	-176.2	0	0	0	0	0	115.4	R49 C50	R49-G54 VanDerWaalsContact CG-O 3.3Å; R49-G54 WeakPolarHBondContact CG-O 3.44Å; R49-G54 PolarHBondContact NH1-O 3.42Å; C50-G54 WeakPolarHBondContact O-CA 3.47Å; C50-G54 PolarHBondContact O-N 3.01Å
55	R	96	Very high	96.1	Very high	140 Å²	140	49.1 Å²	49.1	53%	0.528	25%	0.249	S	C	.	.			trans	-66.8	137.1	-177.1	-171.9	177.6	-177	-176.3	2.3	111.5	R49 C50 T53	R49-R55 WeakPolarHBondContact CA-O 3.36Å; C50-R55 PolarHBondContact N-O 2.72Å; T53-R55 PolarHBondContact O-N 3.26Å; T53-R55 WeakPolarHBondContact OG1-CB 3.43Å
56	L	97.2	Very high	95.9	Very high	60 Å²	60	49.9 Å²	49.9	31%	0.314	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	138.3	172.4	-67.3	178.5	0	0	0	111.4	L47 V48 R49 Y113	L47-L56 HydrophobicContact CD1-CB 4.13Å; L47-L56 HydrophobicContact CD1-CD1 4.38Å; L47-L56 HydrophobicContact CD1-CD2 4.08Å; L47-L56 HydrophobicContact CD1-CG 4.43Å; L47-L56 HydrophobicContact CD2-CD2 4.39Å; L47-L56 HydrophobicContact CG-CD2 4.19Å; V48-L56 CarbonylContact O-C 3.53Å; V48-L56 WeakPolarHBondContact O-CA 3.5Å; R49-L56 HydrophobicContact CB-CD2 4.34Å; L56-Y113 HydrophobicContact CB-CD1 4.21Å
57	M	97.8	Very high	95.7	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.034	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	163.4	-177.2	-63.8	175.4	-60.8	0	0	109.4	I29 V31 V48 C50 I93 L110 T111	I29-M57 HydrophobicContact CG2-CE 4.41Å; V31-M57 HydrophobicContact CB-CE 4.42Å; V31-M57 HydrophobicContact CG1-CE 3.43Å; V31-M57 VanDerWaalsContact CG1-CE 3.43Å; V48-M57 HydrophobicContact CG2-CB 3.89Å; V48-M57 HydrophobicContact CG2-CE 4.37Å; V48-M57 PolarHBondContact N-O 2.75Å; V48-M57 PolarHBondContact O-N 3.1Å; C50-M57 HydrophobicContact CB-CE 3.51Å; M57-I93 HydrophobicContact CB-CD1 4.39Å; M57-I93 HydrophobicContact CG-CD1 3.69Å; M57-I93 HydrophobicContact SD-CD1 3.53Å; M57-I93 VanDerWaalsContact SD-CD1 3.53Å; M57-I93 HydrophobicContact SD-CG2 4.31Å; M57-L110 HydrophobicContact CB-CD1 3.81Å; M57-L110 HydrophobicContact CB-CG 4.41Å; M57-L110 HydrophobicContact CE-CD1 4.15Å; M57-L110 HydrophobicContact CE-CD2 3.98Å; M57-L110 HydrophobicContact CE-CG 4.45Å; M57-L110 HydrophobicContact SD-CD1 4.31Å; M57-L110 HydrophobicContact SD-CD2 3.91Å; M57-L110 HydrophobicContact SD-CG 4.16Å; M57-T111 WeakPolarHBondContact CB-O 3.4Å
58	A	97.8	Very high	95.4	Very high	11 Å²	11	59 Å²	59	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.5	174.3	0	0	0	0	0	109.8	V45 Y46 L110 T111 Y113	V45-A58 HydrophobicContact CG1-CB 4.34Å; Y46-A58 WeakPolarHBondContact O-CA 3.25Å; A58-L110 WeakPolarHBondContact O-CA 3.26Å; A58-T111 PolarHBondContact N-O 2.89Å; A58-T111 PolarHBondContact O-N 2.72Å; A58-Y113 HydrophobicContact CB-CD2 4.49Å
59	L	97.9	Very high	95.1	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	107.8	177.5	178.3	63.5	0	0	0	109.8	V24 V26 V31 V45 Y46 V48 L108 L109 L110	V24-L59 HydrophobicContact CB-CD2 4.28Å; V24-L59 HydrophobicContact CG1-CD2 4.18Å; V24-L59 HydrophobicContact CG2-CD2 4.43Å; V26-L59 HydrophobicContact CG2-CD1 3.82Å; V31-L59 HydrophobicContact CG2-CD2 4.3Å; V45-L59 CarbonylContact C-O 3.59Å; V45-L59 WeakPolarHBondContact CA-O 3.24Å; Y46-L59 PolarHBondContact N-O 2.93Å; Y46-L59 PolarHBondContact O-N 3.12Å; V48-L59 HydrophobicContact CB-CB 4.47Å; V48-L59 HydrophobicContact CG1-CB 3.51Å; V48-L59 HydrophobicContact CG1-CD2 3.93Å; V48-L59 HydrophobicContact CG1-CG 4.38Å; V48-L59 HydrophobicContact CG2-CB 4.07Å; L59-L108 HydrophobicContact CD1-CB 4.22Å; L59-L108 HydrophobicContact CD1-CD2 4.16Å; L59-L108 HydrophobicContact CD2-CD2 4.46Å; L59-L109 CarbonylContact C-O 3.52Å; L59-L109 WeakPolarHBondContact CA-O 3.18Å; L59-L110 HydrophobicContact CB-CD1 4.28Å; L59-L110 HydrophobicContact CD1-CD1 4.35Å
60	K	96.8	Very high	95	Very high	24 Å²	24	56.8 Å²	56.8	10%	0.104	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.5	165.7	-176.9	177.1	178.7	-178.5	0	108.3	S43 Y44 V45 E76 L108 L109 D180	S43-K60 WeakPolarHBondContact OG-CG 3.39Å; Y44-K60 CarbonylContact O-C 3.54Å; Y44-K60 WeakPolarHBondContact O-CA 3.46Å; V45-K60 HydrophobicContact CG2-CB 4.44Å; V45-K60 HydrophobicContact CG2-CG 4.47Å; K60-E76 IonicContact NZ-OE1 3.88Å; K60-E76 PolarHBondContact NZ-OE1 3.46Å; K60-E76 IonicContact NZ-OE2 3.62Å; K60-E76 PolarHBondContact NZ-OE2 2.76Å; K60-L108 WeakPolarHBondContact O-CA 3.48Å; K60-L109 HydrophobicContact CB-CB 4.27Å; K60-L109 HydrophobicContact CD-CD2 4.44Å; K60-L109 PolarHBondContact N-O 2.71Å; K60-L109 PolarHBondContact O-N 3.16Å; K60-D180 IonicContact NZ-OD1 2.64Å; K60-D180 PolarHBondContact NZ-OD1 3.02Å
61	R	96.4	Very high	94.8	Very high	18 Å²	18	61.3 Å²	61.3	7%	0.068	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	128.9	-177.6	-177.5	174.7	-162.4	-142	3	109.5	E16 S43 Y44 Y46 E106 Y107 L108	E16-R61 IonicContact OE1-NH1 3.9Å; E16-R61 PolarHBondContact OE1-NH1 3.39Å; S43-R61 WeakPolarHBondContact CA-O 3.3Å; Y44-R61 PolarHBondContact N-O 3.24Å; Y44-R61 PolarHBondContact O-N 2.94Å; Y46-R61 HydrophobicContact CD2-CB 4.32Å; Y46-R61 HydrophobicContact CE2-CB 3.88Å; Y46-R61 HydrophobicContact CE2-CG 4.44Å; R61-E106 IonicContact CZ-OE1 3.22Å; R61-E106 IonicContact NE-OE1 3.4Å; R61-E106 PolarHBondContact NE-OE1 3.36Å; R61-E106 IonicContact NH2-OE1 2.73Å; R61-E106 PolarHBondContact NH2-OE1 3.46Å; R61-Y107 WeakPolarHBondContact CA-O 3.32Å; R61-L108 HydrophobicContact CB-CD2 3.94Å; R61-L108 HydrophobicContact CG-CD2 3.64Å
62	Q	94.8	Very high	94.8	Very high	24 Å²	24	57.7 Å²	57.7	11%	0.112	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	138.3	-178.4	-179.5	171.7	-52.2	0	0	110.3	F42 V64 C73 Y107	F42-Q62 WeakPolarHBondContact O-CG 3.49Å; Q62-V64 HydrophobicContact CG-CG2 3.76Å; Q62-C73 PolarHBondContact NE2-SG 2.84Å; Q62-Y107 HydrophobicContact CB-CD1 4.24Å; Q62-Y107 PolarHBondContact N-O 2.93Å; Q62-Y107 PolarHBondContact O-N 2.9Å
63	F	94.4	Very high	95	Very high	73 Å²	73	51.2 Å²	51.2	32%	0.32	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.7	175.3	-58.8	-79.6	0	0	0	109.4	I100 I104 E106	F63-I100 HydrophobicContact CD1-CD1 3.46Å; F63-I100 VanDerWaalsContact CD1-CD1 3.46Å; F63-I100 HydrophobicContact CE1-CD1 3.48Å; F63-I100 VanDerWaalsContact CE1-CD1 3.48Å; F63-I104 HydrophobicContact CB-CG2 4.07Å; F63-E106 HydrophobicContact CD1-CG 4.17Å; F63-E106 HydrophobicContact CE1-CG 3.93Å
64	V	94.4	Very high	95.1	Very high	2 Å²	2	52 Å²	52	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.8	-169.2	-176.6	0	0	0	0	111.1	Q62 E66 L69 L70 Q105	Q62-V64 HydrophobicContact CG-CG2 3.76Å; V64-E66 WeakPolarHBondContact CG1-O 3.41Å; V64-L69 HydrophobicContact CG1-CB 3.52Å; V64-L70 HydrophobicContact CG1-CB 3.98Å; V64-Q105 PolarHBondContact N-O 2.98Å; V64-Q105 PolarHBondContact O-N 2.91Å
65	N	93.5	Very high	95.2	Very high	124 Å²	124	52.9 Å²	52.9	66%	0.663	25%	0.251	S	S	*	.			trans	-114.9	3.6	174.4	65.6	-17	0	0	0	113.3	I104	N65-I104 HydrophobicContact CB-CG1 4.33Å
66	E	92	Very high	95.3	Very high	55 Å²	55	46.4 Å²	46.4	26%	0.257	23%	0.227	S	C	.	.	S	Bend	trans	-116.9	127.3	-177.2	-169.5	-174.9	145.8	0	0	111.2	V64 R68 L69 L70 R205	V64-E66 WeakPolarHBondContact CG1-O 3.41Å; E66-R68 VanDerWaalsContact C-N 3.29Å; E66-R68 PolarHBondContact O-N 3.32Å; E66-L69 HydrophobicContact CB-CB 4.41Å; E66-L69 HydrophobicContact CB-CD1 4.38Å; E66-L69 HydrophobicContact CB-CG 4.42Å; E66-L69 PolarHBondContact O-N 2.87Å; E66-L69 VanDerWaalsContact O-N 3.12Å; E66-L70 PolarHBondContact O-N 2.87Å; E66-R205 VanDerWaalsContact CD-NH1 3.34Å; E66-R205 IonicContact OE1-CZ 3.4Å; E66-R205 IonicContact OE1-NH1 3.62Å; E66-R205 PolarHBondContact OE1-NH1 3.05Å; E66-R205 IonicContact OE1-NH2 2.78Å; E66-R205 IonicContact OE2-CZ 3.42Å; E66-R205 IonicContact OE2-NH1 2.76Å; E66-R205 PolarHBondContact OE2-NH1 3.26Å; E66-R205 IonicContact OE2-NH2 3.18Å; E66-R205 PolarHBondContact OE2-NH2 2.92Å
67	P	92.3	Very high	95.2	Very high	101 Å²	101	44 Å²	44	66%	0.656	22%	0.216	S	C	*	.	H	α-helix	trans	-55.4	-37.7	-178.3	-28.6	35.6	0	0	0	114.6	L70 E71	P67-L70 WeakPolarHBondContact O-CB 3.25Å; P67-L70 PolarHBondContact O-N 2.81Å; P67-E71 PolarHBondContact O-N 2.71Å
68	R	90.9	Very high	95.2	Very high	132 Å²	132	47.5 Å²	47.5	50%	0.498	23%	0.232	S	C	.	.	H	α-helix	trans	-65.2	-39.4	178.9	-68.4	178	170.4	-179	-5.9	112.7	E66 A72 E201	E66-R68 VanDerWaalsContact C-N 3.29Å; E66-R68 PolarHBondContact O-N 3.32Å; R68-A72 PolarHBondContact O-N 3.24Å; R68-A72 VanDerWaalsContact O-N 3.16Å; R68-E201 IonicContact CZ-OE2 3.8Å; R68-E201 IonicContact NH1-OE1 3.62Å; R68-E201 PolarHBondContact NH1-OE1 3.38Å; R68-E201 IonicContact NH1-OE2 2.71Å; R68-E201 PolarHBondContact NH1-OE2 2.9Å
69	L	92.6	Very high	95.2	Very high	27 Å²	27	47.2 Å²	47.2	14%	0.141	23%	0.229	C	C	.	.	H	α-helix	trans	-70.9	-35.9	174.2	-75	-179	0	0	0	111.6	V64 E66 E71 A72 C73 R205 F206	V64-L69 HydrophobicContact CG1-CB 3.52Å; E66-L69 HydrophobicContact CB-CB 4.41Å; E66-L69 HydrophobicContact CB-CD1 4.38Å; E66-L69 HydrophobicContact CB-CG 4.42Å; E66-L69 PolarHBondContact O-N 2.87Å; E66-L69 VanDerWaalsContact O-N 3.12Å; L69-E71 VanDerWaalsContact C-N 3.28Å; L69-E71 PolarHBondContact O-N 3.42Å; L69-A72 WeakPolarHBondContact O-CB 3.41Å; L69-A72 PolarHBondContact O-N 2.94Å; L69-C73 PolarHBondContact O-N 2.83Å; L69-C73 PolarHBondContact O-SG 2.9Å; L69-C73 VanDerWaalsContact O-SG 3.36Å; L69-R205 VanDerWaalsContact CD1-NH2 3.33Å; L69-F206 HydrophobicContact CD2-CE1 4.37Å; L69-F206 HydrophobicContact CD2-CZ 4.36Å
70	L	94.5	Very high	95.1	Very high	22 Å²	22	47.4 Å²	47.4	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-39.7	179.5	-174.4	63.2	0	0	0	110.6	V64 E66 P67 C73 R74 I97 Q105	V64-L70 HydrophobicContact CG1-CB 3.98Å; E66-L70 PolarHBondContact O-N 2.87Å; P67-L70 WeakPolarHBondContact O-CB 3.25Å; P67-L70 PolarHBondContact O-N 2.81Å; L70-C73 PolarHBondContact O-N 3.1Å; L70-R74 WeakPolarHBondContact O-CG 3.02Å; L70-R74 PolarHBondContact O-N 3.14Å; L70-I97 HydrophobicContact CD1-CD1 4.39Å; L70-I97 HydrophobicContact CD1-CG2 3.82Å; L70-Q105 HydrophobicContact CD1-CB 3.78Å; L70-Q105 HydrophobicContact CD1-CG 3.87Å; L70-Q105 HydrophobicContact CD2-CG 3.93Å
71	E	95.1	Very high	95.1	Very high	104 Å²	104	52.3 Å²	52.3	49%	0.486	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-38.6	174.5	-159.2	56.4	-149.4	0	0	112.2	P67 L69 C73 R74 L75	P67-E71 PolarHBondContact O-N 2.71Å; L69-E71 VanDerWaalsContact C-N 3.28Å; L69-E71 PolarHBondContact O-N 3.42Å; E71-C73 VanDerWaalsContact C-N 3.33Å; E71-C73 PolarHBondContact O-N 2.76Å; E71-R74 PolarHBondContact O-N 2.79Å; E71-R74 WeakPolarHBondContact OE2-CD 3.41Å; E71-R74 IonicContact OE2-CZ 2.68Å; E71-R74 IonicContact OE2-NH1 3.23Å; E71-R74 PolarHBondContact OE2-NH1 3.48Å; E71-L75 WeakPolarHBondContact O-CB 3.44Å; E71-L75 PolarHBondContact O-N 2.95Å
72	A	94.7	Very high	95.1	Very high	18 Å²	18	53.3 Å²	53.3	15%	0.149	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-40.4	171.5	0	0	0	0	0	112.3	R68 L69 L75 E76 F206	R68-A72 PolarHBondContact O-N 3.24Å; R68-A72 VanDerWaalsContact O-N 3.16Å; L69-A72 WeakPolarHBondContact O-CB 3.41Å; L69-A72 PolarHBondContact O-N 2.94Å; A72-L75 PolarHBondContact O-N 2.87Å; A72-E76 WeakPolarHBondContact O-CB 3.4Å; A72-E76 PolarHBondContact O-N 2.83Å; A72-F206 HydrophobicContact CB-CE1 3.96Å; A72-F206 HydrophobicContact CB-CZ 4.1Å
73	C	96.4	Very high	95.1	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-37.4	175.1	-69.3	0	0	0	0	113.5	Q62 L69 L70 E71 A77 Y107	Q62-C73 PolarHBondContact NE2-SG 2.84Å; L69-C73 PolarHBondContact O-N 2.83Å; L69-C73 PolarHBondContact O-SG 2.9Å; L69-C73 VanDerWaalsContact O-SG 3.36Å; L70-C73 PolarHBondContact O-N 3.1Å; E71-C73 VanDerWaalsContact C-N 3.33Å; E71-C73 PolarHBondContact O-N 2.76Å; C73-A77 PolarHBondContact O-N 3.08Å; C73-A77 VanDerWaalsContact O-N 3.15Å; C73-Y107 HydrophobicContact CB-CD1 3.69Å; C73-Y107 HydrophobicContact CB-CD2 3.86Å; C73-Y107 HydrophobicContact CB-CE1 3.94Å; C73-Y107 HydrophobicContact CB-CE2 4.1Å; C73-Y107 HydrophobicContact CB-CG 3.62Å; C73-Y107 WeakPolarHBondContact O-CE2 3.21Å; C73-Y107 PolarHBondContact O-OH 2.82Å; C73-Y107 WeakPolarHBondContact SG-CD1 3.15Å
74	R	96.8	Very high	94.9	Very high	117 Å²	117	50.5 Å²	50.5	44%	0.442	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-48.4	172.3	-73.4	173.9	-175.8	142.8	-1.6	111	L70 E71 E76 A77 E78 I97	L70-R74 WeakPolarHBondContact O-CG 3.02Å; L70-R74 PolarHBondContact O-N 3.14Å; E71-R74 PolarHBondContact O-N 2.79Å; E71-R74 WeakPolarHBondContact OE2-CD 3.41Å; E71-R74 IonicContact OE2-CZ 2.68Å; E71-R74 IonicContact OE2-NH1 3.23Å; E71-R74 PolarHBondContact OE2-NH1 3.48Å; R74-E76 VanDerWaalsContact C-N 3.33Å; R74-E76 PolarHBondContact O-N 2.85Å; R74-A77 PolarHBondContact O-N 3.48Å; R74-E78 WeakPolarHBondContact O-CB 3.46Å; R74-E78 PolarHBondContact O-N 2.9Å; R74-I97 HydrophobicContact CB-CD1 4.47Å; R74-I97 HydrophobicContact CG-CD1 3.46Å; R74-I97 VanDerWaalsContact CG-CD1 3.46Å
75	L	96.6	Very high	94.8	Very high	50 Å²	50	57 Å²	57	26%	0.262	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-38.7	179.6	-174.1	60.2	0	0	0	111.5	E71 A72 E78 I79	E71-L75 WeakPolarHBondContact O-CB 3.44Å; E71-L75 PolarHBondContact O-N 2.95Å; A72-L75 PolarHBondContact O-N 2.87Å; L75-E78 PolarHBondContact O-N 3.12Å; L75-I79 HydrophobicContact CD1-CD1 3.93Å; L75-I79 HydrophobicContact CD1-CG1 4.06Å; L75-I79 HydrophobicContact CD2-CD1 4.4Å; L75-I79 HydrophobicContact CG-CD1 3.71Å; L75-I79 HydrophobicContact CG-CG1 4.26Å; L75-I79 VanDerWaalsContact O-CB 3.26Å; L75-I79 WeakPolarHBondContact O-CB 3.26Å; L75-I79 WeakPolarHBondContact O-CG1 3.48Å; L75-I79 PolarHBondContact O-N 2.85Å
76	E	97.5	Very high	95	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.019	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-52.7	172.3	177	170.2	-157.1	0	0	111.7	K60 A72 R74 E78 I79 I80 Y107 L109 F181 G182	K60-E76 IonicContact NZ-OE1 3.88Å; K60-E76 PolarHBondContact NZ-OE1 3.46Å; K60-E76 IonicContact NZ-OE2 3.62Å; K60-E76 PolarHBondContact NZ-OE2 2.76Å; A72-E76 WeakPolarHBondContact O-CB 3.4Å; A72-E76 PolarHBondContact O-N 2.83Å; R74-E76 VanDerWaalsContact C-N 3.33Å; R74-E76 PolarHBondContact O-N 2.85Å; E76-E78 VanDerWaalsContact C-N 3.34Å; E76-E78 PolarHBondContact O-N 3.26Å; E76-I79 PolarHBondContact O-N 3.35Å; E76-I80 HydrophobicContact CG-CD1 3.94Å; E76-I80 VanDerWaalsContact O-CG1 3.3Å; E76-I80 WeakPolarHBondContact O-CG1 3.42Å; E76-I80 PolarHBondContact O-N 2.81Å; E76-I80 VanDerWaalsContact O-N 3.12Å; E76-Y107 WeakPolarHBondContact CG-OH 3.22Å; E76-L109 HydrophobicContact CG-CD2 4.27Å; E76-F181 HydrophobicContact CG-CB 4.1Å; E76-F181 PolarHBondContact OE1-N 3.4Å; E76-G182 VanDerWaalsContact CD-CA 3.45Å; E76-G182 PolarHBondContact OE1-N 3.28Å; E76-G182 VanDerWaalsContact OE2-CA 3.31Å; E76-G182 WeakPolarHBondContact OE2-CA 3.37Å
77	A	96.6	Very high	95.2	Very high	10 Å²	10	54.7 Å²	54.7	8%	0.083	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-43.6	178.9	0	0	0	0	0	112	C73 R74 R81 Y107	C73-A77 PolarHBondContact O-N 3.08Å; C73-A77 VanDerWaalsContact O-N 3.15Å; R74-A77 PolarHBondContact O-N 3.48Å; A77-R81 WeakPolarHBondContact O-CB 3.34Å; A77-R81 PolarHBondContact O-N 2.74Å; A77-Y107 HydrophobicContact CB-CE2 4.15Å; A77-Y107 PolarHBondContact N-OH 3.09Å
78	E	97.1	Very high	95.5	Very high	80 Å²	80	50.4 Å²	50.4	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-67.5	-39.5	-179.6	-179.6	59.1	-170.7	0	0	112.7	R74 L75 E76 R81 T82	R74-E78 WeakPolarHBondContact O-CB 3.46Å; R74-E78 PolarHBondContact O-N 2.9Å; L75-E78 PolarHBondContact O-N 3.12Å; E76-E78 VanDerWaalsContact C-N 3.34Å; E76-E78 PolarHBondContact O-N 3.26Å; E78-R81 IonicContact OE1-CZ 3.69Å; E78-R81 IonicContact OE1-NH2 3.74Å; E78-R81 PolarHBondContact OE1-NH2 3.16Å; E78-R81 IonicContact OE2-CZ 3.76Å; E78-R81 IonicContact OE2-NE 3.75Å; E78-R81 PolarHBondContact OE2-NE 2.91Å; E78-R81 IonicContact OE2-NH2 2.6Å; E78-R81 PolarHBondContact OE2-NH2 3.23Å; E78-T82 HydrophobicContact CG-CG2 4.36Å; E78-T82 WeakPolarHBondContact O-CB 3.38Å; E78-T82 VanDerWaalsContact O-CG2 3.24Å; E78-T82 WeakPolarHBondContact O-CG2 3.35Å; E78-T82 PolarHBondContact O-N 2.93Å; E78-T82 PolarHBondContact O-OG1 2.95Å; E78-T82 WeakPolarHBondContact OE1-CG2 3.31Å
79	I	97.1	Very high	95.8	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-54.9	175.6	-77	172.6	0	0	0	110	L75 E76 R81 T82 L83 I158 F181	L75-I79 HydrophobicContact CD1-CD1 3.93Å; L75-I79 HydrophobicContact CD1-CG1 4.06Å; L75-I79 HydrophobicContact CD2-CD1 4.4Å; L75-I79 HydrophobicContact CG-CD1 3.71Å; L75-I79 HydrophobicContact CG-CG1 4.26Å; L75-I79 VanDerWaalsContact O-CB 3.26Å; L75-I79 WeakPolarHBondContact O-CB 3.26Å; L75-I79 WeakPolarHBondContact O-CG1 3.48Å; L75-I79 PolarHBondContact O-N 2.85Å; E76-I79 PolarHBondContact O-N 3.35Å; I79-R81 VanDerWaalsContact C-N 3.33Å; I79-R81 PolarHBondContact O-N 3.07Å; I79-T82 PolarHBondContact O-N 3.36Å; I79-T82 PolarHBondContact O-OG1 3.34Å; I79-L83 HydrophobicContact CG2-CD1 3.54Å; I79-L83 HydrophobicContact CG2-CG 4.41Å; I79-L83 VanDerWaalsContact O-CD1 3.31Å; I79-L83 WeakPolarHBondContact O-CD1 3.16Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 2.9Å; I79-I158 HydrophobicContact CD1-CD1 4.4Å; I79-I158 HydrophobicContact CD1-CG2 3.88Å; I79-I158 HydrophobicContact CG1-CD1 3.99Å; I79-I158 HydrophobicContact CG2-CD1 4.09Å; I79-F181 HydrophobicContact CG2-CB 4.22Å; I79-F181 HydrophobicContact CG2-CD1 3.73Å; I79-F181 HydrophobicContact CG2-CE1 4.43Å; I79-F181 HydrophobicContact CG2-CG 4.12Å
80	I	96.3	Very high	96.1	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-43.1	-176.3	-53.6	166.6	0	0	0	110.1	E76 T82 L83 V90 Y92 L109 F181	E76-I80 HydrophobicContact CG-CD1 3.94Å; E76-I80 VanDerWaalsContact O-CG1 3.3Å; E76-I80 WeakPolarHBondContact O-CG1 3.42Å; E76-I80 PolarHBondContact O-N 2.81Å; E76-I80 VanDerWaalsContact O-N 3.12Å; I80-T82 PolarHBondContact O-N 2.92Å; I80-L83 PolarHBondContact O-N 3.3Å; I80-V90 HydrophobicContact CD1-CG1 4.33Å; I80-V90 HydrophobicContact CG2-CG1 3.88Å; I80-V90 WeakPolarHBondContact CG2-O 3.43Å; I80-Y92 HydrophobicContact CG2-CD2 4.44Å; I80-L109 HydrophobicContact CD1-CD1 4.4Å; I80-L109 HydrophobicContact CD1-CD2 3.6Å; I80-F181 HydrophobicContact CD1-CB 4.21Å; I80-F181 HydrophobicContact CD1-CD2 3.78Å; I80-F181 HydrophobicContact CD1-CG 4.34Å; I80-F181 HydrophobicContact CG1-CB 3.97Å; I80-F181 HydrophobicContact CG1-CD2 3.45Å; I80-F181 VanDerWaalsContact CG1-CD2 3.45Å; I80-F181 HydrophobicContact CG1-CE2 4.16Å; I80-F181 HydrophobicContact CG1-CG 3.83Å
81	R	96.6	Very high	96.2	Very high	127 Å²	127	44 Å²	44	48%	0.479	23%	0.229	S	C	.	.	H	α-helix	trans	-58.6	-43.1	176	-173	-167.4	74	79.2	-3.9	112.8	A77 E78 I79 Y92	A77-R81 WeakPolarHBondContact O-CB 3.34Å; A77-R81 PolarHBondContact O-N 2.74Å; E78-R81 IonicContact OE1-CZ 3.69Å; E78-R81 IonicContact OE1-NH2 3.74Å; E78-R81 PolarHBondContact OE1-NH2 3.16Å; E78-R81 IonicContact OE2-CZ 3.76Å; E78-R81 IonicContact OE2-NE 3.75Å; E78-R81 PolarHBondContact OE2-NE 2.91Å; E78-R81 IonicContact OE2-NH2 2.6Å; E78-R81 PolarHBondContact OE2-NH2 3.23Å; I79-R81 VanDerWaalsContact C-N 3.33Å; I79-R81 PolarHBondContact O-N 3.07Å; R81-Y92 HydrophobicContact CB-CD1 4.42Å; R81-Y92 HydrophobicContact CB-CD2 4.29Å; R81-Y92 HydrophobicContact CB-CE1 4.39Å; R81-Y92 HydrophobicContact CB-CE2 4.26Å; R81-Y92 HydrophobicContact CB-CG 4.37Å; R81-Y92 HydrophobicContact CG-CD1 4.33Å; R81-Y92 HydrophobicContact CG-CE1 4.09Å
82	T	96	Very high	96.3	Very high	40 Å²	40	42.1 Å²	42.1	25%	0.245	22%	0.218	C	C	.	.	H	α-helix	trans	-83.8	-12.9	-176.4	57.7	0	0	0	0	114.4	E78 I79 I80 R154	E78-T82 HydrophobicContact CG-CG2 4.36Å; E78-T82 WeakPolarHBondContact O-CB 3.38Å; E78-T82 VanDerWaalsContact O-CG2 3.24Å; E78-T82 WeakPolarHBondContact O-CG2 3.35Å; E78-T82 PolarHBondContact O-N 2.93Å; E78-T82 PolarHBondContact O-OG1 2.95Å; E78-T82 WeakPolarHBondContact OE1-CG2 3.31Å; I79-T82 PolarHBondContact O-N 3.36Å; I79-T82 PolarHBondContact O-OG1 3.34Å; I80-T82 PolarHBondContact O-N 2.92Å; T82-R154 VanDerWaalsContact C-NH1 3.34Å; T82-R154 PolarHBondContact O-NH1 2.97Å
83	L	94.9	Very high	96.4	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-73.4	-30.9	174.5	-72.6	161.1	0	0	0	111.9	I79 I80 I89 R150 L151 F181	I79-L83 HydrophobicContact CG2-CD1 3.54Å; I79-L83 HydrophobicContact CG2-CG 4.41Å; I79-L83 VanDerWaalsContact O-CD1 3.31Å; I79-L83 WeakPolarHBondContact O-CD1 3.16Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 2.9Å; I80-L83 PolarHBondContact O-N 3.3Å; L83-I89 HydrophobicContact CB-CD1 4.3Å; L83-I89 HydrophobicContact CB-CG2 4.36Å; L83-I89 HydrophobicContact CD1-CD1 4.18Å; L83-I89 HydrophobicContact CD1-CG2 4.15Å; L83-I89 HydrophobicContact CD2-CD1 4.16Å; L83-I89 HydrophobicContact CG-CD1 4.43Å; L83-R150 HydrophobicContact CD2-CG 3.86Å; L83-R150 PolarHBondContact O-NE 3.05Å; L83-R150 PolarHBondContact O-NH2 3.49Å; L83-L151 HydrophobicContact CD1-CD2 3.57Å; L83-L151 HydrophobicContact CD2-CD2 3.77Å; L83-L151 HydrophobicContact CG-CD2 4.32Å; L83-F181 HydrophobicContact CD1-CE1 4.09Å; L83-F181 HydrophobicContact CD1-CZ 4.38Å
84	G	90.9	Very high	96.5	Very high	34 Å²	34	44 Å²	44	35%	0.351	23%	0.226	S	C	.	.			trans	77.2	-168	179.9	0	0	0	0	0	112.9	H86	G84-H86 PolarHBondContact O-N 3.01Å
85	D	92.9	Very high	96.5	Very high	138 Å²	138	40 Å²	40	74%	0.738	22%	0.217	S	C	*	.	S	Bend	trans	-75.9	52.4	-178.8	-59.4	-44.3	0	0	0	112.8
86	H	96.8	Very high	96.5	Very high	44 Å²	44	38.8 Å²	38.8	20%	0.204	21%	0.212	C	C	.	.			trans	-73.2	128.2	175.5	179.8	-85.6	0	0	0	110	G84 N88 I89 R150	G84-H86 PolarHBondContact O-N 3.01Å; H86-N88 PolarHBondContact ND1-N 3.43Å; H86-N88 PolarHBondContact O-N 3.38Å; H86-I89 HydrophobicContact CB-CB 4.25Å; H86-I89 HydrophobicContact CB-CD1 4.02Å; H86-I89 HydrophobicContact CB-CG1 4.45Å; H86-I89 PolarHBondContact O-N 2.84Å; H86-R150 HydrophobicContact CB-CG 4.44Å
87	P	96.8	Very high	96.5	Very high	87 Å²	87	41.3 Å²	41.3	57%	0.565	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.3	-166.4	23	-35.1	0	0	0	114.6	T175	P87-T175 WeakPolarHBondContact O-CG2 3.45Å
88	N	98.3	Very high	96.4	Very high	11 Å²	11	44.8 Å²	44.8	6%	0.059	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	15.4	178.4	-49.7	110.2	0	0	0	114.1	H86 S143 F146 A147 T175 C176 L178	H86-N88 PolarHBondContact ND1-N 3.43Å; H86-N88 PolarHBondContact O-N 3.38Å; N88-S143 VanDerWaalsContact CB-O 3.22Å; N88-S143 WeakPolarHBondContact CB-O 3.44Å; N88-S143 WeakPolarHBondContact ND2-CB 3.49Å; N88-F146 WeakPolarHBondContact OD1-CB 3.31Å; N88-A147 HydrophobicContact CB-CB 3.98Å; N88-A147 VanDerWaalsContact O-CB 3.24Å; N88-A147 WeakPolarHBondContact O-CB 3.06Å; N88-T175 WeakPolarHBondContact ND2-CG2 3.38Å; N88-C176 WeakPolarHBondContact CB-O 3.13Å; N88-C176 PolarHBondContact ND2-O 2.87Å; N88-L178 PolarHBondContact O-N 3.34Å
89	I	98.2	Very high	96.3	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.01	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-124.4	141.1	176.9	-69.3	164.5	0	0	0	109.2	L83 H86 T91 A147 R150 F181	L83-I89 HydrophobicContact CB-CD1 4.3Å; L83-I89 HydrophobicContact CB-CG2 4.36Å; L83-I89 HydrophobicContact CD1-CD1 4.18Å; L83-I89 HydrophobicContact CD1-CG2 4.15Å; L83-I89 HydrophobicContact CD2-CD1 4.16Å; L83-I89 HydrophobicContact CG-CD1 4.43Å; H86-I89 HydrophobicContact CB-CB 4.25Å; H86-I89 HydrophobicContact CB-CD1 4.02Å; H86-I89 HydrophobicContact CB-CG1 4.45Å; H86-I89 PolarHBondContact O-N 2.84Å; I89-T91 PolarHBondContact O-N 2.89Å; I89-A147 HydrophobicContact CD1-CB 4.44Å; I89-A147 HydrophobicContact CG1-CB 3.83Å; I89-R150 HydrophobicContact CD1-CB 3.97Å; I89-R150 HydrophobicContact CD1-CG 3.73Å; I89-F181 HydrophobicContact CG1-CZ 4.47Å; I89-F181 HydrophobicContact CG2-CE2 4.11Å; I89-F181 HydrophobicContact CG2-CZ 3.88Å
90	V	97.7	Very high	96	Very high	7 Å²	7	50 Å²	50	4%	0.042	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-55.3	125	-176.7	72.5	0	0	0	0	111.8	I80 Y92 T111 Y114 V177 L178 C179 F181	I80-V90 HydrophobicContact CD1-CG1 4.33Å; I80-V90 HydrophobicContact CG2-CG1 3.88Å; I80-V90 WeakPolarHBondContact CG2-O 3.43Å; V90-Y92 PolarHBondContact O-N 3.42Å; V90-T111 HydrophobicContact CG1-CG2 4.46Å; V90-T111 HydrophobicContact CG2-CG2 4.11Å; V90-Y114 HydrophobicContact CG2-CD2 4.33Å; V90-Y114 HydrophobicContact CG2-CE2 3.69Å; V90-V177 HydrophobicContact CB-CG1 4.28Å; V90-V177 VanDerWaalsContact N-CG1 3.27Å; V90-L178 PolarHBondContact N-O 3.39Å; V90-C179 HydrophobicContact CB-CB 4.12Å; V90-C179 HydrophobicContact CG1-CB 4.4Å; V90-C179 HydrophobicContact CG2-CB 4.37Å; V90-F181 HydrophobicContact CG1-CD2 4.39Å; V90-F181 HydrophobicContact CG1-CE2 4Å
91	T	97.4	Very high	95.7	Very high	39 Å²	39	51.6 Å²	51.6	24%	0.239	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-67.9	116.3	-177.3	-47.7	0	0	0	0	111.4	I89 T111 K112 Y114	I89-T91 PolarHBondContact O-N 2.89Å; T91-T111 CarbonylContact O-C 3.6Å; T91-T111 VanDerWaalsContact O-CA 3.23Å; T91-T111 WeakPolarHBondContact O-CA 3.35Å; T91-T111 VanDerWaalsContact O-CB 3.26Å; T91-T111 WeakPolarHBondContact O-CB 3.46Å; T91-K112 PolarHBondContact O-N 3.01Å; T91-Y114 PolarHBondContact N-OH 3.27Å; T91-Y114 PolarHBondContact OG1-OH 3.29Å
92	Y	97.7	Very high	95.4	Very high	63 Å²	63	53.3 Å²	53.3	25%	0.247	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	142.7	171.5	-179.7	-97.1	0	0	0	111.3	I80 R81 V90 S95 L109	I80-Y92 HydrophobicContact CG2-CD2 4.44Å; R81-Y92 HydrophobicContact CB-CD1 4.42Å; R81-Y92 HydrophobicContact CB-CD2 4.29Å; R81-Y92 HydrophobicContact CB-CE1 4.39Å; R81-Y92 HydrophobicContact CB-CE2 4.26Å; R81-Y92 HydrophobicContact CB-CG 4.37Å; R81-Y92 HydrophobicContact CG-CD1 4.33Å; R81-Y92 HydrophobicContact CG-CE1 4.09Å; V90-Y92 PolarHBondContact O-N 3.42Å; Y92-S95 PolarHBondContact OH-N 3.15Å; Y92-S95 VanDerWaalsContact OH-N 3.09Å; Y92-S95 PolarHBondContact OH-OG 3.28Å; Y92-L109 HydrophobicContact CD2-CD1 3.96Å; Y92-L109 HydrophobicContact CE2-CD1 3.95Å
93	I	96.8	Very high	95.1	Very high	48 Å²	48	54.2 Å²	54.2	25%	0.246	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	-57.2	170.8	-58.7	-179.6	0	0	0	110.2	I29 M57 L110 T111	I29-I93 HydrophobicContact CD1-CG2 3.55Å; M57-I93 HydrophobicContact CB-CD1 4.39Å; M57-I93 HydrophobicContact CG-CD1 3.69Å; M57-I93 HydrophobicContact SD-CD1 3.53Å; M57-I93 VanDerWaalsContact SD-CD1 3.53Å; M57-I93 HydrophobicContact SD-CG2 4.31Å; I93-L110 HydrophobicContact CB-CD2 4.37Å; I93-L110 HydrophobicContact CB-CG 4.23Å; I93-L110 WeakPolarHBondContact CB-O 3.4Å; I93-L110 HydrophobicContact CG2-CD2 3.95Å; I93-L110 HydrophobicContact CG2-CG 4.35Å; I93-L110 PolarHBondContact N-O 2.8Å; I93-T111 VanDerWaalsContact CD1-C 3.43Å
94	A	97.3	Very high	95.1	Very high	11 Å²	11	57 Å²	57	9%	0.091	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	162.5	-179.9	0	0	0	0	0	110.8	V26 I29 L110	V26-A94 HydrophobicContact CB-CB 4.38Å; V26-A94 HydrophobicContact CG1-CB 3.81Å; I29-A94 HydrophobicContact CD1-CB 4.19Å; A94-L110 HydrophobicContact CB-CB 4.31Å; A94-L110 HydrophobicContact CB-CD2 4.35Å; A94-L110 PolarHBondContact N-O 3.05Å; A94-L110 PolarHBondContact O-N 2.84Å
95	S	97.5	Very high	95.3	Very high	34 Å²	34	57.7 Å²	57.7	24%	0.238	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	160.5	168	60	0	0	0	0	110.3	Y92 L108	Y92-S95 PolarHBondContact OH-N 3.15Å; Y92-S95 VanDerWaalsContact OH-N 3.09Å; Y92-S95 PolarHBondContact OH-OG 3.28Å; S95-L108 CarbonylContact C-O 3.58Å; S95-L108 WeakPolarHBondContact CA-O 3.11Å; S95-L108 WeakPolarHBondContact CB-O 3.31Å
96	S	97.2	Very high	95.5	Very high	24 Å²	24	51.7 Å²	51.7	17%	0.168	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	148.2	172.2	50.3	0	0	0	0	110.5	L108	S96-L108 PolarHBondContact N-O 2.73Å; S96-L108 PolarHBondContact O-N 3.2Å
97	I	96.1	Very high	95.5	Very high	58 Å²	58	49.6 Å²	49.6	30%	0.297	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124	169.6	-67.7	172.4	0	0	0	106.9	L70 R74 Q105 E106 Y107	L70-I97 HydrophobicContact CD1-CD1 4.39Å; L70-I97 HydrophobicContact CD1-CG2 3.82Å; R74-I97 HydrophobicContact CB-CD1 4.47Å; R74-I97 HydrophobicContact CG-CD1 3.46Å; R74-I97 VanDerWaalsContact CG-CD1 3.46Å; I97-Q105 HydrophobicContact CG2-CB 4.29Å; I97-E106 CarbonylContact C-O 3.6Å; I97-E106 VanDerWaalsContact CA-O 3.24Å; I97-E106 WeakPolarHBondContact CA-O 3.3Å; I97-Y107 HydrophobicContact CD1-CD2 4.21Å; I97-Y107 HydrophobicContact CG1-CD2 3.74Å
98	Q	94.8	Very high	95.5	Very high	82 Å²	82	45.5 Å²	45.5	38%	0.383	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	138.3	-176.8	61.1	-177.9	20.3	0	0	112.5	Q105 E106	Q98-Q105 CarbonylContact O-C 3.56Å; Q98-Q105 WeakPolarHBondContact O-CA 3.49Å; Q98-E106 HydrophobicContact CG-CB 3.76Å; Q98-E106 PolarHBondContact N-O 2.86Å; Q98-E106 PolarHBondContact NE2-OE2 3.39Å; Q98-E106 PolarHBondContact O-N 3.28Å
99	P	95	Very high	95.5	Very high	99 Å²	99	45.2 Å²	45.2	64%	0.643	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	131	173	28.4	-33.2	0	0	0	110.4
100	I	91.7	Very high	95.5	Very high	96 Å²	96	45.1 Å²	45.1	49%	0.492	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-34.5	173.4	-62.8	158.8	0	0	0	111.2	F63 I104 E106	F63-I100 HydrophobicContact CD1-CD1 3.46Å; F63-I100 VanDerWaalsContact CD1-CD1 3.46Å; F63-I100 HydrophobicContact CE1-CD1 3.48Å; F63-I100 VanDerWaalsContact CE1-CD1 3.48Å; I100-I104 PolarHBondContact N-O 2.84Å; I100-E106 HydrophobicContact CD1-CB 3.55Å; I100-E106 HydrophobicContact CD1-CG 3.86Å; I100-E106 HydrophobicContact CG1-CB 3.96Å
101	G	90.1	Very high	95.5	Very high	37 Å²	37	45.5 Å²	45.5	38%	0.381	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	145.7	169.3	-172.5	0	0	0	0	0	110.9	G103 I104	G101-G103 PolarHBondContact O-N 2.65Å; G101-I104 WeakPolarHBondContact O-CA 3.3Å; G101-I104 WeakPolarHBondContact O-CB 3.42Å; G101-I104 PolarHBondContact O-N 3.33Å
102	D	89.8	Confident	95.5	Very high	162 Å²	162	45.5 Å²	45.5	87%	0.866	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	28.4	173	-58	-24.9	0	0	0	116.1	I104	D102-I104 PolarHBondContact O-N 3.16Å
103	G	90	Very high	95.4	Very high	60 Å²	60	45.3 Å²	45.3	62%	0.619	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	4.8	-175.3	0	0	0	0	0	114.9	G101	G101-G103 PolarHBondContact O-N 2.65Å
104	I	94.5	Very high	95.4	Very high	61 Å²	61	43.8 Å²	43.8	31%	0.313	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.9	177.7	-51.5	177.4	0	0	0	110	F63 N65 I100 G101 D102	F63-I104 HydrophobicContact CB-CG2 4.07Å; N65-I104 HydrophobicContact CB-CG1 4.33Å; I100-I104 PolarHBondContact N-O 2.84Å; G101-I104 WeakPolarHBondContact O-CA 3.3Å; G101-I104 WeakPolarHBondContact O-CB 3.42Å; G101-I104 PolarHBondContact O-N 3.33Å; D102-I104 PolarHBondContact O-N 3.16Å
105	Q	95.4	Very high	95.2	Very high	49 Å²	49	48.3 Å²	48.3	23%	0.229	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	135.5	170.1	-56.6	-65.4	-44	0	0	109.6	V64 L70 I97 Q98	V64-Q105 PolarHBondContact N-O 2.98Å; V64-Q105 PolarHBondContact O-N 2.91Å; L70-Q105 HydrophobicContact CD1-CB 3.78Å; L70-Q105 HydrophobicContact CD1-CG 3.87Å; L70-Q105 HydrophobicContact CD2-CG 3.93Å; I97-Q105 HydrophobicContact CG2-CB 4.29Å; Q98-Q105 CarbonylContact O-C 3.56Å; Q98-Q105 WeakPolarHBondContact O-CA 3.49Å
106	E	96	Very high	95.1	Very high	12 Å²	12	48 Å²	48	6%	0.056	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.2	162.7	-148.1	170.4	-178.1	0	0	109.2	R61 F63 I97 Q98 I100 L108	R61-E106 IonicContact CZ-OE1 3.22Å; R61-E106 IonicContact NE-OE1 3.4Å; R61-E106 PolarHBondContact NE-OE1 3.36Å; R61-E106 IonicContact NH2-OE1 2.73Å; R61-E106 PolarHBondContact NH2-OE1 3.46Å; F63-E106 HydrophobicContact CD1-CG 4.17Å; F63-E106 HydrophobicContact CE1-CG 3.93Å; I97-E106 CarbonylContact C-O 3.6Å; I97-E106 VanDerWaalsContact CA-O 3.24Å; I97-E106 WeakPolarHBondContact CA-O 3.3Å; Q98-E106 HydrophobicContact CG-CB 3.76Å; Q98-E106 PolarHBondContact N-O 2.86Å; Q98-E106 PolarHBondContact NE2-OE2 3.39Å; Q98-E106 PolarHBondContact O-N 3.28Å; I100-E106 HydrophobicContact CD1-CB 3.55Å; I100-E106 HydrophobicContact CD1-CG 3.86Å; I100-E106 HydrophobicContact CG1-CB 3.96Å; E106-L108 HydrophobicContact CG-CD2 4.26Å; E106-L108 HydrophobicContact CG-CG 4.18Å
107	Y	97.1	Very high	95.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.7	164	172.1	-125	0	0	0	109	R61 Q62 C73 E76 A77 I97 L109	R61-Y107 WeakPolarHBondContact CA-O 3.32Å; Q62-Y107 HydrophobicContact CB-CD1 4.24Å; Q62-Y107 PolarHBondContact N-O 2.93Å; Q62-Y107 PolarHBondContact O-N 2.9Å; C73-Y107 HydrophobicContact CB-CD1 3.69Å; C73-Y107 HydrophobicContact CB-CD2 3.86Å; C73-Y107 HydrophobicContact CB-CE1 3.94Å; C73-Y107 HydrophobicContact CB-CE2 4.1Å; C73-Y107 HydrophobicContact CB-CG 3.62Å; C73-Y107 WeakPolarHBondContact O-CE2 3.21Å; C73-Y107 PolarHBondContact O-OH 2.82Å; C73-Y107 WeakPolarHBondContact SG-CD1 3.15Å; E76-Y107 WeakPolarHBondContact CG-OH 3.22Å; A77-Y107 HydrophobicContact CB-CE2 4.15Å; A77-Y107 PolarHBondContact N-OH 3.09Å; I97-Y107 HydrophobicContact CD1-CD2 4.21Å; I97-Y107 HydrophobicContact CG1-CD2 3.74Å; Y107-L109 HydrophobicContact CE1-CB 4.19Å; Y107-L109 HydrophobicContact CE2-CB 4.3Å
