A0A5K4FCD6_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCD6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 549 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	35.3	Very low	32.7	Very low	242 Å²	242	137.4 Å²	137.4	100%	1.192	70%	0.699	S	S	*	*				0	108	0	-76.2	-177	-178.8	0	0	107.2	F3	M1-F3 PolarHBondContact O-N 3.5Å
2	D	30.9	Very low	32.5	Very low	131 Å²	131	145.5 Å²	145.5	70%	0.701	72%	0.715	S	S	*	*			trans	-68.8	123.3	-171.4	-118.3	-9.4	0	0	0	110.9	K4	D2-K4 PolarHBondContact O-N 2.99Å
3	F	41.8	Very low	33.1	Very low	171 Å²	171	141.9 Å²	141.9	75%	0.75	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-70	25.7	-177.5	-124.7	-90.9	0	0	0	113.9	M1 C495	M1-F3 PolarHBondContact O-N 3.5Å; F3-C495 HydrophobicContact CZ-CB 4.39Å
4	K	32.2	Very low	32.9	Very low	159 Å²	159	132.7 Å²	132.7	69%	0.691	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-78.8	-18.5	-175.9	-78	179.6	178.8	167.2	0	113.9	D2 C6 K7	D2-K4 PolarHBondContact O-N 2.99Å; K4-C6 VanDerWaalsContact C-N 3.29Å; K4-C6 PolarHBondContact O-N 3.47Å; K4-K7 PolarHBondContact O-N 3.3Å
5	L	32.7	Very low	32.8	Very low	167 Å²	167	130.7 Å²	130.7	87%	0.874	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-73.9	-15.1	-174.6	-143.5	77.2	0	0	0	114.2
6	C	35.9	Very low	32.9	Very low	68 Å²	68	127.6 Å²	127.6	46%	0.459	63%	0.633	S	S	.	*	G	3₁₀ helix	trans	-88.8	-12.8	179.2	-157.7	0	0	0	0	114.2	K4 V10	K4-C6 VanDerWaalsContact C-N 3.29Å; K4-C6 PolarHBondContact O-N 3.47Å; C6-V10 WeakPolarHBondContact O-CG2 3.24Å
7	K	29.9	Very low	32.9	Very low	156 Å²	156	122.3 Å²	122.3	68%	0.678	61%	0.612	S	S	*	*	H	α-helix	trans	-70.7	-32.5	178.7	-102.5	-175.6	176.8	-176.5	0	113.3	K4 M11	K4-K7 PolarHBondContact O-N 3.3Å; K7-M11 HydrophobicContact CB-CE 4.19Å; K7-M11 PolarHBondContact O-N 3.3Å
8	L	28.7	Very low	32.9	Very low	148 Å²	148	121.2 Å²	121.2	78%	0.775	61%	0.612	S	S	*	*	H	α-helix	trans	-76	-33.7	-172.9	-124	88.2	0	0	0	113.5
9	C	31	Very low	32.9	Very low	113 Å²	113	120.3 Å²	120.3	76%	0.764	61%	0.609	S	S	*	*	H	α-helix	trans	-76.6	-25.6	175.7	-83.1	0	0	0	0	113
10	V	34.2	Very low	33.2	Very low	36 Å²	36	123.1 Å²	123.1	22%	0.218	63%	0.626	C	S	.	*	H	α-helix	trans	-79.6	-30.9	-176.2	174.3	0	0	0	0	112.4	C6 R12 F16 P498	C6-V10 WeakPolarHBondContact O-CG2 3.24Å; V10-R12 VanDerWaalsContact C-N 3.27Å; V10-R12 PolarHBondContact O-N 2.99Å; V10-R12 VanDerWaalsContact O-N 3.15Å; V10-F16 HydrophobicContact CG1-CD2 3.52Å; V10-F16 HydrophobicContact CG1-CE2 3.6Å; V10-P498 HydrophobicContact CG2-CG 4.4Å
11	M	26.8	Very low	33.6	Very low	120 Å²	120	120.4 Å²	120.4	59%	0.591	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-13.2	-174.3	-79.9	-168.5	-124.4	0	0	116.2	K7	K7-M11 HydrophobicContact CB-CE 4.19Å; K7-M11 PolarHBondContact O-N 3.3Å
12	R	30.6	Very low	33.9	Very low	235 Å²	235	115 Å²	115	89%	0.887	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-6	-177	-87	-172.2	178	-174.5	0.3	115.8	V10	V10-R12 VanDerWaalsContact C-N 3.27Å; V10-R12 PolarHBondContact O-N 2.99Å; V10-R12 VanDerWaalsContact O-N 3.15Å
13	L	40.3	Very low	34.5	Very low	99 Å²	99	110 Å²	110	52%	0.518	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.9	-14.7	-178.8	-67.7	170.5	0	0	0	114.6	I500	L13-I500 HydrophobicContact CB-CD1 4.03Å; L13-I500 HydrophobicContact CB-CG1 4.19Å; L13-I500 HydrophobicContact CD1-CD1 4.11Å; L13-I500 HydrophobicContact CD1-CG1 3.97Å
14	G	31	Very low	34.7	Very low	13 Å²	13	106.3 Å²	106.3	13%	0.134	57%	0.574	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-177	151.6	170.5	0	0	0	0	0	112.9	E27	G14-E27 CarbonylContact C-O 3.55Å; G14-E27 WeakPolarHBondContact CA-O 3.49Å
15	N	30.4	Very low	35.4	Very low	102 Å²	102	100.7 Å²	100.7	55%	0.545	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79	126.3	170.9	-77.8	-21.3	0	0	0	108.9	E27	N15-E27 HydrophobicContact CB-CB 4.13Å; N15-E27 WeakPolarHBondContact CB-OE2 3.32Å; N15-E27 PolarHBondContact N-O 3.46Å; N15-E27 WeakPolarHBondContact O-CB 3.5Å; N15-E27 PolarHBondContact O-N 3.35Å
16	F	34.8	Very low	36.5	Very low	81 Å²	81	93.4 Å²	93.4	36%	0.355	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	105	165.5	-88.9	-105.3	0	0	0	107.4	V10 V24 V26 P498	V10-F16 HydrophobicContact CG1-CD2 3.52Å; V10-F16 HydrophobicContact CG1-CE2 3.6Å; F16-V24 HydrophobicContact CD1-CG1 3.36Å; F16-V24 HydrophobicContact CE1-CG1 3.52Å; F16-V26 HydrophobicContact CE1-CG2 3.83Å; F16-V26 HydrophobicContact CE2-CG1 4.39Å; F16-V26 HydrophobicContact CE2-CG2 3.96Å; F16-V26 HydrophobicContact CZ-CG2 3.48Å; F16-V26 VanDerWaalsContact CZ-CG2 3.48Å; F16-P498 HydrophobicContact CE2-CB 4.08Å; F16-P498 HydrophobicContact CZ-CB 3.64Å
17	S	32.1	Very low	37.6	Very low	38 Å²	38	95.3 Å²	95.3	27%	0.266	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	115.7	162.9	-176.2	0	0	0	0	108.4	N19	S17-N19 PolarHBondContact O-N 3.26Å; S17-N19 PolarHBondContact OG-OD1 2.9Å
18	V	33.4	Very low	39.5	Very low	103 Å²	103	88.5 Å²	88.5	62%	0.624	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	94.1	157.3	179.7	0	0	0	0	105	N20	V18-N20 PolarHBondContact O-N 2.93Å
19	N	33	Very low	42.1	Very low	104 Å²	104	85.5 Å²	85.5	56%	0.556	48%	0.475	S	S	*	.			trans	-66.2	131.2	163.8	-80.5	-13.2	0	0	0	107	S17 G21	S17-N19 PolarHBondContact O-N 3.26Å; S17-N19 PolarHBondContact OG-OD1 2.9Å; N19-G21 PolarHBondContact O-N 3.37Å
20	N	39.4	Very low	44.7	Very low	175 Å²	175	83.6 Å²	83.6	94%	0.936	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	41.4	-175.5	-85.8	-16.3	0	0	0	115.1	V18	V18-N20 PolarHBondContact O-N 2.93Å
21	G	40.9	Very low	47.3	Very low	67 Å²	67	85 Å²	85	69%	0.691	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	176.4	-20.2	172.6	0	0	0	0	0	117	N19	N19-G21 PolarHBondContact O-N 3.37Å
22	I	42.4	Very low	50.2	Low	129 Å²	129	81.5 Å²	81.5	66%	0.662	46%	0.461	S	S	*	.	S	Bend	trans	-151.8	109.5	-171.9	-50.7	175.8	0	0	0	109.7
23	G	42	Very low	52.8	Low	27 Å²	27	73.5 Å²	73.5	28%	0.278	43%	0.431	S	S	.	.			trans	75.7	128.3	162	0	0	0	0	0	117.4	S25	G23-S25 PolarHBondContact O-N 3Å
24	V	46.1	Very low	55.3	Low	92 Å²	92	73.7 Å²	73.7	56%	0.558	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	100.9	163.6	-179.4	0	0	0	0	107.6	F16	F16-V24 HydrophobicContact CD1-CG1 3.36Å; F16-V24 HydrophobicContact CE1-CG1 3.52Å
25	S	48.8	Very low	58.2	Low	41 Å²	41	75.8 Å²	75.8	29%	0.287	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.7	168.4	57.3	0	0	0	0	109.5	G23 E27	G23-S25 PolarHBondContact O-N 3Å; S25-E27 PolarHBondContact O-N 3.47Å
26	V	54.6	Low	61.1	Low	15 Å²	15	72.5 Å²	72.5	9%	0.091	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	111.3	167.7	179.5	0	0	0	0	108	F16 W28 E499	F16-V26 HydrophobicContact CE1-CG2 3.83Å; F16-V26 HydrophobicContact CE2-CG1 4.39Å; F16-V26 HydrophobicContact CE2-CG2 3.96Å; F16-V26 HydrophobicContact CZ-CG2 3.48Å; F16-V26 VanDerWaalsContact CZ-CG2 3.48Å; V26-W28 HydrophobicContact CG1-CD2 4.09Å; V26-W28 HydrophobicContact CG1-CG 4.03Å; V26-W28 PolarHBondContact O-N 3.22Å; V26-E499 HydrophobicContact CG2-CB 3.82Å; V26-E499 HydrophobicContact CG2-CG 4.2Å
27	E	59.6	Low	63.9	Low	107 Å²	107	69.4 Å²	69.4	50%	0.5	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	82.1	167.4	-69.6	-172.4	161.7	0	0	108.7	G14 N15 S25	G14-E27 CarbonylContact C-O 3.55Å; G14-E27 WeakPolarHBondContact CA-O 3.49Å; N15-E27 HydrophobicContact CB-CB 4.13Å; N15-E27 WeakPolarHBondContact CB-OE2 3.32Å; N15-E27 PolarHBondContact N-O 3.46Å; N15-E27 WeakPolarHBondContact O-CB 3.5Å; N15-E27 PolarHBondContact O-N 3.35Å; S25-E27 PolarHBondContact O-N 3.47Å
28	W	68.7	Low	66.9	Low	13 Å²	13	74.5 Å²	74.5	5%	0.049	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	141.7	167.7	-67	91.3	0	0	0	109.9	V26 P30 V32 R33 I500 V503	V26-W28 HydrophobicContact CG1-CD2 4.09Å; V26-W28 HydrophobicContact CG1-CG 4.03Å; V26-W28 PolarHBondContact O-N 3.22Å; W28-P30 WeakPolarHBondContact O-CD 3.35Å; W28-P30 VanDerWaalsContact O-N 3.15Å; W28-V32 HydrophobicContact CE3-CB 4.38Å; W28-V32 HydrophobicContact CE3-CG1 3.59Å; W28-V32 HydrophobicContact CZ3-CG1 3.75Å; W28-R33 HydrophobicContact CB-CB 3.96Å; W28-R33 PolarHBondContact O-NH1 3.27Å; W28-I500 HydrophobicContact CE3-CD1 3.76Å; W28-I500 HydrophobicContact CH2-CB 4.17Å; W28-I500 HydrophobicContact CH2-CD1 3.28Å; W28-I500 HydrophobicContact CH2-CG1 4.26Å; W28-I500 HydrophobicContact CZ2-CD1 4.27Å; W28-I500 HydrophobicContact CZ3-CD1 2.97Å; W28-I500 HydrophobicContact CZ3-CG1 4.3Å; W28-V503 HydrophobicContact CH2-CB 4.33Å; W28-V503 HydrophobicContact CH2-CG1 4.35Å; W28-V503 HydrophobicContact CZ2-CB 4.05Å; W28-V503 HydrophobicContact CZ2-CG1 4.23Å; W28-V503 HydrophobicContact CZ2-CG2 4.2Å
29	N	83.1	Confident	69.8	Low	86 Å²	86	73.5 Å²	73.5	46%	0.46	42%	0.422	S	S	.	.			trans	-48.6	126.5	161.7	179.4	-31.7	0	0	0	108.3	A31 V32 R33	N29-A31 PolarHBondContact O-N 3.31Å; N29-A31 VanDerWaalsContact O-N 3.09Å; N29-A31 WeakPolarHBondContact OD1-CB 3.36Å; N29-A31 PolarHBondContact OD1-N 3.21Å; N29-V32 HydrophobicContact CB-CB 4.28Å; N29-V32 HydrophobicContact CB-CG2 3.94Å; N29-V32 PolarHBondContact O-N 3.35Å; N29-R33 PolarHBondContact O-N 3.5Å