108	L	97.7	Very high	95.1	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.3	176.9	-61.8	170.2	0	0	0	108.7	V24 V26 L59 K60 R61 S95 S96 E106	V24-L108 HydrophobicContact CG1-CD1 3.68Å; V24-L108 HydrophobicContact CG1-CD2 4.24Å; V26-L108 HydrophobicContact CG1-CB 4.3Å; V26-L108 HydrophobicContact CG2-CB 4.12Å; V26-L108 HydrophobicContact CG2-CD1 4.27Å; L59-L108 HydrophobicContact CD1-CB 4.22Å; L59-L108 HydrophobicContact CD1-CD2 4.16Å; L59-L108 HydrophobicContact CD2-CD2 4.46Å; K60-L108 WeakPolarHBondContact O-CA 3.48Å; R61-L108 HydrophobicContact CB-CD2 3.94Å; R61-L108 HydrophobicContact CG-CD2 3.64Å; S95-L108 CarbonylContact C-O 3.58Å; S95-L108 WeakPolarHBondContact CA-O 3.11Å; S95-L108 WeakPolarHBondContact CB-O 3.31Å; S96-L108 PolarHBondContact N-O 2.73Å; S96-L108 PolarHBondContact O-N 3.2Å; E106-L108 HydrophobicContact CG-CD2 4.26Å; E106-L108 HydrophobicContact CG-CG 4.18Å
109	L	97.6	Very high	95.2	Very high	5 Å²	5	42 Å²	42	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	120.9	174.4	170.8	70.7	0	0	0	108.9	L59 K60 E76 I80 Y92 Y107 T111	L59-L109 CarbonylContact C-O 3.52Å; L59-L109 WeakPolarHBondContact CA-O 3.18Å; K60-L109 HydrophobicContact CB-CB 4.27Å; K60-L109 HydrophobicContact CD-CD2 4.44Å; K60-L109 PolarHBondContact N-O 2.71Å; K60-L109 PolarHBondContact O-N 3.16Å; E76-L109 HydrophobicContact CG-CD2 4.27Å; I80-L109 HydrophobicContact CD1-CD1 4.4Å; I80-L109 HydrophobicContact CD1-CD2 3.6Å; Y92-L109 HydrophobicContact CD2-CD1 3.96Å; Y92-L109 HydrophobicContact CE2-CD1 3.95Å; Y107-L109 HydrophobicContact CE1-CB 4.19Å; Y107-L109 HydrophobicContact CE2-CB 4.3Å; L109-T111 HydrophobicContact CD1-CG2 4.38Å; L109-T111 HydrophobicContact CD2-CG2 4.38Å; L109-T111 HydrophobicContact CG-CG2 4.1Å
110	L	98	Very high	95.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.6	-178.8	-171.9	69.9	0	0	0	109.5	V26 I29 V31 V48 M57 A58 L59 I93 A94	V26-L110 HydrophobicContact CB-CB 4.46Å; V26-L110 HydrophobicContact CB-CD2 4.48Å; V26-L110 HydrophobicContact CG1-CB 4.16Å; I29-L110 HydrophobicContact CB-CD2 4.37Å; I29-L110 HydrophobicContact CD1-CD2 4.26Å; I29-L110 HydrophobicContact CG2-CD2 4.12Å; V31-L110 HydrophobicContact CG1-CD1 4.22Å; V31-L110 HydrophobicContact CG1-CD2 4Å; V48-L110 HydrophobicContact CG2-CD1 3.61Å; M57-L110 HydrophobicContact CB-CD1 3.81Å; M57-L110 HydrophobicContact CB-CG 4.41Å; M57-L110 HydrophobicContact CE-CD1 4.15Å; M57-L110 HydrophobicContact CE-CD2 3.98Å; M57-L110 HydrophobicContact CE-CG 4.45Å; M57-L110 HydrophobicContact SD-CD1 4.31Å; M57-L110 HydrophobicContact SD-CD2 3.91Å; M57-L110 HydrophobicContact SD-CG 4.16Å; A58-L110 WeakPolarHBondContact O-CA 3.26Å; L59-L110 HydrophobicContact CB-CD1 4.28Å; L59-L110 HydrophobicContact CD1-CD1 4.35Å; I93-L110 HydrophobicContact CB-CD2 4.37Å; I93-L110 HydrophobicContact CB-CG 4.23Å; I93-L110 WeakPolarHBondContact CB-O 3.4Å; I93-L110 HydrophobicContact CG2-CD2 3.95Å; I93-L110 HydrophobicContact CG2-CG 4.35Å; I93-L110 PolarHBondContact N-O 2.8Å; A94-L110 HydrophobicContact CB-CB 4.31Å; A94-L110 HydrophobicContact CB-CD2 4.35Å; A94-L110 PolarHBondContact N-O 3.05Å; A94-L110 PolarHBondContact O-N 2.84Å
111	T	97.7	Very high	95.4	Very high	16 Å²	16	38.5 Å²	38.5	10%	0.098	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	169.9	-179.7	67.4	0	0	0	0	111.7	M57 A58 V90 T91 I93 L109 Y113	M57-T111 WeakPolarHBondContact CB-O 3.4Å; A58-T111 PolarHBondContact N-O 2.89Å; A58-T111 PolarHBondContact O-N 2.72Å; V90-T111 HydrophobicContact CG1-CG2 4.46Å; V90-T111 HydrophobicContact CG2-CG2 4.11Å; T91-T111 CarbonylContact O-C 3.6Å; T91-T111 VanDerWaalsContact O-CA 3.23Å; T91-T111 WeakPolarHBondContact O-CA 3.35Å; T91-T111 VanDerWaalsContact O-CB 3.26Å; T91-T111 WeakPolarHBondContact O-CB 3.46Å; I93-T111 VanDerWaalsContact CD1-C 3.43Å; L109-T111 HydrophobicContact CD1-CG2 4.38Å; L109-T111 HydrophobicContact CD2-CG2 4.38Å; L109-T111 HydrophobicContact CG-CG2 4.1Å; T111-Y113 PolarHBondContact O-N 2.92Å
112	K	96.7	Very high	95.8	Very high	38 Å²	38	37 Å²	37	17%	0.165	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	140.2	163.1	175.7	171.7	173.6	-179.6	0	109.6	T91 Y114 D171	T91-K112 PolarHBondContact O-N 3.01Å; K112-Y114 HydrophobicContact CB-CE2 3.78Å; K112-Y114 HydrophobicContact CD-CE1 4.09Å; K112-Y114 HydrophobicContact CD-CE2 4.29Å; K112-Y114 HydrophobicContact CG-CD2 4.38Å; K112-Y114 HydrophobicContact CG-CE1 4.43Å; K112-Y114 HydrophobicContact CG-CE2 3.85Å; K112-Y114 WeakPolarHBondContact O-CD2 3.3Å; K112-Y114 WeakPolarHBondContact O-CE2 3.24Å; K112-D171 VanDerWaalsContact CE-OD1 3.26Å; K112-D171 WeakPolarHBondContact CE-OD1 3.14Å; K112-D171 IonicContact NZ-OD1 3.65Å; K112-D171 PolarHBondContact NZ-OD1 3.42Å; K112-D171 IonicContact NZ-OD2 3.87Å; K112-D171 PolarHBondContact NZ-OD2 3.22Å
113	Y	97.2	Very high	96	Very high	60 Å²	60	32 Å²	32	24%	0.235	17%	0.168	C	C	.	.			trans	-83.4	135.1	169.7	173.7	-120.1	0	0	0	109.8	I37 L47 L56 A58 T111 R115	I37-Y113 HydrophobicContact CD1-CD2 3.78Å; I37-Y113 HydrophobicContact CD1-CE2 3.58Å; I37-Y113 HydrophobicContact CG1-CE2 4.34Å; L47-Y113 HydrophobicContact CD1-CD1 3.74Å; L47-Y113 HydrophobicContact CD1-CD2 3.74Å; L47-Y113 HydrophobicContact CD1-CE1 3.83Å; L47-Y113 HydrophobicContact CD1-CE2 3.85Å; L47-Y113 HydrophobicContact CD1-CG 3.68Å; L56-Y113 HydrophobicContact CB-CD1 4.21Å; A58-Y113 HydrophobicContact CB-CD2 4.49Å; T111-Y113 PolarHBondContact O-N 2.92Å; Y113-R115 HydrophobicContact CE1-CB 4.14Å
114	Y	96.7	Very high	96.3	Very high	16 Å²	16	31.5 Å²	31.5	6%	0.063	15%	0.153	C	C	.	.			trans	-119.5	127.1	174.1	-60.6	-97.4	0	0	0	107.3	V90 T91 K112 L169 D171 V177	V90-Y114 HydrophobicContact CG2-CD2 4.33Å; V90-Y114 HydrophobicContact CG2-CE2 3.69Å; T91-Y114 PolarHBondContact N-OH 3.27Å; T91-Y114 PolarHBondContact OG1-OH 3.29Å; K112-Y114 HydrophobicContact CB-CE2 3.78Å; K112-Y114 HydrophobicContact CD-CE1 4.09Å; K112-Y114 HydrophobicContact CD-CE2 4.29Å; K112-Y114 HydrophobicContact CG-CD2 4.38Å; K112-Y114 HydrophobicContact CG-CE1 4.43Å; K112-Y114 HydrophobicContact CG-CE2 3.85Å; K112-Y114 WeakPolarHBondContact O-CD2 3.3Å; K112-Y114 WeakPolarHBondContact O-CE2 3.24Å; Y114-L169 HydrophobicContact CD1-CB 4.48Å; Y114-L169 HydrophobicContact CD2-CB 4.48Å; Y114-L169 HydrophobicContact CD2-CD1 3.75Å; Y114-L169 HydrophobicContact CG-CB 4Å; Y114-L169 HydrophobicContact CG-CD1 4.06Å; Y114-D171 HydrophobicContact CD1-CB 3.76Å; Y114-D171 HydrophobicContact CE1-CB 3.77Å; Y114-D171 WeakPolarHBondContact CE1-OD2 3.3Å; Y114-V177 HydrophobicContact CD1-CG2 4.3Å; Y114-V177 HydrophobicContact CE1-CB 4.11Å; Y114-V177 HydrophobicContact CE1-CG1 4.12Å; Y114-V177 HydrophobicContact CE1-CG2 3.7Å; Y114-V177 HydrophobicContact CE2-CG1 4.47Å
115	R	93.2	Very high	96.3	Very high	105 Å²	105	29.5 Å²	29.5	40%	0.396	14%	0.142	S	C	.	.	S	Bend	trans	-80.5	-23	-165.3	176.6	174	143.3	70.3	8.3	113.6	Y113 V649 P652	Y113-R115 HydrophobicContact CE1-CB 4.14Å; R115-V649 PolarHBondContact NE-O 3.49Å; R115-V649 PolarHBondContact NH2-O 2.95Å; R115-P652 VanDerWaalsContact NH2-CG 3.29Å
116	V	95.2	Very high	96.2	Very high	28 Å²	28	29.8 Å²	29.8	17%	0.17	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.5	-176.1	-175.4	0	0	0	0	109.4	Q120 V121 I170	V116-Q120 HydrophobicContact CG1-CB 4.38Å; V116-V121 HydrophobicContact CG1-CG2 3.81Å; V116-I170 HydrophobicContact CB-CB 4.38Å; V116-I170 HydrophobicContact CG1-CD1 4.34Å; V116-I170 PolarHBondContact O-N 3.41Å
117	S	96.7	Very high	96.1	Very high	17 Å²	17	37.4 Å²	37.4	12%	0.119	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	155.7	171.4	59	0	0	0	0	111	L119 Q120 V121	S117-L119 PolarHBondContact O-N 2.84Å; S117-Q120 WeakPolarHBondContact O-CB 3.48Å; S117-Q120 PolarHBondContact O-N 2.85Å; S117-Q120 WeakPolarHBondContact OG-CG 3.42Å; S117-Q120 PolarHBondContact OG-N 3.01Å; S117-Q120 PolarHBondContact OG-OE1 3.3Å; S117-V121 PolarHBondContact O-N 3.38Å
118	V	97.1	Very high	95.9	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-57.9	-38	175.1	170.7	0	0	0	0	111.2	Q120 V121 M122 I140 V165 V168 I170 L241	V118-Q120 VanDerWaalsContact C-N 3.31Å; V118-Q120 PolarHBondContact O-N 2.9Å; V118-V121 PolarHBondContact O-N 2.92Å; V118-M122 HydrophobicContact CG1-CG 4.32Å; V118-M122 HydrophobicContact CG1-SD 4.02Å; V118-M122 VanDerWaalsContact O-CG 3.31Å; V118-M122 WeakPolarHBondContact O-CG 3.38Å; V118-M122 PolarHBondContact O-N 2.92Å; V118-I140 HydrophobicContact CG1-CD1 4.16Å; V118-I140 HydrophobicContact CG1-CG2 4.14Å; V118-I140 HydrophobicContact CG2-CD1 4.44Å; V118-I140 HydrophobicContact CG2-CG1 4.33Å; V118-I140 HydrophobicContact CG2-CG2 3.89Å; V118-V165 HydrophobicContact CG1-CB 4.49Å; V118-V168 HydrophobicContact CB-CB 4.14Å; V118-V168 HydrophobicContact CB-CG1 4.44Å; V118-V168 HydrophobicContact CG2-CB 3.78Å; V118-V168 HydrophobicContact CG2-CG1 3.55Å; V118-V168 PolarHBondContact N-O 3.2Å; V118-I170 HydrophobicContact CG2-CD1 3.99Å; V118-I170 HydrophobicContact CG2-CG1 3.92Å; V118-L241 HydrophobicContact CG1-CD2 3.59Å
119	L	96.1	Very high	95.6	Very high	21 Å²	21	45.1 Å²	45.1	11%	0.11	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-40.1	173.9	-173.8	74.9	0	0	0	112.5	S117 N123 V165 E166	S117-L119 PolarHBondContact O-N 2.84Å; L119-N123 WeakPolarHBondContact O-CB 3.49Å; L119-N123 PolarHBondContact O-N 2.92Å; L119-N123 PolarHBondContact O-ND2 3.18Å; L119-N123 VanDerWaalsContact O-ND2 3.1Å; L119-V165 HydrophobicContact CD1-CG2 4.18Å; L119-E166 HydrophobicContact CD2-CG 4.21Å
120	Q	95.8	Very high	95.4	Very high	101 Å²	101	49.3 Å²	49.3	47%	0.472	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-41.1	176.2	-75.8	162.3	-54.9	0	0	111.8	V116 S117 V118 N123 V124	V116-Q120 HydrophobicContact CG1-CB 4.38Å; S117-Q120 WeakPolarHBondContact O-CB 3.48Å; S117-Q120 PolarHBondContact O-N 2.85Å; S117-Q120 WeakPolarHBondContact OG-CG 3.42Å; S117-Q120 PolarHBondContact OG-N 3.01Å; S117-Q120 PolarHBondContact OG-OE1 3.3Å; V118-Q120 VanDerWaalsContact C-N 3.31Å; V118-Q120 PolarHBondContact O-N 2.9Å; Q120-N123 PolarHBondContact O-N 2.93Å; Q120-V124 WeakPolarHBondContact O-CG2 3.4Å; Q120-V124 PolarHBondContact O-N 3.02Å
121	V	95.8	Very high	95.2	Very high	19 Å²	19	52.9 Å²	52.9	12%	0.115	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-46.9	175.5	-179	0	0	0	0	111	V116 S117 V118 N123 V124 H125 L132 I170	V116-V121 HydrophobicContact CG1-CG2 3.81Å; S117-V121 PolarHBondContact O-N 3.38Å; V118-V121 PolarHBondContact O-N 2.92Å; V121-N123 VanDerWaalsContact C-N 3.29Å; V121-N123 PolarHBondContact O-N 3.26Å; V121-V124 WeakPolarHBondContact O-CB 3.33Å; V121-V124 PolarHBondContact O-N 2.71Å; V121-H125 PolarHBondContact O-CD2 3.48Å; V121-H125 PolarHBondContact O-N 2.97Å; V121-L132 HydrophobicContact CG1-CD2 4.02Å; V121-I170 HydrophobicContact CG2-CD1 3.55Å
122	M	96.9	Very high	95	Very high	7 Å²	7	52.3 Å²	52.3	3%	0.034	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-42.7	174.7	-66.6	171	71.8	0	0	111.9	V118 V124 H125 L126 L132 V165 K240 L241 F244	V118-M122 HydrophobicContact CG1-CG 4.32Å; V118-M122 HydrophobicContact CG1-SD 4.02Å; V118-M122 VanDerWaalsContact O-CG 3.31Å; V118-M122 WeakPolarHBondContact O-CG 3.38Å; V118-M122 PolarHBondContact O-N 2.92Å; M122-V124 VanDerWaalsContact C-N 3.29Å; M122-V124 PolarHBondContact O-N 3.3Å; M122-H125 PolarHBondContact O-N 2.67Å; M122-L126 VanDerWaalsContact O-CB 3.3Å; M122-L126 WeakPolarHBondContact O-CB 3.37Å; M122-L126 PolarHBondContact O-N 3.18Å; M122-L132 HydrophobicContact CG-CD1 4.15Å; M122-V165 HydrophobicContact SD-CB 4.12Å; M122-V165 HydrophobicContact SD-CG1 4.23Å; M122-V165 HydrophobicContact SD-CG2 4.06Å; M122-K240 HydrophobicContact CE-CG 4.24Å; M122-K240 VanDerWaalsContact CE-O 3.24Å; M122-K240 WeakPolarHBondContact CE-O 3.42Å; M122-L241 HydrophobicContact SD-CD2 4.04Å; M122-F244 HydrophobicContact CB-CE1 4.07Å; M122-F244 HydrophobicContact CB-CE2 4.4Å; M122-F244 HydrophobicContact CB-CZ 4.01Å; M122-F244 HydrophobicContact CE-CD1 3.42Å; M122-F244 VanDerWaalsContact CE-CD1 3.42Å; M122-F244 HydrophobicContact CE-CE1 3.82Å; M122-F244 HydrophobicContact CE-CG 4.09Å; M122-F244 HydrophobicContact CG-CD1 4.39Å; M122-F244 HydrophobicContact CG-CE1 3.85Å; M122-F244 HydrophobicContact CG-CZ 4.19Å; M122-F244 VanDerWaalsContact O-CE2 3.28Å; M122-F244 WeakPolarHBondContact O-CE2 3.43Å
123	N	95.4	Very high	94.9	Very high	57 Å²	57	53.1 Å²	53.1	31%	0.305	28%	0.276	S	S	.	.	H	α-helix	trans	-66.8	-25.6	177.1	-74.6	-31.5	0	0	0	113.6	L119 Q120 V121 K127	L119-N123 WeakPolarHBondContact O-CB 3.49Å; L119-N123 PolarHBondContact O-N 2.92Å; L119-N123 PolarHBondContact O-ND2 3.18Å; L119-N123 VanDerWaalsContact O-ND2 3.1Å; Q120-N123 PolarHBondContact O-N 2.93Å; V121-N123 VanDerWaalsContact C-N 3.29Å; V121-N123 PolarHBondContact O-N 3.26Å; N123-K127 WeakPolarHBondContact O-CD 3.27Å; N123-K127 VanDerWaalsContact O-CG 3.22Å; N123-K127 WeakPolarHBondContact O-CG 3.33Å; N123-K127 PolarHBondContact O-N 2.84Å
124	V	95.5	Very high	94.7	Very high	48 Å²	48	52.6 Å²	52.6	29%	0.291	28%	0.28	S	S	.	.	H	α-helix	trans	-73	-53.9	171.6	171	0	0	0	0	109.6	Q120 V121 M122 L126 K127 D128	Q120-V124 WeakPolarHBondContact O-CG2 3.4Å; Q120-V124 PolarHBondContact O-N 3.02Å; V121-V124 WeakPolarHBondContact O-CB 3.33Å; V121-V124 PolarHBondContact O-N 2.71Å; M122-V124 VanDerWaalsContact C-N 3.29Å; M122-V124 PolarHBondContact O-N 3.3Å; V124-L126 VanDerWaalsContact C-N 3.26Å; V124-L126 PolarHBondContact O-N 3.04Å; V124-K127 WeakPolarHBondContact O-CB 3.35Å; V124-K127 PolarHBondContact O-N 2.89Å; V124-D128 PolarHBondContact O-N 3.47Å; V124-D128 VanDerWaalsContact O-N 3.08Å
125	H	94.8	Very high	94.5	Very high	19 Å²	19	57.5 Å²	57.5	9%	0.088	30%	0.302	C	S	.	.	H	α-helix	trans	-54.9	-43.3	177.7	-77.1	-120.5	0	0	0	111.6	V121 M122 K127 D128 G129 N130 Y131 E136 F244	V121-H125 PolarHBondContact O-CD2 3.48Å; V121-H125 PolarHBondContact O-N 2.97Å; M122-H125 PolarHBondContact O-N 2.67Å; H125-K127 PolarHBondContact O-N 2.77Å; H125-D128 CarbonylContact O-C 3.58Å; H125-D128 PolarHBondContact O-N 2.84Å; H125-D128 VanDerWaalsContact O-N 3.14Å; H125-G129 PolarHBondContact O-N 2.95Å; H125-G129 VanDerWaalsContact O-N 3.15Å; H125-N130 CarbonylContact C-O 3.58Å; H125-N130 HydrophobicContact CB-CB 4.42Å; H125-N130 WeakPolarHBondContact O-CA 3.06Å; H125-N130 PolarHBondContact O-N 3.05Å; H125-N130 VanDerWaalsContact O-O 3.05Å; H125-Y131 PolarHBondContact ND1-O 2.83Å; H125-E136 IonicContact CE1-OE1 3.54Å; H125-E136 IonicContact NE2-OE1 3.57Å; H125-F244 HydrophobicContact CB-CE2 4Å; H125-F244 HydrophobicContact CB-CZ 3.93Å
126	L	92.7	Very high	94.6	Very high	55 Å²	55	54.2 Å²	54.2	29%	0.288	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-39.1	178.3	-179.6	58	0	0	0	113	M122 V124 D128 G129 F244 F465	M122-L126 VanDerWaalsContact O-CB 3.3Å; M122-L126 WeakPolarHBondContact O-CB 3.37Å; M122-L126 PolarHBondContact O-N 3.18Å; V124-L126 VanDerWaalsContact C-N 3.26Å; V124-L126 PolarHBondContact O-N 3.04Å; L126-D128 VanDerWaalsContact C-N 3.31Å; L126-G129 PolarHBondContact O-N 3.43Å; L126-F244 HydrophobicContact CB-CD2 3.88Å; L126-F244 HydrophobicContact CB-CE2 3.92Å; L126-F244 HydrophobicContact CD1-CD2 4.23Å; L126-F244 HydrophobicContact CG-CD2 4.45Å; L126-F465 HydrophobicContact CD1-CD1 4.33Å; L126-F465 HydrophobicContact CD1-CE1 3.84Å
127	K	93.8	Very high	94.7	Very high	172 Å²	172	52.9 Å²	52.9	75%	0.748	28%	0.283	S	S	*	.	H	α-helix	trans	-66.8	-35.1	175.5	-76.2	168.8	-176.9	177.5	0	112	N123 V124 H125 G129	N123-K127 WeakPolarHBondContact O-CD 3.27Å; N123-K127 VanDerWaalsContact O-CG 3.22Å; N123-K127 WeakPolarHBondContact O-CG 3.33Å; N123-K127 PolarHBondContact O-N 2.84Å; V124-K127 WeakPolarHBondContact O-CB 3.35Å; V124-K127 PolarHBondContact O-N 2.89Å; H125-K127 PolarHBondContact O-N 2.77Å; K127-G129 PolarHBondContact O-N 3.29Å
128	D	93.5	Very high	94.7	Very high	106 Å²	106	52.6 Å²	52.6	57%	0.567	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	2.6	178	-61.1	-21	0	0	0	112.7	V124 H125 L126 N130	V124-D128 PolarHBondContact O-N 3.47Å; V124-D128 VanDerWaalsContact O-N 3.08Å; H125-D128 CarbonylContact O-C 3.58Å; H125-D128 PolarHBondContact O-N 2.84Å; H125-D128 VanDerWaalsContact O-N 3.14Å; L126-D128 VanDerWaalsContact C-N 3.31Å; D128-N130 VanDerWaalsContact C-N 3.25Å; D128-N130 PolarHBondContact O-N 2.83Å; D128-N130 PolarHBondContact O-ND2 3.4Å
129	G	91	Very high	94.6	Very high	57 Å²	57	54 Å²	54	59%	0.588	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	13.9	-178.6	0	0	0	0	0	114.5	H125 L126 K127	H125-G129 PolarHBondContact O-N 2.95Å; H125-G129 VanDerWaalsContact O-N 3.15Å; L126-G129 PolarHBondContact O-N 3.43Å; K127-G129 PolarHBondContact O-N 3.29Å
130	N	93.3	Very high	94.7	Very high	93 Å²	93	53.1 Å²	53.1	50%	0.497	28%	0.283	S	S	.	.			trans	-107.8	165.9	-174.4	-68.5	-49.5	0	0	0	112.3	H125 D128	H125-N130 CarbonylContact C-O 3.58Å; H125-N130 HydrophobicContact CB-CB 4.42Å; H125-N130 WeakPolarHBondContact O-CA 3.06Å; H125-N130 PolarHBondContact O-N 3.05Å; H125-N130 VanDerWaalsContact O-O 3.05Å; D128-N130 VanDerWaalsContact C-N 3.25Å; D128-N130 PolarHBondContact O-N 2.83Å; D128-N130 PolarHBondContact O-ND2 3.4Å
131	Y	93.3	Very high	94.8	Very high	74 Å²	74	48.3 Å²	48.3	29%	0.29	26%	0.261	S	S	.	.			trans	-112.1	172.3	168	-63.5	-90.5	0	0	0	109.8	H125 C242 F244 P266	H125-Y131 PolarHBondContact ND1-O 2.83Å; Y131-C242 WeakPolarHBondContact CD1-O 3.4Å; Y131-F244 HydrophobicContact CD1-CD1 4.49Å; Y131-F244 HydrophobicContact CD1-CD2 4.33Å; Y131-F244 HydrophobicContact CD1-CE2 4.5Å; Y131-F244 HydrophobicContact CD1-CG 4.33Å; Y131-P266 HydrophobicContact CD1-CG 3.77Å; Y131-P266 HydrophobicContact CD2-CB 3.94Å; Y131-P266 HydrophobicContact CD2-CG 3.79Å; Y131-P266 HydrophobicContact CE1-CG 4.18Å; Y131-P266 HydrophobicContact CE2-CB 4.45Å; Y131-P266 HydrophobicContact CE2-CG 4.21Å; Y131-P266 HydrophobicContact CG-CB 4.12Å; Y131-P266 HydrophobicContact CG-CG 3.56Å
132	L	94.6	Very high	94.9	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	26%	0.255	C	S	.	.			trans	-69.6	143	169.1	-65.9	172.8	0	0	0	110	V121 M122 E136 V137 I140 L241 F244 Y268	V121-L132 HydrophobicContact CG1-CD2 4.02Å; M122-L132 HydrophobicContact CG-CD1 4.15Å; L132-E136 HydrophobicContact CB-CB 4.27Å; L132-E136 HydrophobicContact CD2-CB 4.29Å; L132-V137 HydrophobicContact CB-CG2 3.57Å; L132-V137 HydrophobicContact CD1-CG2 4.16Å; L132-I140 HydrophobicContact CD1-CD1 3.95Å; L132-L241 HydrophobicContact CD1-CD2 4.27Å; L132-F244 HydrophobicContact CD1-CE1 4.2Å; L132-F244 HydrophobicContact CG-CE1 4Å; L132-F244 HydrophobicContact CG-CZ 4.1Å; L132-Y268 PolarHBondContact O-OH 3.19Å
133	S	93.4	Very high	94.9	Very high	54 Å²	54	47.9 Å²	47.9	38%	0.378	26%	0.259	S	S	.	.			trans	-66.9	157.4	170	69.2	0	0	0	0	111.2	K135 E136 V137	S133-K135 PolarHBondContact O-N 2.75Å; S133-E136 WeakPolarHBondContact CA-OE2 3.42Å; S133-E136 WeakPolarHBondContact CB-OE2 3.49Å; S133-E136 PolarHBondContact N-OE2 2.88Å; S133-E136 PolarHBondContact O-N 2.74Å; S133-E136 VanDerWaalsContact O-N 3.12Å; S133-E136 WeakPolarHBondContact OG-CG 3.4Å; S133-E136 PolarHBondContact OG-N 3.26Å; S133-E136 PolarHBondContact OG-OE2 3.07Å; S133-V137 WeakPolarHBondContact O-CG2 3.35Å; S133-V137 PolarHBondContact O-N 3.22Å
134	C	93.6	Very high	95.1	Very high	50 Å²	50	45.2 Å²	45.2	34%	0.338	25%	0.245	S	C	.	.	H	α-helix	trans	-50.2	-35.5	172.8	-63.6	0	0	0	0	112.9	L138	C134-L138 WeakPolarHBondContact O-CB 3.44Å; C134-L138 WeakPolarHBondContact O-CD1 3.48Å; C134-L138 VanDerWaalsContact O-CG 3.28Å; C134-L138 WeakPolarHBondContact O-CG 3.28Å; C134-L138 PolarHBondContact O-N 3Å
135	K	93.4	Very high	95.2	Very high	119 Å²	119	42.9 Å²	42.9	52%	0.517	23%	0.231	S	C	.	.	H	α-helix	trans	-72	-44.1	-178.6	-168.2	174.8	-175.8	-177.1	0	111.5	S133 L138 N139 F641	S133-K135 PolarHBondContact O-N 2.75Å; K135-L138 PolarHBondContact O-N 3.12Å; K135-N139 WeakPolarHBondContact O-CB 3.4Å; K135-N139 VanDerWaalsContact O-CG 3.24Å; K135-N139 PolarHBondContact O-N 3.3Å; K135-N139 PolarHBondContact O-ND2 2.97Å; K135-F641 HydrophobicContact CD-CD2 4.36Å; K135-F641 HydrophobicContact CD-CE2 3.61Å; K135-F641 HydrophobicContact CD-CZ 4.07Å; K135-F641 HydrophobicContact CG-CE2 4.24Å; K135-F641 HydrophobicContact CG-CZ 4.2Å
136	E	95.2	Very high	95.4	Very high	35 Å²	35	43.6 Å²	43.6	16%	0.164	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-47.5	174.8	-70.9	158.7	123.1	0	0	111.2	H125 L132 S133 L138 N139 I140	H125-E136 IonicContact CE1-OE1 3.54Å; H125-E136 IonicContact NE2-OE1 3.57Å; L132-E136 HydrophobicContact CB-CB 4.27Å; L132-E136 HydrophobicContact CD2-CB 4.29Å; S133-E136 WeakPolarHBondContact CA-OE2 3.42Å; S133-E136 WeakPolarHBondContact CB-OE2 3.49Å; S133-E136 PolarHBondContact N-OE2 2.88Å; S133-E136 PolarHBondContact O-N 2.74Å; S133-E136 VanDerWaalsContact O-N 3.12Å; S133-E136 WeakPolarHBondContact OG-CG 3.4Å; S133-E136 PolarHBondContact OG-N 3.26Å; S133-E136 PolarHBondContact OG-OE2 3.07Å; E136-L138 PolarHBondContact O-N 3.17Å; E136-N139 PolarHBondContact O-N 3.1Å; E136-I140 WeakPolarHBondContact O-CD1 3.35Å; E136-I140 WeakPolarHBondContact O-CG1 3.14Å; E136-I140 PolarHBondContact O-N 2.94Å
137	V	96.7	Very high	95.7	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.8	-46.8	176.7	177.3	0	0	0	0	111.2	L132 S133 F141 L238 L241 Y268 L272	L132-V137 HydrophobicContact CB-CG2 3.57Å; L132-V137 HydrophobicContact CD1-CG2 4.16Å; S133-V137 WeakPolarHBondContact O-CG2 3.35Å; S133-V137 PolarHBondContact O-N 3.22Å; V137-F141 WeakPolarHBondContact O-CB 3.41Å; V137-F141 PolarHBondContact O-N 3.37Å; V137-L238 HydrophobicContact CG1-CD1 3.47Å; V137-L238 VanDerWaalsContact CG1-CD1 3.47Å; V137-L241 HydrophobicContact CG1-CB 4.01Å; V137-L241 HydrophobicContact CG2-CB 4.45Å; V137-Y268 HydrophobicContact CG2-CE1 4.4Å; V137-L272 HydrophobicContact CB-CD1 4.17Å; V137-L272 HydrophobicContact CG1-CD1 3.8Å
138	L	95.9	Very high	95.9	Very high	12 Å²	12	32.8 Å²	32.8	6%	0.063	18%	0.184	C	C	.	.	H	α-helix	trans	-65.1	-38	178.7	-78.8	167.5	0	0	0	112.7	C134 K135 E136 C142 L272 L300 A301	C134-L138 WeakPolarHBondContact O-CB 3.44Å; C134-L138 WeakPolarHBondContact O-CD1 3.48Å; C134-L138 VanDerWaalsContact O-CG 3.28Å; C134-L138 WeakPolarHBondContact O-CG 3.28Å; C134-L138 PolarHBondContact O-N 3Å; K135-L138 PolarHBondContact O-N 3.12Å; E136-L138 PolarHBondContact O-N 3.17Å; L138-C142 VanDerWaalsContact O-CB 3.26Å; L138-C142 WeakPolarHBondContact O-CB 3.47Å; L138-C142 PolarHBondContact O-N 2.98Å; L138-C142 PolarHBondContact O-SG 3.07Å; L138-L272 HydrophobicContact CD1-CD2 4.46Å; L138-L272 HydrophobicContact CD2-CD2 3.67Å; L138-L272 HydrophobicContact CG-CD2 3.92Å; L138-L300 HydrophobicContact CD1-CB 4.05Å; L138-L300 HydrophobicContact CD2-CB 3.86Å; L138-L300 HydrophobicContact CD2-CD1 4.35Å; L138-A301 HydrophobicContact CB-CB 4.27Å; L138-A301 HydrophobicContact CD1-CB 4.33Å
139	N	95.8	Very high	96.1	Very high	30 Å²	30	27.8 Å²	27.8	16%	0.16	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-47.2	178.8	-76.1	-26.1	0	0	0	112.3	K135 E136 S143 F641	K135-N139 WeakPolarHBondContact O-CB 3.4Å; K135-N139 VanDerWaalsContact O-CG 3.24Å; K135-N139 PolarHBondContact O-N 3.3Å; K135-N139 PolarHBondContact O-ND2 2.97Å; E136-N139 PolarHBondContact O-N 3.1Å; N139-S143 WeakPolarHBondContact O-CB 3.26Å; N139-S143 PolarHBondContact O-N 3.1Å; N139-S143 VanDerWaalsContact O-N 3.12Å; N139-S143 PolarHBondContact O-OG 3.22Å; N139-F641 WeakPolarHBondContact ND2-CE1 3.48Å; N139-F641 WeakPolarHBondContact ND2-CZ 3.47Å
140	I	97.8	Very high	96.5	Very high	3 Å²	3	30 Å²	30	2%	0.015	15%	0.148	C	C	.	.	H	α-helix	trans	-58.5	-53.3	174.2	-64.7	160.5	0	0	0	109.1	V118 L132 E136 C142 S143 V144 L241	V118-I140 HydrophobicContact CG1-CD1 4.16Å; V118-I140 HydrophobicContact CG1-CG2 4.14Å; V118-I140 HydrophobicContact CG2-CD1 4.44Å; V118-I140 HydrophobicContact CG2-CG1 4.33Å; V118-I140 HydrophobicContact CG2-CG2 3.89Å; L132-I140 HydrophobicContact CD1-CD1 3.95Å; E136-I140 WeakPolarHBondContact O-CD1 3.35Å; E136-I140 WeakPolarHBondContact O-CG1 3.14Å; E136-I140 PolarHBondContact O-N 2.94Å; I140-C142 PolarHBondContact O-N 3.21Å; I140-S143 WeakPolarHBondContact O-CB 3.49Å; I140-S143 PolarHBondContact O-N 3.34Å; I140-V144 WeakPolarHBondContact O-CG2 3.33Å; I140-V144 PolarHBondContact O-N 2.61Å; I140-V144 VanDerWaalsContact O-N 3.07Å; I140-L241 HydrophobicContact CB-CD1 4.38Å; I140-L241 HydrophobicContact CD1-CD2 4.41Å; I140-L241 HydrophobicContact CG2-CD1 3.84Å; I140-L241 HydrophobicContact CG2-CD2 4.05Å
141	F	98.3	Very high	96.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.8	-44.5	-174.4	-175.3	-104.9	0	0	0	113	V137 S143 V144 C145 L234 L238 L241 L275 M279 V293 A297	V137-F141 WeakPolarHBondContact O-CB 3.41Å; V137-F141 PolarHBondContact O-N 3.37Å; F141-S143 VanDerWaalsContact C-N 3.34Å; F141-S143 PolarHBondContact O-N 3.01Å; F141-V144 PolarHBondContact O-N 2.64Å; F141-C145 WeakPolarHBondContact CE1-SG 3.32Å; F141-C145 WeakPolarHBondContact CZ-SG 3.28Å; F141-C145 PolarHBondContact O-N 3.31Å; F141-C145 PolarHBondContact O-SG 3.18Å; F141-L234 HydrophobicContact CE2-CB 4.03Å; F141-L234 HydrophobicContact CE2-CD2 4.12Å; F141-L234 HydrophobicContact CZ-CB 4.29Å; F141-L238 HydrophobicContact CB-CD1 4.1Å; F141-L238 HydrophobicContact CD1-CD1 4.37Å; F141-L238 HydrophobicContact CD1-CD2 4.3Å; F141-L238 HydrophobicContact CD2-CB 3.84Å; F141-L238 HydrophobicContact CD2-CD1 3.99Å; F141-L238 HydrophobicContact CD2-CD2 4.44Å; F141-L238 HydrophobicContact CD2-CG 4.3Å; F141-L238 HydrophobicContact CE1-CD2 4.17Å; F141-L238 HydrophobicContact CE2-CB 3.79Å; F141-L238 HydrophobicContact CE2-CD2 4.31Å; F141-L238 HydrophobicContact CE2-CG 4.45Å; F141-L238 HydrophobicContact CG-CD1 3.87Å; F141-L238 HydrophobicContact CG-CD2 4.45Å; F141-L238 HydrophobicContact CZ-CB 4.43Å; F141-L238 HydrophobicContact CZ-CD2 4.19Å; F141-L241 HydrophobicContact CB-CD1 4.39Å; F141-L275 HydrophobicContact CD1-CD2 4.41Å; F141-L275 HydrophobicContact CE1-CD2 4.03Å; F141-M279 HydrophobicContact CE1-CE 4.14Å; F141-M279 HydrophobicContact CE2-CE 3.97Å; F141-M279 HydrophobicContact CE2-SD 4.35Å; F141-M279 HydrophobicContact CZ-CE 3.39Å; F141-M279 HydrophobicContact CZ-SD 3.68Å; F141-V293 HydrophobicContact CE1-CG1 3.93Å; F141-V293 HydrophobicContact CZ-CG1 3.81Å; F141-A297 HydrophobicContact CD1-CB 3.89Å; F141-A297 HydrophobicContact CE1-CB 3.93Å
142	C	97.8	Very high	97	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.1	-36.1	177.8	-64.2	0	0	0	0	112.2	L138 I140 C145 F146 A297	L138-C142 VanDerWaalsContact O-CB 3.26Å; L138-C142 WeakPolarHBondContact O-CB 3.47Å; L138-C142 PolarHBondContact O-N 2.98Å; L138-C142 PolarHBondContact O-SG 3.07Å; I140-C142 PolarHBondContact O-N 3.21Å; C142-C145 WeakPolarHBondContact O-CB 3.24Å; C142-C145 PolarHBondContact O-N 3.11Å; C142-F146 VanDerWaalsContact O-CD1 3.26Å; C142-F146 WeakPolarHBondContact O-CD1 3.49Å; C142-F146 WeakPolarHBondContact O-CG 3.16Å; C142-F146 PolarHBondContact O-N 2.95Å; C142-A297 VanDerWaalsContact SG-CB 3.58Å
143	S	98	Very high	97.1	Very high	16 Å²	16	23.8 Å²	23.8	11%	0.112	12%	0.119	C	C	.	.	H	α-helix	trans	-62.4	-44.4	175.4	-62.6	0	0	0	0	111.5	N88 N139 I140 F141 C145 F146 A147	N88-S143 VanDerWaalsContact CB-O 3.22Å; N88-S143 WeakPolarHBondContact CB-O 3.44Å; N88-S143 WeakPolarHBondContact ND2-CB 3.49Å; N139-S143 WeakPolarHBondContact O-CB 3.26Å; N139-S143 PolarHBondContact O-N 3.1Å; N139-S143 VanDerWaalsContact O-N 3.12Å; N139-S143 PolarHBondContact O-OG 3.22Å; I140-S143 WeakPolarHBondContact O-CB 3.49Å; I140-S143 PolarHBondContact O-N 3.34Å; F141-S143 VanDerWaalsContact C-N 3.34Å; F141-S143 PolarHBondContact O-N 3.01Å; S143-C145 VanDerWaalsContact C-N 3.33Å; S143-C145 PolarHBondContact O-N 3.47Å; S143-F146 PolarHBondContact O-N 3.27Å; S143-A147 PolarHBondContact O-N 3.24Å; S143-A147 VanDerWaalsContact O-N 3.13Å
144	V	98.6	Very high	97.1	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-63.6	-39.9	173.1	-179.6	0	0	0	0	110.8	I140 F141 F146 A147 V148 V168 L234 M237	I140-V144 WeakPolarHBondContact O-CG2 3.33Å; I140-V144 PolarHBondContact O-N 2.61Å; I140-V144 VanDerWaalsContact O-N 3.07Å; F141-V144 PolarHBondContact O-N 2.64Å; V144-F146 VanDerWaalsContact C-N 3.31Å; V144-F146 PolarHBondContact O-N 2.63Å; V144-A147 WeakPolarHBondContact O-CB 3.38Å; V144-A147 PolarHBondContact O-N 3.5Å; V144-V148 HydrophobicContact CG1-CG2 4.21Å; V144-V148 WeakPolarHBondContact O-CG2 3.23Å; V144-V148 PolarHBondContact O-N 3.47Å; V144-V168 HydrophobicContact CG2-CB 4.49Å; V144-V168 HydrophobicContact CG2-CG1 3.85Å; V144-V168 HydrophobicContact CG2-CG2 3.74Å; V144-L234 HydrophobicContact CG1-CD2 3.71Å; V144-M237 HydrophobicContact CB-SD 4.41Å; V144-M237 HydrophobicContact CG1-CE 4.07Å; V144-M237 HydrophobicContact CG1-SD 3.98Å; V144-M237 HydrophobicContact CG2-SD 4.2Å
145	C	98.7	Very high	97.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-38.1	175.6	-68.6	0	0	0	0	112.7	F141 C142 S143 V148 A149 I290 T294	F141-C145 WeakPolarHBondContact CE1-SG 3.32Å; F141-C145 WeakPolarHBondContact CZ-SG 3.28Å; F141-C145 PolarHBondContact O-N 3.31Å; F141-C145 PolarHBondContact O-SG 3.18Å; C142-C145 WeakPolarHBondContact O-CB 3.24Å; C142-C145 PolarHBondContact O-N 3.11Å; S143-C145 VanDerWaalsContact C-N 3.33Å; S143-C145 PolarHBondContact O-N 3.47Å; C145-V148 PolarHBondContact O-N 2.82Å; C145-A149 VanDerWaalsContact O-CB 3.31Å; C145-A149 WeakPolarHBondContact O-CB 3.26Å; C145-A149 PolarHBondContact O-N 2.9Å; C145-I290 HydrophobicContact CB-CD1 4.23Å; C145-T294 HydrophobicContact CB-CG2 4.25Å
146	F	98.3	Very high	97.2	Very high	33 Å²	33	31.8 Å²	31.8	15%	0.145	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-42.4	175.1	-60.3	-15.2	0	0	0	111.6	N88 C142 S143 V144 A149 R150 T294 P306 V307	N88-F146 WeakPolarHBondContact OD1-CB 3.31Å; C142-F146 VanDerWaalsContact O-CD1 3.26Å; C142-F146 WeakPolarHBondContact O-CD1 3.49Å; C142-F146 WeakPolarHBondContact O-CG 3.16Å; C142-F146 PolarHBondContact O-N 2.95Å; S143-F146 PolarHBondContact O-N 3.27Å; V144-F146 VanDerWaalsContact C-N 3.31Å; V144-F146 PolarHBondContact O-N 2.63Å; F146-A149 PolarHBondContact O-N 2.6Å; F146-R150 PolarHBondContact O-N 2.99Å; F146-T294 HydrophobicContact CD1-CG2 3.7Å; F146-T294 HydrophobicContact CE1-CG2 3.49Å; F146-T294 VanDerWaalsContact CE1-CG2 3.49Å; F146-P306 HydrophobicContact CD1-CG 4.02Å; F146-P306 HydrophobicContact CE1-CG 3.42Å; F146-P306 VanDerWaalsContact CE1-CG 3.42Å; F146-P306 HydrophobicContact CE2-CG 4Å; F146-P306 HydrophobicContact CZ-CG 3.38Å; F146-V307 HydrophobicContact CD1-CG2 4.05Å
147	A	98.5	Very high	97.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.7	-47.8	173.3	0	0	0	0	0	112	N88 I89 S143 V144 A149 R150 L151 L178	N88-A147 HydrophobicContact CB-CB 3.98Å; N88-A147 VanDerWaalsContact O-CB 3.24Å; N88-A147 WeakPolarHBondContact O-CB 3.06Å; I89-A147 HydrophobicContact CD1-CB 4.44Å; I89-A147 HydrophobicContact CG1-CB 3.83Å; S143-A147 PolarHBondContact O-N 3.24Å; S143-A147 VanDerWaalsContact O-N 3.13Å; V144-A147 WeakPolarHBondContact O-CB 3.38Å; V144-A147 PolarHBondContact O-N 3.5Å; A147-A149 PolarHBondContact O-N 3.36Å; A147-R150 WeakPolarHBondContact O-CB 3.4Å; A147-R150 PolarHBondContact O-N 2.96Å; A147-L151 WeakPolarHBondContact O-CG 3.1Å; A147-L151 PolarHBondContact O-N 3.34Å; A147-L178 HydrophobicContact CB-CB 3.79Å; A147-L178 HydrophobicContact CB-CD2 3.89Å
148	V	98.7	Very high	97.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.9	-35.6	179	176.4	0	0	0	0	111.6	V144 C145 R150 L151 H152 L163 L178 L234 I290	V144-V148 HydrophobicContact CG1-CG2 4.21Å; V144-V148 WeakPolarHBondContact O-CG2 3.23Å; V144-V148 PolarHBondContact O-N 3.47Å; C145-V148 PolarHBondContact O-N 2.82Å; V148-R150 VanDerWaalsContact C-N 3.33Å; V148-R150 PolarHBondContact O-N 3.48Å; V148-L151 WeakPolarHBondContact O-CB 3.46Å; V148-L151 PolarHBondContact O-N 3.1Å; V148-L151 VanDerWaalsContact O-N 3.12Å; V148-H152 WeakPolarHBondContact CG1-CE1 3.45Å; V148-H152 WeakPolarHBondContact CG1-NE2 3.27Å; V148-H152 WeakPolarHBondContact O-CB 3.49Å; V148-H152 PolarHBondContact O-N 3.48Å; V148-L163 HydrophobicContact CG2-CD1 3.7Å; V148-L163 HydrophobicContact CG2-CD2 3.91Å; V148-L163 HydrophobicContact CG2-CG 4.5Å; V148-L178 HydrophobicContact CG2-CD2 4.31Å; V148-L234 HydrophobicContact CB-CD1 4.48Å; V148-L234 HydrophobicContact CG1-CD1 4.24Å; V148-L234 HydrophobicContact CG2-CD1 4.48Å; V148-L234 HydrophobicContact CG2-CD2 4.36Å; V148-I290 HydrophobicContact CB-CD1 3.99Å; V148-I290 HydrophobicContact CB-CG1 4.34Å; V148-I290 HydrophobicContact CG1-CD1 3.79Å; V148-I290 HydrophobicContact CG1-CG1 4.05Å
149	A	98.4	Very high	97.5	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-45.2	172.9	0	0	0	0	0	111	C145 F146 A147 L151 H152 Q153 I290 V307	C145-A149 VanDerWaalsContact O-CB 3.31Å; C145-A149 WeakPolarHBondContact O-CB 3.26Å; C145-A149 PolarHBondContact O-N 2.9Å; F146-A149 PolarHBondContact O-N 2.6Å; A147-A149 PolarHBondContact O-N 3.36Å; A149-L151 PolarHBondContact O-N 3.34Å; A149-H152 PolarHBondContact O-N 3.34Å; A149-Q153 WeakPolarHBondContact O-CB 3.36Å; A149-Q153 VanDerWaalsContact O-CG 3.3Å; A149-Q153 WeakPolarHBondContact O-CG 3.39Å; A149-Q153 PolarHBondContact O-N 3.23Å; A149-I290 HydrophobicContact CB-CG1 3.87Å; A149-I290 HydrophobicContact CB-CG2 4.3Å; A149-V307 HydrophobicContact CB-CB 4.33Å; A149-V307 HydrophobicContact CB-CG1 3.75Å; A149-V307 HydrophobicContact CB-CG2 3.54Å
150	R	97.9	Very high	97.6	Very high	103 Å²	103	30.5 Å²	30.5	39%	0.389	14%	0.143	S	C	.	.	H	α-helix	trans	-61.1	-25.4	176.3	-179.6	57.4	177.5	162.2	-1.2	113.5	L83 H86 I89 F146 A147 V148 R154	L83-R150 HydrophobicContact CD2-CG 3.86Å; L83-R150 PolarHBondContact O-NE 3.05Å; L83-R150 PolarHBondContact O-NH2 3.49Å; H86-R150 HydrophobicContact CB-CG 4.44Å; I89-R150 HydrophobicContact CD1-CB 3.97Å; I89-R150 HydrophobicContact CD1-CG 3.73Å; F146-R150 PolarHBondContact O-N 2.99Å; A147-R150 WeakPolarHBondContact O-CB 3.4Å; A147-R150 PolarHBondContact O-N 2.96Å; V148-R150 VanDerWaalsContact C-N 3.33Å; V148-R150 PolarHBondContact O-N 3.48Å; R150-R154 WeakPolarHBondContact O-CG 3.26Å
151	L	98.3	Very high	97.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-80.1	-51.4	172.4	-60.6	171.8	0	0	0	112.5	L83 A147 V148 A149 Q153 I158 H160 L178 F181	L83-L151 HydrophobicContact CD1-CD2 3.57Å; L83-L151 HydrophobicContact CD2-CD2 3.77Å; L83-L151 HydrophobicContact CG-CD2 4.32Å; A147-L151 WeakPolarHBondContact O-CG 3.1Å; A147-L151 PolarHBondContact O-N 3.34Å; V148-L151 WeakPolarHBondContact O-CB 3.46Å; V148-L151 PolarHBondContact O-N 3.1Å; V148-L151 VanDerWaalsContact O-N 3.12Å; A149-L151 PolarHBondContact O-N 3.34Å; L151-Q153 VanDerWaalsContact C-N 3.34Å; L151-Q153 PolarHBondContact O-N 2.76Å; L151-I158 HydrophobicContact CB-CB 4.12Å; L151-I158 HydrophobicContact CD2-CB 4.2Å; L151-I158 HydrophobicContact CD2-CD1 4.23Å; L151-I158 HydrophobicContact CD2-CG2 4.06Å; L151-I158 PolarHBondContact O-N 3.21Å; L151-H160 HydrophobicContact CD1-CB 4.11Å; L151-L178 HydrophobicContact CD1-CD2 4.18Å; L151-F181 HydrophobicContact CD1-CE1 3.96Å; L151-F181 HydrophobicContact CD2-CD1 4.33Å; L151-F181 HydrophobicContact CD2-CE1 3.74Å; L151-F181 HydrophobicContact CG-CE1 4.41Å
152	H	98.2	Very high	97.6	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.028	15%	0.148	C	C	.	.	H	α-helix	trans	-72.8	-25.6	-172.8	-71.3	-169	0	0	0	113.5	V148 A149 I158 T227 D230 I290	V148-H152 WeakPolarHBondContact CG1-CE1 3.45Å; V148-H152 WeakPolarHBondContact CG1-NE2 3.27Å; V148-H152 WeakPolarHBondContact O-CB 3.49Å; V148-H152 PolarHBondContact O-N 3.48Å; A149-H152 PolarHBondContact O-N 3.34Å; H152-I158 PolarHBondContact CD2-O 2.97Å; H152-I158 VanDerWaalsContact CD2-O 3.26Å; H152-T227 HydrophobicContact CB-CG2 4.2Å; H152-T227 PolarHBondContact CE1-O 3.07Å; H152-T227 VanDerWaalsContact CE1-O 3.25Å; H152-D230 IonicContact CD2-OD2 3.89Å; H152-D230 IonicContact CE1-OD2 3.62Å; H152-D230 IonicContact NE2-OD2 3.83Å; H152-D230 PolarHBondContact NE2-OD2 3.17Å; H152-I290 HydrophobicContact CB-CG2 3.97Å
153	Q	96.7	Very high	97.6	Very high	36 Å²	36	31.7 Å²	31.7	17%	0.168	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	12.6	-174.7	-64	-168.9	-23.8	0	0	114	A149 L151 I290 P308 L310	A149-Q153 WeakPolarHBondContact O-CB 3.36Å; A149-Q153 VanDerWaalsContact O-CG 3.3Å; A149-Q153 WeakPolarHBondContact O-CG 3.39Å; A149-Q153 PolarHBondContact O-N 3.23Å; L151-Q153 VanDerWaalsContact C-N 3.34Å; L151-Q153 PolarHBondContact O-N 2.76Å; Q153-I290 HydrophobicContact CG-CG2 4.37Å; Q153-P308 PolarHBondContact NE2-O 3.21Å; Q153-L310 HydrophobicContact CB-CD1 3.63Å; Q153-L310 HydrophobicContact CG-CD1 3.96Å; Q153-L310 HydrophobicContact CG-CG 4.44Å
154	R	95.2	Very high	97.6	Very high	76 Å²	76	32.6 Å²	32.6	29%	0.287	15%	0.15	S	C	.	.	S	Bend	trans	-72	156	167.2	-62.9	-165.6	73.2	114.5	2.8	110.6	T82 R150 L156	T82-R154 VanDerWaalsContact C-NH1 3.34Å; T82-R154 PolarHBondContact O-NH1 2.97Å; R150-R154 WeakPolarHBondContact O-CG 3.26Å; R154-L156 WeakPolarHBondContact CB-O 3.31Å; R154-L156 PolarHBondContact O-N 3.24Å
155	Q	93	Very high	97.5	Very high	206 Å²	206	32.5 Å²	32.5	96%	0.963	15%	0.15	S	C	*	.	S	Bend	trans	-54.4	-35.8	173.6	-174.1	-179.9	19	0	0	112.6
156	L	94.8	Very high	97.3	Very high	109 Å²	109	35.7 Å²	35.7	57%	0.571	16%	0.164	S	C	*	.	S	Bend	trans	-111.4	101.1	164	-175.3	64.7	0	0	0	107.6	R154 T186	R154-L156 WeakPolarHBondContact CB-O 3.31Å; R154-L156 PolarHBondContact O-N 3.24Å; L156-T186 HydrophobicContact CD2-CG2 3.78Å; L156-T186 HydrophobicContact CG-CG2 3.9Å
157	P	97.4	Very high	97.3	Very high	40 Å²	40	34.7 Å²	34.7	26%	0.26	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-59.5	138.5	-176.4	-27.7	36.4	0	0	0	112.8	T227	P157-T227 HydrophobicContact CB-CG2 3.93Å
158	I	98.2	Very high	97.2	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-101.4	127.7	174.9	-61.6	164	0	0	0	108.5	I79 L151 H152 T186	I79-I158 HydrophobicContact CD1-CD1 4.4Å; I79-I158 HydrophobicContact CD1-CG2 3.88Å; I79-I158 HydrophobicContact CG1-CD1 3.99Å; I79-I158 HydrophobicContact CG2-CD1 4.09Å; L151-I158 HydrophobicContact CB-CB 4.12Å; L151-I158 HydrophobicContact CD2-CB 4.2Å; L151-I158 HydrophobicContact CD2-CD1 4.23Å; L151-I158 HydrophobicContact CD2-CG2 4.06Å; L151-I158 PolarHBondContact O-N 3.21Å; H152-I158 PolarHBondContact CD2-O 2.97Å; H152-I158 VanDerWaalsContact CD2-O 3.26Å; I158-T186 HydrophobicContact CG1-CG2 3.94Å
159	I	98.3	Very high	97.2	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-96.5	124	171	-45.3	172.2	0	0	0	107.4	R161 S184 T185 T227 D230	I159-R161 HydrophobicContact CB-CG 4.16Å; I159-R161 HydrophobicContact CG2-CG 3.63Å; I159-S184 CarbonylContact O-C 3.22Å; I159-S184 VanDerWaalsContact O-CA 3.26Å; I159-S184 WeakPolarHBondContact O-CA 3.3Å; I159-T185 HydrophobicContact CB-CG2 4.19Å; I159-T185 HydrophobicContact CD1-CG2 4.43Å; I159-T185 PolarHBondContact N-O 3.27Å; I159-T185 PolarHBondContact O-N 2.98Å; I159-T227 HydrophobicContact CG1-CG2 4.04Å; I159-D230 WeakPolarHBondContact CA-OD2 3.38Å
160	H	98.4	Very high	97.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.171	C	C	.	.			trans	-76.2	-36.1	-176.5	-168.1	-77.2	0	0	0	112.7	L151 D162 L163 D180 F181 S183 D230	L151-H160 HydrophobicContact CD1-CB 4.11Å; H160-D162 PolarHBondContact O-N 3.43Å; H160-L163 HydrophobicContact CB-CD2 3.86Å; H160-L163 HydrophobicContact CB-CG 3.9Å; H160-D180 PolarHBondContact CE1-O 3.09Å; H160-D180 VanDerWaalsContact CE1-O 3.31Å; H160-D180 PolarHBondContact NE2-O 2.86Å; H160-F181 AromaticContact CD2-CD1 3.78Å; H160-F181 AromaticContact CD2-CE1 3.67Å; H160-F181 AromaticContact NE2-CD1 3.94Å; H160-F181 AromaticContact NE2-CE1 3.91Å; H160-S183 CarbonylContact O-C 3.49Å; H160-D230 PolarHBondContact N-OD1 2.97Å; H160-D230 PolarHBondContact N-OD2 3.22Å
161	R	97.8	Very high	97.1	Very high	19 Å²	19	33 Å²	33	7%	0.072	16%	0.159	C	C	.	.	S	Bend	trans	64.8	-20.4	176.1	-60.8	-163.8	-61.6	-171	-3.1	117.7	I159 S183 T185 E202 T207 M216 D230	I159-R161 HydrophobicContact CB-CG 4.16Å; I159-R161 HydrophobicContact CG2-CG 3.63Å; R161-S183 VanDerWaalsContact CZ-O 3.23Å; R161-S183 PolarHBondContact NE-O 3.32Å; R161-S183 PolarHBondContact NH2-O 3.05Å; R161-T185 HydrophobicContact CG-CG2 4.3Å; R161-E202 IonicContact CZ-OE1 2.82Å; R161-E202 IonicContact NH1-OE1 2.9Å; R161-E202 PolarHBondContact NH1-OE1 3.39Å; R161-E202 IonicContact NH2-OE1 3.57Å; R161-T207 HydrophobicContact CB-CG2 4.12Å; R161-M216 HydrophobicContact CG-CE 4.49Å; R161-D230 PolarHBondContact N-OD1 3.39Å
162	D	97.5	Very high	96.8	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.053	19%	0.188	C	C	.	.			trans	-128.9	48.7	177.3	-156.8	37.9	0	0	0	112.9	H160 K164 N167 T208	H160-D162 PolarHBondContact O-N 3.43Å; D162-K164 PolarHBondContact O-N 2.86Å; D162-K164 IonicContact OD1-NZ 3.64Å; D162-K164 WeakPolarHBondContact OD2-CE 3.37Å; D162-K164 IonicContact OD2-NZ 2.73Å; D162-K164 PolarHBondContact OD2-NZ 2.73Å; D162-N167 PolarHBondContact O-ND2 2.9Å; D162-N167 VanDerWaalsContact O-ND2 3.11Å; D162-T208 WeakPolarHBondContact OD1-CB 3.36Å; D162-T208 PolarHBondContact OD1-N 3.38Å; D162-T208 PolarHBondContact OD1-OG1 3.14Å
163	L	98.4	Very high	96.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.			trans	-73.1	116.6	173.2	-67.9	177.8	0	0	0	110.7	V148 H160 L178 Y211 D230 A233 L234 M237	V148-L163 HydrophobicContact CG2-CD1 3.7Å; V148-L163 HydrophobicContact CG2-CD2 3.91Å; V148-L163 HydrophobicContact CG2-CG 4.5Å; H160-L163 HydrophobicContact CB-CD2 3.86Å; H160-L163 HydrophobicContact CB-CG 3.9Å; L163-L178 HydrophobicContact CD2-CD1 3.75Å; L163-L178 HydrophobicContact CD2-CD2 3.85Å; L163-L178 HydrophobicContact CD2-CG 4.46Å; L163-Y211 WeakPolarHBondContact O-CD1 3.42Å; L163-Y211 WeakPolarHBondContact O-CE1 3.22Å; L163-D230 HydrophobicContact CD1-CB 3.63Å; L163-A233 HydrophobicContact CB-CB 3.95Å; L163-L234 HydrophobicContact CD1-CD2 4.1Å; L163-L234 HydrophobicContact CD1-CG 3.99Å; L163-M237 HydrophobicContact CB-CE 4.01Å
164	K	97.3	Very high	96.4	Very high	34 Å²	34	42.3 Å²	42.3	15%	0.148	21%	0.208	C	C	.	.			trans	-156.9	160.8	-179.3	63	-170	-178.1	-155.6	0	110.8	D162 E166 N167 Y211	D162-K164 PolarHBondContact O-N 2.86Å; D162-K164 IonicContact OD1-NZ 3.64Å; D162-K164 WeakPolarHBondContact OD2-CE 3.37Å; D162-K164 IonicContact OD2-NZ 2.73Å; D162-K164 PolarHBondContact OD2-NZ 2.73Å; K164-E166 WeakPolarHBondContact CB-OE2 3.48Å; K164-E166 HydrophobicContact CD-CB 4.27Å; K164-E166 HydrophobicContact CG-CB 4.06Å; K164-E166 PolarHBondContact O-N 3.25Å; K164-N167 WeakPolarHBondContact CE-OD1 3.28Å; K164-N167 HydrophobicContact CG-CB 4.21Å; K164-N167 PolarHBondContact O-N 2.9Å; K164-Y211 HydrophobicContact CB-CD1 4.39Å; K164-Y211 HydrophobicContact CB-CD2 4.18Å; K164-Y211 HydrophobicContact CB-CE1 3.93Å; K164-Y211 HydrophobicContact CB-CE2 3.69Å
165	V	97	Very high	96.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-66.2	-23.3	-174.3	-59.8	0	0	0	0	113	V118 L119 M122 N167 V168 M237 K240 L241	V118-V165 HydrophobicContact CG1-CB 4.49Å; L119-V165 HydrophobicContact CD1-CG2 4.18Å; M122-V165 HydrophobicContact SD-CB 4.12Å; M122-V165 HydrophobicContact SD-CG1 4.23Å; M122-V165 HydrophobicContact SD-CG2 4.06Å; V165-N167 PolarHBondContact O-N 3.02Å; V165-V168 PolarHBondContact O-N 2.76Å; V165-M237 HydrophobicContact CG1-CG 3.71Å; V165-K240 HydrophobicContact CG1-CB 4.5Å; V165-K240 HydrophobicContact CG1-CD 4.2Å; V165-K240 HydrophobicContact CG2-CD 3.71Å; V165-L241 HydrophobicContact CG1-CD2 3.84Å; V165-L241 HydrophobicContact CG1-CG 4.07Å
166	E	94.7	Very high	96.7	Very high	66 Å²	66	30.7 Å²	30.7	31%	0.308	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-63.3	-26.5	173.3	-63.7	73.7	-176.5	0	0	112.4	L119 K164 K240	L119-E166 HydrophobicContact CD2-CG 4.21Å; K164-E166 WeakPolarHBondContact CB-OE2 3.48Å; K164-E166 HydrophobicContact CD-CB 4.27Å; K164-E166 HydrophobicContact CG-CB 4.06Å; K164-E166 PolarHBondContact O-N 3.25Å; E166-K240 VanDerWaalsContact CD-NZ 3.32Å; E166-K240 IonicContact OE1-NZ 3.76Å; E166-K240 PolarHBondContact OE1-NZ 3.32Å; E166-K240 IonicContact OE2-NZ 3.51Å; E166-K240 PolarHBondContact OE2-NZ 3.25Å
167	N	97.4	Very high	96.8	Very high	12 Å²	12	25.5 Å²	25.5	6%	0.064	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-98.9	19	-177.5	-68.9	10.7	0	0	0	112.3	D162 K164 V165 C179	D162-N167 PolarHBondContact O-ND2 2.9Å; D162-N167 VanDerWaalsContact O-ND2 3.11Å; K164-N167 WeakPolarHBondContact CE-OD1 3.28Å; K164-N167 HydrophobicContact CG-CB 4.21Å; K164-N167 PolarHBondContact O-N 2.9Å; V165-N167 PolarHBondContact O-N 3.02Å; N167-C179 PolarHBondContact O-N 2.8Å; N167-C179 PolarHBondContact O-SG 3.03Å; N167-C179 VanDerWaalsContact O-SG 3.36Å
168	V	98.4	Very high	96.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.4	176.6	-167.5	0	0	0	0	110.2	V118 V144 V165 C176 V177 M237	V118-V168 HydrophobicContact CB-CB 4.14Å; V118-V168 HydrophobicContact CB-CG1 4.44Å; V118-V168 HydrophobicContact CG2-CB 3.78Å; V118-V168 HydrophobicContact CG2-CG1 3.55Å; V118-V168 PolarHBondContact N-O 3.2Å; V144-V168 HydrophobicContact CG2-CB 4.49Å; V144-V168 HydrophobicContact CG2-CG1 3.85Å; V144-V168 HydrophobicContact CG2-CG2 3.74Å; V165-V168 PolarHBondContact O-N 2.76Å; V168-C176 HydrophobicContact CG1-CB 4.11Å; V168-V177 WeakPolarHBondContact CA-O 3.46Å; V168-M237 HydrophobicContact CG2-CE 4.25Å; V168-M237 HydrophobicContact CG2-SD 4.42Å
169	L	98.1	Very high	96.8	Very high	36 Å²	36	24.4 Å²	24.4	19%	0.188	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	163.5	177.7	-55.3	178.1	0	0	0	110.5	Y114 C176 V177 C179	Y114-L169 HydrophobicContact CD1-CB 4.48Å; Y114-L169 HydrophobicContact CD2-CB 4.48Å; Y114-L169 HydrophobicContact CD2-CD1 3.75Å; Y114-L169 HydrophobicContact CG-CB 4Å; Y114-L169 HydrophobicContact CG-CD1 4.06Å; L169-C176 CarbonylContact O-C 3.56Å; L169-C176 WeakPolarHBondContact O-CA 3.38Å; L169-V177 HydrophobicContact CB-CB 4.49Å; L169-V177 PolarHBondContact N-O 3.39Å; L169-V177 PolarHBondContact O-N 2.8Å; L169-C179 HydrophobicContact CD1-CB 3.85Å; L169-C179 HydrophobicContact CG-CB 4.24Å
170	I	97.8	Very high	96.7	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.041	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.9	177.6	-52.9	180	0	0	0	108.1	V116 V118 V121 M645	V116-I170 HydrophobicContact CB-CB 4.38Å; V116-I170 HydrophobicContact CG1-CD1 4.34Å; V116-I170 PolarHBondContact O-N 3.41Å; V118-I170 HydrophobicContact CG2-CD1 3.99Å; V118-I170 HydrophobicContact CG2-CG1 3.92Å; V121-I170 HydrophobicContact CG2-CD1 3.55Å; I170-M645 HydrophobicContact CD1-CE 4.37Å
171	D	95.2	Very high	96.6	Very high	25 Å²	25	26.7 Å²	26.7	13%	0.134	14%	0.138	C	C	.	.			trans	-85.8	169.2	177.7	-155.5	-11.3	0	0	0	111.7	K112 Y114 D173 G174 T175 V177	K112-D171 VanDerWaalsContact CE-OD1 3.26Å; K112-D171 WeakPolarHBondContact CE-OD1 3.14Å; K112-D171 IonicContact NZ-OD1 3.65Å; K112-D171 PolarHBondContact NZ-OD1 3.42Å; K112-D171 IonicContact NZ-OD2 3.87Å; K112-D171 PolarHBondContact NZ-OD2 3.22Å; Y114-D171 HydrophobicContact CD1-CB 3.76Å; Y114-D171 HydrophobicContact CE1-CB 3.77Å; Y114-D171 WeakPolarHBondContact CE1-OD2 3.3Å; D171-D173 WeakPolarHBondContact CB-OD1 3.36Å; D171-D173 PolarHBondContact O-N 2.82Å; D171-G174 PolarHBondContact O-N 2.92Å; D171-T175 PolarHBondContact N-O 3.39Å; D171-V177 HydrophobicContact CB-CG2 4.43Å
172	E	92.9	Very high	96.5	Very high	132 Å²	132	26.4 Å²	26.4	62%	0.617	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.1	-173.1	-65.4	173.6	167.4	0	0	113	G174	E172-G174 VanDerWaalsContact C-N 3.32Å
173	D	93.4	Very high	96.4	Very high	96 Å²	96	26.7 Å²	26.7	51%	0.513	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-2.9	173.8	70.1	-21.3	0	0	0	113.8	D171 T175	D171-D173 WeakPolarHBondContact CB-OD1 3.36Å; D171-D173 PolarHBondContact O-N 2.82Å; D173-T175 VanDerWaalsContact CG-OG1 3.24Å; D173-T175 WeakPolarHBondContact OD1-CB 3.5Å; D173-T175 PolarHBondContact OD1-N 2.98Å; D173-T175 PolarHBondContact OD1-OG1 2.88Å; D173-T175 WeakPolarHBondContact OD2-CB 3.42Å; D173-T175 PolarHBondContact OD2-OG1 2.88Å
174	G	92.9	Very high	96.4	Very high	11 Å²	11	27 Å²	27	11%	0.113	15%	0.146	C	C	.	.	S	Bend	trans	87.1	-0.5	-173.1	0	0	0	0	0	114.9	D171 E172 C176	D171-G174 PolarHBondContact O-N 2.92Å; E172-G174 VanDerWaalsContact C-N 3.32Å; G174-C176 PolarHBondContact O-N 3.38Å
175	T	95.5	Very high	96.4	Very high	35 Å²	35	25.7 Å²	25.7	22%	0.215	14%	0.141	C	C	.	.			trans	-65.5	128.6	178.1	-68.2	0	0	0	0	110.4	P87 N88 D171 D173 V177	P87-T175 WeakPolarHBondContact O-CG2 3.45Å; N88-T175 WeakPolarHBondContact ND2-CG2 3.38Å; D171-T175 PolarHBondContact N-O 3.39Å; D173-T175 VanDerWaalsContact CG-OG1 3.24Å; D173-T175 WeakPolarHBondContact OD1-CB 3.5Å; D173-T175 PolarHBondContact OD1-N 2.98Å; D173-T175 PolarHBondContact OD1-OG1 2.88Å; D173-T175 WeakPolarHBondContact OD2-CB 3.42Å; D173-T175 PolarHBondContact OD2-OG1 2.88Å; T175-V177 HydrophobicContact CG2-CG2 4.34Å
176	C	98.3	Very high	96.3	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.02	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	136.5	177.3	-66.8	0	0	0	0	110.9	N88 V168 L169 G174	N88-C176 WeakPolarHBondContact CB-O 3.13Å; N88-C176 PolarHBondContact ND2-O 2.87Å; V168-C176 HydrophobicContact CG1-CB 4.11Å; L169-C176 CarbonylContact O-C 3.56Å; L169-C176 WeakPolarHBondContact O-CA 3.38Å; G174-C176 PolarHBondContact O-N 3.38Å
177	V	98.3	Very high	96.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125.9	-166.2	-178.4	0	0	0	0	110.7	V90 Y114 V168 L169 D171 T175	V90-V177 HydrophobicContact CB-CG1 4.28Å; V90-V177 VanDerWaalsContact N-CG1 3.27Å; Y114-V177 HydrophobicContact CD1-CG2 4.3Å; Y114-V177 HydrophobicContact CE1-CB 4.11Å; Y114-V177 HydrophobicContact CE1-CG1 4.12Å; Y114-V177 HydrophobicContact CE1-CG2 3.7Å; Y114-V177 HydrophobicContact CE2-CG1 4.47Å; V168-V177 WeakPolarHBondContact CA-O 3.46Å; L169-V177 HydrophobicContact CB-CB 4.49Å; L169-V177 PolarHBondContact N-O 3.39Å; L169-V177 PolarHBondContact O-N 2.8Å; D171-V177 HydrophobicContact CB-CG2 4.43Å; T175-V177 HydrophobicContact CG2-CG2 4.34Å
178	L	98.5	Very high	96.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.5	176.8	-176.4	64.7	0	0	0	111.2	N88 V90 A147 V148 L151 L163 F181	N88-L178 PolarHBondContact O-N 3.34Å; V90-L178 PolarHBondContact N-O 3.39Å; A147-L178 HydrophobicContact CB-CB 3.79Å; A147-L178 HydrophobicContact CB-CD2 3.89Å; V148-L178 HydrophobicContact CG2-CD2 4.31Å; L151-L178 HydrophobicContact CD1-CD2 4.18Å; L163-L178 HydrophobicContact CD2-CD1 3.75Å; L163-L178 HydrophobicContact CD2-CD2 3.85Å; L163-L178 HydrophobicContact CD2-CG 4.46Å; L178-F181 HydrophobicContact CD2-CE1 4.44Å; L178-F181 HydrophobicContact CD2-CZ 4.25Å; L178-F181 HydrophobicContact CG-CZ 4.21Å
179	C	97.1	Very high	96.1	Very high	20 Å²	20	33.1 Å²	33.1	14%	0.135	18%	0.179	C	C	.	.			trans	-132.1	178.4	178.1	74.2	0	0	0	0	112.8	V90 N167 L169	V90-C179 HydrophobicContact CB-CB 4.12Å; V90-C179 HydrophobicContact CG1-CB 4.4Å; V90-C179 HydrophobicContact CG2-CB 4.37Å; N167-C179 PolarHBondContact O-N 2.8Å; N167-C179 PolarHBondContact O-SG 3.03Å; N167-C179 VanDerWaalsContact O-SG 3.36Å; L169-C179 HydrophobicContact CD1-CB 3.85Å; L169-C179 HydrophobicContact CG-CB 4.24Å
180	D	95.3	Very high	95.9	Very high	51 Å²	51	32.3 Å²	32.3	27%	0.273	18%	0.177	S	C	.	.			trans	60.7	79.1	-180	-165.6	29.5	0	0	0	115.3	K60 H160 G182	K60-D180 IonicContact NZ-OD1 2.64Å; K60-D180 PolarHBondContact NZ-OD1 3.02Å; H160-D180 PolarHBondContact CE1-O 3.09Å; H160-D180 VanDerWaalsContact CE1-O 3.31Å; H160-D180 PolarHBondContact NE2-O 2.86Å; D180-G182 VanDerWaalsContact C-N 3.32Å
181	F	97.1	Very high	95.7	Very high	1 Å²	1	34.1 Å²	34.1	0%	0.004	19%	0.186	C	C	.	.			trans	-90.3	7.4	178.6	-63.9	-94.8	0	0	0	112.7	E76 I79 I80 L83 I89 V90 L151 H160 L178 S183 S184	E76-F181 HydrophobicContact CG-CB 4.1Å; E76-F181 PolarHBondContact OE1-N 3.4Å; I79-F181 HydrophobicContact CG2-CB 4.22Å; I79-F181 HydrophobicContact CG2-CD1 3.73Å; I79-F181 HydrophobicContact CG2-CE1 4.43Å; I79-F181 HydrophobicContact CG2-CG 4.12Å; I80-F181 HydrophobicContact CD1-CB 4.21Å; I80-F181 HydrophobicContact CD1-CD2 3.78Å; I80-F181 HydrophobicContact CD1-CG 4.34Å; I80-F181 HydrophobicContact CG1-CB 3.97Å; I80-F181 HydrophobicContact CG1-CD2 3.45Å; I80-F181 VanDerWaalsContact CG1-CD2 3.45Å; I80-F181 HydrophobicContact CG1-CE2 4.16Å; I80-F181 HydrophobicContact CG1-CG 3.83Å; L83-F181 HydrophobicContact CD1-CE1 4.09Å; L83-F181 HydrophobicContact CD1-CZ 4.38Å; I89-F181 HydrophobicContact CG1-CZ 4.47Å; I89-F181 HydrophobicContact CG2-CE2 4.11Å; I89-F181 HydrophobicContact CG2-CZ 3.88Å; V90-F181 HydrophobicContact CG1-CD2 4.39Å; V90-F181 HydrophobicContact CG1-CE2 4Å; L151-F181 HydrophobicContact CD1-CE1 3.96Å; L151-F181 HydrophobicContact CD2-CD1 4.33Å; L151-F181 HydrophobicContact CD2-CE1 3.74Å; L151-F181 HydrophobicContact CG-CE1 4.41Å; H160-F181 AromaticContact CD2-CD1 3.78Å; H160-F181 AromaticContact CD2-CE1 3.67Å; H160-F181 AromaticContact NE2-CD1 3.94Å; H160-F181 AromaticContact NE2-CE1 3.91Å; L178-F181 HydrophobicContact CD2-CE1 4.44Å; L178-F181 HydrophobicContact CD2-CZ 4.25Å; L178-F181 HydrophobicContact CG-CZ 4.21Å; F181-S183 PolarHBondContact O-N 3.26Å; F181-S183 VanDerWaalsContact O-N 3.07Å; F181-S184 VanDerWaalsContact O-CB 3.24Å; F181-S184 WeakPolarHBondContact O-CB 3.36Å; F181-S184 PolarHBondContact O-N 3.19Å; F181-S184 PolarHBondContact O-OG 3.01Å
182	G	95	Very high	95.6	Very high	14 Å²	14	37.3 Å²	37.3	14%	0.144	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.1	-179.3	0	0	0	0	0	115.5	E76 D180	E76-G182 VanDerWaalsContact CD-CA 3.45Å; E76-G182 PolarHBondContact OE1-N 3.28Å; E76-G182 VanDerWaalsContact OE2-CA 3.31Å; E76-G182 WeakPolarHBondContact OE2-CA 3.37Å; D180-G182 VanDerWaalsContact C-N 3.32Å
183	S	96.2	Very high	95.6	Very high	15 Å²	15	36.1 Å²	36.1	11%	0.105	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-6.3	173.4	-67.4	0	0	0	0	113.8	H160 R161 F181 F206	H160-S183 CarbonylContact O-C 3.49Å; R161-S183 VanDerWaalsContact CZ-O 3.23Å; R161-S183 PolarHBondContact NE-O 3.32Å; R161-S183 PolarHBondContact NH2-O 3.05Å; F181-S183 PolarHBondContact O-N 3.26Å; F181-S183 VanDerWaalsContact O-N 3.07Å; S183-F206 VanDerWaalsContact CB-O 3.3Å; S183-F206 WeakPolarHBondContact CB-O 3.32Å; S183-F206 PolarHBondContact OG-O 3.45Å
184	S	97.7	Very high	95.7	Very high	6 Å²	6	32.3 Å²	32.3	4%	0.042	20%	0.197	C	C	.	.			trans	-68	152.9	-173.7	-67.1	0	0	0	0	112.8	I159 F181	I159-S184 CarbonylContact O-C 3.22Å; I159-S184 VanDerWaalsContact O-CA 3.26Å; I159-S184 WeakPolarHBondContact O-CA 3.3Å; F181-S184 VanDerWaalsContact O-CB 3.24Å; F181-S184 WeakPolarHBondContact O-CB 3.36Å; F181-S184 PolarHBondContact O-N 3.19Å; F181-S184 PolarHBondContact O-OG 3.01Å
185	T	96.8	Very high	95.8	Very high	7 Å²	7	35.5 Å²	35.5	4%	0.043	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-149.5	153.1	177.1	-171.4	0	0	0	0	111.8	I159 R161 R187	I159-T185 HydrophobicContact CB-CG2 4.19Å; I159-T185 HydrophobicContact CD1-CG2 4.43Å; I159-T185 PolarHBondContact N-O 3.27Å; I159-T185 PolarHBondContact O-N 2.98Å; R161-T185 HydrophobicContact CG-CG2 4.3Å; T185-R187 WeakPolarHBondContact CG2-O 3.44Å; T185-R187 PolarHBondContact OG1-N 3.23Å
186	T	95.7	Very high	95.8	Very high	47 Å²	47	36.2 Å²	36.2	29%	0.288	22%	0.218	S	C	.	.	S	Bend	trans	-97.1	-6	166.3	51	0	0	0	0	112.5	L156 I158	L156-T186 HydrophobicContact CD2-CG2 3.78Å; L156-T186 HydrophobicContact CG-CG2 3.9Å; I158-T186 HydrophobicContact CG1-CG2 3.94Å
187	R	94.9	Very high	95.6	Very high	111 Å²	111	41.3 Å²	41.3	42%	0.419	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-84.7	128.5	-179.2	-59.7	-179	69.1	-131.7	-4.7	110.9	T185 D194 E202	T185-R187 WeakPolarHBondContact CG2-O 3.44Å; T185-R187 PolarHBondContact OG1-N 3.23Å; R187-D194 IonicContact CZ-OD1 3.24Å; R187-D194 IonicContact NH2-OD1 3.93Å; R187-D194 PolarHBondContact NH2-OD1 3.14Å; R187-E202 IonicContact NH1-OE2 2.64Å
188	V	95.8	Very high	95.4	Very high	72 Å²	72	42.8 Å²	42.8	44%	0.436	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-81.6	117.9	163.6	171.9	0	0	0	0	107.9	P224 I225 T226	V188-P224 HydrophobicContact CG1-CB 3.74Å; V188-I225 WeakPolarHBondContact CA-O 3.48Å; V188-T226 HydrophobicContact CG1-CG2 3.77Å; V188-T226 HydrophobicContact CG2-CG2 4.13Å
189	L	95.1	Very high	95.3	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-84.6	130.5	177	-58.3	176.5	0	0	0	109.7	I199 E202 P224 I225	L189-I199 HydrophobicContact CB-CG1 4.45Å; L189-I199 HydrophobicContact CB-CG2 4.33Å; L189-I199 HydrophobicContact CD1-CG2 4.42Å; L189-E202 HydrophobicContact CD1-CB 4.16Å; L189-E202 HydrophobicContact CD1-CG 4.19Å; L189-P224 WeakPolarHBondContact O-CA 3.24Å; L189-I225 HydrophobicContact CB-CB 4.31Å; L189-I225 HydrophobicContact CB-CD1 4.38Å; L189-I225 PolarHBondContact N-O 3.42Å; L189-I225 PolarHBondContact O-N 3.3Å
190	S	95.1	Very high	95.3	Very high	20 Å²	20	46.6 Å²	46.6	14%	0.14	27%	0.268	C	S	.	.			trans	-149	139.6	-178.6	-177.7	0	0	0	0	112.2	A192 T193 D194	S190-A192 PolarHBondContact O-N 3.02Å; S190-A192 PolarHBondContact OG-N 2.98Å; S190-T193 PolarHBondContact O-N 3.38Å; S190-T193 PolarHBondContact O-OG1 3.38Å; S190-D194 PolarHBondContact O-N 2.81Å
191	L	93.9	Very high	95.2	Very high	46 Å²	46	47.9 Å²	47.9	24%	0.241	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-3.5	171.1	-70.3	178.9	0	0	0	114	L196 I199 L219 R222	L191-L196 HydrophobicContact CD1-CD1 4.38Å; L191-L196 HydrophobicContact CD2-CB 3.58Å; L191-L196 HydrophobicContact CD2-CD1 4.04Å; L191-L196 HydrophobicContact CD2-CG 4.04Å; L191-I199 HydrophobicContact CD2-CD1 3.81Å; L191-I199 HydrophobicContact CG-CD1 4.16Å; L191-L219 HydrophobicContact CD1-CB 4.35Å; L191-L219 WeakPolarHBondContact CD1-O 3.37Å; L191-R222 HydrophobicContact CD1-CG 4.14Å
192	A	92.6	Very high	95.1	Very high	91 Å²	91	49.1 Å²	49.1	75%	0.752	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-22.4	169.6	0	0	0	0	0	113.2	S190	S190-A192 PolarHBondContact O-N 3.02Å; S190-A192 PolarHBondContact OG-N 2.98Å
193	T	93.2	Very high	95.1	Very high	107 Å²	107	48.8 Å²	48.8	66%	0.656	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.4	-29.3	-172.6	46.7	0	0	0	0	113.3	S190	S190-T193 PolarHBondContact O-N 3.38Å; S190-T193 PolarHBondContact O-OG1 3.38Å
194	D	94.2	Very high	95	Very high	17 Å²	17	51.3 Å²	51.3	9%	0.091	30%	0.295	C	S	.	.	S	Bend	trans	-126.1	142.5	-169.5	-59	-88.1	0	0	0	111	R187 S190 M198 I199	R187-D194 IonicContact CZ-OD1 3.24Å; R187-D194 IonicContact NH2-OD1 3.93Å; R187-D194 PolarHBondContact NH2-OD1 3.14Å; S190-D194 PolarHBondContact O-N 2.81Å; D194-M198 HydrophobicContact CB-CE 3.8Å; D194-M198 WeakPolarHBondContact OD1-CE 3.45Å; D194-I199 HydrophobicContact CB-CD1 3.97Å; D194-I199 HydrophobicContact CB-CG1 3.85Å
195	P	95.4	Very high	94.8	Very high	77 Å²	77	54.8 Å²	54.8	50%	0.5	31%	0.307	S	S	.	.			trans	-73.1	140.9	-179.7	31	-34.8	0	0	0	111.2	N197 M198 I199	P195-N197 VanDerWaalsContact C-N 3.3Å; P195-N197 PolarHBondContact O-N 2.91Å; P195-N197 VanDerWaalsContact O-N 3.16Å; P195-M198 HydrophobicContact CG-CB 3.89Å; P195-M198 WeakPolarHBondContact O-CB 3.44Å; P195-M198 PolarHBondContact O-N 2.81Å; P195-I199 PolarHBondContact O-N 3.45Å
196	L	95.2	Very high	94.7	Very high	51 Å²	51	55.7 Å²	55.7	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-51.3	-44.2	-170.9	-178.8	143.2	0	0	0	113.8	L191 M198 I199 E200 L219 Y220	L191-L196 HydrophobicContact CD1-CD1 4.38Å; L191-L196 HydrophobicContact CD2-CB 3.58Å; L191-L196 HydrophobicContact CD2-CD1 4.04Å; L191-L196 HydrophobicContact CD2-CG 4.04Å; L196-M198 VanDerWaalsContact C-N 3.29Å; L196-M198 PolarHBondContact O-N 2.92Å; L196-I199 PolarHBondContact O-N 2.92Å; L196-E200 VanDerWaalsContact CD2-CD 3.46Å; L196-E200 HydrophobicContact CD2-CG 4.06Å; L196-E200 WeakPolarHBondContact O-CG 3.29Å; L196-E200 PolarHBondContact O-N 3.37Å; L196-L219 HydrophobicContact CG-CD1 4.37Å; L196-Y220 HydrophobicContact CD1-CE1 4.33Å
197	N	95.1	Very high	94.7	Very high	110 Å²	110	54.1 Å²	54.1	59%	0.588	30%	0.301	S	S	*	.	H	α-helix	trans	-64	-30.9	179.7	64.4	-43.7	0	0	0	113.3	P195 E201	P195-N197 VanDerWaalsContact C-N 3.3Å; P195-N197 PolarHBondContact O-N 2.91Å; P195-N197 VanDerWaalsContact O-N 3.16Å; N197-E201 WeakPolarHBondContact O-CB 3.48Å; N197-E201 PolarHBondContact O-N 2.97Å; N197-E201 VanDerWaalsContact O-N 3.07Å
198	M	94.5	Very high	94.7	Very high	30 Å²	30	50.7 Å²	50.7	15%	0.148	29%	0.293	C	S	.	.	H	α-helix	trans	-72.5	-42.6	175.5	-173.6	-83.7	-94.3	0	0	110.5	D194 P195 L196 E201 E202	D194-M198 HydrophobicContact CB-CE 3.8Å; D194-M198 WeakPolarHBondContact OD1-CE 3.45Å; P195-M198 HydrophobicContact CG-CB 3.89Å; P195-M198 WeakPolarHBondContact O-CB 3.44Å; P195-M198 PolarHBondContact O-N 2.81Å; L196-M198 VanDerWaalsContact C-N 3.29Å; L196-M198 PolarHBondContact O-N 2.92Å; M198-E201 PolarHBondContact O-N 3.19Å; M198-E202 WeakPolarHBondContact O-CB 3.35Å; M198-E202 PolarHBondContact O-N 3.18Å
199	I	96	Very high	94.6	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-45.1	175.1	-56.2	-179	0	0	0	110.8	L189 L191 D194 P195 L196 E201 E202 I203 L219 I225	L189-I199 HydrophobicContact CB-CG1 4.45Å; L189-I199 HydrophobicContact CB-CG2 4.33Å; L189-I199 HydrophobicContact CD1-CG2 4.42Å; L191-I199 HydrophobicContact CD2-CD1 3.81Å; L191-I199 HydrophobicContact CG-CD1 4.16Å; D194-I199 HydrophobicContact CB-CD1 3.97Å; D194-I199 HydrophobicContact CB-CG1 3.85Å; P195-I199 PolarHBondContact O-N 3.45Å; L196-I199 PolarHBondContact O-N 2.92Å; I199-E201 PolarHBondContact O-N 3Å; I199-E202 PolarHBondContact O-N 3.23Å; I199-I203 HydrophobicContact CG2-CD1 3.67Å; I199-I203 HydrophobicContact CG2-CG1 4.34Å; I199-I203 WeakPolarHBondContact O-CB 3.43Å; I199-I203 VanDerWaalsContact O-CG1 3.26Å; I199-I203 WeakPolarHBondContact O-CG1 3.48Å; I199-I203 PolarHBondContact O-N 3.04Å; I199-L219 HydrophobicContact CB-CD1 4.31Å; I199-L219 HydrophobicContact CG2-CD1 3.97Å; I199-L219 HydrophobicContact CG2-CD2 3.83Å; I199-I225 HydrophobicContact CG2-CD1 4.05Å
200	E	95.7	Very high	94.7	Very high	98 Å²	98	50.6 Å²	50.6	46%	0.458	29%	0.29	S	S	.	.	H	α-helix	trans	-59.4	-44.7	175.5	-73.4	-175.2	152.1	0	0	112.3	L196 A204 L219	L196-E200 VanDerWaalsContact CD2-CD 3.46Å; L196-E200 HydrophobicContact CD2-CG 4.06Å; L196-E200 WeakPolarHBondContact O-CG 3.29Å; L196-E200 PolarHBondContact O-N 3.37Å; E200-A204 WeakPolarHBondContact O-CB 3.45Å; E200-A204 PolarHBondContact O-N 3.33Å; E200-L219 HydrophobicContact CG-CD1 3.47Å; E200-L219 VanDerWaalsContact CG-CD1 3.47Å
201	E	94.4	Very high	94.8	Very high	78 Å²	78	50.2 Å²	50.2	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-45.9	176.7	-166.7	-163.2	150	0	0	111.4	R68 N197 M198 I199 A204 R205	R68-E201 IonicContact CZ-OE2 3.8Å; R68-E201 IonicContact NH1-OE1 3.62Å; R68-E201 PolarHBondContact NH1-OE1 3.38Å; R68-E201 IonicContact NH1-OE2 2.71Å; R68-E201 PolarHBondContact NH1-OE2 2.9Å; N197-E201 WeakPolarHBondContact O-CB 3.48Å; N197-E201 PolarHBondContact O-N 2.97Å; N197-E201 VanDerWaalsContact O-N 3.07Å; M198-E201 PolarHBondContact O-N 3.19Å; I199-E201 PolarHBondContact O-N 3Å; E201-A204 PolarHBondContact O-N 3.28Å; E201-R205 WeakPolarHBondContact O-CB 3.4Å; E201-R205 PolarHBondContact O-N 3.29Å; E201-R205 IonicContact OE1-NH1 3.72Å
202	E	94.4	Very high	95	Very high	27 Å²	27	50.1 Å²	50.1	13%	0.126	28%	0.282	C	S	.	.	H	α-helix	trans	-66.7	-42.8	-177.4	-158.6	172.4	141.7	0	0	111.6	R161 R187 L189 M198 I199 R205 F206	R161-E202 IonicContact CZ-OE1 2.82Å; R161-E202 IonicContact NH1-OE1 2.9Å; R161-E202 PolarHBondContact NH1-OE1 3.39Å; R161-E202 IonicContact NH2-OE1 3.57Å; R187-E202 IonicContact NH1-OE2 2.64Å; L189-E202 HydrophobicContact CD1-CB 4.16Å; L189-E202 HydrophobicContact CD1-CG 4.19Å; M198-E202 WeakPolarHBondContact O-CB 3.35Å; M198-E202 PolarHBondContact O-N 3.18Å; I199-E202 PolarHBondContact O-N 3.23Å; E202-R205 PolarHBondContact O-N 3.39Å; E202-F206 HydrophobicContact CG-CD2 3.75Å; E202-F206 HydrophobicContact CG-CE2 4.11Å; E202-F206 WeakPolarHBondContact O-CD2 3.42Å; E202-F206 PolarHBondContact O-N 3.05Å
203	I	96.2	Very high	95.2	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-47.7	173.1	-66.5	166.1	0	0	0	110.7	I199 R205 T207 R212 M216 L219 I225	I199-I203 HydrophobicContact CG2-CD1 3.67Å; I199-I203 HydrophobicContact CG2-CG1 4.34Å; I199-I203 WeakPolarHBondContact O-CB 3.43Å; I199-I203 VanDerWaalsContact O-CG1 3.26Å; I199-I203 WeakPolarHBondContact O-CG1 3.48Å; I199-I203 PolarHBondContact O-N 3.04Å; I203-R205 PolarHBondContact O-N 3.34Å; I203-R205 VanDerWaalsContact O-N 3.16Å; I203-T207 PolarHBondContact O-N 3.04Å; I203-T207 PolarHBondContact O-OG1 3.35Å; I203-R212 PolarHBondContact O-NH2 3.46Å; I203-M216 HydrophobicContact CD1-CB 4.27Å; I203-M216 HydrophobicContact CD1-CG 4.42Å; I203-M216 HydrophobicContact CG2-CB 4.24Å; I203-L219 HydrophobicContact CD1-CD2 3.75Å; I203-I225 HydrophobicContact CD1-CD1 3.47Å; I203-I225 VanDerWaalsContact CD1-CD1 3.47Å; I203-I225 HydrophobicContact CG1-CD1 4.04Å
204	A	94.2	Very high	95.4	Very high	68 Å²	68	40.8 Å²	40.8	56%	0.562	22%	0.216	S	C	*	.	H	α-helix	trans	-59.9	-28.3	-178.5	0	0	0	0	0	112.5	E200 E201	E200-A204 WeakPolarHBondContact O-CB 3.45Å; E200-A204 PolarHBondContact O-N 3.33Å; E201-A204 PolarHBondContact O-N 3.28Å
205	R	92.8	Very high	95.6	Very high	78 Å²	78	40.1 Å²	40.1	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-89.7	-43.3	-175.8	-171.6	172.8	-157.4	150.9	8.9	114.7	E66 L69 E201 E202 I203	E66-R205 VanDerWaalsContact CD-NH1 3.34Å; E66-R205 IonicContact OE1-CZ 3.4Å; E66-R205 IonicContact OE1-NH1 3.62Å; E66-R205 PolarHBondContact OE1-NH1 3.05Å; E66-R205 IonicContact OE1-NH2 2.78Å; E66-R205 IonicContact OE2-CZ 3.42Å; E66-R205 IonicContact OE2-NH1 2.76Å; E66-R205 PolarHBondContact OE2-NH1 3.26Å; E66-R205 IonicContact OE2-NH2 3.18Å; E66-R205 PolarHBondContact OE2-NH2 2.92Å; L69-R205 VanDerWaalsContact CD1-NH2 3.33Å; E201-R205 WeakPolarHBondContact O-CB 3.4Å; E201-R205 PolarHBondContact O-N 3.29Å; E201-R205 IonicContact OE1-NH1 3.72Å; E202-R205 PolarHBondContact O-N 3.39Å; I203-R205 PolarHBondContact O-N 3.34Å; I203-R205 VanDerWaalsContact O-N 3.16Å