30	P	85.9	Confident	72.7	Confident	73 Å²	73	68.5 Å²	68.5	47%	0.474	40%	0.396	S	S	.	.	H	α-helix	trans	-48.9	-38.5	-179.6	-29	34.5	0	0	0	113.8	W28 R33 I34	W28-P30 WeakPolarHBondContact O-CD 3.35Å; W28-P30 VanDerWaalsContact O-N 3.15Å; P30-R33 PolarHBondContact O-N 3.06Å; P30-I34 WeakPolarHBondContact O-CB 3.47Å; P30-I34 WeakPolarHBondContact O-CD1 3.31Å; P30-I34 VanDerWaalsContact O-CG1 3.24Å; P30-I34 WeakPolarHBondContact O-CG1 3.41Å; P30-I34 PolarHBondContact O-N 2.87Å
31	A	88.9	Confident	75.4	Confident	64 Å²	64	63.8 Å²	63.8	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-43.6	177.3	0	0	0	0	0	112.3	N29 I34 A35	N29-A31 PolarHBondContact O-N 3.31Å; N29-A31 VanDerWaalsContact O-N 3.09Å; N29-A31 WeakPolarHBondContact OD1-CB 3.36Å; N29-A31 PolarHBondContact OD1-N 3.21Å; A31-I34 PolarHBondContact O-N 2.92Å; A31-A35 VanDerWaalsContact O-CB 3.3Å; A31-A35 WeakPolarHBondContact O-CB 3.45Å; A31-A35 PolarHBondContact O-N 3.47Å
32	V	87.3	Confident	78	Confident	48 Å²	48	64 Å²	64	29%	0.291	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-42.2	177.9	178	0	0	0	0	110.4	W28 N29 A35 M36	W28-V32 HydrophobicContact CE3-CB 4.38Å; W28-V32 HydrophobicContact CE3-CG1 3.59Å; W28-V32 HydrophobicContact CZ3-CG1 3.75Å; N29-V32 HydrophobicContact CB-CB 4.28Å; N29-V32 HydrophobicContact CB-CG2 3.94Å; N29-V32 PolarHBondContact O-N 3.35Å; V32-A35 PolarHBondContact O-N 3.17Å; V32-M36 HydrophobicContact CG1-CG 4.17Å; V32-M36 VanDerWaalsContact O-CB 3.3Å; V32-M36 WeakPolarHBondContact O-CB 3.4Å; V32-M36 VanDerWaalsContact O-CG 3.23Å; V32-M36 WeakPolarHBondContact O-CG 3.4Å; V32-M36 PolarHBondContact O-N 3.32Å
33	R	86.5	Confident	80.5	Confident	67 Å²	67	58.1 Å²	58.1	25%	0.253	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-46.6	177	-173.7	171.9	64.8	-113.6	-0.6	112	W28 N29 P30 T37 Y95	W28-R33 HydrophobicContact CB-CB 3.96Å; W28-R33 PolarHBondContact O-NH1 3.27Å; N29-R33 PolarHBondContact O-N 3.5Å; P30-R33 PolarHBondContact O-N 3.06Å; R33-T37 WeakPolarHBondContact O-CB 3.36Å; R33-T37 PolarHBondContact O-N 2.98Å; R33-T37 PolarHBondContact O-OG1 3.21Å; R33-Y95 WeakPolarHBondContact CD-O 3.24Å
34	I	91.9	Very high	83.1	Confident	102 Å²	102	57.3 Å²	57.3	52%	0.523	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-46.9	177.5	-68.3	165.8	0	0	0	110.5	P30 A31 M36 T37 F38	P30-I34 WeakPolarHBondContact O-CB 3.47Å; P30-I34 WeakPolarHBondContact O-CD1 3.31Å; P30-I34 VanDerWaalsContact O-CG1 3.24Å; P30-I34 WeakPolarHBondContact O-CG1 3.41Å; P30-I34 PolarHBondContact O-N 2.87Å; A31-I34 PolarHBondContact O-N 2.92Å; I34-M36 PolarHBondContact O-N 2.85Å; I34-T37 PolarHBondContact O-N 3.16Å; I34-F38 WeakPolarHBondContact O-CB 3.45Å; I34-F38 PolarHBondContact O-N 2.97Å
35	A	92.4	Very high	85.4	Confident	57 Å²	57	54.4 Å²	54.4	47%	0.471	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-45.4	179.4	0	0	0	0	0	112.4	A31 V32 F38 F39	A31-A35 VanDerWaalsContact O-CB 3.3Å; A31-A35 WeakPolarHBondContact O-CB 3.45Å; A31-A35 PolarHBondContact O-N 3.47Å; V32-A35 PolarHBondContact O-N 3.17Å; A35-F38 PolarHBondContact O-N 3.29Å; A35-F39 WeakPolarHBondContact O-CB 3.35Å; A35-F39 PolarHBondContact O-N 2.91Å
36	M	90.6	Very high	87.6	Confident	33 Å²	33	54.7 Å²	54.7	16%	0.163	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-40	176.4	-73.4	-68.8	-74.9	0	0	111.8	V32 I34 F39 S40 V503 P504	V32-M36 HydrophobicContact CG1-CG 4.17Å; V32-M36 VanDerWaalsContact O-CB 3.3Å; V32-M36 WeakPolarHBondContact O-CB 3.4Å; V32-M36 VanDerWaalsContact O-CG 3.23Å; V32-M36 WeakPolarHBondContact O-CG 3.4Å; V32-M36 PolarHBondContact O-N 3.32Å; I34-M36 PolarHBondContact O-N 2.85Å; M36-F39 PolarHBondContact O-N 2.97Å; M36-S40 VanDerWaalsContact O-CB 3.29Å; M36-S40 WeakPolarHBondContact O-CB 3.28Å; M36-S40 PolarHBondContact O-N 3.01Å; M36-S40 PolarHBondContact O-OG 3.41Å; M36-V503 HydrophobicContact CE-CG1 3.71Å; M36-P504 HydrophobicContact CE-CB 4.05Å; M36-P504 HydrophobicContact CE-CG 3.79Å
37	T	93.6	Very high	89.6	Confident	16 Å²	16	54 Å²	54	10%	0.098	31%	0.306	C	S	.	.	H	α-helix	trans	-64.9	-45.6	176.3	-55.3	0	0	0	0	111	R33 I34 F39 S40 V41 I91 Y95	R33-T37 WeakPolarHBondContact O-CB 3.36Å; R33-T37 PolarHBondContact O-N 2.98Å; R33-T37 PolarHBondContact O-OG1 3.21Å; I34-T37 PolarHBondContact O-N 3.16Å; T37-F39 PolarHBondContact O-N 3.05Å; T37-S40 VanDerWaalsContact O-CB 3.31Å; T37-S40 WeakPolarHBondContact O-CB 3.42Å; T37-S40 PolarHBondContact O-N 3.27Å; T37-V41 WeakPolarHBondContact O-CG2 3.35Å; T37-V41 PolarHBondContact O-N 2.92Å; T37-I91 HydrophobicContact CG2-CG2 4.16Å; T37-Y95 HydrophobicContact CG2-CD2 3.84Å; T37-Y95 HydrophobicContact CG2-CG 4.22Å; T37-Y95 WeakPolarHBondContact OG1-CA 3.19Å
38	F	95.4	Very high	91.4	Very high	145 Å²	145	52.3 Å²	52.3	64%	0.636	30%	0.297	S	S	*	.	H	α-helix	trans	-59.2	-47.7	176.3	177.6	-99.2	0	0	0	111.4	I34 A35 S40 V41 V42	I34-F38 WeakPolarHBondContact O-CB 3.45Å; I34-F38 PolarHBondContact O-N 2.97Å; A35-F38 PolarHBondContact O-N 3.29Å; F38-S40 VanDerWaalsContact C-N 3.31Å; F38-S40 PolarHBondContact O-N 3.45Å; F38-V41 PolarHBondContact O-N 3.26Å; F38-V42 HydrophobicContact CD1-CG2 4.36Å; F38-V42 HydrophobicContact CE1-CG2 3.93Å; F38-V42 HydrophobicContact CE2-CG2 4.34Å; F38-V42 HydrophobicContact CZ-CG2 3.92Å; F38-V42 WeakPolarHBondContact O-CG2 3.42Å; F38-V42 PolarHBondContact O-N 3.46Å
39	F	94.6	Very high	92.6	Very high	82 Å²	82	57 Å²	57	36%	0.36	32%	0.322	S	S	.	.	H	α-helix	trans	-55.8	-46.2	174.2	173.1	-99.9	0	0	0	111.9	A35 M36 T37 V41 V42 V43 W507 L511	A35-F39 WeakPolarHBondContact O-CB 3.35Å; A35-F39 PolarHBondContact O-N 2.91Å; M36-F39 PolarHBondContact O-N 2.97Å; T37-F39 PolarHBondContact O-N 3.05Å; F39-V41 PolarHBondContact O-N 2.94Å; F39-V42 PolarHBondContact O-N 3.06Å; F39-V43 HydrophobicContact CD1-CG2 4.21Å; F39-V43 HydrophobicContact CD2-CG2 4.28Å; F39-V43 HydrophobicContact CE1-CG2 3.78Å; F39-V43 HydrophobicContact CE2-CG2 3.86Å; F39-V43 HydrophobicContact CG-CG2 4.45Å; F39-V43 HydrophobicContact CZ-CG2 3.59Å; F39-V43 WeakPolarHBondContact O-CB 3.46Å; F39-V43 WeakPolarHBondContact O-CG2 3.46Å; F39-V43 PolarHBondContact O-N 3.11Å; F39-W507 HydrophobicContact CE1-CB 4.12Å; F39-L511 HydrophobicContact CZ-CD1 4Å; F39-L511 HydrophobicContact CZ-CD2 4.21Å; F39-L511 HydrophobicContact CZ-CG 4.3Å
40	S	93.9	Very high	93.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.7	-43.1	178.1	-60.8	0	0	0	0	112.8	M36 T37 F38 V43 A44 W507	M36-S40 VanDerWaalsContact O-CB 3.29Å; M36-S40 WeakPolarHBondContact O-CB 3.28Å; M36-S40 PolarHBondContact O-N 3.01Å; M36-S40 PolarHBondContact O-OG 3.41Å; T37-S40 VanDerWaalsContact O-CB 3.31Å; T37-S40 WeakPolarHBondContact O-CB 3.42Å; T37-S40 PolarHBondContact O-N 3.27Å; F38-S40 VanDerWaalsContact C-N 3.31Å; F38-S40 PolarHBondContact O-N 3.45Å; S40-V43 PolarHBondContact O-N 2.93Å; S40-A44 WeakPolarHBondContact O-CB 3.25Å; S40-A44 PolarHBondContact O-N 3.15Å; S40-W507 WeakPolarHBondContact O-CZ3 3.22Å; S40-W507 WeakPolarHBondContact OG-CZ2 3.48Å; S40-W507 PolarHBondContact OG-NE1 3.49Å
41	V	96.6	Very high	93.5	Very high	76 Å²	76	50.2 Å²	50.2	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-44.6	176.3	171.3	0	0	0	0	111	T37 F38 F39 A44 G45 I91	T37-V41 WeakPolarHBondContact O-CG2 3.35Å; T37-V41 PolarHBondContact O-N 2.92Å; F38-V41 PolarHBondContact O-N 3.26Å; F39-V41 PolarHBondContact O-N 2.94Å; V41-A44 PolarHBondContact O-N 3.5Å; V41-G45 PolarHBondContact O-N 3.41Å; V41-I91 HydrophobicContact CG2-CD1 4.15Å; V41-I91 HydrophobicContact CG2-CG2 3.78Å
42	V	95.5	Very high	93.7	Very high	70 Å²	70	50 Å²	50	42%	0.424	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-46.8	177.1	172.3	0	0	0	0	110.7	F38 F39 G45 V46	F38-V42 HydrophobicContact CD1-CG2 4.36Å; F38-V42 HydrophobicContact CE1-CG2 3.93Å; F38-V42 HydrophobicContact CE2-CG2 4.34Å; F38-V42 HydrophobicContact CZ-CG2 3.92Å; F38-V42 WeakPolarHBondContact O-CG2 3.42Å; F38-V42 PolarHBondContact O-N 3.46Å; F39-V42 PolarHBondContact O-N 3.06Å; V42-G45 PolarHBondContact O-N 2.85Å; V42-V46 HydrophobicContact CG1-CG2 4.48Å; V42-V46 VanDerWaalsContact O-CG2 3.32Å; V42-V46 WeakPolarHBondContact O-CG2 3.48Å; V42-V46 PolarHBondContact O-N 3.39Å
43	V	94.3	Very high	93.9	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-57.4	-50.8	176.5	165.8	0	0	0	0	110.9	F39 S40 G45 V46 I47 W507 L511	F39-V43 HydrophobicContact CD1-CG2 4.21Å; F39-V43 HydrophobicContact CD2-CG2 4.28Å; F39-V43 HydrophobicContact CE1-CG2 3.78Å; F39-V43 HydrophobicContact CE2-CG2 3.86Å; F39-V43 HydrophobicContact CG-CG2 4.45Å; F39-V43 HydrophobicContact CZ-CG2 3.59Å; F39-V43 WeakPolarHBondContact O-CB 3.46Å; F39-V43 WeakPolarHBondContact O-CG2 3.46Å; F39-V43 PolarHBondContact O-N 3.11Å; S40-V43 PolarHBondContact O-N 2.93Å; V43-G45 VanDerWaalsContact C-N 3.34Å; V43-G45 PolarHBondContact O-N 3.47Å; V43-V46 PolarHBondContact O-N 3.02Å; V43-I47 HydrophobicContact CG1-CD1 3.85Å; V43-I47 VanDerWaalsContact O-CG1 3.3Å; V43-I47 WeakPolarHBondContact O-CG1 3.42Å; V43-I47 PolarHBondContact O-N 2.96Å; V43-W507 HydrophobicContact CB-CE3 4.33Å; V43-W507 HydrophobicContact CB-CZ3 4.32Å; V43-W507 HydrophobicContact CG1-CE3 4Å; V43-W507 HydrophobicContact CG1-CZ3 4.05Å; V43-L511 HydrophobicContact CB-CD2 4.5Å; V43-L511 HydrophobicContact CG1-CD2 4.15Å; V43-L511 HydrophobicContact CG2-CD2 3.56Å; V43-L511 HydrophobicContact CG2-CG 4.41Å