206	F	94.9	Very high	95.7	Very high	27 Å²	27	37.1 Å²	37.1	12%	0.118	19%	0.192	C	C	.	.	H	α-helix	trans	-110.6	14.9	-168.6	-62.3	-72.9	0	0	0	114.5	L69 A72 S183 E202	L69-F206 HydrophobicContact CD2-CE1 4.37Å; L69-F206 HydrophobicContact CD2-CZ 4.36Å; A72-F206 HydrophobicContact CB-CE1 3.96Å; A72-F206 HydrophobicContact CB-CZ 4.1Å; S183-F206 VanDerWaalsContact CB-O 3.3Å; S183-F206 WeakPolarHBondContact CB-O 3.32Å; S183-F206 PolarHBondContact OG-O 3.45Å; E202-F206 HydrophobicContact CG-CD2 3.75Å; E202-F206 HydrophobicContact CG-CE2 4.11Å; E202-F206 WeakPolarHBondContact O-CD2 3.42Å; E202-F206 PolarHBondContact O-N 3.05Å
207	T	95.8	Very high	95.7	Very high	14 Å²	14	36.3 Å²	36.3	9%	0.086	19%	0.189	C	C	.	.	S	Bend	trans	-140.5	138.3	179.7	70.3	0	0	0	0	113.2	R161 I203 R212 M216	R161-T207 HydrophobicContact CB-CG2 4.12Å; I203-T207 PolarHBondContact O-N 3.04Å; I203-T207 PolarHBondContact O-OG1 3.35Å; T207-R212 PolarHBondContact O-NH2 3.29Å; T207-R212 PolarHBondContact OG1-NE 3.41Å; T207-R212 PolarHBondContact OG1-NH2 3.21Å; T207-M216 HydrophobicContact CG2-CE 3.91Å; T207-M216 HydrophobicContact CG2-SD 4.1Å
208	T	93.7	Very high	95.7	Very high	39 Å²	39	33 Å²	33	24%	0.239	17%	0.171	C	C	.	.			trans	-75.1	122.8	171.1	-59.6	0	0	0	0	111.1	D162 S210 Y211 R212	D162-T208 WeakPolarHBondContact OD1-CB 3.36Å; D162-T208 PolarHBondContact OD1-N 3.38Å; D162-T208 PolarHBondContact OD1-OG1 3.14Å; T208-S210 VanDerWaalsContact C-N 3.35Å; T208-S210 PolarHBondContact O-N 3.05Å; T208-Y211 HydrophobicContact CG2-CD2 3.92Å; T208-Y211 PolarHBondContact O-N 3.27Å; T208-R212 PolarHBondContact O-N 3.15Å
209	L	94.5	Very high	95.7	Very high	62 Å²	62	32.4 Å²	32.4	33%	0.325	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-49.6	-48.4	-173.2	175.1	59.8	0	0	0	113.8	Y211 R212 D250	L209-Y211 PolarHBondContact O-N 3.08Å; L209-Y211 VanDerWaalsContact O-N 3.1Å; L209-R212 WeakPolarHBondContact O-CB 3.42Å; L209-R212 PolarHBondContact O-N 3.42Å; L209-D250 HydrophobicContact CD2-CB 3.95Å
210	S	96.3	Very high	95.5	Very high	12 Å²	12	40.2 Å²	40.2	8%	0.084	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-65.8	-12.9	-176	-20.6	0	0	0	0	114.2	T208 R249 D250	T208-S210 VanDerWaalsContact C-N 3.35Å; T208-S210 PolarHBondContact O-N 3.05Å; S210-R249 WeakPolarHBondContact CA-O 3.24Å; S210-R249 VanDerWaalsContact CB-O 3.27Å; S210-R249 WeakPolarHBondContact CB-O 3.48Å; S210-D250 PolarHBondContact OG-OD1 3.24Å
211	Y	97.9	Very high	95.1	Very high	12 Å²	12	39.6 Å²	39.6	5%	0.047	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-108.5	-3.9	177.6	-73.5	-95.7	0	0	0	113.2	L163 K164 T208 L209 A233 V236 M237 K240 L246	L163-Y211 WeakPolarHBondContact O-CD1 3.42Å; L163-Y211 WeakPolarHBondContact O-CE1 3.22Å; K164-Y211 HydrophobicContact CB-CD1 4.39Å; K164-Y211 HydrophobicContact CB-CD2 4.18Å; K164-Y211 HydrophobicContact CB-CE1 3.93Å; K164-Y211 HydrophobicContact CB-CE2 3.69Å; T208-Y211 HydrophobicContact CG2-CD2 3.92Å; T208-Y211 PolarHBondContact O-N 3.27Å; L209-Y211 PolarHBondContact O-N 3.08Å; L209-Y211 VanDerWaalsContact O-N 3.1Å; Y211-A233 HydrophobicContact CD1-CB 4.26Å; Y211-V236 HydrophobicContact CD1-CB 3.72Å; Y211-V236 HydrophobicContact CD1-CG1 3.44Å; Y211-V236 VanDerWaalsContact CD1-CG1 3.44Å; Y211-V236 HydrophobicContact CD2-CG1 4.4Å; Y211-V236 HydrophobicContact CE1-CB 3.96Å; Y211-V236 HydrophobicContact CE1-CG1 3.48Å; Y211-V236 VanDerWaalsContact CE1-CG1 3.48Å; Y211-V236 HydrophobicContact CE2-CG1 4.44Å; Y211-V236 HydrophobicContact CG-CB 4.49Å; Y211-V236 HydrophobicContact CG-CG1 3.94Å; Y211-M237 HydrophobicContact CE1-CB 4.26Å; Y211-K240 WeakPolarHBondContact OH-CD 3.49Å; Y211-L246 HydrophobicContact CD2-CD2 4.48Å; Y211-L246 HydrophobicContact CE2-CD2 3.82Å
212	R	97.8	Very high	95	Very high	44 Å²	44	44.8 Å²	44.8	17%	0.166	21%	0.214	C	C	.	.			trans	-63.5	138.9	178.4	-70.3	179.7	-169.1	166.5	5.1	110.7	I203 T207 T208 L209 M216 V217 W232 I255	I203-R212 PolarHBondContact O-NH2 3.46Å; T207-R212 PolarHBondContact O-NH2 3.29Å; T207-R212 PolarHBondContact OG1-NE 3.41Å; T207-R212 PolarHBondContact OG1-NH2 3.21Å; T208-R212 PolarHBondContact O-N 3.15Å; L209-R212 WeakPolarHBondContact O-CB 3.42Å; L209-R212 PolarHBondContact O-N 3.42Å; R212-M216 HydrophobicContact CB-CB 4Å; R212-M216 HydrophobicContact CB-SD 4.29Å; R212-M216 HydrophobicContact CG-CB 4.31Å; R212-M216 HydrophobicContact CG-SD 4.21Å; R212-V217 HydrophobicContact CB-CG2 3.72Å; R212-W232 PolarHBondContact O-NE1 2.83Å; R212-I255 VanDerWaalsContact O-CG2 3.28Å; R212-I255 WeakPolarHBondContact O-CG2 3.47Å
213	S	97.8	Very high	95	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.228	C	C	.	.			trans	-78.7	162.6	172.8	58.6	0	0	0	0	111.9	E215 M216 V217 S229 W232	S213-E215 VanDerWaalsContact CB-CD 3.46Å; S213-E215 WeakPolarHBondContact CB-OE1 3.45Å; S213-E215 PolarHBondContact O-N 3.28Å; S213-E215 PolarHBondContact OG-OE1 2.8Å; S213-E215 PolarHBondContact OG-OE2 3.49Å; S213-M216 WeakPolarHBondContact O-CA 3.49Å; S213-M216 WeakPolarHBondContact O-CB 3.33Å; S213-M216 PolarHBondContact O-N 3.26Å; S213-V217 PolarHBondContact O-N 2.91Å; S213-S229 WeakPolarHBondContact OG-CB 3.31Å; S213-W232 VanDerWaalsContact CA-CD1 3.46Å
214	P	97.5	Very high	95	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-53.4	-41.3	178.2	-28	36.2	0	0	0	112.9	M216 V217 D218 W232 I255	P214-M216 PolarHBondContact O-N 3.46Å; P214-V217 PolarHBondContact O-N 3.44Å; P214-D218 PolarHBondContact O-N 2.92Å; P214-W232 HydrophobicContact CG-CE3 4.18Å; P214-W232 HydrophobicContact CG-CH2 3.68Å; P214-W232 HydrophobicContact CG-CZ2 4.15Å; P214-W232 HydrophobicContact CG-CZ3 3.71Å; P214-I255 HydrophobicContact CG-CG2 4.41Å
215	E	97.3	Very high	95.1	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.019	22%	0.215	C	C	.	.	H	α-helix	trans	-69.1	-12	176.3	67.8	-80.8	178.8	0	0	115	S213 R223 I225 R287	S213-E215 VanDerWaalsContact CB-CD 3.46Å; S213-E215 WeakPolarHBondContact CB-OE1 3.45Å; S213-E215 PolarHBondContact O-N 3.28Å; S213-E215 PolarHBondContact OG-OE1 2.8Å; S213-E215 PolarHBondContact OG-OE2 3.49Å; E215-R223 HydrophobicContact CB-CB 3.79Å; E215-I225 HydrophobicContact CG-CG1 4.34Å; E215-R287 IonicContact OE1-CZ 3.83Å; E215-R287 IonicContact OE1-NH1 2.64Å; E215-R287 PolarHBondContact OE1-NH1 3.29Å; E215-R287 IonicContact OE1-NH2 2.63Å; E215-R287 IonicContact OE2-CZ 2.73Å; E215-R287 IonicContact OE2-NH1 2.84Å; E215-R287 PolarHBondContact OE2-NH1 2.73Å; E215-R287 IonicContact OE2-NH2 3.77Å; E215-R287 PolarHBondContact OE2-NH2 2.64Å
216	M	96.9	Very high	95.3	Very high	14 Å²	14	45.5 Å²	45.5	7%	0.069	21%	0.211	C	C	.	.	H	α-helix	trans	-93.4	-17.6	168.4	-71.4	177.5	163.7	0	0	113.2	R161 I203 T207 R212 S213 P214 I225	R161-M216 HydrophobicContact CG-CE 4.49Å; I203-M216 HydrophobicContact CD1-CB 4.27Å; I203-M216 HydrophobicContact CD1-CG 4.42Å; I203-M216 HydrophobicContact CG2-CB 4.24Å; T207-M216 HydrophobicContact CG2-CE 3.91Å; T207-M216 HydrophobicContact CG2-SD 4.1Å; R212-M216 HydrophobicContact CB-CB 4Å; R212-M216 HydrophobicContact CB-SD 4.29Å; R212-M216 HydrophobicContact CG-CB 4.31Å; R212-M216 HydrophobicContact CG-SD 4.21Å; S213-M216 WeakPolarHBondContact O-CA 3.49Å; S213-M216 WeakPolarHBondContact O-CB 3.33Å; S213-M216 PolarHBondContact O-N 3.26Å; P214-M216 PolarHBondContact O-N 3.46Å; M216-I225 HydrophobicContact CE-CG2 3.56Å; M216-I225 HydrophobicContact CG-CD1 3.97Å; M216-I225 HydrophobicContact CG-CG1 4.2Å; M216-I225 HydrophobicContact CG-CG2 4.15Å
217	V	96	Very high	95.5	Very high	34 Å²	34	45.7 Å²	45.7	21%	0.206	21%	0.214	C	C	.	.	H	α-helix	trans	-100.6	-33.1	-177.3	177.4	0	0	0	0	111.8	R212 S213 P214 A252 I255 Q256	R212-V217 HydrophobicContact CB-CG2 3.72Å; S213-V217 PolarHBondContact O-N 2.91Å; P214-V217 PolarHBondContact O-N 3.44Å; V217-A252 HydrophobicContact CG1-CB 3.61Å; V217-I255 HydrophobicContact CB-CG2 4.29Å; V217-I255 HydrophobicContact CG2-CB 4.42Å; V217-I255 HydrophobicContact CG2-CD1 4.31Å; V217-I255 HydrophobicContact CG2-CG2 3.77Å; V217-Q256 HydrophobicContact CB-CG 4.39Å; V217-Q256 HydrophobicContact CG1-CG 3.88Å
218	D	94.6	Very high	95.6	Very high	41 Å²	41	47 Å²	47	22%	0.219	22%	0.219	C	C	.	.			trans	-120.5	90.8	171.2	-171.7	2.3	0	0	0	110.9	P214 Y220 L221 Q256	P214-D218 PolarHBondContact O-N 2.92Å; D218-Y220 PolarHBondContact O-N 3.26Å; D218-Y220 VanDerWaalsContact OD1-CB 3.31Å; D218-Y220 WeakPolarHBondContact OD1-CB 3.5Å; D218-Y220 PolarHBondContact OD1-N 3Å; D218-L221 HydrophobicContact CB-CD1 3.96Å; D218-L221 HydrophobicContact CB-CG 3.89Å; D218-L221 WeakPolarHBondContact O-CB 3.34Å; D218-L221 WeakPolarHBondContact O-CG 3.21Å; D218-L221 PolarHBondContact O-N 3.46Å; D218-Q256 HydrophobicContact CB-CG 4.12Å
219	L	94.1	Very high	95.8	Very high	16 Å²	16	45.3 Å²	45.3	8%	0.084	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-65.5	-21.3	175.1	-61	-178.2	0	0	0	112.4	L191 L196 I199 E200 I203 L221 R222 I225	L191-L219 HydrophobicContact CD1-CB 4.35Å; L191-L219 WeakPolarHBondContact CD1-O 3.37Å; L196-L219 HydrophobicContact CG-CD1 4.37Å; I199-L219 HydrophobicContact CB-CD1 4.31Å; I199-L219 HydrophobicContact CG2-CD1 3.97Å; I199-L219 HydrophobicContact CG2-CD2 3.83Å; E200-L219 HydrophobicContact CG-CD1 3.47Å; E200-L219 VanDerWaalsContact CG-CD1 3.47Å; I203-L219 HydrophobicContact CD1-CD2 3.75Å; L219-L221 PolarHBondContact O-N 2.78Å; L219-R222 PolarHBondContact O-N 3.39Å; L219-I225 HydrophobicContact CD2-CD1 4.22Å
220	Y	92.3	Very high	96	Very high	168 Å²	168	42.4 Å²	42.4	66%	0.659	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-71.1	-12.4	179.9	-60.8	-88.1	0	0	0	112.7	L196 D218 R222	L196-Y220 HydrophobicContact CD1-CE1 4.33Å; D218-Y220 PolarHBondContact O-N 3.26Å; D218-Y220 VanDerWaalsContact OD1-CB 3.31Å; D218-Y220 WeakPolarHBondContact OD1-CB 3.5Å; D218-Y220 PolarHBondContact OD1-N 3Å; Y220-R222 PolarHBondContact O-N 3.45Å
221	L	88.9	Confident	96.2	Very high	84 Å²	84	41.9 Å²	41.9	44%	0.44	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-62.4	-15	165.4	-60.2	176.7	0	0	0	113.2	D218 L219 R223	D218-L221 HydrophobicContact CB-CD1 3.96Å; D218-L221 HydrophobicContact CB-CG 3.89Å; D218-L221 WeakPolarHBondContact O-CB 3.34Å; D218-L221 WeakPolarHBondContact O-CG 3.21Å; D218-L221 PolarHBondContact O-N 3.46Å; L219-L221 PolarHBondContact O-N 2.78Å; L221-R223 HydrophobicContact CB-CG 4.09Å; L221-R223 PolarHBondContact O-N 3.16Å
222	R	92	Very high	96.2	Very high	188 Å²	188	41.3 Å²	41.3	71%	0.709	19%	0.187	S	C	*	.			trans	52.1	27.7	-178.9	-63.3	176.3	177.5	-100.6	2.1	113.7	L191 L219 Y220	L191-R222 HydrophobicContact CD1-CG 4.14Å; L219-R222 PolarHBondContact O-N 3.39Å; Y220-R222 PolarHBondContact O-N 3.45Å
223	R	94.3	Very high	96.2	Very high	112 Å²	112	39.4 Å²	39.4	42%	0.423	18%	0.181	S	C	.	.			trans	-84.1	137.3	173.9	-63.9	-55.4	-157.6	-165.2	5.9	109.6	E215 L221 D283 N285	E215-R223 HydrophobicContact CB-CB 3.79Å; L221-R223 HydrophobicContact CB-CG 4.09Å; L221-R223 PolarHBondContact O-N 3.16Å; R223-D283 IonicContact CZ-OD1 3.13Å; R223-D283 IonicContact NE-OD1 2.75Å; R223-D283 IonicContact NH2-OD1 2.71Å; R223-D283 PolarHBondContact NH2-OD1 3.11Å; R223-N285 PolarHBondContact NE-ND2 2.96Å; R223-N285 PolarHBondContact NH2-ND2 2.81Å; R223-N285 VanDerWaalsContact NH2-ND2 3.13Å
224	P	95.7	Very high	96.3	Very high	46 Å²	46	39.4 Å²	39.4	30%	0.299	18%	0.181	S	C	.	.			trans	-72.2	140	174.6	30.3	-34.2	0	0	0	110.8	V188 L189 T226	V188-P224 HydrophobicContact CG1-CB 3.74Å; L189-P224 WeakPolarHBondContact O-CA 3.24Å; P224-T226 HydrophobicContact CB-CG2 4.15Å; P224-T226 HydrophobicContact CG-CG2 4.18Å; P224-T226 PolarHBondContact O-N 3.24Å
225	I	96.9	Very high	96.3	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-83.8	104.8	176.3	-61.8	166	0	0	0	107.7	V188 L189 I199 I203 E215 M216 L219	V188-I225 WeakPolarHBondContact CA-O 3.48Å; L189-I225 HydrophobicContact CB-CB 4.31Å; L189-I225 HydrophobicContact CB-CD1 4.38Å; L189-I225 PolarHBondContact N-O 3.42Å; L189-I225 PolarHBondContact O-N 3.3Å; I199-I225 HydrophobicContact CG2-CD1 4.05Å; I203-I225 HydrophobicContact CD1-CD1 3.47Å; I203-I225 VanDerWaalsContact CD1-CD1 3.47Å; I203-I225 HydrophobicContact CG1-CD1 4.04Å; E215-I225 HydrophobicContact CG-CG1 4.34Å; M216-I225 HydrophobicContact CE-CG2 3.56Å; M216-I225 HydrophobicContact CG-CD1 3.97Å; M216-I225 HydrophobicContact CG-CG1 4.2Å; M216-I225 HydrophobicContact CG-CG2 4.15Å; L219-I225 HydrophobicContact CD2-CD1 4.22Å
226	T	97.4	Very high	96.4	Very high	34 Å²	34	39.2 Å²	39.2	21%	0.209	18%	0.18	C	C	.	.			trans	-119.4	-176.4	-173.9	59.2	0	0	0	0	110.5	V188 P224 K228 S229	V188-T226 HydrophobicContact CG1-CG2 3.77Å; V188-T226 HydrophobicContact CG2-CG2 4.13Å; P224-T226 HydrophobicContact CB-CG2 4.15Å; P224-T226 HydrophobicContact CG-CG2 4.18Å; P224-T226 PolarHBondContact O-N 3.24Å; T226-K228 PolarHBondContact O-N 3.46Å; T226-K228 PolarHBondContact OG1-N 3.37Å; T226-S229 PolarHBondContact O-N 3.25Å; T226-S229 PolarHBondContact O-OG 3.23Å
227	T	98.1	Very high	96.5	Very high	32 Å²	32	38.5 Å²	38.5	20%	0.196	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-21	170.1	50	0	0	0	0	114.2	H152 P157 I159 S229 D230 I231	H152-T227 HydrophobicContact CB-CG2 4.2Å; H152-T227 PolarHBondContact CE1-O 3.07Å; H152-T227 VanDerWaalsContact CE1-O 3.25Å; P157-T227 HydrophobicContact CB-CG2 3.93Å; I159-T227 HydrophobicContact CG1-CG2 4.04Å; T227-S229 PolarHBondContact O-N 3.25Å; T227-D230 WeakPolarHBondContact O-CB 3.4Å; T227-D230 PolarHBondContact O-N 3.48Å; T227-D230 VanDerWaalsContact O-N 3.17Å; T227-I231 PolarHBondContact O-N 3.29Å
228	K	98.3	Very high	96.6	Very high	42 Å²	42	36.9 Å²	36.9	18%	0.183	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-21.9	172.2	-62.3	-63.2	-167.7	76.3	0	114	T226 I231 W232 C284 N285 R287 P288	T226-K228 PolarHBondContact O-N 3.46Å; T226-K228 PolarHBondContact OG1-N 3.37Å; K228-I231 HydrophobicContact CD-CG1 4.46Å; K228-I231 PolarHBondContact O-N 3.46Å; K228-W232 PolarHBondContact O-N 2.98Å; K228-C284 HydrophobicContact CB-CB 4.32Å; K228-C284 WeakPolarHBondContact CG-O 3.49Å; K228-C284 PolarHBondContact NZ-O 3.13Å; K228-N285 PolarHBondContact NZ-O 2.84Å; K228-R287 WeakPolarHBondContact CE-O 3.36Å; K228-R287 PolarHBondContact NZ-O 3.17Å; K228-R287 WeakPolarHBondContact O-CD 3.39Å; K228-R287 PolarHBondContact O-NH1 3.27Å; K228-P288 VanDerWaalsContact CD-O 3.26Å; K228-P288 WeakPolarHBondContact CD-O 3.32Å; K228-P288 WeakPolarHBondContact CE-O 3.43Å
229	S	98.3	Very high	96.7	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-68.1	-37.3	173.6	64.7	0	0	0	0	111.8	S213 T226 T227 I231 W232 A233	S213-S229 WeakPolarHBondContact OG-CB 3.31Å; T226-S229 PolarHBondContact O-N 3.25Å; T226-S229 PolarHBondContact O-OG 3.23Å; T227-S229 PolarHBondContact O-N 3.25Å; S229-I231 VanDerWaalsContact C-N 3.3Å; S229-I231 PolarHBondContact O-N 3.21Å; S229-W232 WeakPolarHBondContact O-CB 3.22Å; S229-W232 PolarHBondContact O-N 3.15Å; S229-A233 PolarHBondContact O-N 3.12Å
230	D	98.7	Very high	96.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-65.4	-35.3	174.7	-71.1	-15.5	0	0	0	111.2	H152 I159 H160 R161 L163 T227 W232 A233 L234	H152-D230 IonicContact CD2-OD2 3.89Å; H152-D230 IonicContact CE1-OD2 3.62Å; H152-D230 IonicContact NE2-OD2 3.83Å; H152-D230 PolarHBondContact NE2-OD2 3.17Å; I159-D230 WeakPolarHBondContact CA-OD2 3.38Å; H160-D230 PolarHBondContact N-OD1 2.97Å; H160-D230 PolarHBondContact N-OD2 3.22Å; R161-D230 PolarHBondContact N-OD1 3.39Å; L163-D230 HydrophobicContact CD1-CB 3.63Å; T227-D230 WeakPolarHBondContact O-CB 3.4Å; T227-D230 PolarHBondContact O-N 3.48Å; T227-D230 VanDerWaalsContact O-N 3.17Å; D230-W232 VanDerWaalsContact C-N 3.3Å; D230-W232 PolarHBondContact O-N 3.35Å; D230-A233 CarbonylContact O-C 3.59Å; D230-A233 PolarHBondContact O-N 2.82Å; D230-A233 VanDerWaalsContact O-N 3.16Å; D230-L234 WeakPolarHBondContact O-CG 3.31Å; D230-L234 PolarHBondContact O-N 3.16Å
231	I	98.8	Very high	97.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-37.9	175.2	-55.3	-59	0	0	0	111.7	T227 K228 S229 L234 G235 M279 R287 P288 I290 V293	T227-I231 PolarHBondContact O-N 3.29Å; K228-I231 HydrophobicContact CD-CG1 4.46Å; K228-I231 PolarHBondContact O-N 3.46Å; S229-I231 VanDerWaalsContact C-N 3.3Å; S229-I231 PolarHBondContact O-N 3.21Å; I231-L234 HydrophobicContact CD1-CD1 4.29Å; I231-L234 PolarHBondContact O-N 2.99Å; I231-G235 PolarHBondContact O-N 2.95Å; I231-G235 VanDerWaalsContact O-N 3.15Å; I231-M279 HydrophobicContact CG2-CB 4.37Å; I231-M279 HydrophobicContact CG2-CG 4.06Å; I231-R287 HydrophobicContact CB-CG 4.4Å; I231-R287 HydrophobicContact CG2-CG 3.93Å; I231-P288 HydrophobicContact CG2-CG 4.08Å; I231-I290 HydrophobicContact CD1-CB 3.98Å; I231-I290 HydrophobicContact CD1-CD1 4.12Å; I231-V293 HydrophobicContact CG2-CG2 3.98Å
232	W	98.7	Very high	97.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-65.1	-45.7	172	174.3	-84.6	0	0	0	111.4	R212 S213 P214 K228 S229 D230 L234 G235 V236 F248 I255 A258 L280	R212-W232 PolarHBondContact O-NE1 2.83Å; S213-W232 VanDerWaalsContact CA-CD1 3.46Å; P214-W232 HydrophobicContact CG-CE3 4.18Å; P214-W232 HydrophobicContact CG-CH2 3.68Å; P214-W232 HydrophobicContact CG-CZ2 4.15Å; P214-W232 HydrophobicContact CG-CZ3 3.71Å; K228-W232 PolarHBondContact O-N 2.98Å; S229-W232 WeakPolarHBondContact O-CB 3.22Å; S229-W232 PolarHBondContact O-N 3.15Å; D230-W232 VanDerWaalsContact C-N 3.3Å; D230-W232 PolarHBondContact O-N 3.35Å; W232-L234 VanDerWaalsContact C-N 3.28Å; W232-L234 PolarHBondContact O-N 2.83Å; W232-G235 WeakPolarHBondContact O-CA 3.47Å; W232-G235 PolarHBondContact O-N 3Å; W232-V236 PolarHBondContact O-N 3.47Å; W232-F248 AromaticContact CE2-CE2 3.87Å; W232-F248 HydrophobicContact CH2-CE1 4.48Å; W232-F248 AromaticContact CH2-CE2 3.87Å; W232-F248 HydrophobicContact CH2-CE2 3.87Å; W232-F248 AromaticContact CH2-CZ 3.63Å; W232-F248 HydrophobicContact CH2-CZ 3.63Å; W232-F248 AromaticContact CZ2-CD2 3.99Å; W232-F248 HydrophobicContact CZ2-CD2 3.99Å; W232-F248 HydrophobicContact CZ2-CE1 4.44Å; W232-F248 AromaticContact CZ2-CE2 3.22Å; W232-F248 HydrophobicContact CZ2-CE2 3.22Å; W232-F248 AromaticContact CZ2-CZ 3.49Å; W232-F248 HydrophobicContact CZ2-CZ 3.49Å; W232-F248 VanDerWaalsContact CZ2-CZ 3.49Å; W232-I255 HydrophobicContact CZ2-CB 4.49Å; W232-I255 HydrophobicContact CZ2-CG2 3.85Å; W232-A258 HydrophobicContact CH2-CB 3.87Å; W232-A258 HydrophobicContact CZ3-CB 4.09Å; W232-L280 HydrophobicContact CD2-CD2 3.82Å; W232-L280 HydrophobicContact CE3-CD2 3.97Å; W232-L280 HydrophobicContact CG-CD2 4.31Å; W232-L280 HydrophobicContact CH2-CD2 4.49Å; W232-L280 HydrophobicContact CZ2-CD2 4.35Å; W232-L280 HydrophobicContact CZ3-CB 4.33Å; W232-L280 HydrophobicContact CZ3-CD2 4.3Å
233	A	98.7	Very high	97.6	Very high	4 Å²	4	15.4 Å²	15.4	3%	0.033	8%	0.075	C	C	.	.	H	α-helix	trans	-61.7	-33.9	177.4	0	0	0	0	0	112.6	L163 Y211 S229 D230 V236 M237	L163-A233 HydrophobicContact CB-CB 3.95Å; Y211-A233 HydrophobicContact CD1-CB 4.26Å; S229-A233 PolarHBondContact O-N 3.12Å; D230-A233 CarbonylContact O-C 3.59Å; D230-A233 PolarHBondContact O-N 2.82Å; D230-A233 VanDerWaalsContact O-N 3.16Å; A233-V236 PolarHBondContact O-N 2.81Å; A233-M237 WeakPolarHBondContact O-CB 3.44Å; A233-M237 PolarHBondContact O-N 3.36Å
234	L	98.8	Very high	97.6	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.7	-39.8	169	-74.2	177.3	0	0	0	112.4	F141 V144 V148 L163 D230 I231 W232 M237 L238 M279 I290	F141-L234 HydrophobicContact CE2-CB 4.03Å; F141-L234 HydrophobicContact CE2-CD2 4.12Å; F141-L234 HydrophobicContact CZ-CB 4.29Å; V144-L234 HydrophobicContact CG1-CD2 3.71Å; V148-L234 HydrophobicContact CB-CD1 4.48Å; V148-L234 HydrophobicContact CG1-CD1 4.24Å; V148-L234 HydrophobicContact CG2-CD1 4.48Å; V148-L234 HydrophobicContact CG2-CD2 4.36Å; L163-L234 HydrophobicContact CD1-CD2 4.1Å; L163-L234 HydrophobicContact CD1-CG 3.99Å; D230-L234 WeakPolarHBondContact O-CG 3.31Å; D230-L234 PolarHBondContact O-N 3.16Å; I231-L234 HydrophobicContact CD1-CD1 4.29Å; I231-L234 PolarHBondContact O-N 2.99Å; W232-L234 VanDerWaalsContact C-N 3.28Å; W232-L234 PolarHBondContact O-N 2.83Å; L234-M237 HydrophobicContact CD2-SD 4.43Å; L234-M237 PolarHBondContact O-N 3.46Å; L234-L238 WeakPolarHBondContact O-CB 3.47Å; L234-L238 PolarHBondContact O-N 3.07Å; L234-M279 HydrophobicContact CB-SD 3.67Å; L234-I290 HydrophobicContact CD1-CD1 3.74Å
235	G	98.5	Very high	97.6	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.4	-43.7	172.8	0	0	0	0	0	112.8	I231 W232 Y239	I231-G235 PolarHBondContact O-N 2.95Å; I231-G235 VanDerWaalsContact O-N 3.15Å; W232-G235 WeakPolarHBondContact O-CA 3.47Å; W232-G235 PolarHBondContact O-N 3Å; G235-Y239 WeakPolarHBondContact O-CB 3.48Å; G235-Y239 PolarHBondContact O-N 3.44Å; G235-Y239 VanDerWaalsContact O-N 3.07Å
236	V	98.5	Very high	97.5	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.5	-42.2	174.2	177.3	0	0	0	0	111.2	Y211 W232 A233 Y239 K240 L246 P247 F248 L280	Y211-V236 HydrophobicContact CD1-CB 3.72Å; Y211-V236 HydrophobicContact CD1-CG1 3.44Å; Y211-V236 VanDerWaalsContact CD1-CG1 3.44Å; Y211-V236 HydrophobicContact CD2-CG1 4.4Å; Y211-V236 HydrophobicContact CE1-CB 3.96Å; Y211-V236 HydrophobicContact CE1-CG1 3.48Å; Y211-V236 VanDerWaalsContact CE1-CG1 3.48Å; Y211-V236 HydrophobicContact CE2-CG1 4.44Å; Y211-V236 HydrophobicContact CG-CB 4.49Å; Y211-V236 HydrophobicContact CG-CG1 3.94Å; W232-V236 PolarHBondContact O-N 3.47Å; A233-V236 PolarHBondContact O-N 2.81Å; V236-Y239 PolarHBondContact O-N 2.85Å; V236-K240 PolarHBondContact O-N 2.81Å; V236-L246 HydrophobicContact CG1-CD2 3.49Å; V236-L246 VanDerWaalsContact CG1-CD2 3.49Å; V236-P247 HydrophobicContact CB-CG 4.44Å; V236-P247 HydrophobicContact CG1-CG 4.23Å; V236-P247 HydrophobicContact CG2-CG 4.17Å; V236-F248 HydrophobicContact CG2-CD2 4.38Å; V236-F248 HydrophobicContact CG2-CE2 4.14Å; V236-L280 HydrophobicContact CG2-CD2 3.9Å
237	M	98.4	Very high	97.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.5	-48.5	177	-174.2	-167.7	-71.9	0	0	111.5	V144 L163 V165 V168 Y211 A233 L234 Y239 K240 L241	V144-M237 HydrophobicContact CB-SD 4.41Å; V144-M237 HydrophobicContact CG1-CE 4.07Å; V144-M237 HydrophobicContact CG1-SD 3.98Å; V144-M237 HydrophobicContact CG2-SD 4.2Å; L163-M237 HydrophobicContact CB-CE 4.01Å; V165-M237 HydrophobicContact CG1-CG 3.71Å; V168-M237 HydrophobicContact CG2-CE 4.25Å; V168-M237 HydrophobicContact CG2-SD 4.42Å; Y211-M237 HydrophobicContact CE1-CB 4.26Å; A233-M237 WeakPolarHBondContact O-CB 3.44Å; A233-M237 PolarHBondContact O-N 3.36Å; L234-M237 HydrophobicContact CD2-SD 4.43Å; L234-M237 PolarHBondContact O-N 3.46Å; M237-Y239 VanDerWaalsContact C-N 3.33Å; M237-Y239 PolarHBondContact O-N 3.32Å; M237-K240 CarbonylContact O-C 3.34Å; M237-K240 PolarHBondContact O-N 2.83Å; M237-K240 VanDerWaalsContact O-N 3.08Å; M237-L241 HydrophobicContact CG-CD1 4.37Å; M237-L241 WeakPolarHBondContact O-CG 3.45Å; M237-L241 PolarHBondContact O-N 3.07Å
238	L	98.2	Very high	97.4	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.1	-41.1	178.7	-178	57	0	0	0	111.5	V137 F141 L234 K240 L241 C242 L275 I276 M279	V137-L238 HydrophobicContact CG1-CD1 3.47Å; V137-L238 VanDerWaalsContact CG1-CD1 3.47Å; F141-L238 HydrophobicContact CB-CD1 4.1Å; F141-L238 HydrophobicContact CD1-CD1 4.37Å; F141-L238 HydrophobicContact CD1-CD2 4.3Å; F141-L238 HydrophobicContact CD2-CB 3.84Å; F141-L238 HydrophobicContact CD2-CD1 3.99Å; F141-L238 HydrophobicContact CD2-CD2 4.44Å; F141-L238 HydrophobicContact CD2-CG 4.3Å; F141-L238 HydrophobicContact CE1-CD2 4.17Å; F141-L238 HydrophobicContact CE2-CB 3.79Å; F141-L238 HydrophobicContact CE2-CD2 4.31Å; F141-L238 HydrophobicContact CE2-CG 4.45Å; F141-L238 HydrophobicContact CG-CD1 3.87Å; F141-L238 HydrophobicContact CG-CD2 4.45Å; F141-L238 HydrophobicContact CZ-CB 4.43Å; F141-L238 HydrophobicContact CZ-CD2 4.19Å; L234-L238 WeakPolarHBondContact O-CB 3.47Å; L234-L238 PolarHBondContact O-N 3.07Å; L238-K240 VanDerWaalsContact C-N 3.33Å; L238-K240 PolarHBondContact O-N 2.91Å; L238-L241 PolarHBondContact O-N 2.85Å; L238-C242 PolarHBondContact O-N 3.38Å; L238-C242 PolarHBondContact O-SG 3.46Å; L238-C242 VanDerWaalsContact O-SG 3.33Å; L238-L275 HydrophobicContact CD2-CB 4.37Å; L238-L275 HydrophobicContact CD2-CD2 3.86Å; L238-L275 HydrophobicContact CD2-CG 3.79Å; L238-I276 HydrophobicContact CB-CG1 4.08Å; L238-I276 HydrophobicContact CD2-CD1 4.49Å; L238-I276 HydrophobicContact CD2-CG1 3.61Å; L238-I276 HydrophobicContact CG-CD1 4.09Å; L238-I276 HydrophobicContact CG-CG1 3.6Å; L238-M279 HydrophobicContact CB-CE 4.12Å; L238-M279 HydrophobicContact CD2-CE 3.59Å
239	Y	97.7	Very high	97	Very high	12 Å²	12	14.1 Å²	14.1	5%	0.047	7%	0.066	C	C	.	.	H	α-helix	trans	-59.5	-43.5	172.1	-174.9	-75.2	0	0	0	111.6	G235 V236 M237 C242 Y243 T245 P247 F260 S261 F262 P263 I276	G235-Y239 WeakPolarHBondContact O-CB 3.48Å; G235-Y239 PolarHBondContact O-N 3.44Å; G235-Y239 VanDerWaalsContact O-N 3.07Å; V236-Y239 PolarHBondContact O-N 2.85Å; M237-Y239 VanDerWaalsContact C-N 3.33Å; M237-Y239 PolarHBondContact O-N 3.32Å; Y239-C242 WeakPolarHBondContact O-CB 3.39Å; Y239-C242 PolarHBondContact O-N 2.91Å; Y239-Y243 AromaticContact CD1-CD2 3.99Å; Y239-Y243 HydrophobicContact CD1-CD2 3.99Å; Y239-Y243 AromaticContact CD2-CD2 3.82Å; Y239-Y243 HydrophobicContact CD2-CD2 3.82Å; Y239-Y243 HydrophobicContact CD2-CE2 4.13Å; Y239-Y243 AromaticContact CE1-CD2 3.95Å; Y239-Y243 HydrophobicContact CE1-CD2 3.95Å; Y239-Y243 HydrophobicContact CE1-CG 4.33Å; Y239-Y243 AromaticContact CE2-CD2 3.78Å; Y239-Y243 HydrophobicContact CE2-CD2 3.78Å; Y239-Y243 HydrophobicContact CE2-CE2 4.14Å; Y239-Y243 AromaticContact CG-CD2 3.93Å; Y239-Y243 HydrophobicContact CG-CD2 3.93Å; Y239-Y243 AromaticContact CZ-CD2 3.85Å; Y239-Y243 WeakPolarHBondContact O-CD2 3.26Å; Y239-Y243 PolarHBondContact O-N 2.98Å; Y239-T245 VanDerWaalsContact CD1-O 3.27Å; Y239-T245 WeakPolarHBondContact CD1-O 3.17Å; Y239-T245 HydrophobicContact CE1-CG2 3.95Å; Y239-T245 WeakPolarHBondContact CE1-O 3.4Å; Y239-P247 HydrophobicContact CD1-CB 3.89Å; Y239-P247 VanDerWaalsContact CD1-CD 3.45Å; Y239-P247 HydrophobicContact CD1-CG 4.06Å; Y239-P247 HydrophobicContact CD2-CB 3.88Å; Y239-P247 HydrophobicContact CD2-CG 4.49Å; Y239-P247 HydrophobicContact CE1-CB 4.02Å; Y239-P247 HydrophobicContact CE2-CB 4.01Å; Y239-P247 HydrophobicContact CG-CB 3.82Å; Y239-P247 HydrophobicContact CG-CG 4Å; Y239-F260 HydrophobicContact CD2-CD2 4.27Å; Y239-F260 HydrophobicContact CE2-CD2 4.08Å; Y239-S261 PolarHBondContact OH-O 3.28Å; Y239-S261 VanDerWaalsContact OH-O 3.12Å; Y239-F262 HydrophobicContact CD2-CD1 4.15Å; Y239-F262 AromaticContact CD2-CE1 3.99Å; Y239-F262 HydrophobicContact CD2-CE1 3.99Å; Y239-F262 AromaticContact CE2-CD1 3.93Å; Y239-F262 HydrophobicContact CE2-CD1 3.93Å; Y239-F262 HydrophobicContact CE2-CE1 4.2Å; Y239-P263 WeakPolarHBondContact OH-CD 3.44Å; Y239-I276 HydrophobicContact CD2-CG2 4.25Å
240	K	97.5	Very high	96.6	Very high	21 Å²	21	18.3 Å²	18.3	9%	0.091	9%	0.088	C	C	.	.	H	α-helix	trans	-68.1	-36.7	178.5	-166.9	-177.1	178.6	179.2	0	113.1	M122 V165 E166 Y211 V236 M237 L238 C242 F244 T245 L246	M122-K240 HydrophobicContact CE-CG 4.24Å; M122-K240 VanDerWaalsContact CE-O 3.24Å; M122-K240 WeakPolarHBondContact CE-O 3.42Å; V165-K240 HydrophobicContact CG1-CB 4.5Å; V165-K240 HydrophobicContact CG1-CD 4.2Å; V165-K240 HydrophobicContact CG2-CD 3.71Å; E166-K240 VanDerWaalsContact CD-NZ 3.32Å; E166-K240 IonicContact OE1-NZ 3.76Å; E166-K240 PolarHBondContact OE1-NZ 3.32Å; E166-K240 IonicContact OE2-NZ 3.51Å; E166-K240 PolarHBondContact OE2-NZ 3.25Å; Y211-K240 WeakPolarHBondContact OH-CD 3.49Å; V236-K240 PolarHBondContact O-N 2.81Å; M237-K240 CarbonylContact O-C 3.34Å; M237-K240 PolarHBondContact O-N 2.83Å; M237-K240 VanDerWaalsContact O-N 3.08Å; L238-K240 VanDerWaalsContact C-N 3.33Å; L238-K240 PolarHBondContact O-N 2.91Å; K240-C242 VanDerWaalsContact C-N 3.31Å; K240-F244 WeakPolarHBondContact O-CA 3.49Å; K240-F244 PolarHBondContact O-N 3.12Å; K240-T245 WeakPolarHBondContact CA-O 3.33Å; K240-L246 HydrophobicContact CB-CD2 4.49Å; K240-L246 HydrophobicContact CD-CD2 4.03Å; K240-L246 HydrophobicContact CD-CG 4.35Å
241	L	97.1	Very high	96.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62	-39.9	172.9	-70.4	172.3	0	0	0	111.6	V118 M122 L132 V137 I140 F141 V165 M237 L238 F244	V118-L241 HydrophobicContact CG1-CD2 3.59Å; M122-L241 HydrophobicContact SD-CD2 4.04Å; L132-L241 HydrophobicContact CD1-CD2 4.27Å; V137-L241 HydrophobicContact CG1-CB 4.01Å; V137-L241 HydrophobicContact CG2-CB 4.45Å; I140-L241 HydrophobicContact CB-CD1 4.38Å; I140-L241 HydrophobicContact CD1-CD2 4.41Å; I140-L241 HydrophobicContact CG2-CD1 3.84Å; I140-L241 HydrophobicContact CG2-CD2 4.05Å; F141-L241 HydrophobicContact CB-CD1 4.39Å; V165-L241 HydrophobicContact CG1-CD2 3.84Å; V165-L241 HydrophobicContact CG1-CG 4.07Å; M237-L241 HydrophobicContact CG-CD1 4.37Å; M237-L241 WeakPolarHBondContact O-CG 3.45Å; M237-L241 PolarHBondContact O-N 3.07Å; L238-L241 PolarHBondContact O-N 2.85Å; L241-F244 WeakPolarHBondContact O-CE1 3.48Å
242	C	95.9	Very high	96.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-67.9	-59.7	175.4	-72.2	0	0	0	0	112.2	Y131 L238 Y239 K240 Y268	Y131-C242 WeakPolarHBondContact CD1-O 3.4Å; L238-C242 PolarHBondContact O-N 3.38Å; L238-C242 PolarHBondContact O-SG 3.46Å; L238-C242 VanDerWaalsContact O-SG 3.33Å; Y239-C242 WeakPolarHBondContact O-CB 3.39Å; Y239-C242 PolarHBondContact O-N 2.91Å; K240-C242 VanDerWaalsContact C-N 3.31Å; C242-Y268 HydrophobicContact CB-CD2 3.59Å; C242-Y268 HydrophobicContact CB-CE2 3.31Å; C242-Y268 HydrophobicContact CB-CG 4.46Å; C242-Y268 WeakPolarHBondContact O-CE2 3.49Å; C242-Y268 PolarHBondContact O-OH 3.08Å; C242-Y268 VanDerWaalsContact O-OH 3.08Å
243	Y	94.9	Very high	95.8	Very high	12 Å²	12	29.8 Å²	29.8	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-105.4	1.1	-161	-60	-67.5	0	0	0	114.6	Y239 T245 F262 P263 P266 Y268 Q273 I276	Y239-Y243 AromaticContact CD1-CD2 3.99Å; Y239-Y243 HydrophobicContact CD1-CD2 3.99Å; Y239-Y243 AromaticContact CD2-CD2 3.82Å; Y239-Y243 HydrophobicContact CD2-CD2 3.82Å; Y239-Y243 HydrophobicContact CD2-CE2 4.13Å; Y239-Y243 AromaticContact CE1-CD2 3.95Å; Y239-Y243 HydrophobicContact CE1-CD2 3.95Å; Y239-Y243 HydrophobicContact CE1-CG 4.33Å; Y239-Y243 AromaticContact CE2-CD2 3.78Å; Y239-Y243 HydrophobicContact CE2-CD2 3.78Å; Y239-Y243 HydrophobicContact CE2-CE2 4.14Å; Y239-Y243 AromaticContact CG-CD2 3.93Å; Y239-Y243 HydrophobicContact CG-CD2 3.93Å; Y239-Y243 AromaticContact CZ-CD2 3.85Å; Y239-Y243 WeakPolarHBondContact O-CD2 3.26Å; Y239-Y243 PolarHBondContact O-N 2.98Å; Y243-T245 PolarHBondContact O-N 3.38Å; Y243-F262 AromaticContact CE2-CD1 3.64Å; Y243-F262 HydrophobicContact CE2-CD1 3.64Å; Y243-F262 HydrophobicContact CE2-CE1 4.22Å; Y243-F262 AromaticContact CZ-CD1 3.98Å; Y243-P263 HydrophobicContact CD1-CB 3.95Å; Y243-P263 HydrophobicContact CD1-CG 3.59Å; Y243-P263 HydrophobicContact CE1-CB 4.15Å; Y243-P263 HydrophobicContact CE1-CG 4.1Å; Y243-P263 HydrophobicContact CG-CG 3.95Å; Y243-P266 HydrophobicContact CD1-CG 4.43Å; Y243-P266 HydrophobicContact CE1-CG 4.43Å; Y243-Y268 AromaticContact CE1-CD2 3.86Å; Y243-Y268 HydrophobicContact CE1-CD2 3.86Å; Y243-Y268 HydrophobicContact CE1-CE2 4.26Å; Y243-Y268 AromaticContact CZ-CD2 3.82Å; Y243-Q273 PolarHBondContact OH-NE2 2.89Å; Y243-I276 HydrophobicContact CE2-CD1 4.4Å
244	F	94.6	Very high	95.7	Very high	39 Å²	39	30.3 Å²	30.3	17%	0.171	16%	0.157	C	C	.	.	S	Bend	trans	53.9	16.3	-177	-65.5	3.7	0	0	0	114.4	M122 H125 L126 Y131 L132 K240 L241	M122-F244 HydrophobicContact CB-CE1 4.07Å; M122-F244 HydrophobicContact CB-CE2 4.4Å; M122-F244 HydrophobicContact CB-CZ 4.01Å; M122-F244 HydrophobicContact CE-CD1 3.42Å; M122-F244 VanDerWaalsContact CE-CD1 3.42Å; M122-F244 HydrophobicContact CE-CE1 3.82Å; M122-F244 HydrophobicContact CE-CG 4.09Å; M122-F244 HydrophobicContact CG-CD1 4.39Å; M122-F244 HydrophobicContact CG-CE1 3.85Å; M122-F244 HydrophobicContact CG-CZ 4.19Å; M122-F244 VanDerWaalsContact O-CE2 3.28Å; M122-F244 WeakPolarHBondContact O-CE2 3.43Å; H125-F244 HydrophobicContact CB-CE2 4Å; H125-F244 HydrophobicContact CB-CZ 3.93Å; L126-F244 HydrophobicContact CB-CD2 3.88Å; L126-F244 HydrophobicContact CB-CE2 3.92Å; L126-F244 HydrophobicContact CD1-CD2 4.23Å; L126-F244 HydrophobicContact CG-CD2 4.45Å; Y131-F244 HydrophobicContact CD1-CD1 4.49Å; Y131-F244 HydrophobicContact CD1-CD2 4.33Å; Y131-F244 HydrophobicContact CD1-CE2 4.5Å; Y131-F244 HydrophobicContact CD1-CG 4.33Å; L132-F244 HydrophobicContact CD1-CE1 4.2Å; L132-F244 HydrophobicContact CG-CE1 4Å; L132-F244 HydrophobicContact CG-CZ 4.1Å; K240-F244 WeakPolarHBondContact O-CA 3.49Å; K240-F244 PolarHBondContact O-N 3.12Å; L241-F244 WeakPolarHBondContact O-CE1 3.48Å