44	A	95.9	Very high	94	Very high	11 Å²	11	47.6 Å²	47.6	9%	0.091	27%	0.265	C	S	.	.	H	α-helix	trans	-60.3	-42.3	178.7	0	0	0	0	0	112.5	S40 V41 V46 I47 F48 L87 I91	S40-A44 WeakPolarHBondContact O-CB 3.25Å; S40-A44 PolarHBondContact O-N 3.15Å; V41-A44 PolarHBondContact O-N 3.5Å; A44-V46 PolarHBondContact O-N 3.43Å; A44-I47 PolarHBondContact O-N 2.97Å; A44-F48 WeakPolarHBondContact O-CB 3.26Å; A44-F48 PolarHBondContact O-N 2.97Å; A44-L87 HydrophobicContact CB-CB 4.02Å; A44-L87 HydrophobicContact CB-CD1 3.72Å; A44-I91 HydrophobicContact CB-CD1 3.76Å
45	G	96	Very high	94	Very high	30 Å²	30	44.3 Å²	44.3	31%	0.309	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-40.8	175.8	0	0	0	0	0	112.9	V41 V42 V43 F48 L49	V41-G45 PolarHBondContact O-N 3.41Å; V42-G45 PolarHBondContact O-N 2.85Å; V43-G45 VanDerWaalsContact C-N 3.34Å; V43-G45 PolarHBondContact O-N 3.47Å; G45-F48 PolarHBondContact O-N 3.41Å; G45-L49 WeakPolarHBondContact O-CB 3.22Å; G45-L49 WeakPolarHBondContact O-CG 3.46Å; G45-L49 PolarHBondContact O-N 2.95Å
46	V	95.1	Very high	93.9	Very high	48 Å²	48	44 Å²	44	29%	0.291	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-42.5	175.8	169.3	0	0	0	0	111.6	V42 V43 A44 G50 C514 F518	V42-V46 HydrophobicContact CG1-CG2 4.48Å; V42-V46 VanDerWaalsContact O-CG2 3.32Å; V42-V46 WeakPolarHBondContact O-CG2 3.48Å; V42-V46 PolarHBondContact O-N 3.39Å; V43-V46 PolarHBondContact O-N 3.02Å; A44-V46 PolarHBondContact O-N 3.43Å; V46-G50 WeakPolarHBondContact O-CA 3.43Å; V46-G50 PolarHBondContact O-N 2.74Å; V46-C514 HydrophobicContact CG1-CB 4.09Å; V46-F518 HydrophobicContact CG1-CE2 3.52Å; V46-F518 HydrophobicContact CG1-CZ 3.84Å
47	I	95.8	Very high	93.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-47.8	176.5	-63.3	166.5	0	0	0	109.9	V43 A44 N51 D79 L87 Y510 C514	V43-I47 HydrophobicContact CG1-CD1 3.85Å; V43-I47 VanDerWaalsContact O-CG1 3.3Å; V43-I47 WeakPolarHBondContact O-CG1 3.42Å; V43-I47 PolarHBondContact O-N 2.96Å; A44-I47 PolarHBondContact O-N 2.97Å; I47-N51 WeakPolarHBondContact O-CB 3.49Å; I47-N51 PolarHBondContact O-N 3.08Å; I47-N51 PolarHBondContact O-ND2 3.28Å; I47-D79 HydrophobicContact CG2-CB 4.27Å; I47-D79 WeakPolarHBondContact CG2-O 3.43Å; I47-L87 HydrophobicContact CD1-CD1 3.62Å; I47-Y510 WeakPolarHBondContact CD1-O 3.44Å; I47-C514 HydrophobicContact CG1-CB 4.39Å; I47-C514 WeakPolarHBondContact CG1-SG 3.38Å
48	F	96.5	Very high	93.2	Very high	71 Å²	71	44.3 Å²	44.3	31%	0.311	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-58.8	179.2	170	-101.8	0	0	0	111.5	A44 G45 G50 L52 F80 S83 I84	A44-F48 WeakPolarHBondContact O-CB 3.26Å; A44-F48 PolarHBondContact O-N 2.97Å; G45-F48 PolarHBondContact O-N 3.41Å; F48-G50 PolarHBondContact O-N 3.4Å; F48-L52 HydrophobicContact CE1-CD2 4.2Å; F48-L52 HydrophobicContact CE2-CD2 4.5Å; F48-L52 HydrophobicContact CZ-CD2 3.92Å; F48-L52 WeakPolarHBondContact O-CB 3.29Å; F48-L52 PolarHBondContact O-N 3.48Å; F48-F80 HydrophobicContact CD2-CD2 4.08Å; F48-F80 AromaticContact CD2-CE2 3.76Å; F48-F80 HydrophobicContact CD2-CE2 3.76Å; F48-F80 HydrophobicContact CE2-CD2 4.32Å; F48-F80 AromaticContact CE2-CE2 3.55Å; F48-F80 HydrophobicContact CE2-CE2 3.55Å; F48-F80 HydrophobicContact CE2-CZ 4.29Å; F48-S83 WeakPolarHBondContact CA-OG 3.35Å; F48-I84 HydrophobicContact CD2-CD1 4.11Å; F48-I84 HydrophobicContact CD2-CG1 3.83Å; F48-I84 HydrophobicContact CE2-CD1 3.88Å; F48-I84 HydrophobicContact CE2-CG1 4.02Å
49	L	94.7	Very high	92.8	Very high	112 Å²	112	40.3 Å²	40.3	59%	0.586	23%	0.234	S	C	*	.	H	α-helix	trans	-64.9	-42.6	-175.8	-69.6	174.2	0	0	0	111.9	G45 L53	G45-L49 WeakPolarHBondContact O-CB 3.22Å; G45-L49 WeakPolarHBondContact O-CG 3.46Å; G45-L49 PolarHBondContact O-N 2.95Å; L49-L53 VanDerWaalsContact O-CB 3.3Å; L49-L53 WeakPolarHBondContact O-CB 3.46Å; L49-L53 PolarHBondContact O-N 3.4Å
50	G	93	Very high	92.3	Very high	13 Å²	13	42.6 Å²	42.6	13%	0.134	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-47.2	-177.8	0	0	0	0	0	112.2	V46 F48 L53 V54 P517	V46-G50 WeakPolarHBondContact O-CA 3.43Å; V46-G50 PolarHBondContact O-N 2.74Å; F48-G50 PolarHBondContact O-N 3.4Å; G50-L53 PolarHBondContact O-N 3.23Å; G50-V54 WeakPolarHBondContact O-CG2 3.41Å; G50-V54 PolarHBondContact O-N 3.05Å; G50-P517 WeakPolarHBondContact O-CG 3.38Å
51	N	94.4	Very high	91.7	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-75.5	-33.4	179.8	-69.7	-69.4	0	0	0	112.1	I47 L53 V54 L55 A76 D79 F80 S513	I47-N51 WeakPolarHBondContact O-CB 3.49Å; I47-N51 PolarHBondContact O-N 3.08Å; I47-N51 PolarHBondContact O-ND2 3.28Å; N51-L53 VanDerWaalsContact C-N 3.31Å; N51-L53 PolarHBondContact O-N 3.45Å; N51-V54 WeakPolarHBondContact O-CB 3.26Å; N51-V54 PolarHBondContact O-N 3.05Å; N51-L55 WeakPolarHBondContact O-CG 2.98Å; N51-L55 PolarHBondContact O-N 3.04Å; N51-A76 HydrophobicContact CB-CB 4.34Å; N51-D79 HydrophobicContact CB-CB 4.42Å; N51-D79 WeakPolarHBondContact ND2-CB 3.32Å; N51-F80 HydrophobicContact CB-CB 4.22Å; N51-S513 PolarHBondContact ND2-O 3.16Å
52	L	93.8	Very high	90.6	Very high	59 Å²	59	47.3 Å²	47.3	31%	0.309	26%	0.263	S	S	.	.	H	α-helix	trans	-58.6	-44.5	169.8	179.7	60.9	0	0	0	111.3	F48 V54 L55 V56 F80	F48-L52 HydrophobicContact CE1-CD2 4.2Å; F48-L52 HydrophobicContact CE2-CD2 4.5Å; F48-L52 HydrophobicContact CZ-CD2 3.92Å; F48-L52 WeakPolarHBondContact O-CB 3.29Å; F48-L52 PolarHBondContact O-N 3.48Å; L52-V54 VanDerWaalsContact C-N 3.32Å; L52-V54 PolarHBondContact O-N 2.86Å; L52-L55 PolarHBondContact O-N 3.43Å; L52-V56 HydrophobicContact CD1-CG2 4.08Å; L52-V56 HydrophobicContact CG-CG2 4.29Å; L52-V56 WeakPolarHBondContact O-CB 3.27Å; L52-V56 WeakPolarHBondContact O-CG2 3.48Å; L52-V56 PolarHBondContact O-N 2.82Å; L52-F80 HydrophobicContact CB-CD2 4.21Å; L52-F80 HydrophobicContact CB-CE2 4.08Å; L52-F80 HydrophobicContact CD1-CE2 3.94Å; L52-F80 HydrophobicContact CD1-CZ 4.35Å; L52-F80 HydrophobicContact CG-CE2 4.45Å
53	L	91.2	Very high	89.3	Confident	59 Å²	59	49 Å²	49	31%	0.309	27%	0.27	S	S	.	.	H	α-helix	trans	-60.5	-41.3	176.8	179.1	63.2	0	0	0	111.7	L49 G50 N51 T57 F531	L49-L53 VanDerWaalsContact O-CB 3.3Å; L49-L53 WeakPolarHBondContact O-CB 3.46Å; L49-L53 PolarHBondContact O-N 3.4Å; G50-L53 PolarHBondContact O-N 3.23Å; N51-L53 VanDerWaalsContact C-N 3.31Å; N51-L53 PolarHBondContact O-N 3.45Å; L53-T57 VanDerWaalsContact O-CB 3.25Å; L53-T57 WeakPolarHBondContact O-CB 3.25Å; L53-T57 PolarHBondContact O-N 2.95Å; L53-T57 PolarHBondContact O-OG1 3.21Å; L53-F531 HydrophobicContact CD1-CD1 3.92Å; L53-F531 HydrophobicContact CD1-CE1 4.31Å; L53-F531 HydrophobicContact CD2-CD1 3.76Å; L53-F531 HydrophobicContact CD2-CE1 3.99Å; L53-F531 HydrophobicContact CD2-CG 4.27Å; L53-F531 HydrophobicContact CG-CD1 3.58Å; L53-F531 HydrophobicContact CG-CE1 3.59Å
54	V	89.6	Confident	87.7	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.036	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-46.9	174.1	173.4	0	0	0	0	111	G50 N51 L52 T57 F58 I72 A76 P517 F531	G50-V54 WeakPolarHBondContact O-CG2 3.41Å; G50-V54 PolarHBondContact O-N 3.05Å; N51-V54 WeakPolarHBondContact O-CB 3.26Å; N51-V54 PolarHBondContact O-N 3.05Å; L52-V54 VanDerWaalsContact C-N 3.32Å; L52-V54 PolarHBondContact O-N 2.86Å; V54-T57 PolarHBondContact O-N 3.24Å; V54-F58 PolarHBondContact O-N 3.41Å; V54-I72 HydrophobicContact CG1-CG2 4.22Å; V54-A76 HydrophobicContact CB-CB 4.16Å; V54-A76 HydrophobicContact CG1-CB 3.8Å; V54-P517 HydrophobicContact CG2-CB 4.11Å; V54-P517 HydrophobicContact CG2-CG 4.26Å; V54-F531 HydrophobicContact CG2-CZ 4.1Å
55	L	91.6	Very high	86.1	Confident	34 Å²	34	54.7 Å²	54.7	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-45.9	179.7	-65.9	173.1	0	0	0	112.4	N51 L52 T57 F58 A59 V73 A76 V77 F80	N51-L55 WeakPolarHBondContact O-CG 2.98Å; N51-L55 PolarHBondContact O-N 3.04Å; L52-L55 PolarHBondContact O-N 3.43Å; L55-T57 VanDerWaalsContact C-N 3.31Å; L55-T57 PolarHBondContact O-N 3.42Å; L55-F58 WeakPolarHBondContact O-CB 3.49Å; L55-F58 PolarHBondContact O-N 2.92Å; L55-A59 PolarHBondContact O-N 3.35Å; L55-V73 HydrophobicContact CD2-CG1 3.98Å; L55-A76 HydrophobicContact CD2-CB 3.88Å; L55-A76 HydrophobicContact CG-CB 4.06Å; L55-V77 HydrophobicContact CD1-CG2 4.47Å; L55-V77 HydrophobicContact CD2-CG2 3.72Å; L55-F80 HydrophobicContact CD1-CB 4.09Å; L55-F80 HydrophobicContact CD1-CD1 4.26Å; L55-F80 HydrophobicContact CD1-CG 4.07Å