245	T	94.6	Very high	95.6	Very high	43 Å²	43	30.3 Å²	30.3	26%	0.264	16%	0.157	S	C	.	.	S	Bend	trans	-138.4	168.4	178	-165	0	0	0	0	109.9	Y239 K240 Y243	Y239-T245 VanDerWaalsContact CD1-O 3.27Å; Y239-T245 WeakPolarHBondContact CD1-O 3.17Å; Y239-T245 HydrophobicContact CE1-CG2 3.95Å; Y239-T245 WeakPolarHBondContact CE1-O 3.4Å; K240-T245 WeakPolarHBondContact CA-O 3.33Å; Y243-T245 PolarHBondContact O-N 3.38Å
246	L	96.5	Very high	95.4	Very high	29 Å²	29	33.6 Å²	33.6	15%	0.152	17%	0.172	C	C	.	.			trans	-98.2	140.1	-176.4	-73.1	157.3	0	0	0	110.9	Y211 V236 K240 F248	Y211-L246 HydrophobicContact CD2-CD2 4.48Å; Y211-L246 HydrophobicContact CE2-CD2 3.82Å; V236-L246 HydrophobicContact CG1-CD2 3.49Å; V236-L246 VanDerWaalsContact CG1-CD2 3.49Å; K240-L246 HydrophobicContact CB-CD2 4.49Å; K240-L246 HydrophobicContact CD-CD2 4.03Å; K240-L246 HydrophobicContact CD-CG 4.35Å; L246-F248 VanDerWaalsContact C-N 3.27Å; L246-F248 PolarHBondContact O-N 2.9Å
247	P	96.8	Very high	95.2	Very high	16 Å²	16	38 Å²	38	10%	0.104	20%	0.196	C	C	.	.	S	Bend	trans	-64.3	-29.8	-175.1	23.2	-30	0	0	0	113.3	V236 Y239 F260 L280	V236-P247 HydrophobicContact CB-CG 4.44Å; V236-P247 HydrophobicContact CG1-CG 4.23Å; V236-P247 HydrophobicContact CG2-CG 4.17Å; Y239-P247 HydrophobicContact CD1-CB 3.89Å; Y239-P247 VanDerWaalsContact CD1-CD 3.45Å; Y239-P247 HydrophobicContact CD1-CG 4.06Å; Y239-P247 HydrophobicContact CD2-CB 3.88Å; Y239-P247 HydrophobicContact CD2-CG 4.49Å; Y239-P247 HydrophobicContact CE1-CB 4.02Å; Y239-P247 HydrophobicContact CE2-CB 4.01Å; Y239-P247 HydrophobicContact CG-CB 3.82Å; Y239-P247 HydrophobicContact CG-CG 4Å; P247-F260 HydrophobicContact CB-CB 3.77Å; P247-F260 HydrophobicContact CB-CD2 4.23Å; P247-F260 HydrophobicContact CB-CG 4.09Å; P247-F260 WeakPolarHBondContact O-CB 3.31Å; P247-L280 HydrophobicContact CB-CD1 4.4Å; P247-L280 HydrophobicContact CG-CD1 4.26Å
248	F	96.3	Very high	95	Very high	9 Å²	9	39.1 Å²	39.1	4%	0.039	21%	0.205	C	C	.	.	S	Bend	trans	-117	-7.1	-177	-48.2	-67.5	0	0	0	113.9	W232 V236 L246 D250 S251 A254 I255 F260 L280	W232-F248 AromaticContact CE2-CE2 3.87Å; W232-F248 HydrophobicContact CH2-CE1 4.48Å; W232-F248 AromaticContact CH2-CE2 3.87Å; W232-F248 HydrophobicContact CH2-CE2 3.87Å; W232-F248 AromaticContact CH2-CZ 3.63Å; W232-F248 HydrophobicContact CH2-CZ 3.63Å; W232-F248 AromaticContact CZ2-CD2 3.99Å; W232-F248 HydrophobicContact CZ2-CD2 3.99Å; W232-F248 HydrophobicContact CZ2-CE1 4.44Å; W232-F248 AromaticContact CZ2-CE2 3.22Å; W232-F248 HydrophobicContact CZ2-CE2 3.22Å; W232-F248 AromaticContact CZ2-CZ 3.49Å; W232-F248 HydrophobicContact CZ2-CZ 3.49Å; W232-F248 VanDerWaalsContact CZ2-CZ 3.49Å; V236-F248 HydrophobicContact CG2-CD2 4.38Å; V236-F248 HydrophobicContact CG2-CE2 4.14Å; L246-F248 VanDerWaalsContact C-N 3.27Å; L246-F248 PolarHBondContact O-N 2.9Å; F248-D250 PolarHBondContact O-N 3.08Å; F248-S251 WeakPolarHBondContact O-CB 3.37Å; F248-S251 PolarHBondContact O-N 2.94Å; F248-A254 HydrophobicContact CB-CB 4.31Å; F248-A254 HydrophobicContact CD1-CB 4.02Å; F248-I255 HydrophobicContact CB-CD1 4.45Å; F248-I255 HydrophobicContact CB-CG1 3.64Å; F248-I255 HydrophobicContact CD2-CG1 3.9Å; F248-I255 HydrophobicContact CG-CG1 3.76Å; F248-F260 HydrophobicContact CD1-CB 4.13Å; F248-F260 HydrophobicContact CE1-CB 3.7Å; F248-F260 AromaticContact CE1-CD1 3.7Å; F248-F260 HydrophobicContact CE1-CD1 3.7Å; F248-F260 HydrophobicContact CE1-CG 4.08Å; F248-F260 HydrophobicContact CZ-CB 4.3Å; F248-F260 AromaticContact CZ-CD1 3.75Å; F248-F260 HydrophobicContact CZ-CD1 3.75Å; F248-F260 HydrophobicContact CZ-CE1 4.5Å; F248-F260 HydrophobicContact CZ-CG 4.27Å; F248-L280 HydrophobicContact CE2-CD1 4.25Å; F248-L280 HydrophobicContact CE2-CD2 4.12Å; F248-L280 HydrophobicContact CZ-CD1 4.12Å; F248-L280 HydrophobicContact CZ-CD2 4.41Å
249	R	90.1	Very high	94.9	Very high	107 Å²	107	42 Å²	42	40%	0.404	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.7	-124.7	-160.6	-57.7	-175.8	-174.8	-127.4	2	109.4	S210 D466 D468	S210-R249 WeakPolarHBondContact CA-O 3.24Å; S210-R249 VanDerWaalsContact CB-O 3.27Å; S210-R249 WeakPolarHBondContact CB-O 3.48Å; R249-D466 PolarHBondContact NH1-O 2.63Å; R249-D468 WeakPolarHBondContact CD-OD2 3.48Å; R249-D468 IonicContact CZ-OD1 2.8Å; R249-D468 IonicContact CZ-OD2 2.72Å; R249-D468 IonicContact NE-OD2 3.83Å; R249-D468 IonicContact NH1-OD1 3.29Å; R249-D468 PolarHBondContact NH1-OD1 3.14Å; R249-D468 IonicContact NH1-OD2 2.79Å; R249-D468 PolarHBondContact NH1-OD2 2.64Å
250	D	88.4	Confident	94.7	Very high	90 Å²	90	43.8 Å²	43.8	48%	0.481	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	17.9	176.9	-65	-28.5	0	0	0	113.7	L209 S210 F248 A252	L209-D250 HydrophobicContact CD2-CB 3.95Å; S210-D250 PolarHBondContact OG-OD1 3.24Å; F248-D250 PolarHBondContact O-N 3.08Å; D250-A252 PolarHBondContact O-N 3.12Å; D250-A252 VanDerWaalsContact O-N 3.1Å
251	S	94.4	Very high	94.6	Very high	55 Å²	55	47.1 Å²	47.1	39%	0.385	26%	0.263	S	S	.	.			trans	-79.9	94.5	-177.3	-176	0	0	0	0	112	F248 F253 A254 I255	F248-S251 WeakPolarHBondContact O-CB 3.37Å; F248-S251 PolarHBondContact O-N 2.94Å; S251-F253 PolarHBondContact O-N 3.42Å; S251-F253 VanDerWaalsContact O-N 3.17Å; S251-A254 WeakPolarHBondContact O-CB 3.43Å; S251-A254 PolarHBondContact O-N 3.41Å; S251-A254 WeakPolarHBondContact OG-CB 3.49Å; S251-A254 PolarHBondContact OG-N 3.13Å; S251-I255 PolarHBondContact O-N 2.89Å
252	A	92.5	Very high	94.4	Very high	40 Å²	40	49.2 Å²	49.2	33%	0.331	27%	0.272	S	S	.	.	H	α-helix	trans	-48.5	-40.2	172.5	0	0	0	0	0	113.3	V217 D250 I255 Q256	V217-A252 HydrophobicContact CG1-CB 3.61Å; D250-A252 PolarHBondContact O-N 3.12Å; D250-A252 VanDerWaalsContact O-N 3.1Å; A252-I255 PolarHBondContact O-N 3.47Å; A252-Q256 WeakPolarHBondContact O-CG 3.14Å; A252-Q256 PolarHBondContact O-N 3.42Å
253	F	94.4	Very high	94.2	Very high	149 Å²	149	51.4 Å²	51.4	65%	0.654	29%	0.286	S	S	*	.	H	α-helix	trans	-68.8	-34.6	177.5	-176	-100.2	0	0	0	112.9	S251 N257	S251-F253 PolarHBondContact O-N 3.42Å; S251-F253 VanDerWaalsContact O-N 3.17Å; F253-N257 PolarHBondContact O-N 3.32Å; F253-N257 PolarHBondContact O-ND2 2.93Å
254	A	96.3	Very high	93.7	Very high	15 Å²	15	56 Å²	56	12%	0.124	32%	0.32	C	S	.	.	H	α-helix	trans	-71.1	-39.2	174.5	0	0	0	0	0	111.4	F248 S251 N257 A258 A259	F248-A254 HydrophobicContact CB-CB 4.31Å; F248-A254 HydrophobicContact CD1-CB 4.02Å; S251-A254 WeakPolarHBondContact O-CB 3.43Å; S251-A254 PolarHBondContact O-N 3.41Å; S251-A254 WeakPolarHBondContact OG-CB 3.49Å; S251-A254 PolarHBondContact OG-N 3.13Å; A254-N257 PolarHBondContact O-N 2.93Å; A254-A258 WeakPolarHBondContact O-CA 3.42Å; A254-A258 PolarHBondContact O-N 2.87Å; A254-A258 VanDerWaalsContact O-N 3.09Å; A254-A259 PolarHBondContact O-N 2.87Å
255	I	96.3	Very high	93.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-57.9	-55.1	173.5	-67	168.7	0	0	0	110.2	R212 P214 V217 W232 F248 S251 A252 N257 A258	R212-I255 VanDerWaalsContact O-CG2 3.28Å; R212-I255 WeakPolarHBondContact O-CG2 3.47Å; P214-I255 HydrophobicContact CG-CG2 4.41Å; V217-I255 HydrophobicContact CB-CG2 4.29Å; V217-I255 HydrophobicContact CG2-CB 4.42Å; V217-I255 HydrophobicContact CG2-CD1 4.31Å; V217-I255 HydrophobicContact CG2-CG2 3.77Å; W232-I255 HydrophobicContact CZ2-CB 4.49Å; W232-I255 HydrophobicContact CZ2-CG2 3.85Å; F248-I255 HydrophobicContact CB-CD1 4.45Å; F248-I255 HydrophobicContact CB-CG1 3.64Å; F248-I255 HydrophobicContact CD2-CG1 3.9Å; F248-I255 HydrophobicContact CG-CG1 3.76Å; S251-I255 PolarHBondContact O-N 2.89Å; A252-I255 PolarHBondContact O-N 3.47Å; I255-N257 PolarHBondContact O-N 3.13Å; I255-N257 VanDerWaalsContact O-N 3.16Å; I255-A258 PolarHBondContact O-N 3.09Å
256	Q	93.8	Very high	92.8	Very high	68 Å²	68	59.1 Å²	59.1	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-51.6	-40.6	-179.1	-77.2	170.2	-14.2	0	0	113.4	V217 D218 A252	V217-Q256 HydrophobicContact CB-CG 4.39Å; V217-Q256 HydrophobicContact CG1-CG 3.88Å; D218-Q256 HydrophobicContact CB-CG 4.12Å; A252-Q256 WeakPolarHBondContact O-CG 3.14Å; A252-Q256 PolarHBondContact O-N 3.42Å
257	N	93.9	Very high	92.1	Very high	94 Å²	94	61.3 Å²	61.3	50%	0.503	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	2.8	-178.2	-66.9	-81.2	0	0	0	113.8	F253 A254 I255 A259	F253-N257 PolarHBondContact O-N 3.32Å; F253-N257 PolarHBondContact O-ND2 2.93Å; A254-N257 PolarHBondContact O-N 2.93Å; I255-N257 PolarHBondContact O-N 3.13Å; I255-N257 VanDerWaalsContact O-N 3.16Å; N257-A259 HydrophobicContact CB-CB 4.19Å; N257-A259 PolarHBondContact O-N 3.48Å
258	A	94.9	Very high	91.4	Very high	22 Å²	22	61 Å²	61	18%	0.182	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	39.7	-167.1	0	0	0	0	0	113.2	W232 A254 I255 F260 A282	W232-A258 HydrophobicContact CH2-CB 3.87Å; W232-A258 HydrophobicContact CZ3-CB 4.09Å; A254-A258 WeakPolarHBondContact O-CA 3.42Å; A254-A258 PolarHBondContact O-N 2.87Å; A254-A258 VanDerWaalsContact O-N 3.09Å; I255-A258 PolarHBondContact O-N 3.09Å; A258-F260 VanDerWaalsContact O-CD1 3.29Å; A258-F260 WeakPolarHBondContact O-CD1 3.49Å; A258-F260 PolarHBondContact O-N 2.96Å; A258-A282 HydrophobicContact CB-CB 4.02Å
259	A	95.6	Very high	90	Very high	60 Å²	60	62.7 Å²	62.7	50%	0.496	37%	0.368	S	S	.	.			trans	-88.6	93.5	-174.8	0	0	0	0	0	111.2	A254 N257	A254-A259 PolarHBondContact O-N 2.87Å; N257-A259 HydrophobicContact CB-CB 4.19Å; N257-A259 PolarHBondContact O-N 3.48Å
260	F	94.7	Very high	89	Confident	50 Å²	50	60.1 Å²	60.1	22%	0.219	37%	0.37	C	S	.	.			trans	-134.9	169	173.6	69.1	-77.5	0	0	0	110.9	Y239 P247 F248 A258 F262 I276 L280	Y239-F260 HydrophobicContact CD2-CD2 4.27Å; Y239-F260 HydrophobicContact CE2-CD2 4.08Å; P247-F260 HydrophobicContact CB-CB 3.77Å; P247-F260 HydrophobicContact CB-CD2 4.23Å; P247-F260 HydrophobicContact CB-CG 4.09Å; P247-F260 WeakPolarHBondContact O-CB 3.31Å; F248-F260 HydrophobicContact CD1-CB 4.13Å; F248-F260 HydrophobicContact CE1-CB 3.7Å; F248-F260 AromaticContact CE1-CD1 3.7Å; F248-F260 HydrophobicContact CE1-CD1 3.7Å; F248-F260 HydrophobicContact CE1-CG 4.08Å; F248-F260 HydrophobicContact CZ-CB 4.3Å; F248-F260 AromaticContact CZ-CD1 3.75Å; F248-F260 HydrophobicContact CZ-CD1 3.75Å; F248-F260 HydrophobicContact CZ-CE1 4.5Å; F248-F260 HydrophobicContact CZ-CG 4.27Å; A258-F260 VanDerWaalsContact O-CD1 3.29Å; A258-F260 WeakPolarHBondContact O-CD1 3.49Å; A258-F260 PolarHBondContact O-N 2.96Å; F260-F262 HydrophobicContact CD2-CZ 4.5Å; F260-F262 AromaticContact CE2-CE1 3.99Å; F260-F262 HydrophobicContact CE2-CE1 3.99Å; F260-F262 AromaticContact CE2-CE2 3.79Å; F260-F262 HydrophobicContact CE2-CE2 3.79Å; F260-F262 AromaticContact CE2-CZ 3.52Å; F260-F262 HydrophobicContact CE2-CZ 3.52Å; F260-F262 HydrophobicContact CZ-CE2 4.47Å; F260-F262 HydrophobicContact CZ-CZ 4.26Å; F260-I276 HydrophobicContact CE2-CG2 4.11Å; F260-I276 HydrophobicContact CZ-CG2 4.38Å; F260-L280 HydrophobicContact CD1-CD1 4.08Å; F260-L280 HydrophobicContact CD2-CD1 4.33Å; F260-L280 HydrophobicContact CE1-CB 3.73Å; F260-L280 HydrophobicContact CE1-CD1 3.74Å; F260-L280 HydrophobicContact CE1-CG 4.4Å; F260-L280 HydrophobicContact CE2-CD1 3.99Å; F260-L280 HydrophobicContact CG-CD1 4.39Å; F260-L280 HydrophobicContact CZ-CB 4.02Å; F260-L280 HydrophobicContact CZ-CD1 3.7Å; F260-L280 HydrophobicContact CZ-CG 4.46Å
261	S	94	Very high	88.6	Confident	92 Å²	92	58.9 Å²	58.9	64%	0.643	36%	0.363	S	S	*	.			trans	-143.5	141.5	177.5	60.4	0	0	0	0	110.4	Y239	Y239-S261 PolarHBondContact OH-O 3.28Å; Y239-S261 VanDerWaalsContact OH-O 3.12Å
262	F	93.1	Very high	88.5	Confident	44 Å²	44	56.2 Å²	56.2	19%	0.193	35%	0.345	C	S	.	.			trans	-77.8	136.1	175.5	-62.5	-75.2	0	0	0	112	Y239 Y243 F260 Q273 I276 F325	Y239-F262 HydrophobicContact CD2-CD1 4.15Å; Y239-F262 AromaticContact CD2-CE1 3.99Å; Y239-F262 HydrophobicContact CD2-CE1 3.99Å; Y239-F262 AromaticContact CE2-CD1 3.93Å; Y239-F262 HydrophobicContact CE2-CD1 3.93Å; Y239-F262 HydrophobicContact CE2-CE1 4.2Å; Y243-F262 AromaticContact CE2-CD1 3.64Å; Y243-F262 HydrophobicContact CE2-CD1 3.64Å; Y243-F262 HydrophobicContact CE2-CE1 4.22Å; Y243-F262 AromaticContact CZ-CD1 3.98Å; F260-F262 HydrophobicContact CD2-CZ 4.5Å; F260-F262 AromaticContact CE2-CE1 3.99Å; F260-F262 HydrophobicContact CE2-CE1 3.99Å; F260-F262 AromaticContact CE2-CE2 3.79Å; F260-F262 HydrophobicContact CE2-CE2 3.79Å; F260-F262 AromaticContact CE2-CZ 3.52Å; F260-F262 HydrophobicContact CE2-CZ 3.52Å; F260-F262 HydrophobicContact CZ-CE2 4.47Å; F260-F262 HydrophobicContact CZ-CZ 4.26Å; F262-Q273 HydrophobicContact CB-CG 4.45Å; F262-Q273 VanDerWaalsContact CB-NE2 3.3Å; F262-Q273 HydrophobicContact CD1-CB 4.24Å; F262-Q273 HydrophobicContact CD1-CG 3.58Å; F262-Q273 HydrophobicContact CD2-CB 4.17Å; F262-Q273 HydrophobicContact CD2-CG 4.07Å; F262-Q273 HydrophobicContact CE1-CB 3.89Å; F262-Q273 HydrophobicContact CE1-CG 3.67Å; F262-Q273 HydrophobicContact CE2-CB 3.84Å; F262-Q273 HydrophobicContact CE2-CG 4.17Å; F262-Q273 HydrophobicContact CG-CB 4.34Å; F262-Q273 VanDerWaalsContact CG-CD 3.46Å; F262-Q273 HydrophobicContact CG-CG 3.77Å; F262-Q273 HydrophobicContact CZ-CB 3.65Å; F262-Q273 HydrophobicContact CZ-CG 3.95Å; F262-Q273 WeakPolarHBondContact CZ-O 3.22Å; F262-I276 HydrophobicContact CE1-CB 4.03Å; F262-I276 HydrophobicContact CE1-CD1 3.8Å; F262-I276 HydrophobicContact CE1-CG2 3.84Å; F262-I276 HydrophobicContact CZ-CB 4Å; F262-I276 HydrophobicContact CZ-CG2 3.89Å; F262-F325 HydrophobicContact CD2-CE2 4.27Å; F262-F325 AromaticContact CD2-CZ 3.75Å; F262-F325 HydrophobicContact CD2-CZ 3.75Å; F262-F325 AromaticContact CE2-CE2 3.61Å; F262-F325 HydrophobicContact CE2-CE2 3.61Å; F262-F325 AromaticContact CE2-CZ 3.5Å; F262-F325 HydrophobicContact CE2-CZ 3.5Å; F262-F325 VanDerWaalsContact CE2-CZ 3.5Å; F262-F325 HydrophobicContact CZ-CE2 4.45Å; F262-F325 HydrophobicContact CZ-CZ 4.41Å
263	P	91.1	Very high	88.6	Confident	45 Å²	45	55.2 Å²	55.2	29%	0.292	33%	0.333	S	S	.	.			trans	-58.3	152.9	164.2	-25.4	36.5	0	0	0	111.9	Y239 Y243 E265	Y239-P263 WeakPolarHBondContact OH-CD 3.44Å; Y243-P263 HydrophobicContact CD1-CB 3.95Å; Y243-P263 HydrophobicContact CD1-CG 3.59Å; Y243-P263 HydrophobicContact CE1-CB 4.15Å; Y243-P263 HydrophobicContact CE1-CG 4.1Å; Y243-P263 HydrophobicContact CG-CG 3.95Å; P263-E265 VanDerWaalsContact C-N 3.35Å; P263-E265 VanDerWaalsContact CB-O 3.31Å; P263-E265 WeakPolarHBondContact CB-O 3.37Å
264	S	85.3	Confident	88.6	Confident	109 Å²	109	48.3 Å²	48.3	76%	0.762	30%	0.304	S	S	*	.	S	Bend	trans	-69.8	-34.6	172.8	53.7	0	0	0	0	112.3
265	E	83.9	Confident	88.6	Confident	127 Å²	127	47.6 Å²	47.6	59%	0.593	30%	0.298	S	S	*	.	S	Bend	trans	-124.7	144.2	177.2	-68.3	-58.4	158.1	0	0	110.8	P263 A267	P263-E265 VanDerWaalsContact C-N 3.35Å; P263-E265 VanDerWaalsContact CB-O 3.31Å; P263-E265 WeakPolarHBondContact CB-O 3.37Å; E265-A267 PolarHBondContact OE2-N 2.94Å
266	P	85.7	Confident	88.7	Confident	21 Å²	21	47.6 Å²	47.6	14%	0.136	30%	0.298	C	S	.	.	S	Bend	cis	-69.7	145.5	-10.6	31.7	-40.9	0	0	0	112.8	Y131 Y243 Y268	Y131-P266 HydrophobicContact CD1-CG 3.77Å; Y131-P266 HydrophobicContact CD2-CB 3.94Å; Y131-P266 HydrophobicContact CD2-CG 3.79Å; Y131-P266 HydrophobicContact CE1-CG 4.18Å; Y131-P266 HydrophobicContact CE2-CB 4.45Å; Y131-P266 HydrophobicContact CE2-CG 4.21Å; Y131-P266 HydrophobicContact CG-CB 4.12Å; Y131-P266 HydrophobicContact CG-CG 3.56Å; Y243-P266 HydrophobicContact CD1-CG 4.43Å; Y243-P266 HydrophobicContact CE1-CG 4.43Å; P266-Y268 VanDerWaalsContact C-N 3.35Å; P266-Y268 HydrophobicContact CB-CD2 4.47Å; P266-Y268 HydrophobicContact CB-CE2 4.07Å; P266-Y268 HydrophobicContact CG-CD2 3.84Å; P266-Y268 HydrophobicContact CG-CE2 3.21Å; P266-Y268 WeakPolarHBondContact O-CD2 3.37Å; P266-Y268 PolarHBondContact O-N 3.48Å
267	A	82	Confident	88.7	Confident	74 Å²	74	46.2 Å²	46.2	61%	0.612	30%	0.296	S	S	*	.			trans	-75.3	64.8	-173.3	0	0	0	0	0	115.8	E265 A269	E265-A267 PolarHBondContact OE2-N 2.94Å; A267-A269 PolarHBondContact O-N 2.91Å; A267-A269 VanDerWaalsContact O-N 3.16Å
268	Y	83.5	Confident	88.9	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.039	28%	0.281	C	S	.	.			trans	-73.2	4.9	172.1	-56.6	-75.4	0	0	0	115.3	L132 V137 C242 Y243 P266 A270 N271 L272	L132-Y268 PolarHBondContact O-OH 3.19Å; V137-Y268 HydrophobicContact CG2-CE1 4.4Å; C242-Y268 HydrophobicContact CB-CD2 3.59Å; C242-Y268 HydrophobicContact CB-CE2 3.31Å; C242-Y268 HydrophobicContact CB-CG 4.46Å; C242-Y268 WeakPolarHBondContact O-CE2 3.49Å; C242-Y268 PolarHBondContact O-OH 3.08Å; C242-Y268 VanDerWaalsContact O-OH 3.08Å; Y243-Y268 AromaticContact CE1-CD2 3.86Å; Y243-Y268 HydrophobicContact CE1-CD2 3.86Å; Y243-Y268 HydrophobicContact CE1-CE2 4.26Å; Y243-Y268 AromaticContact CZ-CD2 3.82Å; P266-Y268 VanDerWaalsContact C-N 3.35Å; P266-Y268 HydrophobicContact CB-CD2 4.47Å; P266-Y268 HydrophobicContact CB-CE2 4.07Å; P266-Y268 HydrophobicContact CG-CD2 3.84Å; P266-Y268 HydrophobicContact CG-CE2 3.21Å; P266-Y268 WeakPolarHBondContact O-CD2 3.37Å; P266-Y268 PolarHBondContact O-N 3.48Å; Y268-A270 VanDerWaalsContact C-N 3.34Å; Y268-A270 PolarHBondContact O-N 3.46Å; Y268-A270 VanDerWaalsContact O-N 3.14Å; Y268-N271 PolarHBondContact O-N 2.72Å; Y268-N271 VanDerWaalsContact O-N 3.09Å; Y268-L272 HydrophobicContact CD1-CD1 3.76Å; Y268-L272 HydrophobicContact CE1-CD1 4.32Å; Y268-L272 HydrophobicContact CG-CD1 4.17Å; Y268-L272 PolarHBondContact O-N 2.92Å
269	A	66.6	Low	89	Confident	45 Å²	45	43.1 Å²	43.1	37%	0.372	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-37.3	-157.4	0	0	0	0	0	115.6	A267 N271 Q273	A267-A269 PolarHBondContact O-N 2.91Å; A267-A269 VanDerWaalsContact O-N 3.16Å; A269-N271 VanDerWaalsContact C-N 3.28Å; A269-N271 PolarHBondContact O-N 3.31Å; A269-Q273 VanDerWaalsContact CA-CD 3.46Å
270	A	68.4	Low	89.1	Confident	53 Å²	53	40.6 Å²	40.6	44%	0.438	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.6	-177.4	0	0	0	0	0	114.7	Y268 K322	Y268-A270 VanDerWaalsContact C-N 3.34Å; Y268-A270 PolarHBondContact O-N 3.46Å; Y268-A270 VanDerWaalsContact O-N 3.14Å; A270-K322 WeakPolarHBondContact O-CE 3.46Å; A270-K322 PolarHBondContact O-NZ 3.31Å
271	N	80.4	Confident	89.2	Confident	63 Å²	63	40.8 Å²	40.8	34%	0.337	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-54.7	-168.1	-69.8	-35.7	0	0	0	113.8	Y268 A269 L300 K322	Y268-N271 PolarHBondContact O-N 2.72Å; Y268-N271 VanDerWaalsContact O-N 3.09Å; A269-N271 VanDerWaalsContact C-N 3.28Å; A269-N271 PolarHBondContact O-N 3.31Å; N271-L300 HydrophobicContact CB-CD2 4.37Å; N271-L300 WeakPolarHBondContact O-CD1 3.41Å; N271-K322 PolarHBondContact OD1-NZ 3.47Å
272	L	93.1	Very high	89.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-29.3	-167.3	-60.3	175.1	0	0	0	114.2	V137 L138 Y268 L275 I276 L300	V137-L272 HydrophobicContact CB-CD1 4.17Å; V137-L272 HydrophobicContact CG1-CD1 3.8Å; L138-L272 HydrophobicContact CD1-CD2 4.46Å; L138-L272 HydrophobicContact CD2-CD2 3.67Å; L138-L272 HydrophobicContact CG-CD2 3.92Å; Y268-L272 HydrophobicContact CD1-CD1 3.76Å; Y268-L272 HydrophobicContact CE1-CD1 4.32Å; Y268-L272 HydrophobicContact CG-CD1 4.17Å; Y268-L272 PolarHBondContact O-N 2.92Å; L272-L275 PolarHBondContact O-N 2.91Å; L272-L275 VanDerWaalsContact O-N 3.15Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 2.9Å; L272-L300 HydrophobicContact CD2-CD1 4.12Å
273	Q	94.5	Very high	89.4	Confident	18 Å²	18	38.7 Å²	38.7	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-37.9	179.9	-62.8	-175.6	-8.8	0	0	114.3	Y243 F262 A269 L275 I276 S277 F325	Y243-Q273 PolarHBondContact OH-NE2 2.89Å; F262-Q273 HydrophobicContact CB-CG 4.45Å; F262-Q273 VanDerWaalsContact CB-NE2 3.3Å; F262-Q273 HydrophobicContact CD1-CB 4.24Å; F262-Q273 HydrophobicContact CD1-CG 3.58Å; F262-Q273 HydrophobicContact CD2-CB 4.17Å; F262-Q273 HydrophobicContact CD2-CG 4.07Å; F262-Q273 HydrophobicContact CE1-CB 3.89Å; F262-Q273 HydrophobicContact CE1-CG 3.67Å; F262-Q273 HydrophobicContact CE2-CB 3.84Å; F262-Q273 HydrophobicContact CE2-CG 4.17Å; F262-Q273 HydrophobicContact CG-CB 4.34Å; F262-Q273 VanDerWaalsContact CG-CD 3.46Å; F262-Q273 HydrophobicContact CG-CG 3.77Å; F262-Q273 HydrophobicContact CZ-CB 3.65Å; F262-Q273 HydrophobicContact CZ-CG 3.95Å; F262-Q273 WeakPolarHBondContact CZ-O 3.22Å; A269-Q273 VanDerWaalsContact CA-CD 3.46Å; Q273-L275 PolarHBondContact O-N 3.28Å; Q273-I276 PolarHBondContact O-N 2.82Å; Q273-S277 WeakPolarHBondContact O-CB 3.5Å; Q273-S277 PolarHBondContact O-N 3.45Å; Q273-S277 PolarHBondContact O-OG 2.93Å; Q273-F325 HydrophobicContact CB-CD1 4.31Å; Q273-F325 HydrophobicContact CB-CE1 3.55Å; Q273-F325 HydrophobicContact CB-CE2 4.24Å; Q273-F325 HydrophobicContact CB-CZ 3.51Å; Q273-F325 HydrophobicContact CG-CE1 4.49Å; Q273-F325 HydrophobicContact CG-CZ 4.45Å; Q273-F325 VanDerWaalsContact OE1-CE1 3.23Å
274	P	94.3	Very high	89.6	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.032	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-40.1	173.1	-23.8	35.3	0	0	0	112.8	S277 Y278 F296 K322 F325	P274-S277 PolarHBondContact O-N 3.07Å; P274-Y278 WeakPolarHBondContact O-CB 3.41Å; P274-Y278 PolarHBondContact O-N 3.25Å; P274-F296 HydrophobicContact CB-CZ 4.07Å; P274-K322 HydrophobicContact CG-CG 4.08Å; P274-F325 HydrophobicContact CB-CB 4.04Å; P274-F325 HydrophobicContact CB-CG 4.26Å; P274-F325 HydrophobicContact CG-CB 3.84Å; P274-F325 HydrophobicContact CG-CD1 3.88Å; P274-F325 HydrophobicContact CG-CG 3.86Å
275	L	96	Very high	90	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-69	-41.2	178.3	175.5	54.7	0	0	0	112	F141 L238 L272 Q273 S277 Y278 M279 V293 F296 A297 L300	F141-L275 HydrophobicContact CD1-CD2 4.41Å; F141-L275 HydrophobicContact CE1-CD2 4.03Å; L238-L275 HydrophobicContact CD2-CB 4.37Å; L238-L275 HydrophobicContact CD2-CD2 3.86Å; L238-L275 HydrophobicContact CD2-CG 3.79Å; L272-L275 PolarHBondContact O-N 2.91Å; L272-L275 VanDerWaalsContact O-N 3.15Å; Q273-L275 PolarHBondContact O-N 3.28Å; L275-S277 VanDerWaalsContact C-N 3.33Å; L275-S277 PolarHBondContact O-N 2.92Å; L275-Y278 PolarHBondContact O-N 3.2Å; L275-M279 HydrophobicContact CD1-CE 4.19Å; L275-M279 HydrophobicContact CG-CE 4.05Å; L275-M279 PolarHBondContact O-N 3.38Å; L275-V293 HydrophobicContact CD1-CG1 4.44Å; L275-F296 HydrophobicContact CB-CD1 4.05Å; L275-F296 HydrophobicContact CB-CE1 4Å; L275-F296 HydrophobicContact CB-CZ 4.4Å; L275-F296 HydrophobicContact CD1-CB 3.92Å; L275-F296 HydrophobicContact CD1-CD1 4.14Å; L275-F296 HydrophobicContact CD1-CD2 4.22Å; L275-F296 HydrophobicContact CD1-CG 3.85Å; L275-F296 HydrophobicContact CD2-CD1 4.35Å; L275-F296 HydrophobicContact CG-CD1 4.4Å; L275-A297 HydrophobicContact CD2-CB 3.93Å; L275-L300 HydrophobicContact CB-CD1 4.26Å; L275-L300 HydrophobicContact CD2-CD1 3.87Å
276	I	97.1	Very high	90.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-47.3	171.6	-66.7	166	0	0	0	110.2	L238 Y239 Y243 F260 F262 L272 Q273 Y278 M279 L280	L238-I276 HydrophobicContact CB-CG1 4.08Å; L238-I276 HydrophobicContact CD2-CD1 4.49Å; L238-I276 HydrophobicContact CD2-CG1 3.61Å; L238-I276 HydrophobicContact CG-CD1 4.09Å; L238-I276 HydrophobicContact CG-CG1 3.6Å; Y239-I276 HydrophobicContact CD2-CG2 4.25Å; Y243-I276 HydrophobicContact CE2-CD1 4.4Å; F260-I276 HydrophobicContact CE2-CG2 4.11Å; F260-I276 HydrophobicContact CZ-CG2 4.38Å; F262-I276 HydrophobicContact CE1-CB 4.03Å; F262-I276 HydrophobicContact CE1-CD1 3.8Å; F262-I276 HydrophobicContact CE1-CG2 3.84Å; F262-I276 HydrophobicContact CZ-CB 4Å; F262-I276 HydrophobicContact CZ-CG2 3.89Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 2.9Å; Q273-I276 PolarHBondContact O-N 2.82Å; I276-Y278 VanDerWaalsContact C-N 3.28Å; I276-Y278 PolarHBondContact O-N 3.38Å; I276-M279 PolarHBondContact O-N 3.16Å; I276-L280 HydrophobicContact CG2-CD1 3.68Å; I276-L280 HydrophobicContact CG2-CG 4.25Å; I276-L280 WeakPolarHBondContact O-CB 3.43Å; I276-L280 WeakPolarHBondContact O-CG 3.45Å; I276-L280 PolarHBondContact O-N 3.42Å
277	S	95.6	Very high	91.1	Very high	39 Å²	39	32 Å²	32	27%	0.273	21%	0.207	S	C	.	.	H	α-helix	trans	-66.7	-28.4	-180	-54.4	0	0	0	0	113.3	Q273 P274 L275 F325	Q273-S277 WeakPolarHBondContact O-CB 3.5Å; Q273-S277 PolarHBondContact O-N 3.45Å; Q273-S277 PolarHBondContact O-OG 2.93Å; P274-S277 PolarHBondContact O-N 3.07Å; L275-S277 VanDerWaalsContact C-N 3.33Å; L275-S277 PolarHBondContact O-N 2.92Å; S277-F325 VanDerWaalsContact OG-CE2 3.23Å; S277-F325 WeakPolarHBondContact OG-CE2 3.47Å
278	Y	96	Very high	91.8	Very high	51 Å²	51	28.5 Å²	28.5	20%	0.2	18%	0.179	C	C	.	.	H	α-helix	trans	-69.6	-38.6	175.3	-173.9	-138.1	0	0	0	111.6	P274 L275 I276 P288 Q292 F296 P316	P274-Y278 WeakPolarHBondContact O-CB 3.41Å; P274-Y278 PolarHBondContact O-N 3.25Å; L275-Y278 PolarHBondContact O-N 3.2Å; I276-Y278 VanDerWaalsContact C-N 3.28Å; I276-Y278 PolarHBondContact O-N 3.38Å; Y278-P288 HydrophobicContact CD1-CB 4.22Å; Y278-P288 HydrophobicContact CD1-CG 3.84Å; Y278-P288 HydrophobicContact CD2-CG 4.24Å; Y278-P288 HydrophobicContact CE1-CB 3.63Å; Y278-P288 HydrophobicContact CE1-CG 3.79Å; Y278-P288 HydrophobicContact CE2-CB 4.14Å; Y278-P288 HydrophobicContact CE2-CG 4.19Å; Y278-P288 HydrophobicContact CG-CG 4.07Å; Y278-P288 WeakPolarHBondContact O-CD 3.14Å; Y278-Q292 HydrophobicContact CE1-CB 4.19Å; Y278-F296 AromaticContact CD1-CD2 3.81Å; Y278-F296 HydrophobicContact CD1-CD2 3.81Å; Y278-F296 HydrophobicContact CD1-CE2 4.28Å; Y278-F296 HydrophobicContact CE1-CD2 4.15Å; Y278-P316 HydrophobicContact CE1-CB 4.02Å; Y278-P316 HydrophobicContact CE1-CG 4.07Å
279	M	98.2	Very high	92.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-78.9	-39.4	176.5	-71.5	-173.4	-78.2	0	0	114.1	F141 I231 L234 L238 L275 I276 N281 R287 V293	F141-M279 HydrophobicContact CE1-CE 4.14Å; F141-M279 HydrophobicContact CE2-CE 3.97Å; F141-M279 HydrophobicContact CE2-SD 4.35Å; F141-M279 HydrophobicContact CZ-CE 3.39Å; F141-M279 HydrophobicContact CZ-SD 3.68Å; I231-M279 HydrophobicContact CG2-CB 4.37Å; I231-M279 HydrophobicContact CG2-CG 4.06Å; L234-M279 HydrophobicContact CB-SD 3.67Å; L238-M279 HydrophobicContact CB-CE 4.12Å; L238-M279 HydrophobicContact CD2-CE 3.59Å; L275-M279 HydrophobicContact CD1-CE 4.19Å; L275-M279 HydrophobicContact CG-CE 4.05Å; L275-M279 PolarHBondContact O-N 3.38Å; I276-M279 PolarHBondContact O-N 3.16Å; M279-N281 PolarHBondContact O-N 2.89Å; M279-R287 WeakPolarHBondContact O-CD 3.47Å; M279-R287 WeakPolarHBondContact O-CG 3.4Å; M279-V293 HydrophobicContact CG-CG1 4.28Å; M279-V293 HydrophobicContact CG-CG2 3.66Å; M279-V293 HydrophobicContact SD-CG1 3.63Å; M279-V293 HydrophobicContact SD-CG2 4.03Å
280	L	97.9	Very high	94.1	Very high	6 Å²	6	26.9 Å²	26.9	3%	0.031	16%	0.164	C	C	.	.			trans	-79.3	43.7	-179.6	-64	-176.8	0	0	0	112.7	W232 V236 P247 F248 F260 I276	W232-L280 HydrophobicContact CD2-CD2 3.82Å; W232-L280 HydrophobicContact CE3-CD2 3.97Å; W232-L280 HydrophobicContact CG-CD2 4.31Å; W232-L280 HydrophobicContact CH2-CD2 4.49Å; W232-L280 HydrophobicContact CZ2-CD2 4.35Å; W232-L280 HydrophobicContact CZ3-CB 4.33Å; W232-L280 HydrophobicContact CZ3-CD2 4.3Å; V236-L280 HydrophobicContact CG2-CD2 3.9Å; P247-L280 HydrophobicContact CB-CD1 4.4Å; P247-L280 HydrophobicContact CG-CD1 4.26Å; F248-L280 HydrophobicContact CE2-CD1 4.25Å; F248-L280 HydrophobicContact CE2-CD2 4.12Å; F248-L280 HydrophobicContact CZ-CD1 4.12Å; F248-L280 HydrophobicContact CZ-CD2 4.41Å; F260-L280 HydrophobicContact CD1-CD1 4.08Å; F260-L280 HydrophobicContact CD2-CD1 4.33Å; F260-L280 HydrophobicContact CE1-CB 3.73Å; F260-L280 HydrophobicContact CE1-CD1 3.74Å; F260-L280 HydrophobicContact CE1-CG 4.4Å; F260-L280 HydrophobicContact CE2-CD1 3.99Å; F260-L280 HydrophobicContact CG-CD1 4.39Å; F260-L280 HydrophobicContact CZ-CB 4.02Å; F260-L280 HydrophobicContact CZ-CD1 3.7Å; F260-L280 HydrophobicContact CZ-CG 4.46Å; I276-L280 HydrophobicContact CG2-CD1 3.68Å; I276-L280 HydrophobicContact CG2-CG 4.25Å; I276-L280 WeakPolarHBondContact O-CB 3.43Å; I276-L280 WeakPolarHBondContact O-CG 3.45Å; I276-L280 PolarHBondContact O-N 3.42Å
281	N	96.4	Very high	95.5	Very high	55 Å²	55	25.2 Å²	25.2	29%	0.294	15%	0.147	S	C	.	.			trans	-83.5	127.6	172.5	-168.4	-17	0	0	0	110.2	M279 D283 A286 R287	M279-N281 PolarHBondContact O-N 2.89Å; N281-D283 PolarHBondContact O-N 3.27Å; N281-D283 PolarHBondContact OD1-N 3.21Å; N281-A286 VanDerWaalsContact ND2-CB 3.32Å; N281-A286 WeakPolarHBondContact ND2-CB 3.45Å; N281-A286 PolarHBondContact ND2-O 2.97Å; N281-R287 HydrophobicContact CB-CB 4.24Å; N281-R287 HydrophobicContact CB-CG 4.37Å; N281-R287 PolarHBondContact O-NE 3.46Å; N281-R287 PolarHBondContact O-NH2 3.12Å; N281-R287 VanDerWaalsContact O-NH2 3.11Å
282	A	96	Very high	96.3	Very high	39 Å²	39	23.7 Å²	23.7	32%	0.322	14%	0.138	S	C	.	.	S	Bend	trans	-63	-40.6	-177.5	0	0	0	0	0	112.6	A258 C284 R287	A258-A282 HydrophobicContact CB-CB 4.02Å; A282-C284 PolarHBondContact O-N 3.38Å; A282-R287 PolarHBondContact O-NH2 2.95Å
283	D	95.2	Very high	96.6	Very high	53 Å²	53	23.7 Å²	23.7	28%	0.283	14%	0.138	S	C	.	.	S	Bend	trans	-80.9	118.2	176.2	175.6	52.3	0	0	0	111.1	R223 N281 N285 A286 R287	R223-D283 IonicContact CZ-OD1 3.13Å; R223-D283 IonicContact NE-OD1 2.75Å; R223-D283 IonicContact NH2-OD1 2.71Å; R223-D283 PolarHBondContact NH2-OD1 3.11Å; N281-D283 PolarHBondContact O-N 3.27Å; N281-D283 PolarHBondContact OD1-N 3.21Å; D283-N285 PolarHBondContact O-N 3.32Å; D283-N285 PolarHBondContact OD1-ND2 3.36Å; D283-N285 WeakPolarHBondContact OD2-CB 3.49Å; D283-N285 PolarHBondContact OD2-N 3.49Å; D283-A286 HydrophobicContact CB-CB 4.31Å; D283-A286 PolarHBondContact O-N 2.9Å; D283-A286 WeakPolarHBondContact OD2-CB 3.46Å; D283-A286 PolarHBondContact OD2-N 3.2Å; D283-R287 WeakPolarHBondContact O-CB 3.16Å; D283-R287 PolarHBondContact O-N 3.35Å
284	C	95.4	Very high	96.7	Very high	6 Å²	6	22.8 Å²	22.8	4%	0.041	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.7	-180	62.3	0	0	0	0	113.9	K228 A282	K228-C284 HydrophobicContact CB-CB 4.32Å; K228-C284 WeakPolarHBondContact CG-O 3.49Å; K228-C284 PolarHBondContact NZ-O 3.13Å; A282-C284 PolarHBondContact O-N 3.38Å
285	N	94.4	Very high	96.9	Very high	94 Å²	94	26.5 Å²	26.5	50%	0.503	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-47.9	177.2	-51.3	-70.4	0	0	0	110.7	R223 K228 D283 R287	R223-N285 PolarHBondContact NE-ND2 2.96Å; R223-N285 PolarHBondContact NH2-ND2 2.81Å; R223-N285 VanDerWaalsContact NH2-ND2 3.13Å; K228-N285 PolarHBondContact NZ-O 2.84Å; D283-N285 PolarHBondContact O-N 3.32Å; D283-N285 PolarHBondContact OD1-ND2 3.36Å; D283-N285 WeakPolarHBondContact OD2-CB 3.49Å; D283-N285 PolarHBondContact OD2-N 3.49Å; N285-R287 VanDerWaalsContact C-N 3.29Å; N285-R287 PolarHBondContact O-N 3.07Å
286	A	95.1	Very high	96.9	Very high	59 Å²	59	26.5 Å²	26.5	49%	0.488	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-14	175.1	0	0	0	0	0	114.6	N281 D283	N281-A286 VanDerWaalsContact ND2-CB 3.32Å; N281-A286 WeakPolarHBondContact ND2-CB 3.45Å; N281-A286 PolarHBondContact ND2-O 2.97Å; D283-A286 HydrophobicContact CB-CB 4.31Å; D283-A286 PolarHBondContact O-N 2.9Å; D283-A286 WeakPolarHBondContact OD2-CB 3.46Å; D283-A286 PolarHBondContact OD2-N 3.2Å
287	R	97	Very high	96.9	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.008	15%	0.148	C	C	.	.	S	Bend	trans	-64.7	137.3	170.2	-160.8	178.3	-55.2	141.3	7.2	110.2	E215 K228 I231 M279 N281 A282 D283 N285	E215-R287 IonicContact OE1-CZ 3.83Å; E215-R287 IonicContact OE1-NH1 2.64Å; E215-R287 PolarHBondContact OE1-NH1 3.29Å; E215-R287 IonicContact OE1-NH2 2.63Å; E215-R287 IonicContact OE2-CZ 2.73Å; E215-R287 IonicContact OE2-NH1 2.84Å; E215-R287 PolarHBondContact OE2-NH1 2.73Å; E215-R287 IonicContact OE2-NH2 3.77Å; E215-R287 PolarHBondContact OE2-NH2 2.64Å; K228-R287 WeakPolarHBondContact CE-O 3.36Å; K228-R287 PolarHBondContact NZ-O 3.17Å; K228-R287 WeakPolarHBondContact O-CD 3.39Å; K228-R287 PolarHBondContact O-NH1 3.27Å; I231-R287 HydrophobicContact CB-CG 4.4Å; I231-R287 HydrophobicContact CG2-CG 3.93Å; M279-R287 WeakPolarHBondContact O-CD 3.47Å; M279-R287 WeakPolarHBondContact O-CG 3.4Å; N281-R287 HydrophobicContact CB-CB 4.24Å; N281-R287 HydrophobicContact CB-CG 4.37Å; N281-R287 PolarHBondContact O-NE 3.46Å; N281-R287 PolarHBondContact O-NH2 3.12Å; N281-R287 VanDerWaalsContact O-NH2 3.11Å; A282-R287 PolarHBondContact O-NH2 2.95Å; D283-R287 WeakPolarHBondContact O-CB 3.16Å; D283-R287 PolarHBondContact O-N 3.35Å; N285-R287 VanDerWaalsContact C-N 3.29Å; N285-R287 PolarHBondContact O-N 3.07Å
288	P	97.7	Very high	96.9	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	14%	0.135	C	C	.	.			trans	-62.5	167.2	-179.3	24.1	-34.5	0	0	0	113.5	K228 I231 Y278 Q292 V293	K228-P288 VanDerWaalsContact CD-O 3.26Å; K228-P288 WeakPolarHBondContact CD-O 3.32Å; K228-P288 WeakPolarHBondContact CE-O 3.43Å; I231-P288 HydrophobicContact CG2-CG 4.08Å; Y278-P288 HydrophobicContact CD1-CB 4.22Å; Y278-P288 HydrophobicContact CD1-CG 3.84Å; Y278-P288 HydrophobicContact CD2-CG 4.24Å; Y278-P288 HydrophobicContact CE1-CB 3.63Å; Y278-P288 HydrophobicContact CE1-CG 3.79Å; Y278-P288 HydrophobicContact CE2-CB 4.14Å; Y278-P288 HydrophobicContact CE2-CG 4.19Å; Y278-P288 HydrophobicContact CG-CG 4.07Å; Y278-P288 WeakPolarHBondContact O-CD 3.14Å; P288-Q292 HydrophobicContact CB-CB 3.88Å; P288-V293 HydrophobicContact CB-CG2 4.02Å; P288-V293 HydrophobicContact CG-CG2 3.68Å
289	D	98	Very high	96.9	Very high	17 Å²	17	24.8 Å²	24.8	9%	0.091	14%	0.143	C	C	.	.			trans	-90	176.6	162.9	76.7	9.8	0	0	0	112.1	F291 Q292 V293 Y311 V313	D289-F291 VanDerWaalsContact C-N 3.29Å; D289-F291 PolarHBondContact O-N 3.33Å; D289-F291 WeakPolarHBondContact OD1-CA 3.48Å; D289-F291 WeakPolarHBondContact OD1-CB 3.44Å; D289-F291 PolarHBondContact OD1-N 3.01Å; D289-Q292 PolarHBondContact O-N 2.9Å; D289-Q292 WeakPolarHBondContact OD1-CG 3.29Å; D289-Q292 PolarHBondContact OD1-N 3.02Å; D289-V293 WeakPolarHBondContact O-CG2 3.38Å; D289-V293 PolarHBondContact O-N 3.47Å; D289-V293 VanDerWaalsContact O-N 3.12Å; D289-Y311 WeakPolarHBondContact OD2-CD2 3.39Å; D289-V313 WeakPolarHBondContact OD2-CG2 3.12Å
290	I	98.4	Very high	96.6	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.015	15%	0.15	C	C	.	.	H	α-helix	trans	-66.5	-28.5	-179	-168.4	55.3	0	0	0	113.2	C145 V148 A149 H152 Q153 I231 L234 T294	C145-I290 HydrophobicContact CB-CD1 4.23Å; V148-I290 HydrophobicContact CB-CD1 3.99Å; V148-I290 HydrophobicContact CB-CG1 4.34Å; V148-I290 HydrophobicContact CG1-CD1 3.79Å; V148-I290 HydrophobicContact CG1-CG1 4.05Å; A149-I290 HydrophobicContact CB-CG1 3.87Å; A149-I290 HydrophobicContact CB-CG2 4.3Å; H152-I290 HydrophobicContact CB-CG2 3.97Å; Q153-I290 HydrophobicContact CG-CG2 4.37Å; I231-I290 HydrophobicContact CD1-CB 3.98Å; I231-I290 HydrophobicContact CD1-CD1 4.12Å; L234-I290 HydrophobicContact CD1-CD1 3.74Å; I290-T294 VanDerWaalsContact O-CB 3.27Å; I290-T294 WeakPolarHBondContact O-CB 3.32Å; I290-T294 PolarHBondContact O-N 2.86Å; I290-T294 PolarHBondContact O-OG1 2.79Å
291	F	98.3	Very high	96.4	Very high	18 Å²	18	27.5 Å²	27.5	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-67.3	-48.7	176.1	164	-100	0	0	0	110.1	D289 V293 T294 Y295 V307 N309 V313 P315	D289-F291 VanDerWaalsContact C-N 3.29Å; D289-F291 PolarHBondContact O-N 3.33Å; D289-F291 WeakPolarHBondContact OD1-CA 3.48Å; D289-F291 WeakPolarHBondContact OD1-CB 3.44Å; D289-F291 PolarHBondContact OD1-N 3.01Å; F291-V293 PolarHBondContact O-N 3.09Å; F291-T294 PolarHBondContact O-N 2.93Å; F291-Y295 HydrophobicContact CZ-CD2 4.18Å; F291-Y295 VanDerWaalsContact O-CB 3.29Å; F291-Y295 WeakPolarHBondContact O-CB 3.39Å; F291-Y295 PolarHBondContact O-N 3.33Å; F291-V307 HydrophobicContact CB-CG1 4.35Å; F291-V307 HydrophobicContact CD2-CG1 4.39Å; F291-V307 WeakPolarHBondContact CD2-O 3.26Å; F291-N309 HydrophobicContact CD1-CB 3.88Å; F291-N309 VanDerWaalsContact CD1-CG 3.47Å; F291-N309 WeakPolarHBondContact CD1-OD1 3.33Å; F291-N309 HydrophobicContact CD2-CB 3.87Å; F291-N309 HydrophobicContact CE1-CB 3.73Å; F291-N309 VanDerWaalsContact CE1-ND2 3.31Å; F291-N309 WeakPolarHBondContact CE1-ND2 3.22Å; F291-N309 HydrophobicContact CE2-CB 3.73Å; F291-N309 HydrophobicContact CG-CB 3.96Å; F291-N309 HydrophobicContact CZ-CB 3.67Å; F291-V313 HydrophobicContact CD1-CG2 3.96Å; F291-P315 HydrophobicContact CE1-CB 4.4Å
292	Q	97.9	Very high	96.3	Very high	31 Å²	31	28.5 Å²	28.5	15%	0.145	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-41.5	179.1	-67.8	178.2	-48.3	0	0	112.2	Y278 P288 D289 F296 V313 P314 P316	Y278-Q292 HydrophobicContact CE1-CB 4.19Å; P288-Q292 HydrophobicContact CB-CB 3.88Å; D289-Q292 PolarHBondContact O-N 2.9Å; D289-Q292 WeakPolarHBondContact OD1-CG 3.29Å; D289-Q292 PolarHBondContact OD1-N 3.02Å; Q292-F296 WeakPolarHBondContact O-CB 3.45Å; Q292-F296 PolarHBondContact O-N 3.12Å; Q292-F296 VanDerWaalsContact O-N 3.12Å; Q292-V313 HydrophobicContact CG-CG2 3.7Å; Q292-P314 PolarHBondContact NE2-O 3.12Å; Q292-P316 HydrophobicContact CB-CG 4.48Å
293	V	98.1	Very high	96.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-48	174.6	172.5	0	0	0	0	111.3	F141 I231 L275 M279 P288 D289 F291 Y295 F296 A297	F141-V293 HydrophobicContact CE1-CG1 3.93Å; F141-V293 HydrophobicContact CZ-CG1 3.81Å; I231-V293 HydrophobicContact CG2-CG2 3.98Å; L275-V293 HydrophobicContact CD1-CG1 4.44Å; M279-V293 HydrophobicContact CG-CG1 4.28Å; M279-V293 HydrophobicContact CG-CG2 3.66Å; M279-V293 HydrophobicContact SD-CG1 3.63Å; M279-V293 HydrophobicContact SD-CG2 4.03Å; P288-V293 HydrophobicContact CB-CG2 4.02Å; P288-V293 HydrophobicContact CG-CG2 3.68Å; D289-V293 WeakPolarHBondContact O-CG2 3.38Å; D289-V293 PolarHBondContact O-N 3.47Å; D289-V293 VanDerWaalsContact O-N 3.12Å; F291-V293 PolarHBondContact O-N 3.09Å; V293-Y295 VanDerWaalsContact C-N 3.35Å; V293-Y295 PolarHBondContact O-N 2.67Å; V293-F296 PolarHBondContact O-N 3.23Å; V293-A297 WeakPolarHBondContact O-CB 3.3Å; V293-A297 PolarHBondContact O-N 2.85Å
294	T	97.9	Very high	96.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-39	-179	-52.2	0	0	0	0	111.5	C145 F146 I290 F291 A297 C298 V307	C145-T294 HydrophobicContact CB-CG2 4.25Å; F146-T294 HydrophobicContact CD1-CG2 3.7Å; F146-T294 HydrophobicContact CE1-CG2 3.49Å; F146-T294 VanDerWaalsContact CE1-CG2 3.49Å; I290-T294 VanDerWaalsContact O-CB 3.27Å; I290-T294 WeakPolarHBondContact O-CB 3.32Å; I290-T294 PolarHBondContact O-N 2.86Å; I290-T294 PolarHBondContact O-OG1 2.79Å; F291-T294 PolarHBondContact O-N 2.93Å; T294-A297 PolarHBondContact O-N 3.34Å; T294-C298 VanDerWaalsContact O-CB 3.3Å; T294-C298 WeakPolarHBondContact O-CB 3.03Å; T294-C298 PolarHBondContact O-N 3.44Å; T294-V307 HydrophobicContact CG2-CB 4.21Å; T294-V307 HydrophobicContact CG2-CG2 3.76Å
295	Y	97.4	Very high	96.2	Very high	83 Å²	83	34.9 Å²	34.9	33%	0.325	22%	0.217	S	C	.	.	H	α-helix	trans	-58.5	-53.3	175.5	-177.4	-87.9	0	0	0	110.6	F291 V293 A297 C298 S299 C305 P315 P316	F291-Y295 HydrophobicContact CZ-CD2 4.18Å; F291-Y295 VanDerWaalsContact O-CB 3.29Å; F291-Y295 WeakPolarHBondContact O-CB 3.39Å; F291-Y295 PolarHBondContact O-N 3.33Å; V293-Y295 VanDerWaalsContact C-N 3.35Å; V293-Y295 PolarHBondContact O-N 2.67Å; Y295-A297 PolarHBondContact O-N 2.89Å; Y295-C298 PolarHBondContact O-N 2.84Å; Y295-S299 PolarHBondContact O-N 2.99Å; Y295-S299 PolarHBondContact O-OG 3.07Å; Y295-S299 VanDerWaalsContact O-OG 3.06Å; Y295-C305 HydrophobicContact CD2-CB 4.15Å; Y295-P315 HydrophobicContact CD1-CB 3.93Å; Y295-P315 HydrophobicContact CD2-CB 4.22Å; Y295-P315 HydrophobicContact CE1-CB 3.78Å; Y295-P315 HydrophobicContact CE2-CB 4.09Å; Y295-P315 HydrophobicContact CG-CB 4.15Å; Y295-P316 HydrophobicContact CD1-CG 4.04Å
296	F	96.9	Very high	96.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-49.1	177.3	-158.8	-44.8	0	0	0	111.1	P274 L275 Y278 Q292 V293 S299 L300 P316 V318 C321	P274-F296 HydrophobicContact CB-CZ 4.07Å; L275-F296 HydrophobicContact CB-CD1 4.05Å; L275-F296 HydrophobicContact CB-CE1 4Å; L275-F296 HydrophobicContact CB-CZ 4.4Å; L275-F296 HydrophobicContact CD1-CB 3.92Å; L275-F296 HydrophobicContact CD1-CD1 4.14Å; L275-F296 HydrophobicContact CD1-CD2 4.22Å; L275-F296 HydrophobicContact CD1-CG 3.85Å; L275-F296 HydrophobicContact CD2-CD1 4.35Å; L275-F296 HydrophobicContact CG-CD1 4.4Å; Y278-F296 AromaticContact CD1-CD2 3.81Å; Y278-F296 HydrophobicContact CD1-CD2 3.81Å; Y278-F296 HydrophobicContact CD1-CE2 4.28Å; Y278-F296 HydrophobicContact CE1-CD2 4.15Å; Q292-F296 WeakPolarHBondContact O-CB 3.45Å; Q292-F296 PolarHBondContact O-N 3.12Å; Q292-F296 VanDerWaalsContact O-N 3.12Å; V293-F296 PolarHBondContact O-N 3.23Å; F296-S299 PolarHBondContact O-N 3.43Å; F296-L300 HydrophobicContact CD1-CD1 3.76Å; F296-L300 HydrophobicContact CD1-CG 3.9Å; F296-L300 HydrophobicContact CE1-CD1 3.81Å; F296-L300 HydrophobicContact CE1-CD2 4.23Å; F296-L300 HydrophobicContact CE1-CG 4.03Å; F296-L300 WeakPolarHBondContact O-CG 3.41Å; F296-L300 PolarHBondContact O-N 3.06Å; F296-P316 HydrophobicContact CB-CG 4.11Å; F296-P316 HydrophobicContact CD2-CB 4.18Å; F296-P316 HydrophobicContact CD2-CG 4.05Å; F296-V318 HydrophobicContact CB-CG2 4.42Å; F296-V318 HydrophobicContact CD1-CG1 4.1Å; F296-V318 HydrophobicContact CD1-CG2 3.98Å; F296-V318 HydrophobicContact CD2-CG2 4.35Å; F296-V318 HydrophobicContact CE1-CB 4.42Å; F296-V318 HydrophobicContact CE1-CG1 3.74Å; F296-V318 HydrophobicContact CE1-CG2 4.31Å; F296-V318 HydrophobicContact CG-CG2 3.98Å; F296-V318 HydrophobicContact CZ-CG1 4.21Å; F296-C321 HydrophobicContact CE2-CB 3.52Å; F296-C321 HydrophobicContact CZ-CB 3.73Å
297	A	96.6	Very high	96.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-43.9	-178.7	0	0	0	0	0	112.7	F141 C142 L275 V293 T294 Y295 L300 A301	F141-A297 HydrophobicContact CD1-CB 3.89Å; F141-A297 HydrophobicContact CE1-CB 3.93Å; C142-A297 VanDerWaalsContact SG-CB 3.58Å; L275-A297 HydrophobicContact CD2-CB 3.93Å; V293-A297 WeakPolarHBondContact O-CB 3.3Å; V293-A297 PolarHBondContact O-N 2.85Å; T294-A297 PolarHBondContact O-N 3.34Å; Y295-A297 PolarHBondContact O-N 2.89Å; A297-L300 PolarHBondContact O-N 3.19Å; A297-A301 WeakPolarHBondContact O-CB 3.27Å; A297-A301 PolarHBondContact O-N 3.23Å
298	C	96.2	Very high	96.3	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-64.4	-40.6	175.1	-83.2	0	0	0	0	112.2	T294 Y295 L300 A301 G302 R303 C305	T294-C298 VanDerWaalsContact O-CB 3.3Å; T294-C298 WeakPolarHBondContact O-CB 3.03Å; T294-C298 PolarHBondContact O-N 3.44Å; Y295-C298 PolarHBondContact O-N 2.84Å; C298-L300 VanDerWaalsContact C-N 3.34Å; C298-L300 PolarHBondContact O-N 3.04Å; C298-A301 CarbonylContact O-C 3.5Å; C298-A301 WeakPolarHBondContact O-CA 3.46Å; C298-A301 PolarHBondContact O-N 3.39Å; C298-A301 VanDerWaalsContact O-N 3.09Å; C298-G302 PolarHBondContact O-N 2.74Å; C298-G302 VanDerWaalsContact O-N 3.08Å; C298-R303 CarbonylContact C-O 3.53Å; C298-R303 HydrophobicContact CB-CG 3.93Å; C298-R303 WeakPolarHBondContact CB-O 3.38Å; C298-R303 PolarHBondContact O-N 2.59Å; C298-R303 VanDerWaalsContact O-O 3.1Å; C298-C305 HydrophobicContact CB-CB 4.26Å
299	S	94.9	Very high	96.3	Very high	53 Å²	53	37.8 Å²	37.8	37%	0.371	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-39.7	173.7	-62.2	0	0	0	0	112.5	Y295 F296 A301 G302	Y295-S299 PolarHBondContact O-N 2.99Å; Y295-S299 PolarHBondContact O-OG 3.07Å; Y295-S299 VanDerWaalsContact O-OG 3.06Å; F296-S299 PolarHBondContact O-N 3.43Å; S299-A301 VanDerWaalsContact C-N 3.3Å; S299-A301 PolarHBondContact O-N 3.44Å; S299-G302 PolarHBondContact O-N 2.87Å
300	L	94	Very high	96.1	Very high	28 Å²	28	41.5 Å²	41.5	15%	0.147	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-30.9	173.2	-69.1	176.4	0	0	0	112.9	L138 N271 L272 L275 F296 A297 C298 G302 V318	L138-L300 HydrophobicContact CD1-CB 4.05Å; L138-L300 HydrophobicContact CD2-CB 3.86Å; L138-L300 HydrophobicContact CD2-CD1 4.35Å; N271-L300 HydrophobicContact CB-CD2 4.37Å; N271-L300 WeakPolarHBondContact O-CD1 3.41Å; L272-L300 HydrophobicContact CD2-CD1 4.12Å; L275-L300 HydrophobicContact CB-CD1 4.26Å; L275-L300 HydrophobicContact CD2-CD1 3.87Å; F296-L300 HydrophobicContact CD1-CD1 3.76Å; F296-L300 HydrophobicContact CD1-CG 3.9Å; F296-L300 HydrophobicContact CE1-CD1 3.81Å; F296-L300 HydrophobicContact CE1-CD2 4.23Å; F296-L300 HydrophobicContact CE1-CG 4.03Å; F296-L300 WeakPolarHBondContact O-CG 3.41Å; F296-L300 PolarHBondContact O-N 3.06Å; A297-L300 PolarHBondContact O-N 3.19Å; C298-L300 VanDerWaalsContact C-N 3.34Å; C298-L300 PolarHBondContact O-N 3.04Å; L300-G302 VanDerWaalsContact C-N 3.28Å; L300-V318 HydrophobicContact CD2-CG1 4.23Å
301	A	93.7	Very high	95.9	Very high	35 Å²	35	47.5 Å²	47.5	29%	0.289	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.7	176.2	0	0	0	0	0	113.7	L138 A297 C298 S299 R303	L138-A301 HydrophobicContact CB-CB 4.27Å; L138-A301 HydrophobicContact CD1-CB 4.33Å; A297-A301 WeakPolarHBondContact O-CB 3.27Å; A297-A301 PolarHBondContact O-N 3.23Å; C298-A301 CarbonylContact O-C 3.5Å; C298-A301 WeakPolarHBondContact O-CA 3.46Å; C298-A301 PolarHBondContact O-N 3.39Å; C298-A301 VanDerWaalsContact O-N 3.09Å; S299-A301 VanDerWaalsContact C-N 3.3Å; S299-A301 PolarHBondContact O-N 3.44Å; A301-R303 VanDerWaalsContact C-N 3.31Å; A301-R303 HydrophobicContact CB-CG 4.16Å; A301-R303 PolarHBondContact O-N 2.8Å
302	G	93.4	Very high	95.7	Very high	75 Å²	75	55.5 Å²	55.5	77%	0.773	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	26.1	-179.5	0	0	0	0	0	114.3	C298 S299 L300	C298-G302 PolarHBondContact O-N 2.74Å; C298-G302 VanDerWaalsContact O-N 3.08Å; S299-G302 PolarHBondContact O-N 2.87Å; L300-G302 VanDerWaalsContact C-N 3.28Å
303	R	93.2	Very high	95.5	Very high	77 Å²	77	55.9 Å²	55.9	29%	0.291	32%	0.315	S	S	.	.	S	Bend	trans	-128.8	153.5	-174.1	77	-166.3	-162.2	176.2	13.8	112.6	C298 A301	C298-R303 CarbonylContact C-O 3.53Å; C298-R303 HydrophobicContact CB-CG 3.93Å; C298-R303 WeakPolarHBondContact CB-O 3.38Å; C298-R303 PolarHBondContact O-N 2.59Å; C298-R303 VanDerWaalsContact O-O 3.1Å; A301-R303 VanDerWaalsContact C-N 3.31Å; A301-R303 HydrophobicContact CB-CG 4.16Å; A301-R303 PolarHBondContact O-N 2.8Å
304	P	95.2	Very high	95.2	Very high	119 Å²	119	60.6 Å²	60.6	77%	0.773	35%	0.346	S	S	*	.			trans	-63.1	153.1	174.1	26.3	-34.4	0	0	0	111.8	P306	P304-P306 WeakPolarHBondContact O-CD 3.4Å
305	C	96.1	Very high	95	Very high	36 Å²	36	63.8 Å²	63.8	24%	0.243	37%	0.366	C	S	.	.			trans	-87.1	116.6	174.5	-171.2	0	0	0	0	109.9	Y295 C298 V307	Y295-C305 HydrophobicContact CD2-CB 4.15Å; C298-C305 HydrophobicContact CB-CB 4.26Å; C305-V307 VanDerWaalsContact C-N 3.32Å
306	P	96.2	Very high	94.7	Very high	86 Å²	86	60.5 Å²	60.5	56%	0.558	36%	0.355	S	S	*	.			trans	-82.9	-8.7	178.6	34.3	-36.1	0	0	0	113.4	F146 P304	F146-P306 HydrophobicContact CD1-CG 4.02Å; F146-P306 HydrophobicContact CE1-CG 3.42Å; F146-P306 VanDerWaalsContact CE1-CG 3.42Å; F146-P306 HydrophobicContact CE2-CG 4Å; F146-P306 HydrophobicContact CZ-CG 3.38Å; P304-P306 WeakPolarHBondContact O-CD 3.4Å
307	V	96.5	Very high	94.3	Very high	14 Å²	14	65 Å²	65	9%	0.085	38%	0.38	C	S	.	.	S	Bend	trans	-82.2	126.7	-176.6	171.1	0	0	0	0	109.9	F146 A149 F291 T294 C305	F146-V307 HydrophobicContact CD1-CG2 4.05Å; A149-V307 HydrophobicContact CB-CB 4.33Å; A149-V307 HydrophobicContact CB-CG1 3.75Å; A149-V307 HydrophobicContact CB-CG2 3.54Å; F291-V307 HydrophobicContact CB-CG1 4.35Å; F291-V307 HydrophobicContact CD2-CG1 4.39Å; F291-V307 WeakPolarHBondContact CD2-O 3.26Å; T294-V307 HydrophobicContact CG2-CB 4.21Å; T294-V307 HydrophobicContact CG2-CG2 3.76Å; C305-V307 VanDerWaalsContact C-N 3.32Å
308	P	96.4	Very high	93.7	Very high	69 Å²	69	65.9 Å²	65.9	45%	0.448	39%	0.385	S	S	.	.			trans	-73	147.9	-180	29.6	-35.5	0	0	0	112.3	Q153 L310	Q153-P308 PolarHBondContact NE2-O 3.21Å; P308-L310 HydrophobicContact CB-CD2 4.22Å; P308-L310 HydrophobicContact CG-CD2 4.17Å; P308-L310 HydrophobicContact CG-CG 4.43Å; P308-L310 PolarHBondContact O-N 3.24Å; P308-L310 VanDerWaalsContact O-N 3.14Å
309	N	96.9	Very high	93.2	Very high	49 Å²	49	71.6 Å²	71.6	26%	0.262	42%	0.415	S	S	.	.			trans	-87.2	70.5	177.3	-171.1	-1.1	0	0	0	111.7	F291 Y311 K312 V313	F291-N309 HydrophobicContact CD1-CB 3.88Å; F291-N309 VanDerWaalsContact CD1-CG 3.47Å; F291-N309 WeakPolarHBondContact CD1-OD1 3.33Å; F291-N309 HydrophobicContact CD2-CB 3.87Å; F291-N309 HydrophobicContact CE1-CB 3.73Å; F291-N309 VanDerWaalsContact CE1-ND2 3.31Å; F291-N309 WeakPolarHBondContact CE1-ND2 3.22Å; F291-N309 HydrophobicContact CE2-CB 3.73Å; F291-N309 HydrophobicContact CG-CB 3.96Å; F291-N309 HydrophobicContact CZ-CB 3.67Å; N309-Y311 VanDerWaalsContact C-N 3.28Å; N309-Y311 PolarHBondContact O-N 2.85Å; N309-K312 PolarHBondContact O-N 2.97Å; N309-K312 VanDerWaalsContact O-N 3.1Å; N309-K312 WeakPolarHBondContact OD1-CA 3.28Å; N309-K312 PolarHBondContact OD1-N 3.39Å; N309-K312 VanDerWaalsContact OD1-N 3.08Å; N309-V313 PolarHBondContact ND2-O 2.65Å; N309-V313 PolarHBondContact OD1-N 2.94Å
310	L	94.3	Very high	92.6	Very high	94 Å²	94	71 Å²	71	49%	0.492	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-37.5	-174.3	-64.6	-169.3	0	0	0	113.6	Q153 P308 K312	Q153-L310 HydrophobicContact CB-CD1 3.63Å; Q153-L310 HydrophobicContact CG-CD1 3.96Å; Q153-L310 HydrophobicContact CG-CG 4.44Å; P308-L310 HydrophobicContact CB-CD2 4.22Å; P308-L310 HydrophobicContact CG-CD2 4.17Å; P308-L310 HydrophobicContact CG-CG 4.43Å; P308-L310 PolarHBondContact O-N 3.24Å; P308-L310 VanDerWaalsContact O-N 3.14Å; L310-K312 VanDerWaalsContact C-N 3.31Å
311	Y	93.1	Very high	92	Very high	130 Å²	130	71.1 Å²	71.1	51%	0.51	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	1.8	-178.8	-55.6	-62.4	0	0	0	113.7	D289 N309 V313	D289-Y311 WeakPolarHBondContact OD2-CD2 3.39Å; N309-Y311 VanDerWaalsContact C-N 3.28Å; N309-Y311 PolarHBondContact O-N 2.85Å; Y311-V313 PolarHBondContact O-N 3.39Å; Y311-V313 VanDerWaalsContact O-N 3.12Å
312	K	94.2	Very high	91.4	Very high	186 Å²	186	71.5 Å²	71.5	81%	0.809	41%	0.409	S	S	*	.			trans	52.3	30.2	-178.4	-56.3	-179.4	-178	178.2	0	113.5	N309 L310	N309-K312 PolarHBondContact O-N 2.97Å; N309-K312 VanDerWaalsContact O-N 3.1Å; N309-K312 WeakPolarHBondContact OD1-CA 3.28Å; N309-K312 PolarHBondContact OD1-N 3.39Å; N309-K312 VanDerWaalsContact OD1-N 3.08Å; L310-K312 VanDerWaalsContact C-N 3.31Å
313	V	93.6	Very high	90.7	Very high	38 Å²	38	70 Å²	70	23%	0.23	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-72	144.7	179	-67.9	0	0	0	0	110.3	D289 F291 Q292 N309 Y311	D289-V313 WeakPolarHBondContact OD2-CG2 3.12Å; F291-V313 HydrophobicContact CD1-CG2 3.96Å; Q292-V313 HydrophobicContact CG-CG2 3.7Å; N309-V313 PolarHBondContact ND2-O 2.65Å; N309-V313 PolarHBondContact OD1-N 2.94Å; Y311-V313 PolarHBondContact O-N 3.39Å; Y311-V313 VanDerWaalsContact O-N 3.12Å
314	P	93.6	Very high	90.1	Very high	100 Å²	100	74.3 Å²	74.3	65%	0.649	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-57.9	133.2	176.6	-25.9	35.2	0	0	0	111.4	Q292	Q292-P314 PolarHBondContact NE2-O 3.12Å
315	P	91.8	Very high	89.3	Confident	66 Å²	66	70.2 Å²	70.2	43%	0.429	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-64.2	144.8	171.9	28.1	-33.6	0	0	0	109.8	F291 Y295	F291-P315 HydrophobicContact CE1-CB 4.4Å; Y295-P315 HydrophobicContact CD1-CB 3.93Å; Y295-P315 HydrophobicContact CD2-CB 4.22Å; Y295-P315 HydrophobicContact CE1-CB 3.78Å; Y295-P315 HydrophobicContact CE2-CB 4.09Å; Y295-P315 HydrophobicContact CG-CB 4.15Å
316	P	91.3	Very high	88.4	Confident	14 Å²	14	72.9 Å²	72.9	9%	0.091	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-68.8	134.4	179.2	27.3	-33.7	0	0	0	111.2	Y278 Q292 Y295 F296 V318	Y278-P316 HydrophobicContact CE1-CB 4.02Å; Y278-P316 HydrophobicContact CE1-CG 4.07Å; Q292-P316 HydrophobicContact CB-CG 4.48Å; Y295-P316 HydrophobicContact CD1-CG 4.04Å; F296-P316 HydrophobicContact CB-CG 4.11Å; F296-P316 HydrophobicContact CD2-CB 4.18Å; F296-P316 HydrophobicContact CD2-CG 4.05Å; P316-V318 PolarHBondContact O-N 3.48Å
317	D	88.5	Confident	87.3	Confident	96 Å²	96	73.6 Å²	73.6	51%	0.513	38%	0.383	S	S	.	.			trans	-70.1	99.3	163.7	179	-11.9	0	0	0	108.8	N319 C320 C321	D317-N319 PolarHBondContact O-N 2.9Å; D317-N319 WeakPolarHBondContact OD1-CA 3.23Å; D317-N319 WeakPolarHBondContact OD1-CB 3.39Å; D317-N319 PolarHBondContact OD1-N 3.28Å; D317-C320 HydrophobicContact CB-CB 3.83Å; D317-C320 PolarHBondContact O-N 3.39Å; D317-C320 PolarHBondContact OD1-N 3.48Å; D317-C320 VanDerWaalsContact OD2-CB 3.23Å; D317-C320 WeakPolarHBondContact OD2-CB 3.26Å; D317-C321 WeakPolarHBondContact O-CB 3.43Å; D317-C321 PolarHBondContact O-N 3.26Å; D317-C321 PolarHBondContact O-SG 3.42Å
318	V	85.6	Confident	86.3	Confident	18 Å²	18	81.9 Å²	81.9	11%	0.109	41%	0.413	C	S	.	.	H	α-helix	trans	-58.3	-36.7	-179.7	174	0	0	0	0	111.7	F296 L300 P316 C321 K322	F296-V318 HydrophobicContact CB-CG2 4.42Å; F296-V318 HydrophobicContact CD1-CG1 4.1Å; F296-V318 HydrophobicContact CD1-CG2 3.98Å; F296-V318 HydrophobicContact CD2-CG2 4.35Å; F296-V318 HydrophobicContact CE1-CB 4.42Å; F296-V318 HydrophobicContact CE1-CG1 3.74Å; F296-V318 HydrophobicContact CE1-CG2 4.31Å; F296-V318 HydrophobicContact CG-CG2 3.98Å; F296-V318 HydrophobicContact CZ-CG1 4.21Å; L300-V318 HydrophobicContact CD2-CG1 4.23Å; P316-V318 PolarHBondContact O-N 3.48Å; V318-C321 PolarHBondContact O-N 3.48Å; V318-K322 WeakPolarHBondContact O-CG 3.43Å; V318-K322 PolarHBondContact O-N 2.96Å
319	N	85.2	Confident	85	Confident	121 Å²	121	81 Å²	81	65%	0.647	41%	0.412	S	S	*	.	H	α-helix	trans	-74.8	-43.8	-178.4	-68.2	-29.4	0	0	0	110.9	D317 C321 K322 A323	D317-N319 PolarHBondContact O-N 2.9Å; D317-N319 WeakPolarHBondContact OD1-CA 3.23Å; D317-N319 WeakPolarHBondContact OD1-CB 3.39Å; D317-N319 PolarHBondContact OD1-N 3.28Å; N319-C321 VanDerWaalsContact C-N 3.29Å; N319-C321 PolarHBondContact O-N 3.06Å; N319-K322 PolarHBondContact O-N 2.77Å; N319-A323 PolarHBondContact O-N 2.96Å
320	C	82.2	Confident	83.4	Confident	39 Å²	39	84.7 Å²	84.7	26%	0.264	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-38.9	172.3	-173.9	0	0	0	0	111.7	D317 A323 R324	D317-C320 HydrophobicContact CB-CB 3.83Å; D317-C320 PolarHBondContact O-N 3.39Å; D317-C320 PolarHBondContact OD1-N 3.48Å; D317-C320 VanDerWaalsContact OD2-CB 3.23Å; D317-C320 WeakPolarHBondContact OD2-CB 3.26Å; C320-A323 PolarHBondContact O-N 2.96Å; C320-R324 WeakPolarHBondContact O-CB 3.41Å; C320-R324 VanDerWaalsContact O-CG 3.31Å; C320-R324 WeakPolarHBondContact O-CG 3.47Å; C320-R324 PolarHBondContact O-N 2.7Å; C320-R324 PolarHBondContact SG-NE 3.49Å; C320-R324 VanDerWaalsContact SG-NE 3.41Å
321	C	80.6	Confident	81.9	Confident	32 Å²	32	83.7 Å²	83.7	22%	0.216	43%	0.425	C	S	.	.	H	α-helix	trans	-64.8	-40.5	175.5	-67.7	0	0	0	0	112.4	F296 D317 V318 N319 F325	F296-C321 HydrophobicContact CE2-CB 3.52Å; F296-C321 HydrophobicContact CZ-CB 3.73Å; D317-C321 WeakPolarHBondContact O-CB 3.43Å; D317-C321 PolarHBondContact O-N 3.26Å; D317-C321 PolarHBondContact O-SG 3.42Å; V318-C321 PolarHBondContact O-N 3.48Å; N319-C321 VanDerWaalsContact C-N 3.29Å; N319-C321 PolarHBondContact O-N 3.06Å; C321-F325 WeakPolarHBondContact O-CB 3.28Å; C321-F325 PolarHBondContact O-N 3.15Å
322	K	82.5	Confident	80.4	Confident	43 Å²	43	81.2 Å²	81.2	19%	0.187	43%	0.426	C	S	.	.	H	α-helix	trans	-62	-49.4	172.9	-75.8	178.3	176.8	-159.7	0	111.9	A270 N271 P274 V318 N319 F325 Q326	A270-K322 WeakPolarHBondContact O-CE 3.46Å; A270-K322 PolarHBondContact O-NZ 3.31Å; N271-K322 PolarHBondContact OD1-NZ 3.47Å; P274-K322 HydrophobicContact CG-CG 4.08Å; V318-K322 WeakPolarHBondContact O-CG 3.43Å; V318-K322 PolarHBondContact O-N 2.96Å; N319-K322 PolarHBondContact O-N 2.77Å; K322-F325 WeakPolarHBondContact O-CB 3.33Å; K322-F325 PolarHBondContact O-N 3.08Å; K322-Q326 WeakPolarHBondContact O-CG 3.44Å; K322-Q326 PolarHBondContact O-N 3.26Å
323	A	78.3	Confident	78.7	Confident	43 Å²	43	74.3 Å²	74.3	36%	0.355	41%	0.408	S	S	.	.	H	α-helix	trans	-61.3	-51.2	-179.5	0	0	0	0	0	112.2	N319 C320 F325 Q326 D327	N319-A323 PolarHBondContact O-N 2.96Å; C320-A323 PolarHBondContact O-N 2.96Å; A323-F325 PolarHBondContact O-N 3.45Å; A323-F325 VanDerWaalsContact O-N 3.14Å; A323-Q326 WeakPolarHBondContact O-CB 3.42Å; A323-Q326 PolarHBondContact O-N 3.31Å; A323-D327 PolarHBondContact O-N 2.77Å
324	R	79.4	Confident	76.5	Confident	168 Å²	168	78.6 Å²	78.6	63%	0.634	43%	0.426	S	S	*	.	H	α-helix	trans	-58.4	-30.5	177.1	-74.4	176.4	174	-178.6	2.2	113.5	C320 R328	C320-R324 WeakPolarHBondContact O-CB 3.41Å; C320-R324 VanDerWaalsContact O-CG 3.31Å; C320-R324 WeakPolarHBondContact O-CG 3.47Å; C320-R324 PolarHBondContact O-N 2.7Å; C320-R324 PolarHBondContact SG-NE 3.49Å; C320-R324 VanDerWaalsContact SG-NE 3.41Å; R324-R328 WeakPolarHBondContact O-CG 3.09Å; R324-R328 PolarHBondContact O-N 3.16Å
325	F	79.2	Confident	74.5	Confident	33 Å²	33	79.1 Å²	79.1	15%	0.145	42%	0.422	C	S	.	.	H	α-helix	trans	-72.7	-43.3	176	-178.6	-94.4	0	0	0	111.5	F262 Q273 P274 S277 C321 K322 A323 R328 A329	F262-F325 HydrophobicContact CD2-CE2 4.27Å; F262-F325 AromaticContact CD2-CZ 3.75Å; F262-F325 HydrophobicContact CD2-CZ 3.75Å; F262-F325 AromaticContact CE2-CE2 3.61Å; F262-F325 HydrophobicContact CE2-CE2 3.61Å; F262-F325 AromaticContact CE2-CZ 3.5Å; F262-F325 HydrophobicContact CE2-CZ 3.5Å; F262-F325 VanDerWaalsContact CE2-CZ 3.5Å; F262-F325 HydrophobicContact CZ-CE2 4.45Å; F262-F325 HydrophobicContact CZ-CZ 4.41Å; Q273-F325 HydrophobicContact CB-CD1 4.31Å; Q273-F325 HydrophobicContact CB-CE1 3.55Å; Q273-F325 HydrophobicContact CB-CE2 4.24Å; Q273-F325 HydrophobicContact CB-CZ 3.51Å; Q273-F325 HydrophobicContact CG-CE1 4.49Å; Q273-F325 HydrophobicContact CG-CZ 4.45Å; Q273-F325 VanDerWaalsContact OE1-CE1 3.23Å; P274-F325 HydrophobicContact CB-CB 4.04Å; P274-F325 HydrophobicContact CB-CG 4.26Å; P274-F325 HydrophobicContact CG-CB 3.84Å; P274-F325 HydrophobicContact CG-CD1 3.88Å; P274-F325 HydrophobicContact CG-CG 3.86Å; S277-F325 VanDerWaalsContact OG-CE2 3.23Å; S277-F325 WeakPolarHBondContact OG-CE2 3.47Å; C321-F325 WeakPolarHBondContact O-CB 3.28Å; C321-F325 PolarHBondContact O-N 3.15Å; K322-F325 WeakPolarHBondContact O-CB 3.33Å; K322-F325 PolarHBondContact O-N 3.08Å; A323-F325 PolarHBondContact O-N 3.45Å; A323-F325 VanDerWaalsContact O-N 3.14Å; F325-R328 PolarHBondContact O-N 2.83Å; F325-A329 PolarHBondContact O-N 2.83Å
326	Q	77.1	Confident	72.4	Confident	92 Å²	92	85.2 Å²	85.2	43%	0.43	44%	0.437	S	S	.	.	H	α-helix	trans	-60.2	-48.7	174.4	-69.7	168.3	-18.3	0	0	111	K322 A323 R328 A329 H330	K322-Q326 WeakPolarHBondContact O-CG 3.44Å; K322-Q326 PolarHBondContact O-N 3.26Å; A323-Q326 WeakPolarHBondContact O-CB 3.42Å; A323-Q326 PolarHBondContact O-N 3.31Å; Q326-R328 VanDerWaalsContact C-N 3.34Å; Q326-R328 PolarHBondContact O-N 3.22Å; Q326-A329 WeakPolarHBondContact O-CB 3.11Å; Q326-A329 PolarHBondContact O-N 2.69Å; Q326-H330 PolarHBondContact O-CD2 3.27Å; Q326-H330 PolarHBondContact O-N 3.22Å
327	D	73.4	Confident	70.4	Confident	100 Å²	100	87.4 Å²	87.4	54%	0.535	46%	0.456	S	S	.	.	H	α-helix	trans	-53.7	-48.7	176.6	-67.6	-22.6	0	0	0	111.9	A323 A329 H330 T331	A323-D327 PolarHBondContact O-N 2.77Å; D327-A329 VanDerWaalsContact C-N 3.31Å; D327-A329 PolarHBondContact O-N 3.34Å; D327-H330 PolarHBondContact O-N 3.29Å; D327-T331 PolarHBondContact O-N 2.89Å; D327-T331 PolarHBondContact O-OG1 3.17Å; D327-T331 VanDerWaalsContact O-OG1 3.06Å
328	R	74.4	Confident	68.6	Low	188 Å²	188	86.5 Å²	86.5	71%	0.709	45%	0.454	S	S	*	.	H	α-helix	trans	-62.5	-36.2	177.7	-77.1	177.9	172.4	-173.1	-2.4	113	R324 F325 Q326 S332	R324-R328 WeakPolarHBondContact O-CG 3.09Å; R324-R328 PolarHBondContact O-N 3.16Å; F325-R328 PolarHBondContact O-N 2.83Å; Q326-R328 VanDerWaalsContact C-N 3.34Å; Q326-R328 PolarHBondContact O-N 3.22Å; R328-S332 VanDerWaalsContact O-CB 3.28Å; R328-S332 WeakPolarHBondContact O-CB 3.36Å; R328-S332 PolarHBondContact O-N 3.01Å; R328-S332 PolarHBondContact O-OG 2.96Å
329	A	69.8	Low	66.8	Low	52 Å²	52	95.7 Å²	95.7	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-41.8	174.9	0	0	0	0	0	111.2	F325 Q326 D327 S332 G333	F325-A329 PolarHBondContact O-N 2.83Å; Q326-A329 WeakPolarHBondContact O-CB 3.11Å; Q326-A329 PolarHBondContact O-N 2.69Å; D327-A329 VanDerWaalsContact C-N 3.31Å; D327-A329 PolarHBondContact O-N 3.34Å; A329-S332 PolarHBondContact O-N 3.44Å; A329-G333 PolarHBondContact O-N 3.23Å
330	H	63.9	Low	65.1	Low	125 Å²	125	94.7 Å²	94.7	58%	0.579	49%	0.485	S	S	*	.	H	α-helix	trans	-62.6	-53	174.8	-68.7	-60.7	0	0	0	111.9	Q326 D327 S332 G333 E334	Q326-H330 PolarHBondContact O-CD2 3.27Å; Q326-H330 PolarHBondContact O-N 3.22Å; D327-H330 PolarHBondContact O-N 3.29Å; H330-S332 VanDerWaalsContact C-N 3.27Å; H330-S332 PolarHBondContact O-N 3.41Å; H330-G333 WeakPolarHBondContact O-CA 3.31Å; H330-G333 PolarHBondContact O-N 2.82Å; H330-E334 PolarHBondContact O-N 3.16Å
331	T	62.2	Low	63.7	Low	73 Å²	73	97.3 Å²	97.3	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-58.8	-38.1	178.4	-47.6	0	0	0	0	112.3	D327 E334 L335	D327-T331 PolarHBondContact O-N 2.89Å; D327-T331 PolarHBondContact O-OG1 3.17Å; D327-T331 VanDerWaalsContact O-OG1 3.06Å; T331-E334 PolarHBondContact O-N 3Å; T331-L335 HydrophobicContact CG2-CD1 4.05Å; T331-L335 WeakPolarHBondContact O-CB 3.29Å; T331-L335 WeakPolarHBondContact O-CG 3.32Å; T331-L335 PolarHBondContact O-N 2.99Å
332	S	61.3	Low	62.3	Low	78 Å²	78	103 Å²	103	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-35.6	176.1	-58.7	0	0	0	0	112.4	R328 A329 H330 R336	R328-S332 VanDerWaalsContact O-CB 3.28Å; R328-S332 WeakPolarHBondContact O-CB 3.36Å; R328-S332 PolarHBondContact O-N 3.01Å; R328-S332 PolarHBondContact O-OG 2.96Å; A329-S332 PolarHBondContact O-N 3.44Å; H330-S332 VanDerWaalsContact C-N 3.27Å; H330-S332 PolarHBondContact O-N 3.41Å; S332-R336 WeakPolarHBondContact O-CB 3.37Å; S332-R336 PolarHBondContact O-N 3.14Å
333	G	58.5	Low	60.3	Low	41 Å²	41	108.7 Å²	108.7	42%	0.423	56%	0.559	S	S	.	*	H	α-helix	trans	-65.9	-46.1	172.3	0	0	0	0	0	112.4	A329 H330 R336 A337	A329-G333 PolarHBondContact O-N 3.23Å; H330-G333 WeakPolarHBondContact O-CA 3.31Å; H330-G333 PolarHBondContact O-N 2.82Å; G333-R336 WeakPolarHBondContact O-CB 3.37Å; G333-R336 PolarHBondContact O-N 3.25Å; G333-A337 WeakPolarHBondContact O-CB 3.49Å; G333-A337 PolarHBondContact O-N 3.12Å
334	E	47.1	Very low	58.3	Low	128 Å²	128	115.3 Å²	115.3	60%	0.598	58%	0.582	S	S	*	*	H	α-helix	trans	-65.9	-42.5	179.5	-70.7	179.8	143.3	0	0	113	H330 T331 R336 A337 T338	H330-E334 PolarHBondContact O-N 3.16Å; T331-E334 PolarHBondContact O-N 3Å; E334-R336 PolarHBondContact O-N 3.4Å; E334-A337 PolarHBondContact O-N 3.08Å; E334-T338 PolarHBondContact O-N 3.1Å; E334-T338 PolarHBondContact O-OG1 3.03Å
335	L	52.2	Low	56.5	Low	111 Å²	111	113.2 Å²	113.2	58%	0.581	59%	0.591	S	S	*	*	H	α-helix	trans	-61.8	-32.1	173.6	-77	166.6	0	0	0	112.2	T331 T338 R339	T331-L335 HydrophobicContact CG2-CD1 4.05Å; T331-L335 WeakPolarHBondContact O-CB 3.29Å; T331-L335 WeakPolarHBondContact O-CG 3.32Å; T331-L335 PolarHBondContact O-N 2.99Å; L335-T338 WeakPolarHBondContact CA-OG1 3.45Å; L335-T338 PolarHBondContact O-OG1 3.14Å; L335-R339 WeakPolarHBondContact O-CB 3.5Å; L335-R339 PolarHBondContact O-N 2.94Å
336	R	48.8	Very low	54.6	Low	195 Å²	195	117.2 Å²	117.2	74%	0.736	62%	0.623	S	S	*	*	H	α-helix	trans	-77.1	-38.9	174.8	-164.1	173.5	-177	177.5	-0.3	111.6	S332 G333 E334 T340	S332-R336 WeakPolarHBondContact O-CB 3.37Å; S332-R336 PolarHBondContact O-N 3.14Å; G333-R336 WeakPolarHBondContact O-CB 3.37Å; G333-R336 PolarHBondContact O-N 3.25Å; E334-R336 PolarHBondContact O-N 3.4Å; R336-T340 PolarHBondContact O-N 3.27Å; R336-T340 VanDerWaalsContact O-N 3.09Å; R336-T340 PolarHBondContact O-OG1 3.43Å
337	A	47.6	Very low	52.9	Low	59 Å²	59	119 Å²	119	49%	0.488	64%	0.64	S	S	.	*	H	α-helix	trans	-65.3	-48.1	175.9	0	0	0	0	0	111.9	G333 E334 R339 T340 S341	G333-A337 WeakPolarHBondContact O-CB 3.49Å; G333-A337 PolarHBondContact O-N 3.12Å; E334-A337 PolarHBondContact O-N 3.08Å; A337-R339 PolarHBondContact O-N 2.81Å; A337-T340 CarbonylContact O-C 3.43Å; A337-T340 WeakPolarHBondContact O-CA 3.3Å; A337-T340 PolarHBondContact O-N 3.43Å; A337-S341 WeakPolarHBondContact O-CB 3.4Å; A337-S341 PolarHBondContact O-N 3.12Å
338	T	50.5	Low	51.2	Low	78 Å²	78	119.4 Å²	119.4	48%	0.479	65%	0.65	S	S	.	*	H	α-helix	trans	-62.1	-40.5	176.1	42.8	0	0	0	0	112.4	E334 L335 T340 S341 L342	E334-T338 PolarHBondContact O-N 3.1Å; E334-T338 PolarHBondContact O-OG1 3.03Å; L335-T338 WeakPolarHBondContact CA-OG1 3.45Å; L335-T338 PolarHBondContact O-OG1 3.14Å; T338-T340 PolarHBondContact O-N 3.13Å; T338-S341 PolarHBondContact O-N 3.28Å; T338-L342 WeakPolarHBondContact O-CG 3.48Å; T338-L342 PolarHBondContact O-N 2.77Å; T338-L342 VanDerWaalsContact O-N 3.16Å
339	R	49	Very low	49.6	Very low	210 Å²	210	117 Å²	117	79%	0.792	66%	0.657	S	S	*	*	H	α-helix	trans	-61.7	-29.6	170.7	-93.6	-178.1	135.9	155.8	-2.7	114.1	L335 A337	L335-R339 WeakPolarHBondContact O-CB 3.5Å; L335-R339 PolarHBondContact O-N 2.94Å; A337-R339 PolarHBondContact O-N 2.81Å
340	T	49.9	Very low	48.4	Very low	101 Å²	101	121 Å²	121	62%	0.62	68%	0.676	S	S	*	*	H	α-helix	trans	-83.7	-31.3	177.9	-45.8	0	0	0	0	111.6	R336 A337 T338	R336-T340 PolarHBondContact O-N 3.27Å; R336-T340 VanDerWaalsContact O-N 3.09Å; R336-T340 PolarHBondContact O-OG1 3.43Å; A337-T340 CarbonylContact O-C 3.43Å; A337-T340 WeakPolarHBondContact O-CA 3.3Å; A337-T340 PolarHBondContact O-N 3.43Å; T338-T340 PolarHBondContact O-N 3.13Å