56	V	90.2	Very high	84.5	Confident	49 Å²	49	58.1 Å²	58.1	30%	0.297	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-42.5	176.3	169.9	0	0	0	0	110.7	L52 F58 A59 M60	L52-V56 HydrophobicContact CD1-CG2 4.08Å; L52-V56 HydrophobicContact CG-CG2 4.29Å; L52-V56 WeakPolarHBondContact O-CB 3.27Å; L52-V56 WeakPolarHBondContact O-CG2 3.48Å; L52-V56 PolarHBondContact O-N 2.82Å; V56-F58 VanDerWaalsContact C-N 3.34Å; V56-F58 PolarHBondContact O-N 3.3Å; V56-A59 PolarHBondContact O-N 2.92Å; V56-A59 VanDerWaalsContact O-N 3.15Å; V56-M60 HydrophobicContact CG1-CE 3.77Å; V56-M60 HydrophobicContact CG1-CG 4.17Å; V56-M60 HydrophobicContact CG1-SD 3.65Å; V56-M60 WeakPolarHBondContact O-CB 3.27Å; V56-M60 WeakPolarHBondContact O-CG 3.49Å; V56-M60 PolarHBondContact O-N 2.96Å
57	T	84.7	Confident	82.8	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-42.1	179.8	-58.3	0	0	0	0	112.3	L53 V54 L55 T61 L64 A530 F531 L534	L53-T57 VanDerWaalsContact O-CB 3.25Å; L53-T57 WeakPolarHBondContact O-CB 3.25Å; L53-T57 PolarHBondContact O-N 2.95Å; L53-T57 PolarHBondContact O-OG1 3.21Å; V54-T57 PolarHBondContact O-N 3.24Å; L55-T57 VanDerWaalsContact C-N 3.31Å; L55-T57 PolarHBondContact O-N 3.42Å; T57-T61 VanDerWaalsContact O-CB 3.31Å; T57-T61 WeakPolarHBondContact O-CB 3.35Å; T57-T61 PolarHBondContact O-N 3.46Å; T57-T61 VanDerWaalsContact O-N 3.12Å; T57-T61 PolarHBondContact O-OG1 3.39Å; T57-T61 VanDerWaalsContact O-OG1 3.12Å; T57-L64 HydrophobicContact CG2-CD2 3.8Å; T57-A530 HydrophobicContact CG2-CB 3.49Å; T57-A530 VanDerWaalsContact CG2-CB 3.49Å; T57-F531 HydrophobicContact CG2-CD1 3.99Å; T57-F531 HydrophobicContact CG2-CE1 3.95Å; T57-F531 WeakPolarHBondContact OG1-CD1 3.41Å; T57-F531 WeakPolarHBondContact OG1-CE1 3.41Å; T57-L534 HydrophobicContact CG2-CD1 3.95Å; T57-L534 WeakPolarHBondContact OG1-CD1 3.24Å
58	F	85.5	Confident	81.3	Confident	55 Å²	55	60.3 Å²	60.3	24%	0.241	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-50.1	170.9	175.8	-95.9	0	0	0	111	V54 L55 V56 M60 R65 I68 V73	V54-F58 PolarHBondContact O-N 3.41Å; L55-F58 WeakPolarHBondContact O-CB 3.49Å; L55-F58 PolarHBondContact O-N 2.92Å; V56-F58 VanDerWaalsContact C-N 3.34Å; V56-F58 PolarHBondContact O-N 3.3Å; F58-M60 PolarHBondContact O-N 2.94Å; F58-R65 HydrophobicContact CD1-CG 4.49Å; F58-R65 HydrophobicContact CD2-CG 4.34Å; F58-R65 HydrophobicContact CE1-CG 4.29Å; F58-R65 HydrophobicContact CE2-CB 4.35Å; F58-R65 HydrophobicContact CE2-CG 4.13Å; F58-R65 HydrophobicContact CZ-CB 4.44Å; F58-R65 HydrophobicContact CZ-CG 4.1Å; F58-R65 WeakPolarHBondContact O-CD 3.33Å; F58-R65 WeakPolarHBondContact O-CG 3.34Å; F58-I68 HydrophobicContact CB-CD1 4.21Å; F58-I68 HydrophobicContact CD2-CB 3.81Å; F58-I68 HydrophobicContact CD2-CD1 3.57Å; F58-I68 HydrophobicContact CD2-CG1 4.28Å; F58-I68 HydrophobicContact CD2-CG2 3.66Å; F58-I68 HydrophobicContact CE2-CB 3.93Å; F58-I68 HydrophobicContact CE2-CD1 4.46Å; F58-I68 HydrophobicContact CE2-CG2 3.91Å; F58-I68 HydrophobicContact CG-CD1 4.38Å; F58-V73 HydrophobicContact CB-CG2 4.28Å; F58-V73 HydrophobicContact CD1-CG2 4.07Å; F58-V73 HydrophobicContact CD2-CG2 3.53Å; F58-V73 HydrophobicContact CE1-CG2 4.29Å; F58-V73 HydrophobicContact CE2-CG2 3.79Å; F58-V73 HydrophobicContact CG-CG2 3.69Å; F58-V73 HydrophobicContact CZ-CG2 4.16Å
59	A	86.9	Confident	80.2	Confident	62 Å²	62	58.4 Å²	58.4	51%	0.512	30%	0.301	S	S	.	.	H	α-helix	trans	-60.8	-42.2	-177.3	0	0	0	0	0	112.9	L55 V56	L55-A59 PolarHBondContact O-N 3.35Å; V56-A59 PolarHBondContact O-N 2.92Å; V56-A59 VanDerWaalsContact O-N 3.15Å
60	M	84.2	Confident	79.9	Confident	130 Å²	130	56.6 Å²	56.6	64%	0.64	29%	0.29	S	S	*	.	H	α-helix	trans	-84.5	-24.8	-172.7	-67	-172.8	174.2	0	0	114.1	V56 F58 L534	V56-M60 HydrophobicContact CG1-CE 3.77Å; V56-M60 HydrophobicContact CG1-CG 4.17Å; V56-M60 HydrophobicContact CG1-SD 3.65Å; V56-M60 WeakPolarHBondContact O-CB 3.27Å; V56-M60 WeakPolarHBondContact O-CG 3.49Å; V56-M60 PolarHBondContact O-N 2.96Å; F58-M60 PolarHBondContact O-N 2.94Å; M60-L534 HydrophobicContact CB-CD2 4.03Å; M60-L534 HydrophobicContact CG-CD2 4.32Å; M60-L534 HydrophobicContact SD-CD2 3.35Å; M60-L534 WeakPolarHBondContact SD-CD2 3.49Å
61	T	80.4	Confident	79.8	Confident	26 Å²	26	56.1 Å²	56.1	16%	0.16	28%	0.284	C	S	.	.			trans	-102.8	100	-172	-51.4	0	0	0	0	112	T57 N63 L64 R65	T57-T61 VanDerWaalsContact O-CB 3.31Å; T57-T61 WeakPolarHBondContact O-CB 3.35Å; T57-T61 PolarHBondContact O-N 3.46Å; T57-T61 VanDerWaalsContact O-N 3.12Å; T57-T61 PolarHBondContact O-OG1 3.39Å; T57-T61 VanDerWaalsContact O-OG1 3.12Å; T61-N63 PolarHBondContact O-N 3.44Å; T61-L64 HydrophobicContact CG2-CB 3.7Å; T61-L64 HydrophobicContact CG2-CD1 3.82Å; T61-L64 HydrophobicContact CG2-CD2 4.1Å; T61-L64 HydrophobicContact CG2-CG 4.09Å; T61-L64 CarbonylContact O-C 3.59Å; T61-L64 WeakPolarHBondContact O-CA 3.46Å; T61-L64 WeakPolarHBondContact O-CB 3.34Å; T61-L64 PolarHBondContact O-N 3.4Å; T61-R65 PolarHBondContact O-N 2.99Å
62	K	73.5	Confident	79.6	Confident	148 Å²	148	56.3 Å²	56.3	64%	0.643	29%	0.285	S	S	*	.	H	α-helix	trans	-54.2	-45.6	-177.2	-170.5	178.2	-179.9	179	0	114.2	L64 R65 L66	K62-L64 VanDerWaalsContact C-N 3.29Å; K62-L64 PolarHBondContact O-N 3.01Å; K62-R65 PolarHBondContact O-N 3.26Å; K62-L66 PolarHBondContact O-N 3.04Å
63	N	67	Low	79.5	Confident	105 Å²	105	54.8 Å²	54.8	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-64.8	-38.4	178.7	-66.3	-8.8	0	0	0	111.3	T61 L66 E67	T61-N63 PolarHBondContact O-N 3.44Å; N63-L66 PolarHBondContact O-N 3.48Å; N63-E67 WeakPolarHBondContact O-CB 3.42Å; N63-E67 WeakPolarHBondContact O-CG 3.31Å; N63-E67 PolarHBondContact O-N 3.49Å; N63-E67 VanDerWaalsContact O-N 3.12Å
64	L	61.1	Low	79.7	Confident	13 Å²	13	52.3 Å²	52.3	7%	0.068	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-40.7	174.2	-103.9	64.7	0	0	0	110.8	T57 T61 K62 L66 E67 I68 A530	T57-L64 HydrophobicContact CG2-CD2 3.8Å; T61-L64 HydrophobicContact CG2-CB 3.7Å; T61-L64 HydrophobicContact CG2-CD1 3.82Å; T61-L64 HydrophobicContact CG2-CD2 4.1Å; T61-L64 HydrophobicContact CG2-CG 4.09Å; T61-L64 CarbonylContact O-C 3.59Å; T61-L64 WeakPolarHBondContact O-CA 3.46Å; T61-L64 WeakPolarHBondContact O-CB 3.34Å; T61-L64 PolarHBondContact O-N 3.4Å; K62-L64 VanDerWaalsContact C-N 3.29Å; K62-L64 PolarHBondContact O-N 3.01Å; L64-L66 PolarHBondContact O-N 3.47Å; L64-E67 CarbonylContact O-C 3.51Å; L64-E67 PolarHBondContact O-N 3.33Å; L64-I68 HydrophobicContact CB-CD1 3.42Å; L64-I68 VanDerWaalsContact CB-CD1 3.42Å; L64-I68 HydrophobicContact CB-CG1 3.97Å; L64-I68 HydrophobicContact CD2-CD1 3.84Å; L64-I68 HydrophobicContact CG-CD1 3.62Å; L64-I68 HydrophobicContact CG-CG1 4.03Å; L64-I68 WeakPolarHBondContact O-CA 3.38Å; L64-I68 WeakPolarHBondContact O-CB 3.25Å; L64-I68 WeakPolarHBondContact O-CG1 3.31Å; L64-I68 PolarHBondContact O-N 3.48Å; L64-A530 HydrophobicContact CD1-CB 4.44Å; L64-A530 HydrophobicContact CD2-CB 3.37Å
65	R	63.9	Low	79.9	Confident	124 Å²	124	52.1 Å²	52.1	47%	0.468	27%	0.265	S	S	.	.	H	α-helix	trans	-57.5	-35.9	173.9	-68.5	-170.7	-74.4	155.3	-5.4	113.6	F58 T61 K62 E67	F58-R65 HydrophobicContact CD1-CG 4.49Å; F58-R65 HydrophobicContact CD2-CG 4.34Å; F58-R65 HydrophobicContact CE1-CG 4.29Å; F58-R65 HydrophobicContact CE2-CB 4.35Å; F58-R65 HydrophobicContact CE2-CG 4.13Å; F58-R65 HydrophobicContact CZ-CB 4.44Å; F58-R65 HydrophobicContact CZ-CG 4.1Å; F58-R65 WeakPolarHBondContact O-CD 3.33Å; F58-R65 WeakPolarHBondContact O-CG 3.34Å; T61-R65 PolarHBondContact O-N 2.99Å; K62-R65 PolarHBondContact O-N 3.26Å; R65-E67 VanDerWaalsContact C-N 3.32Å
66	L	61.1	Low	80.1	Confident	103 Å²	103	50.7 Å²	50.7	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-77.7	-18.6	177.8	-65.1	174.1	0	0	0	112.9	K62 N63 L64 R146	K62-L66 PolarHBondContact O-N 3.04Å; N63-L66 PolarHBondContact O-N 3.48Å; L64-L66 PolarHBondContact O-N 3.47Å; L66-R146 PolarHBondContact O-NH1 3.27Å; L66-R146 PolarHBondContact O-NH2 3.25Å
67	E	60.3	Low	80.4	Confident	82 Å²	82	50.6 Å²	50.6	38%	0.383	26%	0.257	S	S	.	.	H	α-helix	trans	-115.3	-19	-173.3	-66.8	172	152.5	0	0	113.7	N63 L64 R65 R526	N63-E67 WeakPolarHBondContact O-CB 3.42Å; N63-E67 WeakPolarHBondContact O-CG 3.31Å; N63-E67 PolarHBondContact O-N 3.49Å; N63-E67 VanDerWaalsContact O-N 3.12Å; L64-E67 CarbonylContact O-C 3.51Å; L64-E67 PolarHBondContact O-N 3.33Å; R65-E67 VanDerWaalsContact C-N 3.32Å; E67-R526 VanDerWaalsContact CD-CZ 3.4Å; E67-R526 VanDerWaalsContact CD-NH1 3.33Å; E67-R526 IonicContact OE1-CZ 3.84Å; E67-R526 IonicContact OE1-NH1 3.7Å; E67-R526 PolarHBondContact OE1-NH1 3.4Å; E67-R526 IonicContact OE1-NH2 3.14Å; E67-R526 PolarHBondContact OE1-NH2 2.98Å; E67-R526 IonicContact OE2-CZ 2.97Å; E67-R526 IonicContact OE2-NE 3.59Å; E67-R526 IonicContact OE2-NH1 2.69Å; E67-R526 PolarHBondContact OE2-NH1 2.98Å; E67-R526 VanDerWaalsContact OE2-NH1 3.11Å; E67-R526 IonicContact OE2-NH2 3.55Å; E67-R526 PolarHBondContact OE2-NH2 2.72Å
68	I	62.9	Low	81	Confident	11 Å²	11	50.5 Å²	50.5	6%	0.056	26%	0.257	C	S	.	.	S	Bend	trans	-76.8	135.7	-174.7	-75.3	170.9	0	0	0	109.7	F58 L64 M70 V73 Y527	F58-I68 HydrophobicContact CB-CD1 4.21Å; F58-I68 HydrophobicContact CD2-CB 3.81Å; F58-I68 HydrophobicContact CD2-CD1 3.57Å; F58-I68 HydrophobicContact CD2-CG1 4.28Å; F58-I68 HydrophobicContact CD2-CG2 3.66Å; F58-I68 HydrophobicContact CE2-CB 3.93Å; F58-I68 HydrophobicContact CE2-CD1 4.46Å; F58-I68 HydrophobicContact CE2-CG2 3.91Å; F58-I68 HydrophobicContact CG-CD1 4.38Å; L64-I68 HydrophobicContact CB-CD1 3.42Å; L64-I68 VanDerWaalsContact CB-CD1 3.42Å; L64-I68 HydrophobicContact CB-CG1 3.97Å; L64-I68 HydrophobicContact CD2-CD1 3.84Å; L64-I68 HydrophobicContact CG-CD1 3.62Å; L64-I68 HydrophobicContact CG-CG1 4.03Å; L64-I68 WeakPolarHBondContact O-CA 3.38Å; L64-I68 WeakPolarHBondContact O-CB 3.25Å; L64-I68 WeakPolarHBondContact O-CG1 3.31Å; L64-I68 PolarHBondContact O-N 3.48Å; I68-M70 PolarHBondContact O-N 3.3Å; I68-V73 HydrophobicContact CG2-CG2 3.97Å; I68-Y527 HydrophobicContact CD1-CE1 4.44Å
69	D	74.3	Confident	81.5	Confident	32 Å²	32	47.9 Å²	47.9	17%	0.171	25%	0.245	C	C	.	.			trans	-69.2	116.2	172.1	-57.1	-45.4	0	0	0	109	Y71 I72 R132	D69-Y71 HydrophobicContact CB-CD2 4.2Å; D69-Y71 PolarHBondContact O-N 3.14Å; D69-I72 HydrophobicContact CB-CD1 4.34Å; D69-I72 HydrophobicContact CB-CG1 4.41Å; D69-I72 PolarHBondContact O-N 3.22Å; D69-R132 IonicContact OD1-NH2 3.44Å; D69-R132 PolarHBondContact OD1-NH2 3.1Å; D69-R132 IonicContact OD2-CZ 3.22Å; D69-R132 IonicContact OD2-NH2 3.95Å; D69-R132 PolarHBondContact OD2-NH2 3.04Å
70	M	87.5	Confident	82	Confident	74 Å²	74	47 Å²	47	37%	0.365	23%	0.23	S	C	.	.	H	α-helix	trans	-50.2	-25.2	177.8	-65.1	177	172	0	0	112.8	I68 V73 S74 Y148 P151 L155	I68-M70 PolarHBondContact O-N 3.3Å; M70-V73 PolarHBondContact O-N 3.3Å; M70-S74 PolarHBondContact O-N 2.71Å; M70-Y148 HydrophobicContact CE-CD1 3.98Å; M70-Y148 HydrophobicContact CE-CE1 4.5Å; M70-P151 HydrophobicContact SD-CB 4.09Å; M70-P151 HydrophobicContact SD-CG 4.19Å; M70-L155 HydrophobicContact CB-CD1 3.68Å
71	Y	91.8	Very high	82.6	Confident	3 Å²	3	43.3 Å²	43.3	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-36.5	176.5	-47.1	-68.9	0	0	0	114.1	D69 V73 S74 L75 C127 I128 D131 P151 M154 L155	D69-Y71 HydrophobicContact CB-CD2 4.2Å; D69-Y71 PolarHBondContact O-N 3.14Å; Y71-V73 VanDerWaalsContact C-N 3.31Å; Y71-S74 PolarHBondContact O-N 3.08Å; Y71-L75 WeakPolarHBondContact O-CB 3.35Å; Y71-L75 PolarHBondContact O-N 3.43Å; Y71-C127 HydrophobicContact CD1-CB 3.44Å; Y71-C127 VanDerWaalsContact CD1-CB 3.44Å; Y71-C127 HydrophobicContact CE1-CB 3.66Å; Y71-C127 HydrophobicContact CG-CB 4.16Å; Y71-I128 VanDerWaalsContact CB-CG1 3.45Å; Y71-I128 HydrophobicContact CG-CG1 4.34Å; Y71-D131 HydrophobicContact CD2-CB 4.12Å; Y71-D131 HydrophobicContact CE2-CB 3.51Å; Y71-D131 VanDerWaalsContact CE2-CG 3.47Å; Y71-P151 HydrophobicContact CE1-CB 4.11Å; Y71-P151 HydrophobicContact CE2-CB 4.25Å; Y71-P151 VanDerWaalsContact OH-CA 3.25Å; Y71-P151 WeakPolarHBondContact OH-CA 3.3Å; Y71-P151 WeakPolarHBondContact OH-CB 3.35Å; Y71-M154 HydrophobicContact CE1-CB 4.03Å; Y71-M154 HydrophobicContact CE1-CE 4.16Å; Y71-M154 HydrophobicContact CE1-SD 4.39Å; Y71-M154 PolarHBondContact OH-SD 2.84Å; Y71-L155 HydrophobicContact CD1-CD1 4.36Å; Y71-L155 HydrophobicContact CD1-CD2 3.65Å; Y71-L155 HydrophobicContact CD1-CG 3.89Å; Y71-L155 HydrophobicContact CE1-CD2 4.28Å; Y71-L155 HydrophobicContact CE1-CG 4.11Å
72	I	90.4	Very high	83.4	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-68.3	-37.4	177.4	-64.7	172.2	0	0	0	109.8	V54 D69 L75 A76 I128 Y520 Y527	V54-I72 HydrophobicContact CG1-CG2 4.22Å; D69-I72 HydrophobicContact CB-CD1 4.34Å; D69-I72 HydrophobicContact CB-CG1 4.41Å; D69-I72 PolarHBondContact O-N 3.22Å; I72-L75 PolarHBondContact O-N 3.01Å; I72-A76 WeakPolarHBondContact O-CB 3.32Å; I72-A76 PolarHBondContact O-N 3.01Å; I72-I128 HydrophobicContact CG1-CD1 4.32Å; I72-Y520 HydrophobicContact CD1-CE1 4.09Å; I72-Y520 HydrophobicContact CG1-CE1 4.39Å; I72-Y520 HydrophobicContact CG2-CD2 4.3Å; I72-Y520 HydrophobicContact CG2-CE2 3.97Å; I72-Y527 VanDerWaalsContact CD1-OH 3.24Å; I72-Y527 WeakPolarHBondContact CD1-OH 3.45Å
73	V	91.8	Very high	84.5	Confident	27 Å²	27	35.5 Å²	35.5	16%	0.164	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-46.5	174.2	-179.7	0	0	0	0	110.3	L55 F58 I68 M70 Y71 L75 A76 V77	L55-V73 HydrophobicContact CD2-CG1 3.98Å; F58-V73 HydrophobicContact CB-CG2 4.28Å; F58-V73 HydrophobicContact CD1-CG2 4.07Å; F58-V73 HydrophobicContact CD2-CG2 3.53Å; F58-V73 HydrophobicContact CE1-CG2 4.29Å; F58-V73 HydrophobicContact CE2-CG2 3.79Å; F58-V73 HydrophobicContact CG-CG2 3.69Å; F58-V73 HydrophobicContact CZ-CG2 4.16Å; I68-V73 HydrophobicContact CG2-CG2 3.97Å; M70-V73 PolarHBondContact O-N 3.3Å; Y71-V73 VanDerWaalsContact C-N 3.31Å; V73-L75 VanDerWaalsContact C-N 3.31Å; V73-L75 PolarHBondContact O-N 2.75Å; V73-A76 PolarHBondContact O-N 3.49Å; V73-V77 HydrophobicContact CG1-CG2 4.39Å; V73-V77 WeakPolarHBondContact O-CG2 3.42Å; V73-V77 PolarHBondContact O-N 2.74Å
74	S	94.6	Very high	85.9	Confident	8 Å²	8	34 Å²	34	6%	0.056	17%	0.169	C	C	.	.	H	α-helix	trans	-57.1	-44.4	175.8	-176.2	0	0	0	0	112.3	M70 Y71 V77 A78 S124 L155 W159	M70-S74 PolarHBondContact O-N 2.71Å; Y71-S74 PolarHBondContact O-N 3.08Å; S74-V77 PolarHBondContact O-N 2.98Å; S74-A78 PolarHBondContact O-N 3.33Å; S74-S124 PolarHBondContact OG-OG 3.13Å; S74-L155 VanDerWaalsContact CB-CD2 3.49Å; S74-L155 WeakPolarHBondContact OG-CD2 3.31Å; S74-W159 PolarHBondContact OG-NE1 3.04Å
75	L	94.8	Very high	87.6	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-59.1	-49	175.1	-179	64.6	0	0	0	111.5	Y71 I72 V73 V77 A78 D79 S121 L125 I128 N516	Y71-L75 WeakPolarHBondContact O-CB 3.35Å; Y71-L75 PolarHBondContact O-N 3.43Å; I72-L75 PolarHBondContact O-N 3.01Å; V73-L75 VanDerWaalsContact C-N 3.31Å; V73-L75 PolarHBondContact O-N 2.75Å; L75-V77 VanDerWaalsContact C-N 3.34Å; L75-V77 PolarHBondContact O-N 3.49Å; L75-A78 PolarHBondContact O-N 3.4Å; L75-D79 PolarHBondContact O-N 2.93Å; L75-S121 WeakPolarHBondContact CD1-O 3.25Å; L75-S121 WeakPolarHBondContact CD1-OG 3.48Å; L75-L125 HydrophobicContact CD1-CD2 4.37Å; L75-L125 HydrophobicContact CD1-CG 4.25Å; L75-L125 HydrophobicContact CD2-CD2 3.87Å; L75-I128 HydrophobicContact CD2-CD1 4.05Å; L75-N516 HydrophobicContact CD2-CB 4.48Å
76	A	94.9	Very high	89.1	Confident	3 Å²	3	30.3 Å²	30.3	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-36	178.6	0	0	0	0	0	112.7	N51 V54 L55 I72 V73 F80	N51-A76 HydrophobicContact CB-CB 4.34Å; V54-A76 HydrophobicContact CB-CB 4.16Å; V54-A76 HydrophobicContact CG1-CB 3.8Å; L55-A76 HydrophobicContact CD2-CB 3.88Å; L55-A76 HydrophobicContact CG-CB 4.06Å; I72-A76 WeakPolarHBondContact O-CB 3.32Å; I72-A76 PolarHBondContact O-N 3.01Å; V73-A76 PolarHBondContact O-N 3.49Å; A76-F80 WeakPolarHBondContact O-CB 3.42Å; A76-F80 PolarHBondContact O-N 3.43Å
77	V	96.4	Very high	90.7	Very high	47 Å²	47	25.4 Å²	25.4	29%	0.285	13%	0.132	S	C	.	.	H	α-helix	trans	-64.1	-46.3	174	170.5	0	0	0	0	110.8	L55 V73 S74 L75 F80 L81 W159	L55-V77 HydrophobicContact CD1-CG2 4.47Å; L55-V77 HydrophobicContact CD2-CG2 3.72Å; V73-V77 HydrophobicContact CG1-CG2 4.39Å; V73-V77 WeakPolarHBondContact O-CG2 3.42Å; V73-V77 PolarHBondContact O-N 2.74Å; S74-V77 PolarHBondContact O-N 2.98Å; L75-V77 VanDerWaalsContact C-N 3.34Å; L75-V77 PolarHBondContact O-N 3.49Å; V77-F80 PolarHBondContact O-N 2.81Å; V77-L81 HydrophobicContact CG1-CD1 3.78Å; V77-L81 HydrophobicContact CG1-CG 4.29Å; V77-L81 WeakPolarHBondContact O-CB 3.44Å; V77-L81 VanDerWaalsContact O-CG 3.27Å; V77-L81 WeakPolarHBondContact O-CG 3.35Å; V77-L81 PolarHBondContact O-N 3.32Å; V77-W159 HydrophobicContact CB-CZ2 4.5Å; V77-W159 HydrophobicContact CG1-CH2 4.11Å; V77-W159 HydrophobicContact CG1-CZ2 4.07Å
78	A	97.1	Very high	92.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-48	178.5	0	0	0	0	0	111.7	S74 L75 L81 L82 A120 W159	S74-A78 PolarHBondContact O-N 3.33Å; L75-A78 PolarHBondContact O-N 3.4Å; A78-L81 PolarHBondContact O-N 3.04Å; A78-L82 WeakPolarHBondContact O-CB 3.44Å; A78-L82 PolarHBondContact O-N 2.94Å; A78-A120 HydrophobicContact CB-CB 3.96Å; A78-W159 HydrophobicContact CB-CH2 4.23Å; A78-W159 HydrophobicContact CB-CZ2 4.44Å
79	D	96.6	Very high	93.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.3	-37.7	179.7	-69.1	-19.6	0	0	0	112.1	I47 N51 L75 L82 S83 S121 S513 N516	I47-D79 HydrophobicContact CG2-CB 4.27Å; I47-D79 WeakPolarHBondContact CG2-O 3.43Å; N51-D79 HydrophobicContact CB-CB 4.42Å; N51-D79 WeakPolarHBondContact ND2-CB 3.32Å; L75-D79 PolarHBondContact O-N 2.93Å; D79-L82 WeakPolarHBondContact O-CB 3.4Å; D79-S83 PolarHBondContact O-N 3.47Å; D79-S83 VanDerWaalsContact O-N 3.09Å; D79-S121 WeakPolarHBondContact OD1-CB 3.25Å; D79-S121 PolarHBondContact OD1-OG 2.96Å; D79-S513 VanDerWaalsContact CG-CB 3.43Å; D79-S513 VanDerWaalsContact CG-OG 3.26Å; D79-S513 WeakPolarHBondContact OD1-CB 3.32Å; D79-S513 PolarHBondContact OD1-OG 3.01Å; D79-N516 PolarHBondContact OD2-ND2 2.79Å