341	S	51.8	Low	47.5	Very low	94 Å²	94	120.7 Å²	120.7	66%	0.657	68%	0.683	S	S	*	*	H	α-helix	trans	-73.7	-20.2	176.7	-174.6	0	0	0	0	114.2	A337 T338 Q343	A337-S341 WeakPolarHBondContact O-CB 3.4Å; A337-S341 PolarHBondContact O-N 3.12Å; T338-S341 PolarHBondContact O-N 3.28Å; S341-Q343 VanDerWaalsContact C-N 3.26Å; S341-Q343 PolarHBondContact O-N 3.06Å
342	L	50.9	Low	46.7	Very low	150 Å²	150	123.1 Å²	123.1	79%	0.785	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	16.3	178.9	-72.5	166.9	0	0	0	113.4	T338	T338-L342 WeakPolarHBondContact O-CG 3.48Å; T338-L342 PolarHBondContact O-N 2.77Å; T338-L342 VanDerWaalsContact O-N 3.16Å
343	Q	41.4	Very low	46.1	Very low	163 Å²	163	125.8 Å²	125.8	76%	0.762	71%	0.71	S	S	*	*			trans	-124.5	56.3	173.9	-71.7	-166.6	-36.3	0	0	112.5	S341 P345	S341-Q343 VanDerWaalsContact C-N 3.26Å; S341-Q343 PolarHBondContact O-N 3.06Å; Q343-P345 WeakPolarHBondContact O-CD 3.35Å
344	E	36.1	Very low	45.6	Very low	182 Å²	182	129.1 Å²	129.1	85%	0.85	72%	0.722	S	S	*	*			trans	-91.9	111.7	152.6	-69.9	-154.4	152.7	0	0	109.4	S346	E344-S346 PolarHBondContact O-N 2.91Å
345	P	41.3	Very low	45.6	Very low	125 Å²	125	128.8 Å²	128.8	81%	0.812	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-75.6	116.7	173.8	29.6	-31	0	0	0	109.5	Q343	Q343-P345 WeakPolarHBondContact O-CD 3.35Å
346	S	39.3	Very low	45.2	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-57	147.9	170.6	48.2	0	0	0	0	111.6	E344 S348	E344-S346 PolarHBondContact O-N 2.91Å; S346-S348 PolarHBondContact O-N 3.35Å
347	T	41.4	Very low	45	Very low	130 Å²	130	135.1 Å²	135.1	80%	0.798	76%	0.756	S	S	*	*	S	Bend	trans	-64.1	127.8	-171.9	33.6	0	0	0	0	113.4
348	S	38.5	Very low	44.9	Very low	107 Å²	107	143.4 Å²	143.4	75%	0.748	77%	0.774	S	S	*	*			trans	49.9	89.3	149.7	60.4	0	0	0	0	118.3	S346	S346-S348 PolarHBondContact O-N 3.35Å
349	T	39.5	Very low	45.1	Very low	137 Å²	137	145.8 Å²	145.8	84%	0.84	79%	0.791	S	S	*	*			trans	-134.3	128.8	135.7	21.8	0	0	0	0	109.2	T351	T349-T351 PolarHBondContact O-N 3.4Å
350	V	45.7	Very low	45	Very low	137 Å²	137	145.2 Å²	145.2	83%	0.83	79%	0.794	S	S	*	*			trans	-80.2	117.1	-173.2	177.3	0	0	0	0	109.8
351	T	45.1	Very low	44.4	Very low	119 Å²	119	145.5 Å²	145.5	73%	0.73	81%	0.807	S	S	*	*			trans	-129.3	105.1	169.4	-44.3	0	0	0	0	110.2	T349 V353	T349-T351 PolarHBondContact O-N 3.4Å; T351-V353 PolarHBondContact O-N 2.87Å
352	T	45.8	Very low	44.5	Very low	123 Å²	123	147.7 Å²	147.7	76%	0.755	82%	0.816	S	S	*	*			trans	-77.7	110.3	-177.6	-49	0	0	0	0	110.9
353	V	48.9	Very low	44	Very low	135 Å²	135	145.5 Å²	145.5	82%	0.818	81%	0.811	S	S	*	*			trans	-104.3	113.4	171.8	-177.5	0	0	0	0	109.5	T351	T351-V353 PolarHBondContact O-N 2.87Å
354	T	48	Very low	43.7	Very low	110 Å²	110	146.8 Å²	146.8	68%	0.675	81%	0.814	S	S	*	*			trans	-78.4	151.8	179.1	45	0	0	0	0	112.1	R356	T354-R356 PolarHBondContact O-N 3.41Å
355	P	46.2	Very low	43.9	Very low	121 Å²	121	143.7 Å²	143.7	79%	0.786	81%	0.808	S	S	*	*			trans	-68.2	122.4	179.6	-16.1	30	0	0	0	111.2	Q357	P355-Q357 PolarHBondContact O-N 3.06Å; P355-Q357 VanDerWaalsContact O-N 3.14Å
356	R	43.3	Very low	43.7	Very low	252 Å²	252	142.8 Å²	142.8	95%	0.951	80%	0.802	S	S	*	*			trans	-63.8	114.9	172.4	-87.5	-171.7	178.8	-168.4	0.9	110.4	T354	T354-R356 PolarHBondContact O-N 3.41Å
357	Q	45.4	Very low	43.8	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.874	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.4	142.9	170.9	-68.5	-175.4	-3.3	0	0	111.2	P355	P355-Q357 PolarHBondContact O-N 3.06Å; P355-Q357 VanDerWaalsContact O-N 3.14Å
358	R	45.7	Very low	43.5	Very low	234 Å²	234	144.8 Å²	144.8	88%	0.883	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-76.9	124.1	174.1	-164.1	-179.9	-153.4	157.4	6.9	109.6
359	P	53.4	Low	43.5	Very low	128 Å²	128	145.8 Å²	145.8	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-60.5	140.5	178.7	-24.1	34.4	0	0	0	112.5
360	K	47	Very low	43.2	Very low	197 Å²	197	145.9 Å²	145.9	86%	0.857	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-97.6	136.4	171.4	-69.9	174.8	179.3	170.7	0	109.2
361	A	37.4	Very low	42.8	Very low	108 Å²	108	146.2 Å²	146.2	89%	0.893	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71	145.7	176.7	0	0	0	0	0	112.1
362	V	53.4	Low	42.2	Very low	140 Å²	140	145.7 Å²	145.7	85%	0.848	80%	0.799	S	S	*	*			trans	-125.4	131.2	176.7	-147.6	0	0	0	0	108.1
363	P	40.4	Very low	41.8	Very low	104 Å²	104	146.8 Å²	146.8	68%	0.675	81%	0.806	S	S	*	*			trans	-104.7	151.5	-172.4	37	-33.2	0	0	0	115.2
364	F	35.8	Very low	41.1	Very low	189 Å²	189	145 Å²	145	83%	0.829	80%	0.799	S	S	*	*			trans	69.4	148	161.9	-123.6	-131.7	0	0	0	115.3
365	V	40	Very low	40.8	Very low	118 Å²	118	144.8 Å²	144.8	72%	0.715	80%	0.802	S	S	*	*			cis	-147.4	150.3	21.8	-157.6	0	0	0	0	109
366	P	37.7	Very low	40.4	Very low	105 Å²	105	148.1 Å²	148.1	68%	0.682	80%	0.804	S	S	*	*			trans	-87.3	155.1	179	34.5	-36.7	0	0	0	114.4
367	N	41.1	Very low	40.2	Very low	168 Å²	168	140.3 Å²	140.3	90%	0.898	79%	0.794	S	S	*	*			trans	-155	140.2	158.1	-125	-3.9	0	0	0	110.9
368	V	36	Very low	39.8	Very low	121 Å²	121	137.1 Å²	137.1	73%	0.733	79%	0.787	S	S	*	*			trans	-111.4	152.1	-173.1	-166.7	0	0	0	0	109.7
369	P	38.6	Very low	39.4	Very low	128 Å²	128	132.6 Å²	132.6	83%	0.831	78%	0.78	S	S	*	*			trans	-135	146.9	132	33.8	-21.2	0	0	0	114.6
370	I	32.9	Very low	38.6	Very low	140 Å²	140	132.5 Å²	132.5	72%	0.718	78%	0.777	S	S	*	*			trans	-83.9	139.6	-179.3	-63.6	155	0	0	0	110.2
371	V	37.6	Very low	38	Very low	143 Å²	143	127.4 Å²	127.4	87%	0.867	77%	0.772	S	S	*	*			trans	-140.1	132.1	145.6	-175.7	0	0	0	0	110.3
372	T	30.8	Very low	37.9	Very low	109 Å²	109	134.2 Å²	134.2	67%	0.669	78%	0.775	S	S	*	*			trans	-103.8	143.6	-179.6	-48.9	0	0	0	0	110.5
373	V	38.4	Very low	37.1	Very low	146 Å²	146	131.4 Å²	131.4	89%	0.885	77%	0.766	S	S	*	*			trans	-136.8	142.3	154.1	-170.7	0	0	0	0	109.6
374	S	35	Very low	37	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	77%	0.771	S	S	*	*			trans	-139.2	141.5	-168	166.3	0	0	0	0	111.4
375	S	40.6	Very low	36.9	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	77%	0.765	S	S	*	*			trans	-166.7	105.1	158.9	46.1	0	0	0	0	109.2
376	K	37.5	Very low	36.7	Very low	191 Å²	191	128.7 Å²	128.7	83%	0.83	77%	0.768	S	S	*	*				76.4	106.6	89.9	-76.7	177.2	177.5	179.3	0	112.3
377	A	38.4	Very low	36.6	Very low	88 Å²	88	129.9 Å²	129.9	73%	0.727	77%	0.773	S	S	*	*				87.8	144.5	87.7	0	0	0	0	0	110.9
378	T	38.2	Very low	36.2	Very low	119 Å²	119	127.7 Å²	127.7	73%	0.73	76%	0.761	S	S	*	*			cis	-163.1	153.8	43.1	12.7	0	0	0	0	111.9
379	N	36.2	Very low	36.2	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	77%	0.765	S	S	*	*			trans	35.3	147.7	133.6	-59.3	-5.6	0	0	0	120.8
380	T	37.6	Very low	36	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	76%	0.758	S	S	*	*			cis	-170.2	132.6	29.4	0.9	0	0	0	0	107.9
381	A	35	Very low	36.1	Very low	90 Å²	90	125.1 Å²	125.1	74%	0.744	76%	0.757	S	S	*	*				68.5	104.7	91.9	0	0	0	0	0	118.7
382	R	35.8	Very low	35.8	Very low	251 Å²	251	123.8 Å²	123.8	95%	0.947	76%	0.755	S	S	*	*			trans	172.6	133.2	142.3	-99.1	173.9	165	163.5	-4.5	107
383	A	35.4	Very low	36	Very low	82 Å²	82	124.6 Å²	124.6	68%	0.678	77%	0.765	S	S	*	*			cis	112	138.8	30.1	0	0	0	0	0	110.2
384	S	38.1	Very low	35.7	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	76%	0.755	S	S	*	*			trans	74.9	150.8	164.8	-51.5	0	0	0	0	117.5
385	T	34.8	Very low	35.7	Very low	115 Å²	115	122.6 Å²	122.6	71%	0.706	76%	0.757	S	S	*	*			cis	-179.2	140.7	-24.1	34	0	0	0	0	108
386	V	34.8	Very low	35.4	Very low	128 Å²	128	122.7 Å²	122.7	78%	0.776	75%	0.753	S	S	*	*			trans	67.8	153.8	158.1	-174.1	0	0	0	0	111.7
387	V	37	Very low	35.1	Very low	130 Å²	130	125 Å²	125	79%	0.788	76%	0.758	S	S	*	*			cis	-147.9	167.5	40.4	-152.3	0	0	0	0	111.8
388	D	32.7	Very low	34.7	Very low	123 Å²	123	129 Å²	129	66%	0.658	76%	0.762	S	S	*	*			trans	-72.9	-174.5	-175.4	-46	-90	0	0	0	117.2
389	N	35.4	Very low	34.5	Very low	150 Å²	150	132.2 Å²	132.2	80%	0.802	77%	0.774	S	S	*	*			trans	77.7	151.1	153.8	-64.4	-30.9	0	0	0	117.9
390	S	33.3	Very low	34.4	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	77%	0.768	S	S	*	*			cis	-177.9	175.2	-19.4	56.1	0	0	0	0	107.8
391	A	36.2	Very low	34.3	Very low	84 Å²	84	130.1 Å²	130.1	69%	0.694	77%	0.772	S	S	*	*			trans	67.4	115.1	166.8	0	0	0	0	0	115.9
392	S	31.4	Very low	34.3	Very low	116 Å²	116	130.3 Å²	130.3	81%	0.811	77%	0.768	S	S	*	*				70.2	107.3	60.3	79.6	0	0	0	0	114.9
393	S	35.1	Very low	34.4	Very low	126 Å²	126	125 Å²	125	88%	0.881	76%	0.758	S	S	*	*			trans	-162.2	138.7	137.2	-166.9	0	0	0	0	111.2
394	S	32	Very low	34.3	Very low	98 Å²	98	126.3 Å²	126.3	69%	0.685	76%	0.758	S	S	*	*			trans	-114.8	147.3	-179.7	51.1	0	0	0	0	111.1
395	S	34.6	Very low	34.1	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	77%	0.765	S	S	*	*			trans	-153.5	100.5	160	54.4	0	0	0	0	106.6
396	V	33.5	Very low	33.9	Very low	107 Å²	107	129.1 Å²	129.1	65%	0.648	76%	0.763	S	S	*	*				59.8	93.6	54.5	-168	0	0	0	0	112.2
397	Y	32.8	Very low	33.8	Very low	238 Å²	238	129.3 Å²	129.3	93%	0.933	77%	0.769	S	S	*	*			trans	-132.3	111.3	142	-71.7	-73.4	0	0	0	106.7
398	E	28.4	Very low	33.6	Very low	174 Å²	174	131 Å²	131	81%	0.813	77%	0.768	S	S	*	*			trans	-131.8	133.4	-177.3	-162.9	-178.3	-139.5	0	0	107.2
399	L	35	Very low	33.7	Very low	185 Å²	185	133.2 Å²	133.2	97%	0.969	78%	0.779	S	S	*	*			trans	173	118.8	169.9	-99.5	153.5	0	0	0	107.2
400	G	33.9	Very low	33.6	Very low	60 Å²	60	131.2 Å²	131.2	62%	0.619	78%	0.777	S	S	*	*			cis	-176.3	169.9	-9.4	0	0	0	0	0	110.8
401	N	35.4	Very low	33.9	Very low	161 Å²	161	132.4 Å²	132.4	86%	0.861	78%	0.782	S	S	*	*			trans	21.6	131.6	144.4	-71.1	40.3	0	0	0	118.8
402	S	35.7	Very low	33.7	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	79%	0.791	S	S	*	*			cis	-160.8	-173.5	11.6	-78.8	0	0	0	0	108.6
403	D	36.4	Very low	33.9	Very low	139 Å²	139	133.2 Å²	133.2	74%	0.743	79%	0.788	S	S	*	*			cis	-148.5	175.8	5.4	-141.1	-66.3	0	0	0	112.4
404	T	34	Very low	34	Very low	109 Å²	109	133 Å²	133	67%	0.669	79%	0.787	S	S	*	*			trans	-94.3	144	173.3	34.6	0	0	0	0	113.3
405	L	33.7	Very low	34.4	Very low	175 Å²	175	132.8 Å²	132.8	92%	0.916	79%	0.786	S	S	*	*			trans	-150.5	119.3	134.6	-109.5	175.3	0	0	0	110.4
406	T	30.8	Very low	34.6	Very low	109 Å²	109	134.7 Å²	134.7	67%	0.669	78%	0.783	S	S	*	*			trans	-108.9	133.8	-178.9	-35.2	0	0	0	0	109.2
407	C	33	Very low	34.8	Very low	133 Å²	133	137.9 Å²	137.9	90%	0.899	79%	0.788	S	S	*	*			trans	-127.1	105.9	160	-92.9	0	0	0	0	109.6
408	Q	31.6	Very low	35	Very low	164 Å²	164	130.2 Å²	130.2	77%	0.766	78%	0.781	S	S	*	*			trans	-78.1	153.8	160.8	-60.6	177.8	-8.7	0	0	108.7
409	L	35.2	Very low	35.5	Very low	171 Å²	171	126.1 Å²	126.1	90%	0.895	77%	0.772	S	S	*	*				-175.9	149.3	116.2	-94.9	162.1	0	0	0	110.9
410	S	32.8	Very low	35.8	Very low	107 Å²	107	126.3 Å²	126.3	75%	0.748	77%	0.768	S	S	*	*			trans	-113.9	-164	-172	-45.6	0	0	0	0	110
411	P	40.2	Very low	36	Very low	125 Å²	125	127.2 Å²	127.2	81%	0.812	78%	0.777	S	S	*	*				-119.4	179.4	-70.8	33.3	-17.2	0	0	0	111.8
412	S	32.1	Very low	36.1	Very low	125 Å²	125	124.7 Å²	124.7	87%	0.874	78%	0.779	S	S	*	*			trans	-79	144.2	177.8	40	0	0	0	0	114.2
413	A	34.9	Very low	36.1	Very low	92 Å²	92	123.4 Å²	123.4	76%	0.76	78%	0.78	S	S	*	*			trans	-155	166.2	172.9	0	0	0	0	0	112.2
414	S	38.5	Very low	36.2	Very low	122 Å²	122	124.4 Å²	124.4	85%	0.853	78%	0.78	S	S	*	*			trans	76.5	137.6	-172.8	82.3	0	0	0	0	114.9
415	S	39.3	Very low	36.4	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	78%	0.784	S	S	*	*			cis	-153.7	150.4	-3.6	-153.5	0	0	0	0	111.5
416	E	38.8	Very low	36.6	Very low	144 Å²	144	131.4 Å²	131.4	67%	0.673	78%	0.782	S	S	*	*			trans	39.8	142.1	141.1	-69.4	-176.9	148.2	0	0	121.6
417	K	38.7	Very low	36.7	Very low	173 Å²	173	133.3 Å²	133.3	75%	0.752	79%	0.788	S	S	*	*			cis	-170.2	139.1	29.1	-127.2	154.3	-169.3	144.5	0	112.4
418	G	36.1	Very low	36.9	Very low	77 Å²	77	133.6 Å²	133.6	79%	0.794	79%	0.786	S	S	*	*			trans	77.3	160	149.6	0	0	0	0	0	120.5
419	S	39.8	Very low	37.3	Very low	89 Å²	89	131 Å²	131	62%	0.622	79%	0.786	S	S	*	*			cis	-165.5	144.3	-33.4	-156.8	0	0	0	0	111.4
420	H	41.8	Very low	37	Very low	188 Å²	188	130.4 Å²	130.4	87%	0.87	78%	0.784	S	S	*	*			trans	62.1	148.7	168.8	-48.3	-56.2	0	0	0	117.9
421	G	36.9	Very low	37.6	Very low	79 Å²	79	129.4 Å²	129.4	81%	0.814	78%	0.775	S	S	*	*			cis	-151.6	163.3	3.2	0	0	0	0	0	112.7
422	A	37.2	Very low	37.3	Very low	109 Å²	109	132.9 Å²	132.9	90%	0.901	78%	0.777	S	S	*	*			trans	-101.5	162.2	-162	0	0	0	0	0	115.3
423	G	36.9	Very low	37.2	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	77%	0.766	S	S	*	*			trans	-172.4	75.1	173.9	0	0	0	0	0	117.4
424	H	39.1	Very low	37.2	Very low	161 Å²	161	132.3 Å²	132.3	75%	0.745	77%	0.767	S	S	*	*			trans	46.7	143.7	138.7	-79.1	62.2	0	0	0	121.6
425	R	37.3	Very low	36.7	Very low	201 Å²	201	130.8 Å²	130.8	76%	0.758	76%	0.756	S	S	*	*			cis	-177.9	168.7	-11.7	-120.1	-163.2	-160.1	-160.8	0.3	108.4
426	R	37.2	Very low	36.3	Very low	229 Å²	229	133.5 Å²	133.5	86%	0.864	76%	0.763	S	S	*	*			trans	84.2	110.4	168	-44.7	-179.8	-153.2	-161.9	4.2	114.2
427	N	33.2	Very low	36	Very low	150 Å²	150	132.8 Å²	132.8	80%	0.802	77%	0.769	S	S	*	*			cis	84.8	115.4	44.4	-70.3	29.9	0	0	0	114.6
428	T	38	Very low	35.8	Very low	139 Å²	139	130.1 Å²	130.1	85%	0.853	77%	0.767	S	S	*	*			trans	150.1	133	134.8	48.4	0	0	0	0	107.9
429	S	39	Very low	35.6	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	77%	0.768	S	S	*	*			cis	174.9	127.6	-15.3	38.6	0	0	0	0	105.7
430	D	29.6	Very low	35.3	Very low	157 Å²	157	141.5 Å²	141.5	84%	0.84	78%	0.783	S	S	*	*			trans	-59.4	-175	168.5	-94.2	-36.4	0	0	0	114.3
431	P	44.1	Very low	34.9	Very low	87 Å²	87	140.6 Å²	140.6	57%	0.565	78%	0.783	S	S	*	*			cis	-140.5	-149.3	-38.9	39.7	-20.4	0	0	0	112.4
432	F	34.1	Very low	34.7	Very low	197 Å²	197	141.8 Å²	141.8	86%	0.864	78%	0.779	S	S	*	*			trans	77.6	160	172.9	-55.1	-76.9	0	0	0	117.4
433	A	31.8	Very low	34.3	Very low	78 Å²	78	141.2 Å²	141.2	65%	0.645	77%	0.774	S	S	*	*			cis	-174.9	171.8	-39.3	0	0	0	0	0	109.1
434	V	33.2	Very low	34.1	Very low	128 Å²	128	147.9 Å²	147.9	78%	0.776	79%	0.785	S	S	*	*			trans	77	110.9	157	-172.4	0	0	0	0	120.3
435	S	29	Very low	33.6	Very low	89 Å²	89	150.3 Å²	150.3	62%	0.622	79%	0.787	S	S	*	*			trans	41.6	142.4	140.2	78.8	0	0	0	0	126.4
436	D	30.4	Very low	33.6	Very low	151 Å²	151	146.5 Å²	146.5	81%	0.807	79%	0.788	S	S	*	*			trans	88	152	137.7	-67.4	-18	0	0	0	124
437	V	32.5	Very low	33.1	Very low	130 Å²	130	146.3 Å²	146.3	79%	0.788	79%	0.789	S	S	*	*			trans	80.2	81	164.3	-157.9	0	0	0	0	119.3
438	V	35.4	Very low	33	Very low	117 Å²	117	147.6 Å²	147.6	71%	0.709	78%	0.783	S	S	*	*				26.1	133.6	115.9	177.4	0	0	0	0	119.8
439	N	31.8	Very low	32.8	Very low	152 Å²	152	146 Å²	146	81%	0.813	78%	0.778	S	S	*	*			trans	67.4	99	160.8	-71.4	-19.3	0	0	0	119.4
440	R	33.2	Very low	32.4	Very low	252 Å²	252	146.9 Å²	146.9	95%	0.951	77%	0.769	S	S	*	*			trans	-150.7	119.6	130.5	-112.7	165.9	-164.4	-165.3	3.5	114.1
441	I	34	Very low	32.5	Very low	169 Å²	169	150.5 Å²	150.5	87%	0.867	77%	0.771	S	S	*	*			trans	-47.3	132.2	173.3	-62.9	149.6	0	0	0	113.6
442	S	32.1	Very low	31.7	Very low	104 Å²	104	155.4 Å²	155.4	73%	0.727	79%	0.787	S	S	*	*			trans	-162.2	116.6	136.7	62.7	0	0	0	0	113	F444	S442-F444 PolarHBondContact O-N 2.89Å
443	A	28.2	Very low	31.5	Very low	97 Å²	97	152.3 Å²	152.3	80%	0.802	78%	0.784	S	S	*	*			trans	-33.8	116.6	179.5	0	0	0	0	0	118
444	F	32	Very low	31.5	Very low	208 Å²	208	153.4 Å²	153.4	91%	0.912	79%	0.787	S	S	*	*			trans	-94.5	111.8	152.9	-103.7	-95.2	0	0	0	109.9	S442	S442-F444 PolarHBondContact O-N 2.89Å
445	R	29.3	Very low	31.3	Very low	212 Å²	212	156.8 Å²	156.8	80%	0.8	79%	0.794	S	S	*	*			trans	-75.3	141.2	171.2	-76	180	168.7	-173.7	-3.7	109.9
446	P	36.6	Very low	31.5	Very low	120 Å²	120	159.2 Å²	159.2	78%	0.779	81%	0.805	S	S	*	*			trans	-57.4	142.4	161.5	-19.3	31.5	0	0	0	110.1	R448	P446-R448 PolarHBondContact O-N 3.38Å
447	Y	28.1	Very low	31.5	Very low	226 Å²	226	155.3 Å²	155.3	89%	0.886	80%	0.8	S	S	*	*			trans	-64.9	98.5	-175.9	-172.4	-92.9	0	0	0	111.2	S449	Y447-S449 PolarHBondContact O-N 3.33Å
448	R	31.3	Very low	31.2	Very low	177 Å²	177	155.1 Å²	155.1	67%	0.668	80%	0.804	S	S	*	*			trans	-80.4	105.4	-177.7	-167.1	-177.8	-168.4	-152.2	2.2	110.4	P446 E450	P446-R448 PolarHBondContact O-N 3.38Å; R448-E450 WeakPolarHBondContact CD-OE2 3.44Å; R448-E450 HydrophobicContact CG-CG 4.08Å; R448-E450 IonicContact CZ-OE1 3.17Å; R448-E450 IonicContact CZ-OE2 2.74Å; R448-E450 IonicContact NE-OE1 2.73Å; R448-E450 IonicContact NE-OE2 2.84Å; R448-E450 IonicContact NH1-OE1 2.73Å; R448-E450 PolarHBondContact NH1-OE1 3.04Å; R448-E450 IonicContact NH1-OE2 3.57Å; R448-E450 PolarHBondContact NH1-OE2 3.17Å; R448-E450 IonicContact NH2-OE1 2.67Å; R448-E450 PolarHBondContact NH2-OE1 3.28Å; R448-E450 PolarHBondContact O-N 3.05Å
449	S	32.4	Very low	31	Very low	106 Å²	106	153.7 Å²	153.7	74%	0.741	81%	0.805	S	S	*	*			trans	-77.5	75.2	165.6	58.6	0	0	0	0	110.7	Y447 R451	Y447-S449 PolarHBondContact O-N 3.33Å; S449-R451 PolarHBondContact O-N 2.94Å
450	E	30.3	Very low	31	Very low	127 Å²	127	151.4 Å²	151.4	59%	0.593	79%	0.793	S	S	*	*			trans	-66.4	94.6	164.4	-96	170.7	130.2	0	0	109.6	R448 Q452	R448-E450 WeakPolarHBondContact CD-OE2 3.44Å; R448-E450 HydrophobicContact CG-CG 4.08Å; R448-E450 IonicContact CZ-OE1 3.17Å; R448-E450 IonicContact CZ-OE2 2.74Å; R448-E450 IonicContact NE-OE1 2.73Å; R448-E450 IonicContact NE-OE2 2.84Å; R448-E450 IonicContact NH1-OE1 2.73Å; R448-E450 PolarHBondContact NH1-OE1 3.04Å; R448-E450 IonicContact NH1-OE2 3.57Å; R448-E450 PolarHBondContact NH1-OE2 3.17Å; R448-E450 IonicContact NH2-OE1 2.67Å; R448-E450 PolarHBondContact NH2-OE1 3.28Å; R448-E450 PolarHBondContact O-N 3.05Å; E450-Q452 PolarHBondContact O-N 3.39Å
451	R	32.1	Very low	31	Very low	233 Å²	233	151.3 Å²	151.3	88%	0.879	79%	0.792	S	S	*	*			trans	-77.4	110.5	148.5	-83.3	-170.5	178.5	-179.6	1.8	107.1	S449 V453	S449-R451 PolarHBondContact O-N 2.94Å; R451-V453 PolarHBondContact O-N 3.07Å; R451-V453 VanDerWaalsContact O-N 3.09Å
452	Q	27.1	Very low	31	Very low	191 Å²	191	150.2 Å²	150.2	89%	0.893	79%	0.788	S	S	*	*			trans	-63.9	107.3	159.4	-72	-177	-52.5	0	0	107.9	E450	E450-Q452 PolarHBondContact O-N 3.39Å
453	V	30.4	Very low	31	Very low	132 Å²	132	150.7 Å²	150.7	80%	0.8	78%	0.782	S	S	*	*			trans	-95	109.6	154.5	-179.3	0	0	0	0	105.4	R451	R451-V453 PolarHBondContact O-N 3.07Å; R451-V453 VanDerWaalsContact O-N 3.09Å
454	S	31.7	Very low	31.3	Very low	101 Å²	101	150.7 Å²	150.7	71%	0.706	78%	0.775	S	S	*	*			trans	-66.5	138.5	175.7	47.3	0	0	0	0	110.7	V456	S454-V456 PolarHBondContact O-N 3.03Å
455	E	28.7	Very low	31.4	Very low	199 Å²	199	146.2 Å²	146.2	93%	0.93	76%	0.755	S	S	*	*			trans	-53.8	125	179.3	-63.1	168.7	117.7	0	0	112.7
456	V	32.9	Very low	31.4	Very low	140 Å²	140	142.6 Å²	142.6	85%	0.848	75%	0.751	S	S	*	*			trans	-140.4	109.7	153.9	-173.3	0	0	0	0	109	S454	S454-V456 PolarHBondContact O-N 3.03Å
457	G	30.6	Very low	31.3	Very low	68 Å²	68	141.5 Å²	141.5	70%	0.701	74%	0.738	S	S	*	*			trans	59.7	100.3	145.9	0	0	0	0	0	120.8
458	S	27.8	Very low	31.6	Very low	126 Å²	126	134.3 Å²	134.3	88%	0.881	72%	0.715	S	S	*	*				44.1	97.4	121.9	174.8	0	0	0	0	119.8
459	A	31.3	Very low	31.6	Very low	88 Å²	88	133 Å²	133	73%	0.727	72%	0.721	S	S	*	*			trans	-164.2	149.8	135.9	0	0	0	0	0	112.4
460	D	31.6	Very low	31.6	Very low	103 Å²	103	133.7 Å²	133.7	55%	0.551	72%	0.721	S	S	*	*			trans	15	124.8	172.2	-75.7	-49	0	0	0	123.5	F672	D460-F672 VanDerWaalsContact OD2-CE1 3.28Å; D460-F672 WeakPolarHBondContact OD2-CE1 3.34Å
461	R	31.8	Very low	31.6	Very low	251 Å²	251	133 Å²	133	95%	0.947	73%	0.728	S	S	*	*	S	Bend	trans	-89.4	14.4	170.6	-73.8	-175.8	169.2	-179.9	-3.1	114.8
462	N	34.7	Very low	31.6	Very low	146 Å²	146	127.3 Å²	127.3	78%	0.781	71%	0.71	S	S	*	*			trans	-122.1	15.2	-168.7	-78.8	-6.3	0	0	0	115
463	N	32.3	Very low	31.5	Very low	113 Å²	113	121.3 Å²	121.3	60%	0.604	70%	0.7	S	S	*	*			trans	-99.4	116.8	178.9	-169.1	21.8	0	0	0	111.8	F465	N463-F465 VanDerWaalsContact C-N 3.26Å; N463-F465 PolarHBondContact O-N 3.26Å; N463-F465 WeakPolarHBondContact OD1-CD2 3.2Å
464	P	34.2	Very low	31.5	Very low	98 Å²	98	122.7 Å²	122.7	64%	0.636	69%	0.692	S	S	*	*			trans	-79.7	0.1	179.2	31.9	-34.9	0	0	0	114.5
465	F	33.8	Very low	31.2	Very low	113 Å²	113	129.2 Å²	129.2	50%	0.496	70%	0.701	S	S	.	*			trans	-100.9	42	-168.2	-65.1	-70.4	0	0	0	115.7	L126 N463	L126-F465 HydrophobicContact CD1-CD1 4.33Å; L126-F465 HydrophobicContact CD1-CE1 3.84Å; N463-F465 VanDerWaalsContact C-N 3.26Å; N463-F465 PolarHBondContact O-N 3.26Å; N463-F465 WeakPolarHBondContact OD1-CD2 3.2Å
466	D	29	Very low	31.2	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	70%	0.696	S	S	*	*			trans	-97.2	91.1	169.9	-141.6	5.2	0	0	0	109.7	R249	R249-D466 PolarHBondContact NH1-O 2.63Å
467	I	34.3	Very low	31.1	Very low	98 Å²	98	128 Å²	128	50%	0.503	69%	0.687	S	S	.	*			trans	-74.5	127.6	-175.5	-65	173.2	0	0	0	109.4	D469 F472	I467-D469 PolarHBondContact O-N 3.21Å; I467-F472 HydrophobicContact CG2-CD2 4.26Å; I467-F472 HydrophobicContact CG2-CE2 3.76Å
468	D	35.8	Very low	31.2	Very low	75 Å²	75	133 Å²	133	40%	0.401	69%	0.692	S	S	.	*			trans	-68.1	96.9	-179.9	-70.5	-51	0	0	0	111.4	R249 V470	R249-D468 WeakPolarHBondContact CD-OD2 3.48Å; R249-D468 IonicContact CZ-OD1 2.8Å; R249-D468 IonicContact CZ-OD2 2.72Å; R249-D468 IonicContact NE-OD2 3.83Å; R249-D468 IonicContact NH1-OD1 3.29Å; R249-D468 PolarHBondContact NH1-OD1 3.14Å; R249-D468 IonicContact NH1-OD2 2.79Å; R249-D468 PolarHBondContact NH1-OD2 2.64Å; D468-V470 PolarHBondContact O-N 3.23Å
469	D	29.9	Very low	31.3	Very low	149 Å²	149	134.4 Å²	134.4	80%	0.797	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	37	-169.1	-145.7	12.9	0	0	0	114.2	I467	I467-D469 PolarHBondContact O-N 3.21Å
470	V	34.3	Very low	31.4	Very low	121 Å²	121	134.3 Å²	134.3	73%	0.733	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	-11.9	-167.1	-163	0	0	0	0	114.2	D468	D468-V470 PolarHBondContact O-N 3.23Å
471	C	30.2	Very low	31.4	Very low	111 Å²	111	141 Å²	141	75%	0.75	70%	0.699	S	S	*	*	S	Bend	trans	-123.5	0.5	177.3	-82.6	0	0	0	0	115.9	G473	C471-G473 PolarHBondContact O-N 2.99Å; C471-G473 VanDerWaalsContact O-N 3.1Å
472	F	31.9	Very low	31.4	Very low	115 Å²	115	134.6 Å²	134.6	50%	0.504	69%	0.691	S	S	.	*			trans	-85.6	86.9	-174.5	-73.8	-76	0	0	0	113.8	I467	I467-F472 HydrophobicContact CG2-CD2 4.26Å; I467-F472 HydrophobicContact CG2-CE2 3.76Å
473	G	24.6	Very low	31.2	Very low	65 Å²	65	137.7 Å²	137.7	67%	0.67	70%	0.697	S	S	*	*			trans	-95.7	46.1	173.9	0	0	0	0	0	115.1	C471	C471-G473 PolarHBondContact O-N 2.99Å; C471-G473 VanDerWaalsContact O-N 3.1Å
474	Y	30	Very low	31.1	Very low	161 Å²	161	136 Å²	136	63%	0.631	71%	0.707	S	S	*	*			trans	-130	102.7	173.6	-82.7	-78.3	0	0	0	111.7	A38	A38-Y474 VanDerWaalsContact CB-OH 3.3Å; A38-Y474 WeakPolarHBondContact CB-OH 3.42Å
475	R	25.9	Very low	30.9	Very low	237 Å²	237	136.9 Å²	136.9	89%	0.894	72%	0.715	S	S	*	*			trans	-158.6	111	169.6	-156.9	178.5	-164.4	161.6	6.9	110.7
476	F	29.1	Very low	31.1	Very low	192 Å²	192	135.9 Å²	135.9	84%	0.842	73%	0.728	S	S	*	*			trans	153.3	136.8	164.8	-110.2	-96.3	0	0	0	105.8
477	D	30.9	Very low	31.2	Very low	122 Å²	122	136.6 Å²	136.6	65%	0.652	73%	0.731	S	S	*	*			cis	-169.2	121.1	-25.6	-116.4	8.5	0	0	0	105.7
478	E	31.8	Very low	31.2	Very low	174 Å²	174	137.3 Å²	137.3	81%	0.813	75%	0.745	S	S	*	*			trans	-145.7	82.5	159.3	-77.4	-155.5	156.9	0	0	110.2
479	L	29.6	Very low	31	Very low	155 Å²	155	139.8 Å²	139.8	81%	0.812	76%	0.763	S	S	*	*			trans	-105.1	121.6	157.4	-81.5	172.8	0	0	0	108.3	R481	L479-R481 PolarHBondContact O-N 2.99Å; L479-R481 VanDerWaalsContact O-N 3.15Å
480	P	33.6	Very low	31.1	Very low	86 Å²	86	140.8 Å²	140.8	56%	0.558	77%	0.768	S	S	*	*			trans	-67.8	115.5	178.2	26.6	-32.6	0	0	0	110.2	C482 L656	P480-C482 VanDerWaalsContact C-N 3.27Å; P480-C482 PolarHBondContact O-N 3.3Å; P480-L656 HydrophobicContact CG-CD2 4.49Å
481	R	32.3	Very low	30.8	Very low	244 Å²	244	139.9 Å²	139.9	92%	0.921	77%	0.767	S	S	*	*			trans	-72.7	80.7	170.5	-81	-172.7	172.7	-175.4	-0.7	110.8	L479 K483	L479-R481 PolarHBondContact O-N 2.99Å; L479-R481 VanDerWaalsContact O-N 3.15Å; R481-K483 PolarHBondContact O-N 3.31Å
482	C	30.4	Very low	31	Very low	115 Å²	115	141.7 Å²	141.7	78%	0.777	77%	0.774	S	S	*	*			trans	-62.6	114.1	165.4	-70.5	0	0	0	0	110	P480 G484	P480-C482 VanDerWaalsContact C-N 3.27Å; P480-C482 PolarHBondContact O-N 3.3Å; C482-G484 PolarHBondContact O-N 3.44Å; C482-G484 VanDerWaalsContact O-N 3.1Å
483	K	31.4	Very low	30.9	Very low	211 Å²	211	145.4 Å²	145.4	92%	0.917	79%	0.79	S	S	*	*			trans	-77.3	88.5	170.5	-71.7	-178.5	178.1	176.8	0	109.4	R481	R481-K483 PolarHBondContact O-N 3.31Å
484	G	30.9	Very low	31.4	Very low	78 Å²	78	151.7 Å²	151.7	80%	0.804	80%	0.799	S	S	*	*			trans	-84.7	125.6	171.2	0	0	0	0	0	111.8	C482	C482-G484 PolarHBondContact O-N 3.44Å; C482-G484 VanDerWaalsContact O-N 3.1Å
485	S	29.8	Very low	31.5	Very low	117 Å²	117	148.7 Å²	148.7	82%	0.818	80%	0.801	S	S	*	*			trans	-91.9	136.4	177.1	-180	0	0	0	0	111.5
486	A	36.6	Very low	32.1	Very low	91 Å²	91	145.2 Å²	145.2	75%	0.752	80%	0.795	S	S	*	*			trans	-156.5	99.5	160.9	0	0	0	0	0	112.6
487	N	31.8	Very low	32.4	Very low	151 Å²	151	142.4 Å²	142.4	81%	0.807	79%	0.789	S	S	*	*			trans	34.7	116	142.6	-56.7	-19.4	0	0	0	120.7
488	S	34	Very low	32.3	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	79%	0.792	S	S	*	*				-173	122.6	102.4	33.3	0	0	0	0	114.3
489	T	32.5	Very low	32.4	Very low	127 Å²	127	141.2 Å²	141.2	78%	0.779	80%	0.795	S	S	*	*			trans	46	98.4	138.1	-25.8	0	0	0	0	120.1
490	L	32.3	Very low	32.3	Very low	170 Å²	170	139.8 Å²	139.8	89%	0.89	79%	0.793	S	S	*	*				-176.3	142.2	110.1	-97.9	156.9	0	0	0	111.8
491	S	27.9	Very low	32.2	Very low	102 Å²	102	142 Å²	142	71%	0.713	81%	0.805	S	S	*	*			trans	-93.6	144.2	-169	55.2	0	0	0	0	114
492	V	33.8	Very low	32	Very low	149 Å²	149	139.6 Å²	139.6	90%	0.903	80%	0.804	S	S	*	*				-150.8	140	128.3	171	0	0	0	0	108.9
493	K	29.7	Very low	32.3	Very low	194 Å²	194	140.5 Å²	140.5	84%	0.843	81%	0.805	S	S	*	*			trans	-94.5	146.9	177.2	-67.6	174.2	173.9	177.4	0	112.3
494	K	34.6	Very low	32.1	Very low	196 Å²	196	134.2 Å²	134.2	85%	0.852	80%	0.801	S	S	*	*			trans	159.4	117.5	137.3	-89.5	169.9	178	-173.7	0	107.5
495	S	32.7	Very low	32.3	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	80%	0.802	S	S	*	*			cis	88.1	121.6	41.6	78.2	0	0	0	0	114.9
496	H	37.6	Very low	32.7	Very low	164 Å²	164	138.7 Å²	138.7	76%	0.759	81%	0.806	S	S	*	*			trans	93.7	138.3	153.2	-95.2	-94.1	0	0	0	122.7
497	D	36.2	Very low	32.7	Very low	133 Å²	133	142.2 Å²	142.2	71%	0.711	81%	0.812	S	S	*	*			trans	77.9	96.6	150.5	-56	-32.6	0	0	0	123.3
498	S	29.3	Very low	33	Very low	103 Å²	103	140 Å²	140	72%	0.72	81%	0.806	S	S	*	*				28	124.3	109.8	-169.3	0	0	0	0	119.3
499	L	32.8	Very low	33.1	Very low	168 Å²	168	144.6 Å²	144.6	88%	0.88	81%	0.813	S	S	*	*			trans	-166.7	138.5	130.9	-107	158.4	0	0	0	111.8
500	T	27.2	Very low	33.2	Very low	125 Å²	125	146.4 Å²	146.4	77%	0.767	82%	0.817	S	S	*	*			trans	-91.1	139.2	177.1	41.7	0	0	0	0	111.9
501	V	33.3	Very low	33.1	Very low	133 Å²	133	142.9 Å²	142.9	81%	0.806	81%	0.813	S	S	*	*			trans	-147.4	126.1	158.3	-178.5	0	0	0	0	109.6	V503	V501-V503 HydrophobicContact CG1-CG2 4.2Å
502	E	26.8	Very low	33.3	Very low	193 Å²	193	143 Å²	143	90%	0.902	82%	0.819	S	S	*	*			trans	-86.2	136.4	163.1	-67.5	-168.3	151.8	0	0	110.7
503	V	36.4	Very low	33.4	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	81%	0.813	S	S	*	*			trans	-145.6	126.6	153.4	-176.4	0	0	0	0	108.7	V501	V501-V503 HydrophobicContact CG1-CG2 4.2Å
504	G	28.6	Very low	33.6	Very low	80 Å²	80	141.6 Å²	141.6	83%	0.825	81%	0.814	S	S	*	*			trans	-76.7	150.8	178.3	0	0	0	0	0	114
505	G	34.3	Very low	33.3	Very low	80 Å²	80	139.8 Å²	139.8	83%	0.825	81%	0.808	S	S	*	*			trans	-142.6	134.8	176.7	0	0	0	0	0	111.6
506	K	38.3	Very low	33.2	Very low	208 Å²	208	142.6 Å²	142.6	90%	0.904	82%	0.815	S	S	*	*			trans	-84.9	160.2	-169.3	-67.4	170.4	177.6	173	0	113.5
507	N	37.1	Very low	32.8	Very low	165 Å²	165	142 Å²	142	88%	0.882	81%	0.813	S	S	*	*			trans	-41.1	136.6	167.3	-86.1	-13.4	0	0	0	114.2
508	P	37.9	Very low	32.7	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	81%	0.813	S	S	*	*			trans	-116.2	120.6	153.2	34.2	-21.8	0	0	0	111.1
509	F	36	Very low	32.9	Very low	210 Å²	210	142.1 Å²	142.1	92%	0.921	81%	0.813	S	S	*	*			trans	170.2	85.4	138.2	-93.3	-60.9	0	0	0	109.5
510	N	34.9	Very low	32.8	Very low	165 Å²	165	145 Å²	145	88%	0.882	81%	0.812	S	S	*	*			trans	-155.8	143.4	158.8	-131.7	-14.1	0	0	0	110.8
511	A	30.5	Very low	33.1	Very low	96 Å²	96	151 Å²	151	79%	0.793	82%	0.82	S	S	*	*			trans	60.7	113.6	170.6	0	0	0	0	0	120.1
512	A	32.4	Very low	33	Very low	103 Å²	103	154.2 Å²	154.2	85%	0.851	83%	0.827	S	S	*	*			trans	-155.3	116.7	140.6	0	0	0	0	0	109.7
513	P	35.6	Very low	33.3	Very low	118 Å²	118	148.8 Å²	148.8	77%	0.766	82%	0.823	S	S	*	*			trans	-98.7	158.1	175.2	37.2	-32.2	0	0	0	112
514	F	33.5	Very low	33	Very low	196 Å²	196	148.5 Å²	148.5	86%	0.86	83%	0.827	S	S	*	*			trans	-152	119.7	158	-125.9	-84.8	0	0	0	111.5	L516	F514-L516 HydrophobicContact CD1-CD1 4.46Å; F514-L516 HydrophobicContact CE1-CD1 4.08Å
515	E	28	Very low	33.2	Very low	158 Å²	158	151.7 Å²	151.7	74%	0.738	83%	0.83	S	S	*	*			trans	-101.5	143.1	167	-119.8	-165.9	148.5	0	0	108.7
516	L	31.2	Very low	33.1	Very low	157 Å²	157	151.1 Å²	151.1	82%	0.822	82%	0.824	S	S	*	*			trans	-155	116.6	159.3	-133.7	133.2	0	0	0	110.9	F514	F514-L516 HydrophobicContact CD1-CD1 4.46Å; F514-L516 HydrophobicContact CE1-CD1 4.08Å
517	Q	28.3	Very low	32.5	Very low	153 Å²	153	148.6 Å²	148.6	72%	0.715	82%	0.82	S	S	*	*			trans	-97.2	153.8	177.2	-65.8	-173.5	8.4	0	0	112.1
518	S	33.8	Very low	32.2	Very low	102 Å²	102	152.5 Å²	152.5	71%	0.713	82%	0.822	S	S	*	*			trans	116	129.4	135.1	84.1	0	0	0	0	119.8
519	N	33.3	Very low	32.1	Very low	135 Å²	135	155.4 Å²	155.4	72%	0.722	83%	0.826	S	S	*	*			trans	82.5	101.4	142.7	-68.1	-36.2	0	0	0	123.1
520	R	30.7	Very low	32	Very low	230 Å²	230	151.4 Å²	151.4	87%	0.868	82%	0.824	S	S	*	*				57.4	115.8	125.8	-70	-179.4	168.1	178.5	-3.4	119.6
521	R	33.5	Very low	31.9	Very low	249 Å²	249	149.5 Å²	149.5	94%	0.94	82%	0.818	S	S	*	*				-164.8	159.5	99.4	-103.5	170.9	-179.5	179.2	0.8	112
522	E	32.2	Very low	31.9	Very low	202 Å²	202	148.3 Å²	148.3	94%	0.944	82%	0.815	S	S	*	*			trans	-82.2	152.5	-168.2	-62.4	157.8	135.9	0	0	113.2
523	G	33.5	Very low	31.8	Very low	79 Å²	79	154.6 Å²	154.6	81%	0.814	82%	0.817	S	S	*	*			trans	-175.7	105.6	174.1	0	0	0	0	0	112
524	S	29.5	Very low	31.3	Very low	128 Å²	128	160.8 Å²	160.8	90%	0.895	83%	0.825	S	S	*	*			trans	-89	119.3	-173	-178.2	0	0	0	0	113
525	V	33.4	Very low	31.2	Very low	147 Å²	147	161.5 Å²	161.5	89%	0.891	82%	0.822	S	S	*	*			trans	-147.5	134.7	157.8	-174.7	0	0	0	0	110.7
526	G	31.4	Very low	31.4	Very low	68 Å²	68	164.3 Å²	164.3	70%	0.701	83%	0.826	S	S	*	*			trans	-73.6	176.4	-168	0	0	0	0	0	119.5
527	L	27	Very low	31.2	Very low	155 Å²	155	168 Å²	168	81%	0.812	83%	0.831	S	S	*	*			trans	-54.1	140.1	180	-75.3	72.8	0	0	0	113.6
528	R	30.2	Very low	31.2	Very low	247 Å²	247	169.8 Å²	169.8	93%	0.932	84%	0.836	S	S	*	*			trans	-141.5	122.4	142.5	-77.2	-161	170.8	-167.8	-2.4	112.2
529	H	35.4	Very low	31.2	Very low	165 Å²	165	174 Å²	174	76%	0.764	84%	0.841	S	S	*	*			trans	-68.3	134.8	165.7	-79.2	-97.7	0	0	0	111	V531	H529-V531 PolarHBondContact O-N 3.01Å
530	S	33.2	Very low	31.1	Very low	126 Å²	126	174.4 Å²	174.4	88%	0.881	84%	0.843	S	S	*	*			trans	-84.5	93.6	172.4	55.9	0	0	0	0	111.5
531	V	33	Very low	31.3	Very low	126 Å²	126	170.3 Å²	170.3	76%	0.764	84%	0.837	S	S	*	*			trans	-88.2	119	172.9	178.1	0	0	0	0	110.7	H529 R533	H529-V531 PolarHBondContact O-N 3.01Å; V531-R533 PolarHBondContact O-N 2.99Å
532	G	31.8	Very low	31.1	Very low	71 Å²	71	166.2 Å²	166.2	73%	0.732	83%	0.834	S	S	*	*			trans	-79.1	98.4	177	0	0	0	0	0	114.1
533	R	30.2	Very low	31.4	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.887	82%	0.824	S	S	*	*			trans	54.2	92	149.1	-166.5	-178.7	-92.1	-164.8	-3.9	117.9	V531	V531-R533 PolarHBondContact O-N 2.99Å
534	W	24	Very low	31.5	Very low	248 Å²	248	165.5 Å²	165.5	94%	0.939	82%	0.824	S	S	*	*			trans	-112.5	148	154	-85.3	64.4	0	0	0	110.6
535	R	31.9	Very low	31.8	Very low	210 Å²	210	166.9 Å²	166.9	79%	0.792	82%	0.822	S	S	*	*			trans	-146	127.5	169.6	-83.6	-165.5	172.2	-149.2	-2.3	112.4
536	R	32.4	Very low	31.7	Very low	217 Å²	217	163.3 Å²	163.3	82%	0.819	81%	0.814	S	S	*	*			trans	61.3	122	163.5	-60.3	173.8	173.7	164.8	-5.2	114.4
537	Y	26.8	Very low	31.8	Very low	236 Å²	236	168.6 Å²	168.6	93%	0.925	82%	0.821	S	S	*	*			cis	-135.1	156.8	47	-112	-103.7	0	0	0	113.7
538	K	28.7	Very low	32.1	Very low	189 Å²	189	166.6 Å²	166.6	82%	0.822	82%	0.817	S	S	*	*			trans	-145.3	130.2	-179	-175.6	-176.5	-176	-177.9	0	111.1
539	K	33.1	Very low	32.5	Very low	190 Å²	190	160.6 Å²	160.6	83%	0.826	81%	0.81	S	S	*	*			trans	-165.6	106.6	155.9	-107	172.8	178.9	-172.7	0	106