80	F	96.9	Very high	94.8	Very high	43 Å²	43	24.1 Å²	24.1	19%	0.189	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-47.9	174.5	174.3	-104.2	0	0	0	111.8	F48 N51 L52 L55 A76 V77 L82 S83 I84	F48-F80 HydrophobicContact CD2-CD2 4.08Å; F48-F80 AromaticContact CD2-CE2 3.76Å; F48-F80 HydrophobicContact CD2-CE2 3.76Å; F48-F80 HydrophobicContact CE2-CD2 4.32Å; F48-F80 AromaticContact CE2-CE2 3.55Å; F48-F80 HydrophobicContact CE2-CE2 3.55Å; F48-F80 HydrophobicContact CE2-CZ 4.29Å; N51-F80 HydrophobicContact CB-CB 4.22Å; L52-F80 HydrophobicContact CB-CD2 4.21Å; L52-F80 HydrophobicContact CB-CE2 4.08Å; L52-F80 HydrophobicContact CD1-CE2 3.94Å; L52-F80 HydrophobicContact CD1-CZ 4.35Å; L52-F80 HydrophobicContact CG-CE2 4.45Å; L55-F80 HydrophobicContact CD1-CB 4.09Å; L55-F80 HydrophobicContact CD1-CD1 4.26Å; L55-F80 HydrophobicContact CD1-CG 4.07Å; A76-F80 WeakPolarHBondContact O-CB 3.42Å; A76-F80 PolarHBondContact O-N 3.43Å; V77-F80 PolarHBondContact O-N 2.81Å; F80-L82 PolarHBondContact O-N 2.93Å; F80-S83 PolarHBondContact O-N 3.42Å; F80-S83 VanDerWaalsContact O-N 3.14Å; F80-S83 PolarHBondContact O-OG 3.24Å; F80-I84 HydrophobicContact CD1-CD1 4.12Å; F80-I84 HydrophobicContact CD2-CD1 4.16Å; F80-I84 HydrophobicContact CE1-CD1 3.49Å; F80-I84 VanDerWaalsContact CE1-CD1 3.49Å; F80-I84 HydrophobicContact CE2-CD1 3.55Å; F80-I84 HydrophobicContact CE2-CG1 4.43Å; F80-I84 HydrophobicContact CG-CD1 4.44Å; F80-I84 HydrophobicContact CZ-CD1 3.19Å; F80-I84 HydrophobicContact CZ-CG1 4.44Å; F80-I84 PolarHBondContact O-N 3.22Å; F80-I84 VanDerWaalsContact O-N 3.15Å
81	L	97.6	Very high	95.1	Very high	52 Å²	52	21.9 Å²	21.9	27%	0.272	12%	0.122	S	C	.	.	H	α-helix	trans	-65.5	-38.3	178.3	-69.5	176	0	0	0	111.9	V77 A78 S83 I84 L85 F117	V77-L81 HydrophobicContact CG1-CD1 3.78Å; V77-L81 HydrophobicContact CG1-CG 4.29Å; V77-L81 WeakPolarHBondContact O-CB 3.44Å; V77-L81 VanDerWaalsContact O-CG 3.27Å; V77-L81 WeakPolarHBondContact O-CG 3.35Å; V77-L81 PolarHBondContact O-N 3.32Å; A78-L81 PolarHBondContact O-N 3.04Å; L81-S83 VanDerWaalsContact C-N 3.28Å; L81-S83 PolarHBondContact O-N 3.2Å; L81-I84 PolarHBondContact O-N 3.38Å; L81-L85 HydrophobicContact CB-CD1 4.29Å; L81-L85 HydrophobicContact CD2-CD1 4.17Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CG 3.22Å; L81-L85 PolarHBondContact O-N 3.37Å; L81-F117 HydrophobicContact CB-CD1 3.81Å; L81-F117 HydrophobicContact CB-CE1 3.43Å; L81-F117 VanDerWaalsContact CB-CE1 3.43Å; L81-F117 HydrophobicContact CB-CE2 4.31Å; L81-F117 HydrophobicContact CB-CG 4.42Å; L81-F117 HydrophobicContact CB-CZ 3.72Å; L81-F117 HydrophobicContact CD1-CD1 4.42Å; L81-F117 HydrophobicContact CD1-CE1 3.65Å; L81-F117 HydrophobicContact CD1-CZ 4.29Å; L81-F117 HydrophobicContact CG-CE1 4.18Å
82	L	97	Very high	95.1	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-53.9	-47.3	170.3	-179.8	71.2	0	0	0	111.1	A78 D79 F80 I84 I86 L87 F117 Y510	A78-L82 WeakPolarHBondContact O-CB 3.44Å; A78-L82 PolarHBondContact O-N 2.94Å; D79-L82 WeakPolarHBondContact O-CB 3.4Å; F80-L82 PolarHBondContact O-N 2.93Å; L82-I84 PolarHBondContact O-N 3.38Å; L82-I86 HydrophobicContact CD1-CB 3.92Å; L82-I86 HydrophobicContact CD1-CG1 4.24Å; L82-I86 HydrophobicContact CD1-CG2 4.1Å; L82-I86 WeakPolarHBondContact O-CB 3.38Å; L82-I86 PolarHBondContact O-N 3.05Å; L82-L87 HydrophobicContact CG-CD2 4.4Å; L82-L87 HydrophobicContact CG-CG 4.32Å; L82-L87 PolarHBondContact O-N 3.44Å; L82-F117 HydrophobicContact CB-CB 3.87Å; L82-F117 HydrophobicContact CB-CG 4.38Å; L82-F117 HydrophobicContact CD1-CB 4.07Å; L82-Y510 HydrophobicContact CD1-CE1 4.42Å; L82-Y510 HydrophobicContact CD2-CD1 4.07Å; L82-Y510 HydrophobicContact CD2-CE1 4.48Å
83	S	97	Very high	94.9	Very high	8 Å²	8	27.4 Å²	27.4	6%	0.056	15%	0.148	C	C	.	.	H	α-helix	trans	-66.2	-33.9	-176.7	75.4	0	0	0	0	114.5	F48 D79 F80 L81 P88	F48-S83 WeakPolarHBondContact CA-OG 3.35Å; D79-S83 PolarHBondContact O-N 3.47Å; D79-S83 VanDerWaalsContact O-N 3.09Å; F80-S83 PolarHBondContact O-N 3.42Å; F80-S83 VanDerWaalsContact O-N 3.14Å; F80-S83 PolarHBondContact O-OG 3.24Å; L81-S83 VanDerWaalsContact C-N 3.28Å; L81-S83 PolarHBondContact O-N 3.2Å; S83-P88 WeakPolarHBondContact O-CD 3.42Å
84	I	97	Very high	94.7	Very high	74 Å²	74	26.7 Å²	26.7	38%	0.379	14%	0.143	S	C	.	.	H	α-helix	trans	-85.3	-42.2	-179.4	-67.2	178.3	0	0	0	111.3	F48 F80 L81 L82 P88	F48-I84 HydrophobicContact CD2-CD1 4.11Å; F48-I84 HydrophobicContact CD2-CG1 3.83Å; F48-I84 HydrophobicContact CE2-CD1 3.88Å; F48-I84 HydrophobicContact CE2-CG1 4.02Å; F80-I84 HydrophobicContact CD1-CD1 4.12Å; F80-I84 HydrophobicContact CD2-CD1 4.16Å; F80-I84 HydrophobicContact CE1-CD1 3.49Å; F80-I84 VanDerWaalsContact CE1-CD1 3.49Å; F80-I84 HydrophobicContact CE2-CD1 3.55Å; F80-I84 HydrophobicContact CE2-CG1 4.43Å; F80-I84 HydrophobicContact CG-CD1 4.44Å; F80-I84 HydrophobicContact CZ-CD1 3.19Å; F80-I84 HydrophobicContact CZ-CG1 4.44Å; F80-I84 PolarHBondContact O-N 3.22Å; F80-I84 VanDerWaalsContact O-N 3.15Å; L81-I84 PolarHBondContact O-N 3.38Å; L82-I84 PolarHBondContact O-N 3.38Å; I84-P88 WeakPolarHBondContact O-CG 3.49Å
85	L	96.2	Very high	94.5	Very high	60 Å²	60	32.9 Å²	32.9	31%	0.314	17%	0.166	S	C	.	.	H	α-helix	trans	-93.6	-30.2	-165.8	-63	178.8	0	0	0	113.1	L81 Y109 F117	L81-L85 HydrophobicContact CB-CD1 4.29Å; L81-L85 HydrophobicContact CD2-CD1 4.17Å; L81-L85 WeakPolarHBondContact O-CB 3.44Å; L81-L85 WeakPolarHBondContact O-CG 3.22Å; L81-L85 PolarHBondContact O-N 3.37Å; L85-Y109 WeakPolarHBondContact CB-OH 3.5Å; L85-F117 HydrophobicContact CB-CE2 4.27Å; L85-F117 HydrophobicContact CD1-CE2 3.9Å; L85-F117 HydrophobicContact CD1-CZ 3.68Å
86	I	95	Very high	94.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-44.1	-165.9	-53.2	-56.2	0	0	0	112.3	L82 P88 L89 A90 Y109 F110 N114 F117	L82-I86 HydrophobicContact CD1-CB 3.92Å; L82-I86 HydrophobicContact CD1-CG1 4.24Å; L82-I86 HydrophobicContact CD1-CG2 4.1Å; L82-I86 WeakPolarHBondContact O-CB 3.38Å; L82-I86 PolarHBondContact O-N 3.05Å; I86-P88 VanDerWaalsContact C-CD 3.46Å; I86-L89 PolarHBondContact O-N 3.21Å; I86-A90 PolarHBondContact O-N 3.08Å; I86-A90 VanDerWaalsContact O-N 3.08Å; I86-Y109 HydrophobicContact CD1-CE1 4.05Å; I86-F110 HydrophobicContact CG2-CD2 3.8Å; I86-F110 HydrophobicContact CG2-CE2 3.76Å; I86-N114 HydrophobicContact CG2-CB 4.34Å; I86-N114 WeakPolarHBondContact CG2-ND2 3.41Å; I86-N114 VanDerWaalsContact CG2-OD1 3.23Å; I86-N114 WeakPolarHBondContact CG2-OD1 3.28Å; I86-F117 HydrophobicContact CD1-CD2 4.46Å; I86-F117 HydrophobicContact CD1-CE2 4.31Å; I86-F117 HydrophobicContact CG1-CD2 3.74Å; I86-F117 HydrophobicContact CG1-CE2 3.96Å
87	L	95.4	Very high	93.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-34.6	-178.9	-63.3	-172.8	0	0	0	114.5	A44 I47 L82 L89 A90 I91 W507 Y510	A44-L87 HydrophobicContact CB-CB 4.02Å; A44-L87 HydrophobicContact CB-CD1 3.72Å; I47-L87 HydrophobicContact CD1-CD1 3.62Å; L82-L87 HydrophobicContact CG-CD2 4.4Å; L82-L87 HydrophobicContact CG-CG 4.32Å; L82-L87 PolarHBondContact O-N 3.44Å; L87-L89 VanDerWaalsContact C-N 3.31Å; L87-L89 PolarHBondContact O-N 3.05Å; L87-A90 WeakPolarHBondContact O-CB 3.26Å; L87-A90 PolarHBondContact O-N 2.75Å; L87-A90 VanDerWaalsContact O-N 3.17Å; L87-I91 VanDerWaalsContact O-CG1 3.25Å; L87-I91 WeakPolarHBondContact O-CG1 3.3Å; L87-I91 PolarHBondContact O-N 3.47Å; L87-W507 HydrophobicContact CD2-CH2 4.41Å; L87-W507 HydrophobicContact CD2-CZ3 4.44Å; L87-Y510 HydrophobicContact CD2-CD1 4.01Å; L87-Y510 HydrophobicContact CD2-CD2 3.88Å; L87-Y510 HydrophobicContact CD2-CE1 4.1Å; L87-Y510 HydrophobicContact CD2-CE2 4Å; L87-Y510 HydrophobicContact CD2-CG 3.91Å
88	P	96.8	Very high	92.6	Very high	62 Å²	62	39.9 Å²	39.9	40%	0.403	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-40.4	175.7	-26.3	37.5	0	0	0	112.3	S83 I84 I86 I91 V92	S83-P88 WeakPolarHBondContact O-CD 3.42Å; I84-P88 WeakPolarHBondContact O-CG 3.49Å; I86-P88 VanDerWaalsContact C-CD 3.46Å; P88-I91 PolarHBondContact O-N 3.37Å; P88-V92 WeakPolarHBondContact O-CG2 3.48Å; P88-V92 PolarHBondContact O-N 2.99Å
89	L	93.3	Very high	91.9	Very high	26 Å²	26	40.1 Å²	40.1	14%	0.136	20%	0.203	C	C	.	.	H	α-helix	trans	-67.2	-39.4	175.4	-60.3	177.4	0	0	0	111.3	I86 L87 V92 R93 F101 Y109 F110	I86-L89 PolarHBondContact O-N 3.21Å; L87-L89 VanDerWaalsContact C-N 3.31Å; L87-L89 PolarHBondContact O-N 3.05Å; L89-V92 PolarHBondContact O-N 2.93Å; L89-R93 WeakPolarHBondContact O-CB 3.15Å; L89-R93 PolarHBondContact O-N 2.92Å; L89-F101 HydrophobicContact CD2-CE1 4.25Å; L89-F101 HydrophobicContact CD2-CE2 3.84Å; L89-F101 HydrophobicContact CD2-CZ 3.63Å; L89-Y109 HydrophobicContact CD1-CD1 3.96Å; L89-Y109 HydrophobicContact CD1-CE1 4.1Å; L89-F110 HydrophobicContact CB-CD2 3.68Å; L89-F110 HydrophobicContact CB-CE2 4.16Å; L89-F110 HydrophobicContact CB-CG 4.39Å; L89-F110 HydrophobicContact CD1-CB 4.07Å; L89-F110 HydrophobicContact CD1-CD2 4.25Å
90	A	92.3	Very high	91.4	Very high	9 Å²	9	42.1 Å²	42.1	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-42.6	174.3	0	0	0	0	0	112.2	I86 L87 R93 Q94 F110 W507	I86-A90 PolarHBondContact O-N 3.08Å; I86-A90 VanDerWaalsContact O-N 3.08Å; L87-A90 WeakPolarHBondContact O-CB 3.26Å; L87-A90 PolarHBondContact O-N 2.75Å; L87-A90 VanDerWaalsContact O-N 3.17Å; A90-R93 PolarHBondContact O-N 3.37Å; A90-Q94 VanDerWaalsContact O-CB 3.28Å; A90-Q94 WeakPolarHBondContact O-CB 3.38Å; A90-Q94 PolarHBondContact O-N 3.39Å; A90-F110 HydrophobicContact CB-CE2 3.82Å; A90-F110 HydrophobicContact CB-CZ 4.01Å; A90-W507 HydrophobicContact CB-CH2 4.45Å; A90-W507 HydrophobicContact CB-CZ2 4.16Å
91	I	94.5	Very high	90.9	Very high	27 Å²	27	42.6 Å²	42.6	14%	0.138	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-44.3	178.7	-69.3	163	0	0	0	110.8	T37 V41 A44 L87 P88 Q94 Y95 W507	T37-I91 HydrophobicContact CG2-CG2 4.16Å; V41-I91 HydrophobicContact CG2-CD1 4.15Å; V41-I91 HydrophobicContact CG2-CG2 3.78Å; A44-I91 HydrophobicContact CB-CD1 3.76Å; L87-I91 VanDerWaalsContact O-CG1 3.25Å; L87-I91 WeakPolarHBondContact O-CG1 3.3Å; L87-I91 PolarHBondContact O-N 3.47Å; P88-I91 PolarHBondContact O-N 3.37Å; I91-Q94 WeakPolarHBondContact O-CB 3.36Å; I91-Q94 PolarHBondContact O-N 3.2Å; I91-Y95 WeakPolarHBondContact O-CB 3.13Å; I91-Y95 PolarHBondContact O-N 3.29Å; I91-W507 HydrophobicContact CD1-CH2 4.46Å; I91-W507 HydrophobicContact CG1-CH2 3.72Å; I91-W507 HydrophobicContact CG1-CZ2 4.09Å
92	V	92.6	Very high	90.1	Very high	56 Å²	56	47.3 Å²	47.3	34%	0.339	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-46.4	177.3	171.6	0	0	0	0	110.7	P88 L89 Q94 Y95 V96 P100 F101	P88-V92 WeakPolarHBondContact O-CG2 3.48Å; P88-V92 PolarHBondContact O-N 2.99Å; L89-V92 PolarHBondContact O-N 2.93Å; V92-Q94 VanDerWaalsContact C-N 3.29Å; V92-Q94 PolarHBondContact O-N 3.02Å; V92-Y95 PolarHBondContact O-N 2.92Å; V92-V96 HydrophobicContact CG1-CG2 4.42Å; V92-V96 WeakPolarHBondContact O-CB 3.39Å; V92-V96 WeakPolarHBondContact O-CG2 3.3Å; V92-V96 PolarHBondContact O-N 3.35Å; V92-P100 HydrophobicContact CG1-CG 3.61Å; V92-F101 HydrophobicContact CB-CE2 4.29Å; V92-F101 HydrophobicContact CB-CZ 3.91Å; V92-F101 HydrophobicContact CG1-CE1 4.4Å; V92-F101 HydrophobicContact CG1-CE2 3.93Å; V92-F101 HydrophobicContact CG1-CZ 3.54Å; V92-F101 HydrophobicContact CG2-CZ 4.36Å
93	R	86.3	Confident	89.5	Confident	70 Å²	70	48.9 Å²	48.9	26%	0.264	25%	0.25	S	C	.	.	H	α-helix	trans	-57.5	-43.3	173.5	-179.8	-175.5	173.1	-114.7	-8.3	111.3	L89 A90 G97 W99 E499	L89-R93 WeakPolarHBondContact O-CB 3.15Å; L89-R93 PolarHBondContact O-N 2.92Å; A90-R93 PolarHBondContact O-N 3.37Å; R93-G97 WeakPolarHBondContact O-CA 3.47Å; R93-G97 PolarHBondContact O-N 2.78Å; R93-W99 HydrophobicContact CB-CE3 4.49Å; R93-E499 IonicContact NH2-OE2 3.02Å; R93-E499 PolarHBondContact NH2-OE2 3.4Å
94	Q	87.5	Confident	88.7	Confident	12 Å²	12	52.3 Å²	52.3	6%	0.056	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-43.3	179.2	179.3	57.6	41.8	0	0	112.7	A90 I91 V92	A90-Q94 VanDerWaalsContact O-CB 3.28Å; A90-Q94 WeakPolarHBondContact O-CB 3.38Å; A90-Q94 PolarHBondContact O-N 3.39Å; I91-Q94 WeakPolarHBondContact O-CB 3.36Å; I91-Q94 PolarHBondContact O-N 3.2Å; V92-Q94 VanDerWaalsContact C-N 3.29Å; V92-Q94 PolarHBondContact O-N 3.02Å
95	Y	90	Very high	88	Confident	137 Å²	137	55 Å²	55	54%	0.537	28%	0.281	S	S	.	.	H	α-helix	trans	-70.7	-43.2	-177.9	177.9	-107	0	0	0	112.4	R33 T37 I91 V92	R33-Y95 WeakPolarHBondContact CD-O 3.24Å; T37-Y95 HydrophobicContact CG2-CD2 3.84Å; T37-Y95 HydrophobicContact CG2-CG 4.22Å; T37-Y95 WeakPolarHBondContact OG1-CA 3.19Å; I91-Y95 WeakPolarHBondContact O-CB 3.13Å; I91-Y95 PolarHBondContact O-N 3.29Å; V92-Y95 PolarHBondContact O-N 2.92Å
96	V	86.4	Confident	87.6	Confident	49 Å²	49	55.3 Å²	55.3	30%	0.297	28%	0.283	S	S	.	.	H	α-helix	trans	-77	-28.9	-179.1	175.7	0	0	0	0	111.2	V92 Y98 P100	V92-V96 HydrophobicContact CG1-CG2 4.42Å; V92-V96 WeakPolarHBondContact O-CB 3.39Å; V92-V96 WeakPolarHBondContact O-CG2 3.3Å; V92-V96 PolarHBondContact O-N 3.35Å; V96-Y98 VanDerWaalsContact C-N 3.26Å; V96-Y98 HydrophobicContact CG1-CD1 3.43Å; V96-Y98 VanDerWaalsContact CG1-CD1 3.43Å; V96-Y98 HydrophobicContact CG1-CD2 3.97Å; V96-Y98 HydrophobicContact CG1-CE1 3.15Å; V96-Y98 HydrophobicContact CG1-CE2 3.74Å; V96-Y98 HydrophobicContact CG1-CG 3.82Å; V96-Y98 PolarHBondContact O-N 2.67Å; V96-P100 HydrophobicContact CG1-CB 4.28Å; V96-P100 HydrophobicContact CG2-CG 4.34Å
97	G	79.5	Confident	87.1	Confident	28 Å²	28	55.3 Å²	55.3	29%	0.289	28%	0.283	S	S	.	.	S	Bend	trans	83.9	-3.5	-178.5	0	0	0	0	0	114.1	R93	R93-G97 WeakPolarHBondContact O-CA 3.47Å; R93-G97 PolarHBondContact O-N 2.78Å
98	Y	79.5	Confident	86.5	Confident	123 Å²	123	57.8 Å²	57.8	48%	0.482	29%	0.294	S	S	.	.	S	Bend	trans	-144.5	176.1	174.4	66.6	-97.9	0	0	0	109.4	V96 P100 G181	V96-Y98 VanDerWaalsContact C-N 3.26Å; V96-Y98 HydrophobicContact CG1-CD1 3.43Å; V96-Y98 VanDerWaalsContact CG1-CD1 3.43Å; V96-Y98 HydrophobicContact CG1-CD2 3.97Å; V96-Y98 HydrophobicContact CG1-CE1 3.15Å; V96-Y98 HydrophobicContact CG1-CE2 3.74Å; V96-Y98 HydrophobicContact CG1-CG 3.82Å; V96-Y98 PolarHBondContact O-N 2.67Å; Y98-P100 HydrophobicContact CE2-CB 4.08Å; Y98-P100 VanDerWaalsContact O-CD 3.23Å; Y98-P100 WeakPolarHBondContact O-CD 3.48Å; Y98-G181 WeakPolarHBondContact CB-O 3.34Å
99	W	82.9	Confident	86.1	Confident	5 Å²	5	59.8 Å²	59.8	2%	0.019	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-85.6	106.3	177.1	179.2	-103.1	0	0	0	111.1	R93 F101 L106 C107 F110 G181 C183	R93-W99 HydrophobicContact CB-CE3 4.49Å; W99-F101 AromaticContact CD2-CD2 3.89Å; W99-F101 HydrophobicContact CD2-CD2 3.89Å; W99-F101 AromaticContact CE2-CD2 3.66Å; W99-F101 AromaticContact CE3-CD2 3.91Å; W99-F101 HydrophobicContact CE3-CD2 3.91Å; W99-F101 HydrophobicContact CE3-CE2 4.35Å; W99-F101 AromaticContact CH2-CD2 3.51Å; W99-F101 HydrophobicContact CH2-CD2 3.51Å; W99-F101 HydrophobicContact CH2-CE2 4.02Å; W99-F101 HydrophobicContact CH2-CG 4.4Å; W99-F101 HydrophobicContact CZ2-CB 3.8Å; W99-F101 AromaticContact CZ2-CD2 3.45Å; W99-F101 HydrophobicContact CZ2-CD2 3.45Å; W99-F101 VanDerWaalsContact CZ2-CD2 3.45Å; W99-F101 HydrophobicContact CZ2-CE2 4.4Å; W99-F101 AromaticContact CZ2-CG 4Å; W99-F101 HydrophobicContact CZ2-CG 4Å; W99-F101 AromaticContact CZ3-CD2 3.75Å; W99-F101 HydrophobicContact CZ3-CD2 3.75Å; W99-F101 HydrophobicContact CZ3-CE2 4Å; W99-F101 PolarHBondContact NE1-O 3.04Å; W99-L106 HydrophobicContact CH2-CB 4.38Å; W99-L106 VanDerWaalsContact CZ2-C 3.42Å; W99-L106 HydrophobicContact CZ2-CB 3.75Å; W99-C107 HydrophobicContact CD2-CB 4.49Å; W99-C107 HydrophobicContact CZ2-CB 3.84Å; W99-F110 HydrophobicContact CH2-CB 3.8Å; W99-F110 HydrophobicContact CH2-CD1 4.42Å; W99-F110 HydrophobicContact CH2-CG 4.17Å; W99-F110 HydrophobicContact CZ3-CB 4.08Å; W99-F110 AromaticContact CZ3-CD1 3.87Å; W99-F110 HydrophobicContact CZ3-CD1 3.87Å; W99-F110 AromaticContact CZ3-CG 3.94Å; W99-F110 HydrophobicContact CZ3-CG 3.94Å; W99-G181 PolarHBondContact N-O 3.28Å; W99-G181 VanDerWaalsContact O-CA 3.24Å; W99-G181 WeakPolarHBondContact O-CA 3.45Å; W99-G181 PolarHBondContact O-N 3.28Å; W99-C183 HydrophobicContact CB-CB 3.57Å; W99-C183 HydrophobicContact CD2-CB 3.36Å; W99-C183 HydrophobicContact CE3-CB 3.71Å; W99-C183 HydrophobicContact CG-CB 3.29Å
100	P	84.7	Confident	85.9	Confident	42 Å²	42	58.9 Å²	58.9	27%	0.273	29%	0.289	S	S	.	.			trans	-87.1	-12.2	-170.3	34.4	-34.2	0	0	0	114.1	V92 V96 Y98 Q102	V92-P100 HydrophobicContact CG1-CG 3.61Å; V96-P100 HydrophobicContact CG1-CB 4.28Å; V96-P100 HydrophobicContact CG2-CG 4.34Å; Y98-P100 HydrophobicContact CE2-CB 4.08Å; Y98-P100 VanDerWaalsContact O-CD 3.23Å; Y98-P100 WeakPolarHBondContact O-CD 3.48Å; P100-Q102 PolarHBondContact O-N 3.34Å
101	F	87	Confident	85.5	Confident	53 Å²	53	59.8 Å²	59.8	23%	0.232	29%	0.293	C	S	.	.			trans	-81.9	105.1	-179.5	-46.2	-80.2	0	0	0	107.2	L89 V92 W99 S103 L106	L89-F101 HydrophobicContact CD2-CE1 4.25Å; L89-F101 HydrophobicContact CD2-CE2 3.84Å; L89-F101 HydrophobicContact CD2-CZ 3.63Å; V92-F101 HydrophobicContact CB-CE2 4.29Å; V92-F101 HydrophobicContact CB-CZ 3.91Å; V92-F101 HydrophobicContact CG1-CE1 4.4Å; V92-F101 HydrophobicContact CG1-CE2 3.93Å; V92-F101 HydrophobicContact CG1-CZ 3.54Å; V92-F101 HydrophobicContact CG2-CZ 4.36Å; W99-F101 AromaticContact CD2-CD2 3.89Å; W99-F101 HydrophobicContact CD2-CD2 3.89Å; W99-F101 AromaticContact CE2-CD2 3.66Å; W99-F101 AromaticContact CE3-CD2 3.91Å; W99-F101 HydrophobicContact CE3-CD2 3.91Å; W99-F101 HydrophobicContact CE3-CE2 4.35Å; W99-F101 AromaticContact CH2-CD2 3.51Å; W99-F101 HydrophobicContact CH2-CD2 3.51Å; W99-F101 HydrophobicContact CH2-CE2 4.02Å; W99-F101 HydrophobicContact CH2-CG 4.4Å; W99-F101 HydrophobicContact CZ2-CB 3.8Å; W99-F101 AromaticContact CZ2-CD2 3.45Å; W99-F101 HydrophobicContact CZ2-CD2 3.45Å; W99-F101 VanDerWaalsContact CZ2-CD2 3.45Å; W99-F101 HydrophobicContact CZ2-CE2 4.4Å; W99-F101 AromaticContact CZ2-CG 4Å; W99-F101 HydrophobicContact CZ2-CG 4Å; W99-F101 AromaticContact CZ3-CD2 3.75Å; W99-F101 HydrophobicContact CZ3-CD2 3.75Å; W99-F101 HydrophobicContact CZ3-CE2 4Å; W99-F101 PolarHBondContact NE1-O 3.04Å; F101-S103 PolarHBondContact O-N 3.2Å; F101-L106 HydrophobicContact CB-CB 4.38Å; F101-L106 HydrophobicContact CB-CD1 3.88Å; F101-L106 HydrophobicContact CD1-CD1 4.19Å; F101-L106 HydrophobicContact CG-CD1 4.19Å