540	L	32.4	Very low	32.6	Very low	144 Å²	144	157.7 Å²	157.7	75%	0.754	81%	0.814	S	S	*	*				69.5	128.8	90.8	-71.3	174	0	0	0	110.6
541	I	34.2	Very low	32.5	Very low	144 Å²	144	160 Å²	160	74%	0.738	81%	0.812	S	S	*	*			cis	-146.9	154.4	33.1	-65.4	174.2	0	0	0	111.2
542	N	29.6	Very low	32.5	Very low	163 Å²	163	161.3 Å²	161.3	87%	0.872	81%	0.813	S	S	*	*			trans	-111.3	146.9	164.1	-72.2	0.6	0	0	0	110.8
543	A	37.2	Very low	32.6	Very low	89 Å²	89	163.3 Å²	163.3	74%	0.736	81%	0.814	S	S	*	*			trans	-177.5	108.8	151.4	0	0	0	0	0	105.7
544	E	37	Very low	32.6	Very low	177 Å²	177	160.5 Å²	160.5	83%	0.827	81%	0.81	S	S	*	*				78.4	116.7	75.4	-77.1	179.9	170.8	0	0	114.5
545	D	35.4	Very low	33.2	Very low	158 Å²	158	156.5 Å²	156.5	85%	0.845	81%	0.806	S	S	*	*			trans	68.3	132	148.4	-51.8	-20.8	0	0	0	124.1
546	G	31.8	Very low	33	Very low	71 Å²	71	152.2 Å²	152.2	73%	0.732	80%	0.804	S	S	*	*			trans	131.2	117.4	144.7	0	0	0	0	0	118.4
547	E	32	Very low	33.2	Very low	180 Å²	180	153 Å²	153	84%	0.841	81%	0.807	S	S	*	*			trans	61.9	122.8	152.1	-66.2	-67.8	118.5	0	0	121.4
548	P	34.6	Very low	33.6	Very low	113 Å²	113	148 Å²	148	73%	0.734	80%	0.796	S	S	*	*			trans	-101	151.9	163.6	37.9	-30.1	0	0	0	112.6
549	P	37.3	Very low	33.9	Very low	121 Å²	121	149.4 Å²	149.4	79%	0.786	80%	0.798	S	S	*	*			trans	-141.1	150.9	155.2	37.2	-22.5	0	0	0	117.1
550	A	38.9	Very low	34	Very low	103 Å²	103	143.8 Å²	143.8	85%	0.851	79%	0.794	S	S	*	*			trans	68.9	154.4	138.9	0	0	0	0	0	121.7
551	Q	29.9	Very low	34.1	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	80%	0.799	S	S	*	*			trans	-110	172.9	-174	-56.3	162.9	-62.1	0	0	111
552	L	33.1	Very low	34.4	Very low	152 Å²	152	139.8 Å²	139.8	80%	0.796	80%	0.795	S	S	*	*			trans	72.4	161.1	158.2	-67.6	159.6	0	0	0	117.2
553	P	34.4	Very low	34.7	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	79%	0.792	S	S	*	*			cis	-123.3	176.4	-0.8	32.6	-13.6	0	0	0	115.3
554	E	30	Very low	34.8	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	79%	0.791	S	S	*	*			trans	-59.1	156	161	-65.8	171.1	109.4	0	0	112.2
555	L	35.9	Very low	34.9	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	79%	0.792	S	S	*	*			trans	-137.5	103.8	166.9	-110.7	165.5	0	0	0	110.2
556	T	29.3	Very low	34.9	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	79%	0.79	S	S	*	*			trans	-88.2	136.7	165.4	44.9	0	0	0	0	110.2
557	R	36.3	Very low	35.2	Very low	234 Å²	234	136.9 Å²	136.9	88%	0.883	80%	0.797	S	S	*	*			trans	159.7	155.4	156	-94.1	159.5	171.7	157.4	-0.2	109.6
558	D	33.9	Very low	35.2	Very low	130 Å²	130	132.8 Å²	132.8	70%	0.695	79%	0.794	S	S	*	*			cis	170.4	140.3	-35.3	-125.7	-9.6	0	0	0	106.5
559	Y	35.7	Very low	35.4	Very low	220 Å²	220	132.6 Å²	132.6	86%	0.863	80%	0.796	S	S	*	*			trans	63.6	139.3	161.3	-71.2	-75.7	0	0	0	124.5
560	G	34.2	Very low	35.3	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	80%	0.8	S	S	*	*			trans	111.5	97.9	158.7	0	0	0	0	0	114.8
561	S	36.4	Very low	34.9	Very low	123 Å²	123	138 Å²	138	86%	0.86	80%	0.803	S	S	*	*			cis	108.5	145.6	33.8	-170.4	0	0	0	0	111.8
562	A	39	Very low	35.1	Very low	80 Å²	80	141.2 Å²	141.2	66%	0.661	81%	0.807	S	S	*	*			trans	68.6	134.9	179.8	0	0	0	0	0	116.5
563	D	36.4	Very low	35.2	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	81%	0.811	S	S	*	*			cis	-150.1	138	-2.7	-87.2	-37	0	0	0	109
564	S	39.2	Very low	35.3	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	82%	0.82	S	S	*	*				68.9	135.6	96.3	-139.3	0	0	0	0	114.8
565	V	40.1	Very low	35.3	Very low	140 Å²	140	150 Å²	150	85%	0.848	83%	0.826	S	S	*	*			cis	-155.9	153.1	21.6	-142.4	0	0	0	0	112.4
566	G	34	Very low	35.1	Very low	77 Å²	77	146.8 Å²	146.8	79%	0.794	82%	0.823	S	S	*	*			trans	88.2	132.7	149.8	0	0	0	0	0	118.2
567	S	37.7	Very low	35.6	Very low	127 Å²	127	148.1 Å²	148.1	89%	0.888	83%	0.831	S	S	*	*			cis	-150.8	153.5	-9.1	-170	0	0	0	0	109
568	A	32.2	Very low	35.4	Very low	93 Å²	93	142.5 Å²	142.5	77%	0.769	83%	0.828	S	S	*	*			trans	-117.5	131.1	-171.8	0	0	0	0	0	113.3
569	S	39.6	Very low	35.4	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	83%	0.832	S	S	*	*			trans	-148.6	149	158.3	-44.7	0	0	0	0	109.4
570	D	34.5	Very low	35.4	Very low	164 Å²	164	136.7 Å²	136.7	88%	0.877	83%	0.829	S	S	*	*			trans	64.4	68.6	161.9	-54.5	-17.3	0	0	0	118.6
571	L	32.1	Very low	35.5	Very low	174 Å²	174	139.3 Å²	139.3	91%	0.911	84%	0.836	S	S	*	*			trans	-121.1	68.7	161.5	-153	174.5	0	0	0	109.9
572	R	33.2	Very low	35.4	Very low	242 Å²	242	138.4 Å²	138.4	91%	0.913	83%	0.83	S	S	*	*			trans	-155.9	40.2	171.4	-144.4	-178.1	-172.7	-174	1.6	116.8
573	E	35.6	Very low	35.1	Very low	188 Å²	188	139.5 Å²	139.5	88%	0.879	83%	0.833	S	S	*	*	S	Bend	trans	-151.9	155.2	163.9	-121.1	173.2	-173.2	0	0	110.3
574	R	36.2	Very low	35.1	Very low	246 Å²	246	140.5 Å²	140.5	93%	0.928	83%	0.833	S	S	*	*	S	Bend	trans	79.7	39.8	-176.8	-50.2	179.8	179.4	170.1	1.1	118.3
575	M	29.9	Very low	35.1	Very low	192 Å²	192	147.3 Å²	147.3	95%	0.946	84%	0.844	S	S	*	*	S	Bend	trans	-147.4	83.2	145.9	-74.8	-163.5	-177	0	0	110.3
576	A	32.4	Very low	34.9	Very low	97 Å²	97	148.3 Å²	148.3	80%	0.802	84%	0.84	S	S	*	*			trans	168.2	70.6	158.5	0	0	0	0	0	113.7
577	V	38.3	Very low	35.1	Very low	148 Å²	148	150 Å²	150	90%	0.897	83%	0.831	S	S	*	*			trans	-165.1	134.9	151.2	-106.8	0	0	0	0	106.6
578	S	33.5	Very low	35.1	Very low	116 Å²	116	151.4 Å²	151.4	81%	0.811	83%	0.828	S	S	*	*			cis	-145.3	131.2	9.8	38.8	0	0	0	0	111.7
579	S	34.1	Very low	35.4	Very low	113 Å²	113	151.3 Å²	151.3	79%	0.79	83%	0.827	S	S	*	*			trans	-150.6	148	164.7	56.5	0	0	0	0	108.8
580	S	34.8	Very low	35.4	Very low	115 Å²	115	151 Å²	151	80%	0.804	83%	0.825	S	S	*	*			trans	59.7	103.7	-175.9	66.9	0	0	0	0	117.7
581	S	35.5	Very low	35.6	Very low	126 Å²	126	149.1 Å²	149.1	88%	0.881	82%	0.82	S	S	*	*			trans	-131.8	109.6	137.7	60.5	0	0	0	0	107.3
582	S	34.7	Very low	36	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	81%	0.814	S	S	*	*			trans	-96	163.2	179.3	-66.8	0	0	0	0	111.8
583	S	34.2	Very low	36.3	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	81%	0.806	S	S	*	*			trans	73.1	144.5	148.8	54.5	0	0	0	0	121
584	E	36.3	Very low	36.5	Very low	172 Å²	172	142.6 Å²	142.6	80%	0.804	81%	0.805	S	S	*	*			trans	76.3	93.7	160.7	-67.9	168.2	-153.8	0	0	118.5
585	Y	38.3	Very low	36.6	Very low	246 Å²	246	134.9 Å²	134.9	97%	0.965	79%	0.794	S	S	*	*				-146.2	143.4	118	-99.6	-73.5	0	0	0	110.2
586	E	36.2	Very low	37	Very low	161 Å²	161	132.3 Å²	132.3	75%	0.752	79%	0.789	S	S	*	*			trans	-106.5	157.7	-162.9	-98.5	-164.4	143.2	0	0	115
587	N	38.2	Very low	37.4	Very low	113 Å²	113	132.5 Å²	132.5	60%	0.604	78%	0.782	S	S	*	*			trans	57.9	108.6	142.7	-61.6	-30.4	0	0	0	121.2
588	N	37.7	Very low	37.4	Very low	155 Å²	155	132.7 Å²	132.7	83%	0.829	78%	0.777	S	S	*	*				172.3	114.9	112.6	-83.5	-38.3	0	0	0	109.1
589	A	38.1	Very low	37.6	Very low	92 Å²	92	135 Å²	135	76%	0.76	78%	0.775	S	S	*	*				65.2	133.8	93.8	0	0	0	0	0	114.4
590	S	39.1	Very low	38.3	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	77%	0.767	S	S	*	*			cis	-174.1	142.5	-3.9	51.4	0	0	0	0	111
591	T	38.4	Very low	38.5	Very low	124 Å²	124	133.9 Å²	133.9	76%	0.761	77%	0.765	S	S	*	*			trans	60.4	127.7	145.3	-38.9	0	0	0	0	121.1
592	V	41.9	Very low	38.7	Very low	132 Å²	132	132.9 Å²	132.9	80%	0.8	75%	0.754	S	S	*	*				168.6	132.6	115.5	161.8	0	0	0	0	111.1
593	D	38.2	Very low	39.1	Very low	139 Å²	139	136 Å²	136	74%	0.743	76%	0.757	S	S	*	*			trans	-86.8	177.6	-177	-63	-74	0	0	0	116.5
594	K	40.2	Very low	39.4	Very low	197 Å²	197	136.5 Å²	136.5	86%	0.857	76%	0.755	S	S	*	*			trans	100.3	111.7	156.1	-59.2	172.6	-174.5	178	0	115.6
595	A	37.9	Very low	39.8	Very low	84 Å²	84	135.1 Å²	135.1	69%	0.694	75%	0.754	S	S	*	*				79.2	104.7	69.8	0	0	0	0	0	112.8
596	V	39.7	Very low	40	Very low	137 Å²	137	132 Å²	132	83%	0.83	75%	0.748	S	S	*	*				83	139.9	91.9	157.1	0	0	0	0	112.9
597	P	39.6	Very low	40.7	Very low	102 Å²	102	129.3 Å²	129.3	66%	0.662	74%	0.744	S	S	*	*			cis	-148.3	-174	-23.6	43.5	-23.3	0	0	0	117.1
598	L	39.8	Very low	40.9	Very low	151 Å²	151	128.1 Å²	128.1	79%	0.791	75%	0.75	S	S	*	*			trans	57.9	115.7	146.5	-72.1	161.1	0	0	0	124.1
599	E	37.6	Very low	40.9	Very low	165 Å²	165	127.2 Å²	127.2	77%	0.771	75%	0.745	S	S	*	*				50.3	162.5	122.3	-64.1	-65.6	118.1	0	0	122.9
600	P	48.3	Very low	41.1	Very low	97 Å²	97	130.2 Å²	130.2	63%	0.63	75%	0.747	S	S	*	*			cis	-138.2	-173	-25.7	37.3	-18.8	0	0	0	115.4
601	S	39.2	Very low	40.9	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	75%	0.753	S	S	*	*			trans	77.8	149.8	152.6	83.3	0	0	0	0	118
602	T	40	Very low	41.2	Very low	106 Å²	106	132.9 Å²	132.9	65%	0.65	75%	0.749	S	S	*	*			cis	-151.2	151.3	9.5	39.8	0	0	0	0	111.3
603	E	42	Very low	41	Very low	171 Å²	171	135.3 Å²	135.3	80%	0.799	75%	0.752	S	S	*	*			trans	54	143	137.1	-64.3	168.5	-177.8	0	0	120.4
604	T	41.9	Very low	40.7	Very low	113 Å²	113	133 Å²	133	69%	0.693	75%	0.746	S	S	*	*			cis	-168.3	156.4	42.2	-5.6	0	0	0	0	111.9
605	D	43	Very low	40.2	Very low	143 Å²	143	129.6 Å²	129.6	77%	0.765	75%	0.746	S	S	*	*			trans	69.9	88.5	148.2	-55.8	-24.1	0	0	0	125.6
606	E	43.8	Very low	40.1	Very low	181 Å²	181	134.1 Å²	134.1	85%	0.846	75%	0.753	S	S	*	*				43.8	162.1	99.5	-83.7	-89.3	110.9	0	0	123
607	P	49.4	Very low	40.4	Very low	103 Å²	103	132.5 Å²	132.5	67%	0.669	75%	0.745	S	S	*	*				-139.4	-168.5	-124.5	46.6	-26.8	0	0	0	116.1
608	A	42.2	Very low	40.3	Very low	88 Å²	88	135.6 Å²	135.6	73%	0.727	75%	0.75	S	S	*	*			trans	168.7	158.6	156	0	0	0	0	0	109.3
609	N	39.2	Very low	40.2	Very low	136 Å²	136	134.3 Å²	134.3	73%	0.727	74%	0.743	S	S	*	*			cis	-162.3	151.8	1.2	-129.3	-9.8	0	0	0	111.7
610	L	41.6	Very low	40.2	Very low	155 Å²	155	134.5 Å²	134.5	81%	0.812	75%	0.749	S	S	*	*			trans	67.5	134.1	144.7	-64.3	163.2	0	0	0	123.8
611	E	34.7	Very low	39.7	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	75%	0.75	S	S	*	*			trans	-90.2	-151.6	171.3	-52.3	-174	139.1	0	0	112.4
612	P	44.5	Very low	39.6	Very low	103 Å²	103	140.2 Å²	140.2	67%	0.669	76%	0.761	S	S	*	*				-119.7	-171.3	-75.1	30.8	-11.1	0	0	0	111.3
613	E	37.4	Very low	39.4	Very low	184 Å²	184	144.5 Å²	144.5	86%	0.86	77%	0.77	S	S	*	*			trans	171.8	163.3	133.5	-86.5	-96.9	116	0	0	112.1
614	S	31.8	Very low	39.6	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	76%	0.762	S	S	*	*			trans	-77.8	170.6	-163.1	52.2	0	0	0	0	119.6
615	C	31.7	Very low	39.4	Very low	125 Å²	125	142.2 Å²	142.2	85%	0.845	76%	0.764	S	S	*	*			trans	117.8	122.2	143.9	-69.6	0	0	0	0	119
616	E	34.7	Very low	39.3	Very low	180 Å²	180	143 Å²	143	84%	0.841	77%	0.767	S	S	*	*			trans	-69.1	-172.7	159.1	-66.1	-159.7	140	0	0	111.6
617	P	46.7	Very low	39.2	Very low	103 Å²	103	137.6 Å²	137.6	67%	0.669	75%	0.753	S	S	*	*			cis	-143.8	-163.1	10.8	29.6	-1.3	0	0	0	117.1
618	E	36.3	Very low	38.7	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	76%	0.758	S	S	*	*			trans	83.1	146.8	154.2	-68.8	-155.3	167.7	0	0	119.5
619	I	37.9	Very low	38.9	Very low	125 Å²	125	142.1 Å²	142.1	64%	0.641	76%	0.76	S	S	*	*			cis	-166	174.3	-17.8	-118.6	174.5	0	0	0	109.4
620	L	38.5	Very low	38.9	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	76%	0.759	S	S	*	*			trans	78.9	131.1	162.1	-121.4	74.3	0	0	0	117.9
621	G	37.7	Very low	38.9	Very low	63 Å²	63	142 Å²	142	65%	0.649	76%	0.762	S	S	*	*			cis	142	138.1	-13.5	0	0	0	0	0	114.3
622	R	37.5	Very low	39	Very low	261 Å²	261	137.9 Å²	137.9	99%	0.985	76%	0.759	S	S	*	*			trans	-178.3	154.6	136.8	-101.2	171.8	-176.5	-157.3	0.1	113.7
623	K	34.8	Very low	38.5	Very low	195 Å²	195	139.8 Å²	139.8	85%	0.848	76%	0.763	S	S	*	*			trans	-130.1	-164	-169.2	-124.2	-177.2	-179.7	-178.7	0	106.8
624	P	46.9	Very low	38.5	Very low	95 Å²	95	138.8 Å²	138.8	62%	0.617	76%	0.764	S	S	*	*			cis	-134.3	-167.7	-32.5	34	-13.6	0	0	0	112.4
625	L	38.2	Very low	38.6	Very low	142 Å²	142	141 Å²	141	74%	0.743	77%	0.774	S	S	*	*				169.9	122.9	113.5	-85.3	168.7	0	0	0	113.7
626	L	39.8	Very low	38.6	Very low	159 Å²	159	143.4 Å²	143.4	83%	0.832	77%	0.773	S	S	*	*			trans	61.6	144.3	140.3	-59.6	172.9	0	0	0	121.2
627	A	40.9	Very low	38.4	Very low	67 Å²	67	139.9 Å²	139.9	55%	0.554	77%	0.768	S	S	*	*			cis	-168.3	159.8	-4.3	0	0	0	0	0	112.4
628	D	40.9	Very low	37.9	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	78%	0.779	S	S	*	*			trans	57.5	144.2	150.3	-49.6	-18	0	0	0	119.5
629	D	44.9	Very low	37.9	Very low	142 Å²	142	144.6 Å²	144.6	76%	0.759	78%	0.778	S	S	*	*			cis	-147.9	138.1	11.3	-85.9	-53.4	0	0	0	108
630	S	39.5	Very low	37.9	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	78%	0.779	S	S	*	*				105.5	150.7	71.5	89.7	0	0	0	0	114.2
631	E	41.1	Very low	37.7	Very low	186 Å²	186	140.2 Å²	140.2	87%	0.869	75%	0.752	S	S	*	*			trans	75	106.9	-179.2	-56.2	-168.9	156.9	0	0	117.4
632	A	38.3	Very low	37.7	Very low	94 Å²	94	140.1 Å²	140.1	78%	0.777	74%	0.742	S	S	*	*				84.3	93.4	69.4	0	0	0	0	0	112
633	D	33.7	Very low	37.8	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	72%	0.719	S	S	*	*				82.4	100.6	83.5	-165.2	23.4	0	0	0	112.8
634	D	36.1	Very low	38	Very low	164 Å²	164	126.7 Å²	126.7	88%	0.877	70%	0.7	S	S	*	*			trans	-162.7	79.4	171.4	-109.9	-24.3	0	0	0	109.1
635	T	33.8	Very low	37.8	Very low	135 Å²	135	123.6 Å²	123.6	83%	0.828	68%	0.678	S	S	*	*			trans	-109.5	35.8	-176.6	-32.8	0	0	0	0	113.1
636	E	32.2	Very low	38.2	Very low	177 Å²	177	118.4 Å²	118.4	83%	0.827	65%	0.652	S	S	*	*			trans	-127	96.9	173.3	-71.8	-161.1	170.5	0	0	111.7
637	S	31.2	Very low	38.3	Very low	105 Å²	105	117.2 Å²	117.2	73%	0.734	64%	0.642	S	S	*	*			trans	-157.2	-2.1	174.3	-85.9	0	0	0	0	116.9
638	F	35.3	Very low	38.5	Very low	205 Å²	205	119 Å²	119	90%	0.899	64%	0.638	S	S	*	*	S	Bend	trans	-92.1	-17	-172	-109.3	-93.7	0	0	0	116
639	E	36.4	Very low	38.8	Very low	164 Å²	164	113 Å²	113	77%	0.766	61%	0.606	S	S	*	*	S	Bend	trans	-100	-16.1	-174.9	-67.2	-165.4	142.5	0	0	115.6	F641 S642	E639-F641 VanDerWaalsContact C-N 3.28Å; E639-F641 PolarHBondContact O-N 3.08Å; E639-S642 PolarHBondContact O-OG 3.09Å
640	I	37.6	Very low	38.6	Very low	129 Å²	129	112.1 Å²	112.1	66%	0.662	60%	0.602	S	S	*	*	H	α-helix	trans	-75.3	-21.3	-178.4	-60.3	173.7	0	0	0	111.4
641	F	35.5	Very low	38.6	Very low	73 Å²	73	111.4 Å²	111.4	32%	0.32	59%	0.589	S	S	.	*	H	α-helix	trans	-83.6	-29.8	-166.6	-158.7	-108.8	0	0	0	115.2	K135 N139 E639 Q643	K135-F641 HydrophobicContact CD-CD2 4.36Å; K135-F641 HydrophobicContact CD-CE2 3.61Å; K135-F641 HydrophobicContact CD-CZ 4.07Å; K135-F641 HydrophobicContact CG-CE2 4.24Å; K135-F641 HydrophobicContact CG-CZ 4.2Å; N139-F641 WeakPolarHBondContact ND2-CE1 3.48Å; N139-F641 WeakPolarHBondContact ND2-CZ 3.47Å; E639-F641 VanDerWaalsContact C-N 3.28Å; E639-F641 PolarHBondContact O-N 3.08Å; F641-Q643 VanDerWaalsContact C-N 3.33Å
642	S	37.9	Very low	38.6	Very low	61 Å²	61	105.4 Å²	105.4	43%	0.427	57%	0.567	S	S	.	*	H	α-helix	trans	-60.6	-46	170.8	52.5	0	0	0	0	110.5	E639 S644 M645 T646	E639-S642 PolarHBondContact O-OG 3.09Å; S642-S644 VanDerWaalsContact C-N 3.3Å; S642-S644 PolarHBondContact O-N 3.02Å; S642-M645 PolarHBondContact O-N 2.92Å; S642-T646 WeakPolarHBondContact O-CG2 3.4Å; S642-T646 PolarHBondContact O-N 2.81Å; S642-T646 PolarHBondContact O-OG1 3.49Å
643	Q	38.8	Very low	38.5	Very low	109 Å²	109	106.3 Å²	106.3	51%	0.509	56%	0.559	S	S	.	*	H	α-helix	trans	-56.6	-37.6	-174.8	-58.5	-174.5	19.6	0	0	113.8	F641 M645 T646 Q647	F641-Q643 VanDerWaalsContact C-N 3.33Å; Q643-M645 VanDerWaalsContact C-N 3.32Å; Q643-M645 PolarHBondContact O-N 3.33Å; Q643-T646 WeakPolarHBondContact CA-OG1 3.48Å; Q643-T646 PolarHBondContact O-OG1 3.42Å; Q643-Q647 VanDerWaalsContact O-CB 3.29Å; Q643-Q647 WeakPolarHBondContact O-CB 3.33Å; Q643-Q647 WeakPolarHBondContact O-CG 3.31Å; Q643-Q647 PolarHBondContact O-N 3.27Å; Q643-Q647 VanDerWaalsContact O-N 3.09Å
644	S	38.9	Very low	38.7	Very low	64 Å²	64	110 Å²	110	45%	0.448	56%	0.562	S	S	.	*	H	α-helix	trans	-68.4	-29.8	-179.6	-173.5	0	0	0	0	113.2	S642 F648	S642-S644 VanDerWaalsContact C-N 3.3Å; S642-S644 PolarHBondContact O-N 3.02Å; S644-F648 VanDerWaalsContact O-CD2 3.31Å; S644-F648 WeakPolarHBondContact O-CD2 3.23Å
645	M	42.3	Very low	38.6	Very low	30 Å²	30	108.8 Å²	108.8	15%	0.148	55%	0.554	C	S	.	*	H	α-helix	trans	-98.6	-35.4	-176.4	-145.7	155.5	-177.5	0	0	111	I170 S642 Q643 Q647 F648 V649	I170-M645 HydrophobicContact CD1-CE 4.37Å; S642-M645 PolarHBondContact O-N 2.92Å; Q643-M645 VanDerWaalsContact C-N 3.32Å; Q643-M645 PolarHBondContact O-N 3.33Å; M645-Q647 VanDerWaalsContact C-N 3.3Å; M645-Q647 PolarHBondContact O-N 3.09Å; M645-F648 PolarHBondContact O-N 3.41Å; M645-F648 VanDerWaalsContact O-N 3.13Å; M645-V649 PolarHBondContact O-N 3.45Å
646	T	47.5	Very low	38.4	Very low	33 Å²	33	106 Å²	106	20%	0.202	53%	0.534	C	S	.	.	H	α-helix	trans	-64.5	-31.2	170.5	58.3	0	0	0	0	112.5	S642 Q643 F648 V649 D650	S642-T646 WeakPolarHBondContact O-CG2 3.4Å; S642-T646 PolarHBondContact O-N 2.81Å; S642-T646 PolarHBondContact O-OG1 3.49Å; Q643-T646 WeakPolarHBondContact CA-OG1 3.48Å; Q643-T646 PolarHBondContact O-OG1 3.42Å; T646-F648 PolarHBondContact O-N 2.92Å; T646-F648 VanDerWaalsContact O-N 3.12Å; T646-V649 WeakPolarHBondContact O-CA 3.49Å; T646-V649 WeakPolarHBondContact O-CB 3.49Å; T646-V649 PolarHBondContact O-N 3.41Å; T646-D650 WeakPolarHBondContact O-CB 3.48Å; T646-D650 PolarHBondContact O-N 3.44Å
647	Q	42	Very low	38.1	Very low	135 Å²	135	106.2 Å²	106.2	63%	0.631	53%	0.532	S	S	*	.	H	α-helix	trans	-55.9	-28.6	171.3	-85.4	175	33.3	0	0	113.7	Q643 M645	Q643-Q647 VanDerWaalsContact O-CB 3.29Å; Q643-Q647 WeakPolarHBondContact O-CB 3.33Å; Q643-Q647 WeakPolarHBondContact O-CG 3.31Å; Q643-Q647 PolarHBondContact O-N 3.27Å; Q643-Q647 VanDerWaalsContact O-N 3.09Å; M645-Q647 VanDerWaalsContact C-N 3.3Å; M645-Q647 PolarHBondContact O-N 3.09Å
648	F	45.6	Very low	38.2	Very low	104 Å²	104	107 Å²	107	46%	0.456	54%	0.537	S	S	.	.	H	α-helix	trans	-81	-27.6	172	-71.7	-82	0	0	0	113.2	S644 M645 T646	S644-F648 VanDerWaalsContact O-CD2 3.31Å; S644-F648 WeakPolarHBondContact O-CD2 3.23Å; M645-F648 PolarHBondContact O-N 3.41Å; M645-F648 VanDerWaalsContact O-N 3.13Å; T646-F648 PolarHBondContact O-N 2.92Å; T646-F648 VanDerWaalsContact O-N 3.12Å
649	V	46.1	Very low	38.1	Very low	17 Å²	17	104.3 Å²	104.3	10%	0.103	53%	0.532	C	S	.	.	H	α-helix	trans	-74.7	-43.8	177.4	-178.5	0	0	0	0	111.2	R115 M645 T646	R115-V649 PolarHBondContact NE-O 3.49Å; R115-V649 PolarHBondContact NH2-O 2.95Å; M645-V649 PolarHBondContact O-N 3.45Å; T646-V649 WeakPolarHBondContact O-CA 3.49Å; T646-V649 WeakPolarHBondContact O-CB 3.49Å; T646-V649 PolarHBondContact O-N 3.41Å
650	D	42	Very low	37.8	Very low	125 Å²	125	102.3 Å²	102.3	67%	0.668	54%	0.536	S	S	*	.	H	α-helix	trans	-84	-11.7	-169	-73.9	-33	0	0	0	115.2	T646 P652	T646-D650 WeakPolarHBondContact O-CB 3.48Å; T646-D650 PolarHBondContact O-N 3.44Å; D650-P652 VanDerWaalsContact C-CD 3.48Å; D650-P652 WeakPolarHBondContact O-CD 3.45Å
651	N	39.2	Very low	37.8	Very low	87 Å²	87	100.3 Å²	100.3	47%	0.465	54%	0.539	S	S	.	.			trans	-125	67.5	-177.2	-159.9	-8.1	0	0	0	115.4	N653 R654	N651-N653 PolarHBondContact O-N 2.91Å; N651-R654 PolarHBondContact OD1-N 3.34Å
652	P	39.6	Very low	37.8	Very low	60 Å²	60	104.8 Å²	104.8	39%	0.39	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-66.4	-22.3	171.5	27.1	-33.4	0	0	0	113.9	R115 D650 R654	R115-P652 VanDerWaalsContact NH2-CG 3.29Å; D650-P652 VanDerWaalsContact C-CD 3.48Å; D650-P652 WeakPolarHBondContact O-CD 3.45Å; P652-R654 PolarHBondContact O-N 3.38Å
653	N	36.2	Very low	37.4	Very low	114 Å²	114	107.5 Å²	107.5	61%	0.61	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-87.1	-5.4	-164.4	-72.6	-42.5	0	0	0	114.2	N651 I655 L656	N651-N653 PolarHBondContact O-N 2.91Å; N653-I655 PolarHBondContact O-N 3.02Å; N653-L656 PolarHBondContact O-N 2.93Å
654	R	38.2	Very low	37.3	Very low	220 Å²	220	106.6 Å²	106.6	83%	0.83	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-70.9	-6.5	174.3	-142.9	177.3	-171.5	-176.2	2.3	114	N651 P652	N651-R654 PolarHBondContact OD1-N 3.34Å; P652-R654 PolarHBondContact O-N 3.38Å
655	I	34.1	Very low	37	Very low	138 Å²	138	110.8 Å²	110.8	71%	0.708	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-95.1	-11	175.7	-66	176	0	0	0	112.2	N653	N653-I655 PolarHBondContact O-N 3.02Å
656	L	29.8	Very low	36.5	Very low	77 Å²	77	115.8 Å²	115.8	40%	0.403	65%	0.645	S	S	.	*	S	Bend	trans	-136.8	62.1	-177.9	-70.9	176.3	0	0	0	112.5	P480 N653	P480-L656 HydrophobicContact CG-CD2 4.49Å; N653-L656 PolarHBondContact O-N 2.93Å
657	K	27.3	Very low	35.5	Very low	181 Å²	181	123.7 Å²	123.7	79%	0.787	68%	0.677	S	S	*	*			trans	-173	98.5	158.9	-104.2	153.8	-173.7	-177.4	0	111.3
658	S	31.8	Very low	34.9	Very low	120 Å²	120	122.4 Å²	122.4	84%	0.839	68%	0.683	S	S	*	*			trans	-124.2	106.4	155	59.4	0	0	0	0	106.5
659	D	34.6	Very low	34.1	Very low	150 Å²	150	126.5 Å²	126.5	80%	0.802	71%	0.706	S	S	*	*			trans	-67.6	152.7	-171.9	-71.1	-56	0	0	0	112.8
660	S	30	Very low	33.4	Very low	122 Å²	122	130 Å²	130	85%	0.853	74%	0.737	S	S	*	*			trans	-77.5	117.9	-177.1	54	0	0	0	0	112.7
661	A	36.9	Very low	33.1	Very low	86 Å²	86	129.8 Å²	129.8	71%	0.711	74%	0.742	S	S	*	*			trans	-158.3	115.7	147.8	0	0	0	0	0	111.1
662	D	36	Very low	32.6	Very low	167 Å²	167	132.7 Å²	132.7	89%	0.893	75%	0.751	S	S	*	*			trans	120.8	110.8	147.6	-65.1	-14.2	0	0	0	117.4
663	S	29.4	Very low	32.3	Very low	119 Å²	119	136.5 Å²	136.5	83%	0.832	77%	0.773	S	S	*	*			trans	-87.3	131.3	174.2	55.8	0	0	0	0	111.1
664	A	35.5	Very low	31.8	Very low	89 Å²	89	135.9 Å²	135.9	74%	0.736	78%	0.776	S	S	*	*			trans	-172.4	118.4	131	0	0	0	0	0	112.7
665	N	32.4	Very low	31.5	Very low	153 Å²	153	137.6 Å²	137.6	82%	0.818	78%	0.783	S	S	*	*			trans	58.6	115.9	131.9	-75.7	-11.2	0	0	0	122.2
666	V	32.4	Very low	31.5	Very low	134 Å²	134	135.1 Å²	135.1	81%	0.812	78%	0.783	S	S	*	*				119	120.2	123.3	168.1	0	0	0	0	117.4
667	F	26.1	Very low	31.6	Very low	200 Å²	200	138.9 Å²	138.9	88%	0.877	80%	0.803	S	S	*	*			trans	-56.2	139.9	164.2	-84.6	-118	0	0	0	112.3
668	S	30.3	Very low	31.9	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	81%	0.81	S	S	*	*				-179.6	143.3	107.1	57.6	0	0	0	0	114.2
669	M	28.9	Very low	31.9	Very low	189 Å²	189	141.6 Å²	141.6	93%	0.931	81%	0.812	S	S	*	*			trans	33.9	128.2	146.2	-71.1	-179.2	140.5	0	0	122.4
670	A	30.7	Very low	31.9	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	81%	0.812	S	S	*	*			trans	-67.4	171.3	155.7	0	0	0	0	0	111.6
671	P	36.9	Very low	32	Very low	120 Å²	120	143 Å²	143	78%	0.779	81%	0.813	S	S	*	*				-154	-179	69.1	40.3	-18.4	0	0	0	118.1
672	F	26.8	Very low	31.8	Very low	149 Å²	149	143 Å²	143	65%	0.654	81%	0.814	S	S	*	*			trans	-32.4	143	165.7	-87.9	-102.8	0	0	0	118.6	D460	D460-F672 VanDerWaalsContact OD2-CE1 3.28Å; D460-F672 WeakPolarHBondContact OD2-CE1 3.34Å
673	V	34.4	Very low	32	Very low	140 Å²	140	140.4 Å²	140.4	85%	0.848	81%	0.806	S	S	*	*			trans	-150.7	131.5	138	177.9	0	0	0	0	111.1
674	C	25.1	Very low	32.3	Very low	101 Å²	101	140.5 Å²	140.5	68%	0.682	80%	0.802	S	S	*	*			trans	-94.2	142.6	162.1	-57.7	0	0	0	0	111.3
675	R	32.6	Very low	32.2	Very low	256 Å²	256	143.2 Å²	143.2	97%	0.966	80%	0.803	S	S	*	*			trans	-156.2	150.3	149.8	-140.2	167.3	-176.7	158.1	1.7	114.1
676	A	33.4	Very low	32.2	Very low	86 Å²	86	144.4 Å²	144.4	71%	0.711	80%	0.803	S	S	*	*			trans	-96.9	161.1	-167.5	0	0	0	0	0	115.2
677	N	31.4	Very low	32.4	Very low	155 Å²	155	141.9 Å²	141.9	83%	0.829	80%	0.804	S	S	*	*			trans	30.3	119	148.1	-70.7	-13.1	0	0	0	119.7
678	K	34.4	Very low	32.7	Very low	216 Å²	216	137.8 Å²	137.8	94%	0.939	80%	0.796	S	S	*	*				-158.1	152.1	119.8	-113	170.2	-173.8	-178.2	0	113.8
679	V	31.1	Very low	32.9	Very low	143 Å²	143	144.2 Å²	144.2	87%	0.867	80%	0.803	S	S	*	*			trans	-83.4	137.7	-172.2	172.1	0	0	0	0	112.1
680	A	35.1	Very low	33	Very low	98 Å²	98	139.5 Å²	139.5	81%	0.81	79%	0.789	S	S	*	*			trans	-157.4	133.8	149.8	0	0	0	0	0	113.7
681	K	32.8	Very low	33.1	Very low	202 Å²	202	142.9 Å²	142.9	88%	0.878	79%	0.794	S	S	*	*			trans	-52.8	164.7	165.3	-68.5	167.7	177.3	178	0	113.2
682	A	31.7	Very low	32.8	Very low	88 Å²	88	142.6 Å²	142.6	73%	0.727	79%	0.786	S	S	*	*			cis	-165.9	-146.5	-18.5	0	0	0	0	0	108.3
683	P	40.8	Very low	32.9	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	79%	0.792	S	S	*	*			trans	-111.9	-169.1	-132.3	33.1	-11.1	0	0	0	114.1
684	V	35	Very low	32.8	Very low	121 Å²	121	143.9 Å²	143.9	73%	0.733	79%	0.787	S	S	*	*				163.5	132.1	125.9	155.2	0	0	0	0	115.2
685	L	35	Very low	33.1	Very low	146 Å²	146	146.3 Å²	146.3	76%	0.764	79%	0.793	S	S	*	*			trans	62.2	108.8	154.4	-73.1	165.6	0	0	0	125.1
686	H	32.2	Very low	33	Very low	178 Å²	178	139.6 Å²	139.6	82%	0.824	78%	0.775	S	S	*	*				19	141.2	121.4	-65.7	-30.8	0	0	0	123.5
687	G	35.8	Very low	33	Very low	81 Å²	81	145.5 Å²	145.5	84%	0.835	78%	0.779	S	S	*	*			trans	-169.7	75.1	167.4	0	0	0	0	0	113
688	T	33.2	Very low	33.3	Very low	113 Å²	113	145.2 Å²	145.2	69%	0.693	78%	0.776	S	S	*	*			trans	-54.9	154.4	179	50.9	0	0	0	0	119.2
689	R	33.3	Very low	33.3	Very low	243 Å²	243	145.5 Å²	145.5	92%	0.917	77%	0.771	S	S	*	*			trans	68	162.9	149.5	-73	173.1	177	-174.3	-1.2	117.7
690	S	31.3	Very low	33.6	Very low	91 Å²	91	149.6 Å²	149.6	64%	0.636	77%	0.771	S	S	*	*			cis	176.3	148.9	-27.9	-170.4	0	0	0	0	108.4
691	L	32.5	Very low	33.7	Very low	161 Å²	161	151.4 Å²	151.4	84%	0.843	77%	0.772	S	S	*	*			trans	63.9	151.4	166.3	-63.5	163	0	0	0	116.7
692	D	30.3	Very low	34.1	Very low	115 Å²	115	144.8 Å²	144.8	62%	0.615	76%	0.761	S	S	*	*			cis	178	156.3	-10.8	180	25.9	0	0	0	106.7
693	R	30.5	Very low	34.5	Very low	210 Å²	210	146.9 Å²	146.9	79%	0.792	77%	0.765	S	S	*	*			trans	61.9	154.5	155.8	-90.4	165.9	-165	-159.9	-3.5	124.2
694	S	31.6	Very low	34.5	Very low	106 Å²	106	147.7 Å²	147.7	74%	0.741	77%	0.768	S	S	*	*			trans	85.2	142	154.2	74.2	0	0	0	0	119.4
695	L	32	Very low	35.3	Very low	152 Å²	152	146.8 Å²	146.8	80%	0.796	77%	0.765	S	S	*	*			cis	-162.2	155.7	-19.3	-100.5	176.4	0	0	0	109.3
696	L	30.6	Very low	35.7	Very low	114 Å²	114	146 Å²	146	60%	0.597	76%	0.761	S	S	*	*			trans	56.6	114.1	148.5	-92.3	74.5	0	0	0	123.9
697	R	32.1	Very low	36.2	Very low	210 Å²	210	144 Å²	144	79%	0.792	76%	0.756	S	S	*	*				86	155.9	103.9	-158.8	-171.3	-102.5	170.7	-7.8	120.2
698	I	38.3	Very low	36.6	Very low	149 Å²	149	147.2 Å²	147.2	76%	0.764	75%	0.753	S	S	*	*			trans	93.5	130.3	161.6	-54.4	177.9	0	0	0	114.6
699	R	34.5	Very low	37.1	Very low	222 Å²	222	148.1 Å²	148.1	84%	0.838	75%	0.754	S	S	*	*			cis	-178.1	168.4	-23.6	-133.4	177.9	179	177.7	-2.7	109.4
700	R	37	Very low	37.8	Very low	229 Å²	229	143.7 Å²	143.7	86%	0.864	75%	0.748	S	S	*	*			trans	100.4	140.3	161.6	-61.8	177.1	175.1	166.6	-1.3	116.5
701	T	36.9	Very low	38.4	Very low	137 Å²	137	144.8 Å²	144.8	84%	0.84	75%	0.747	S	S	*	*			cis	153.1	131.1	-32.8	40.6	0	0	0	0	108.8
702	G	41	Very low	38.9	Very low	62 Å²	62	143.5 Å²	143.5	64%	0.639	74%	0.741	S	S	*	*			trans	147.8	103.5	167.5	0	0	0	0	0	111.8
703	T	40	Very low	39.3	Very low	133 Å²	133	146.3 Å²	146.3	82%	0.816	74%	0.743	S	S	*	*				77.5	133.3	67.8	60.2	0	0	0	0	114
704	T	40.6	Very low	39.8	Very low	128 Å²	128	143.6 Å²	143.6	79%	0.785	74%	0.739	S	S	*	*			cis	-159.8	-151.6	-4.4	31.5	0	0	0	0	108.4
705	P	53.6	Low	39.9	Very low	102 Å²	102	145.2 Å²	145.2	66%	0.662	74%	0.739	S	S	*	*				-132	-141.8	-125.1	32.8	-2.3	0	0	0	115
706	D	41.9	Very low	40.2	Very low	129 Å²	129	145.2 Å²	145.2	69%	0.69	74%	0.738	S	S	*	*			trans	89.4	141.2	165.1	-43.6	-16.3	0	0	0	117
707	D	42.9	Very low	40.3	Very low	136 Å²	136	148.9 Å²	148.9	73%	0.727	75%	0.749	S	S	*	*			cis	-171.3	178.4	-20.3	-97.5	-24.6	0	0	0	110.1
708	I	44.1	Very low	40.8	Very low	150 Å²	150	144.2 Å²	144.2	77%	0.769	75%	0.746	S	S	*	*			trans	80.2	135.8	156.2	-43.3	-166.4	0	0	0	119.2
709	D	44.5	Very low	40.5	Very low	132 Å²	132	143 Å²	143	71%	0.706	75%	0.751	S	S	*	*			cis	-173.4	176.2	-35.3	-101.8	-43.3	0	0	0	110.8
710	D	48.5	Very low	40.6	Very low	150 Å²	150	135.8 Å²	135.8	80%	0.802	75%	0.745	S	S	*	*			trans	77.4	153.3	153.2	-70.1	-40.2	0	0	0	122.4
711	D	42.7	Very low	40.4	Very low	113 Å²	113	131.1 Å²	131.1	60%	0.604	74%	0.742	S	S	*	*				-160.2	-173.2	-68.6	-158.8	-12.7	0	0	0	106.3	R713	D711-R713 IonicContact OD1-NE 2.93Å; D711-R713 IonicContact OD2-NH2 2.72Å
712	D	43.5	Very low	40.4	Very low	135 Å²	135	133.7 Å²	133.7	72%	0.722	74%	0.744	S	S	*	*			trans	75.5	141.7	168.4	-79.5	-21.3	0	0	0	119.5
713	R	37.7	Very low	40	Very low	173 Å²	173	139.4 Å²	139.4	65%	0.653	75%	0.752	S	S	*	*			cis	175.1	163.4	-47.7	-102.1	-178.8	-161.9	-159.8	6	108	D711	D711-R713 IonicContact OD1-NE 2.93Å; D711-R713 IonicContact OD2-NH2 2.72Å
714	H	42.2	Very low	39.8	Very low	153 Å²	153	141.6 Å²	141.6	71%	0.708	75%	0.752	S	S	*	*			trans	71.5	152.7	165.6	-59.6	-67.8	0	0	0	118.9
715	L	33.1	Very low	39.7	Very low	140 Å²	140	141 Å²	141	73%	0.733	75%	0.75	S	S	*	*			cis	-167.1	168.8	-40.3	-149.4	74.7	0	0	0	108.1
716	I	39.2	Very low	38.6	Very low	153 Å²	153	147.3 Å²	147.3	79%	0.785	76%	0.761	S	S	*	*			trans	89.3	124.7	159.8	-58.2	153.6	0	0	0	118
717	K	31	Very low	38.2	Very low	191 Å²	191	149.7 Å²	149.7	83%	0.83	77%	0.773	S	S	*	*			trans	-109	-166.9	169.1	-61.5	177.5	176.8	178.4	0	108.3
718	P	43.2	Very low	37.5	Very low	111 Å²	111	148.2 Å²	148.2	72%	0.721	77%	0.773	S	S	*	*				-127.2	-163.9	-67.7	38.3	-21.3	0	0	0	112.2
719	S	31.8	Very low	36.8	Very low	124 Å²	124	145.9 Å²	145.9	87%	0.867	78%	0.776	S	S	*	*			trans	88.8	151.5	154.5	80.4	0	0	0	0	120.9
720	G	37	Very low	36.3	Very low	70 Å²	70	144.4 Å²	144.4	72%	0.722	78%	0.782	S	S	*	*			trans	111.9	91.8	-177.2	0	0	0	0	0	112.3
721	V	32.2	Very low	35.3	Very low	132 Å²	132	146.1 Å²	146.1	80%	0.8	78%	0.783	S	S	*	*				72.6	99.5	55	-174.1	0	0	0	0	114.8
722	Q	36.9	Very low	34.9	Very low	190 Å²	190	147.6 Å²	147.6	89%	0.888	80%	0.796	S	S	*	*			trans	-173.7	102.7	144.1	-101.1	177.2	15.3	0	0	106.7
723	K	34.4	Very low	34.2	Very low	182 Å²	182	147.4 Å²	147.4	79%	0.791	80%	0.795	S	S	*	*				57.9	94	77	-77.9	-164.6	173.8	-174.4	0	116.3
724	H	35.1	Very low	34	Very low	179 Å²	179	145 Å²	145	83%	0.829	80%	0.804	S	S	*	*				50	168	121.5	-73.1	-58.2	0	0	0	121.7
725	P	38.4	Very low	33.5	Very low	115 Å²	115	142.2 Å²	142.2	75%	0.747	80%	0.802	S	S	*	*			cis	-133	-179.8	2.3	23	3	0	0	0	117.2
726	R	29.3	Very low	33.5	Very low	235 Å²	235	145.7 Å²	145.7	89%	0.887	81%	0.812	S	S	*	*			trans	-17.8	144.8	158	-56.8	169.3	176	166.7	-3.2	118.4
727	L	35.5	Very low	33.1	Very low	180 Å²	180	146.2 Å²	146.2	94%	0.942	81%	0.811	S	S	*	*			trans	-140.9	150.5	134.1	-93.4	-179	0	0	0	110.8
728	S	27.6	Very low	33.2	Very low	105 Å²	105	140.7 Å²	140.7	73%	0.734	81%	0.808	S	S	*	*			trans	-116.7	155.1	-170.9	49.7	0	0	0	0	112.6
729	A	29.9	Very low	32.8	Very low	100 Å²	100	142.2 Å²	142.2	83%	0.826	81%	0.81	S	S	*	*			trans	45.6	118.1	150.4	0	0	0	0	0	120.3
730	A	33.1	Very low	33	Very low	101 Å²	101	145 Å²	145	84%	0.835	81%	0.809	S	S	*	*			trans	-150.3	135.8	144.2	0	0	0	0	0	110.9
731	F	27.7	Very low	32.8	Very low	187 Å²	187	148.4 Å²	148.4	82%	0.82	81%	0.81	S	S	*	*			trans	-66.8	149.6	171.4	-80.7	-122.5	0	0	0	111.6
732	V	34.5	Very low	32.9	Very low	143 Å²	143	151.4 Å²	151.4	87%	0.867	81%	0.812	S	S	*	*			trans	-144	130.5	132.9	-175.8	0	0	0	0	109.3
733	N	28.9	Very low	32.5	Very low	132 Å²	132	153.1 Å²	153.1	71%	0.706	81%	0.81	S	S	*	*			trans	-72.4	147.4	172.8	-69.7	-43.2	0	0	0	111.9
734	S	33.3	Very low	32.5	Very low	122 Å²	122	155.9 Å²	155.9	85%	0.853	83%	0.833	S	S	*	*			trans	-140.8	105.2	141.7	54.8	0	0	0	0	110.6
735	S	30.8	Very low	32.4	Very low	95 Å²	95	154.8 Å²	154.8	66%	0.664	83%	0.833	S	S	*	*			trans	-68.7	139.6	171	-54	0	0	0	0	110.1
736	F	33	Very low	32.1	Very low	212 Å²	212	156.8 Å²	156.8	93%	0.93	84%	0.838	S	S	*	*			trans	-128.9	94.6	150.3	-117.3	-88.7	0	0	0	108.1
737	Q	31.2	Very low	32.2	Very low	165 Å²	165	152.5 Å²	152.5	77%	0.771	84%	0.835	S	S	*	*			trans	-70.5	137.7	160.5	-80.1	170.3	-80.2	0	0	108.2
738	G	34	Very low	32	Very low	74 Å²	74	150.9 Å²	150.9	76%	0.763	83%	0.828	S	S	*	*			trans	-150.9	57.1	178.5	0	0	0	0	0	108.8	E740	G738-E740 PolarHBondContact O-N 2.93Å
739	D	33.7	Very low	32.3	Very low	143 Å²	143	153.8 Å²	153.8	77%	0.765	83%	0.834	S	S	*	*			trans	-62.7	114.1	161.6	-71.9	-51.9	0	0	0	107.8
740	E	37.2	Very low	32.5	Very low	182 Å²	182	157.3 Å²	157.3	85%	0.85	84%	0.835	S	S	*	*			trans	-143.1	120.3	140.4	-86.2	-140.7	139.1	0	0	111.4	G738	G738-E740 PolarHBondContact O-N 2.93Å
741	I	32.2	Very low	32.4	Very low	143 Å²	143	161.4 Å²	161.4	73%	0.733	84%	0.835	S	S	*	*			trans	-56.3	134.5	167.7	-65.4	153.8	0	0	0	109.9
742	F	33.5	Very low	32.8	Very low	194 Å²	194	159.4 Å²	159.4	85%	0.851	84%	0.836	S	S	*	*			trans	-135.3	112.2	141.2	-107.3	-81.3	0	0	0	111.2
743	R	28.4	Very low	32.6	Very low	226 Å²	226	160.8 Å²	160.8	85%	0.853	83%	0.833	S	S	*	*			trans	-75.3	131.6	161.3	-76.6	176.7	168.7	166.6	-4.2	108.6
744	L	35.4	Very low	33	Very low	241 Å²	241	163.4 Å²	163.4	100%	1.262	85%	0.845	S	S	*	*			trans	-155.6	0	143.3	-107.4	169.2	0	0	0	108.9

Retrieved 744 of 744 residues in 377.3 ms (Link to these results)

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