102	Q	82.1	Confident	85.2	Confident	150 Å²	150	59.3 Å²	59.3	70%	0.701	29%	0.291	S	S	*	.			trans	-67.9	50.4	175.7	-64.8	171	-17.1	0	0	111.7	P100 E180	P100-Q102 PolarHBondContact O-N 3.34Å; Q102-E180 HydrophobicContact CB-CG 4.24Å; Q102-E180 HydrophobicContact CG-CG 4.02Å
103	S	83.6	Confident	85.1	Confident	36 Å²	36	57 Å²	57	25%	0.252	28%	0.279	S	S	.	.			trans	-143.3	114	-172.6	174.6	0	0	0	0	109.8	F101 I105 L106 C107	F101-S103 PolarHBondContact O-N 3.2Å; S103-I105 PolarHBondContact O-N 2.85Å; S103-I105 PolarHBondContact OG-N 2.78Å; S103-L106 PolarHBondContact O-N 2.95Å; S103-L106 PolarHBondContact OG-N 3.23Å; S103-C107 PolarHBondContact O-N 3.26Å
104	N	79.6	Confident	85.2	Confident	79 Å²	79	54.5 Å²	54.5	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-65.7	-33.1	174.8	-66.7	-5.3	0	0	0	111.2	C107 Q108 F178	N104-C107 PolarHBondContact O-N 3.49Å; N104-Q108 WeakPolarHBondContact O-CB 3.3Å; N104-Q108 VanDerWaalsContact O-CG 3.28Å; N104-Q108 WeakPolarHBondContact O-CG 3.38Å; N104-Q108 PolarHBondContact O-N 2.97Å; N104-F178 HydrophobicContact CB-CB 3.85Å; N104-F178 VanDerWaalsContact CG-CB 3.42Å; N104-F178 PolarHBondContact ND2-O 3.3Å; N104-F178 WeakPolarHBondContact OD1-CB 3.41Å; N104-F178 PolarHBondContact OD1-O 2.93Å
105	I	83.4	Confident	85.3	Confident	130 Å²	130	55.2 Å²	55.2	67%	0.667	27%	0.274	S	S	*	.	H	α-helix	trans	-63.4	-45.3	177.4	-61.1	170.6	0	0	0	110.2	S103 C107 Q108 Y109	S103-I105 PolarHBondContact O-N 2.85Å; S103-I105 PolarHBondContact OG-N 2.78Å; I105-C107 VanDerWaalsContact C-N 3.33Å; I105-C107 PolarHBondContact O-N 3.18Å; I105-Q108 PolarHBondContact O-N 2.78Å; I105-Y109 WeakPolarHBondContact O-CB 3.34Å; I105-Y109 PolarHBondContact O-N 3.47Å
106	L	86.8	Confident	85.4	Confident	67 Å²	67	49.4 Å²	49.4	35%	0.351	25%	0.252	S	S	.	.	H	α-helix	trans	-66.1	-36.7	177.8	-74.8	176.3	0	0	0	112	W99 F101 S103 Y109 F110	W99-L106 HydrophobicContact CH2-CB 4.38Å; W99-L106 VanDerWaalsContact CZ2-C 3.42Å; W99-L106 HydrophobicContact CZ2-CB 3.75Å; F101-L106 HydrophobicContact CB-CB 4.38Å; F101-L106 HydrophobicContact CB-CD1 3.88Å; F101-L106 HydrophobicContact CD1-CD1 4.19Å; F101-L106 HydrophobicContact CG-CD1 4.19Å; S103-L106 PolarHBondContact O-N 2.95Å; S103-L106 PolarHBondContact OG-N 3.23Å; L106-Y109 PolarHBondContact O-N 2.88Å; L106-F110 VanDerWaalsContact O-CB 3.3Å; L106-F110 WeakPolarHBondContact O-CB 3.23Å; L106-F110 PolarHBondContact O-N 3.4Å
107	C	84.4	Confident	85.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-45.3	175.5	176.2	0	0	0	0	111.1	W99 S103 N104 I105 Y109 F110 M111 F178 C183	W99-C107 HydrophobicContact CD2-CB 4.49Å; W99-C107 HydrophobicContact CZ2-CB 3.84Å; S103-C107 PolarHBondContact O-N 3.26Å; N104-C107 PolarHBondContact O-N 3.49Å; I105-C107 VanDerWaalsContact C-N 3.33Å; I105-C107 PolarHBondContact O-N 3.18Å; C107-Y109 VanDerWaalsContact C-N 3.34Å; C107-Y109 PolarHBondContact O-N 2.8Å; C107-F110 PolarHBondContact O-N 3.17Å; C107-M111 WeakPolarHBondContact O-CG 3.37Å; C107-M111 PolarHBondContact O-N 3.35Å; C107-F178 HydrophobicContact CB-CD1 3.92Å; C107-F178 HydrophobicContact CB-CE1 4.34Å; C107-F178 WeakPolarHBondContact SG-CD1 3.3Å; C107-F178 VanDerWaalsContact SG-CE1 3.56Å; C107-C183 WeakPolarHBondContact CA-SG 3.35Å; C107-C183 HydrophobicContact CB-CB 3.83Å; C107-C183 WeakPolarHBondContact CB-SG 3.22Å; C107-C183 WeakPolarHBondContact SG-CA 3.46Å; C107-C183 WeakPolarHBondContact SG-CB 3.32Å; C107-C183 CovalentContact SG-SG 2.02Å; C107-C183 PolarHBondContact SG-SG 3.4Å
108	Q	83.5	Confident	86.4	Confident	52 Å²	52	47.5 Å²	47.5	24%	0.243	24%	0.235	C	C	.	.	H	α-helix	trans	-61	-43	176.4	-74	173.4	21	0	0	112	N104 I105 M111 S112 F178	N104-Q108 WeakPolarHBondContact O-CB 3.3Å; N104-Q108 VanDerWaalsContact O-CG 3.28Å; N104-Q108 WeakPolarHBondContact O-CG 3.38Å; N104-Q108 PolarHBondContact O-N 2.97Å; I105-Q108 PolarHBondContact O-N 2.78Å; Q108-M111 PolarHBondContact O-N 3.09Å; Q108-S112 VanDerWaalsContact O-CB 3.23Å; Q108-S112 WeakPolarHBondContact O-CB 3.34Å; Q108-S112 PolarHBondContact O-N 2.96Å; Q108-S112 PolarHBondContact O-OG 3.31Å; Q108-F178 HydrophobicContact CG-CD1 4.25Å; Q108-F178 HydrophobicContact CG-CD2 4.46Å; Q108-F178 HydrophobicContact CG-CE1 3.65Å; Q108-F178 HydrophobicContact CG-CE2 3.86Å; Q108-F178 HydrophobicContact CG-CZ 3.41Å; Q108-F178 VanDerWaalsContact CG-CZ 3.41Å
109	Y	87.9	Confident	87	Confident	104 Å²	104	42.3 Å²	42.3	41%	0.408	22%	0.215	S	C	.	.	H	α-helix	trans	-59	-49	174.1	172.8	-95.1	0	0	0	111.4	L85 I86 L89 I105 L106 C107 M111 S112 G113	L85-Y109 WeakPolarHBondContact CB-OH 3.5Å; I86-Y109 HydrophobicContact CD1-CE1 4.05Å; L89-Y109 HydrophobicContact CD1-CD1 3.96Å; L89-Y109 HydrophobicContact CD1-CE1 4.1Å; I105-Y109 WeakPolarHBondContact O-CB 3.34Å; I105-Y109 PolarHBondContact O-N 3.47Å; L106-Y109 PolarHBondContact O-N 2.88Å; C107-Y109 VanDerWaalsContact C-N 3.34Å; C107-Y109 PolarHBondContact O-N 2.8Å; Y109-M111 PolarHBondContact O-N 3.21Å; Y109-S112 PolarHBondContact O-N 2.97Å; Y109-G113 PolarHBondContact O-N 3.25Å
110	F	89	Confident	87.6	Confident	7 Å²	7	42 Å²	42	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-49.5	178.1	172.1	-112.1	0	0	0	111.9	I86 L89 A90 W99 L106 C107 N114	I86-F110 HydrophobicContact CG2-CD2 3.8Å; I86-F110 HydrophobicContact CG2-CE2 3.76Å; L89-F110 HydrophobicContact CB-CD2 3.68Å; L89-F110 HydrophobicContact CB-CE2 4.16Å; L89-F110 HydrophobicContact CB-CG 4.39Å; L89-F110 HydrophobicContact CD1-CB 4.07Å; L89-F110 HydrophobicContact CD1-CD2 4.25Å; A90-F110 HydrophobicContact CB-CE2 3.82Å; A90-F110 HydrophobicContact CB-CZ 4.01Å; W99-F110 HydrophobicContact CH2-CB 3.8Å; W99-F110 HydrophobicContact CH2-CD1 4.42Å; W99-F110 HydrophobicContact CH2-CG 4.17Å; W99-F110 HydrophobicContact CZ3-CB 4.08Å; W99-F110 AromaticContact CZ3-CD1 3.87Å; W99-F110 HydrophobicContact CZ3-CD1 3.87Å; W99-F110 AromaticContact CZ3-CG 3.94Å; W99-F110 HydrophobicContact CZ3-CG 3.94Å; L106-F110 VanDerWaalsContact O-CB 3.3Å; L106-F110 WeakPolarHBondContact O-CB 3.23Å; L106-F110 PolarHBondContact O-N 3.4Å; C107-F110 PolarHBondContact O-N 3.17Å; F110-N114 WeakPolarHBondContact CD2-ND2 3.27Å; F110-N114 WeakPolarHBondContact CE2-ND2 3.13Å; F110-N114 VanDerWaalsContact CZ-ND2 3.33Å; F110-N114 WeakPolarHBondContact CZ-ND2 3.35Å; F110-N114 PolarHBondContact O-N 2.69Å; F110-N114 VanDerWaalsContact O-N 3.07Å; F110-N114 PolarHBondContact O-ND2 3Å
111	M	85	Confident	88.1	Confident	29 Å²	29	40.2 Å²	40.2	14%	0.143	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-45.3	-179	-63.7	-52.6	-88.5	0	0	111.9	C107 Q108 Y109 N114 F115 L185	C107-M111 WeakPolarHBondContact O-CG 3.37Å; C107-M111 PolarHBondContact O-N 3.35Å; Q108-M111 PolarHBondContact O-N 3.09Å; Y109-M111 PolarHBondContact O-N 3.21Å; M111-N114 WeakPolarHBondContact O-CB 3.45Å; M111-N114 PolarHBondContact O-N 2.78Å; M111-F115 WeakPolarHBondContact O-CD2 3.31Å; M111-F115 PolarHBondContact O-N 3.5Å; M111-L185 HydrophobicContact CB-CD1 3.71Å; M111-L185 HydrophobicContact CE-CB 3.9Å; M111-L185 HydrophobicContact CE-CD1 3.39Å; M111-L185 HydrophobicContact CE-CD2 4.37Å; M111-L185 HydrophobicContact CE-CG 4.08Å; M111-L185 HydrophobicContact CG-CD1 3.77Å; M111-L185 HydrophobicContact SD-CD1 4.4Å
112	S	86.6	Confident	88.4	Confident	16 Å²	16	38 Å²	38	11%	0.112	19%	0.193	C	C	.	.	H	α-helix	trans	-68.8	-38.5	-178.2	-49.6	0	0	0	0	112.1	Q108 Y109 F115 L116	Q108-S112 VanDerWaalsContact O-CB 3.23Å; Q108-S112 WeakPolarHBondContact O-CB 3.34Å; Q108-S112 PolarHBondContact O-N 2.96Å; Q108-S112 PolarHBondContact O-OG 3.31Å; Y109-S112 PolarHBondContact O-N 2.97Å; S112-F115 PolarHBondContact O-N 3.05Å; S112-L116 WeakPolarHBondContact O-CB 3.47Å; S112-L116 PolarHBondContact O-N 3.32Å
113	G	91.2	Very high	89	Confident	8 Å²	8	31.9 Å²	31.9	8%	0.082	17%	0.165	C	C	.	.	H	α-helix	trans	-66.1	-36.9	175.5	0	0	0	0	0	112.8	Y109 F115 L116 F117	Y109-G113 PolarHBondContact O-N 3.25Å; G113-F115 PolarHBondContact O-N 3.36Å; G113-L116 PolarHBondContact O-N 2.92Å; G113-F117 WeakPolarHBondContact O-CD2 3.29Å; G113-F117 PolarHBondContact O-N 3.28Å
114	N	89.4	Confident	89.5	Confident	18 Å²	18	30.2 Å²	30.2	10%	0.096	15%	0.153	C	C	.	.	H	α-helix	trans	-56.5	-49.4	170.2	-89.2	-63.6	0	0	0	111.5	I86 F110 M111 C118 Y510	I86-N114 HydrophobicContact CG2-CB 4.34Å; I86-N114 WeakPolarHBondContact CG2-ND2 3.41Å; I86-N114 VanDerWaalsContact CG2-OD1 3.23Å; I86-N114 WeakPolarHBondContact CG2-OD1 3.28Å; F110-N114 WeakPolarHBondContact CD2-ND2 3.27Å; F110-N114 WeakPolarHBondContact CE2-ND2 3.13Å; F110-N114 VanDerWaalsContact CZ-ND2 3.33Å; F110-N114 WeakPolarHBondContact CZ-ND2 3.35Å; F110-N114 PolarHBondContact O-N 2.69Å; F110-N114 VanDerWaalsContact O-N 3.07Å; F110-N114 PolarHBondContact O-ND2 3Å; M111-N114 WeakPolarHBondContact O-CB 3.45Å; M111-N114 PolarHBondContact O-N 2.78Å; N114-C118 WeakPolarHBondContact O-CB 3.49Å; N114-C118 PolarHBondContact O-N 2.87Å; N114-C118 PolarHBondContact O-SG 3.28Å; N114-Y510 PolarHBondContact OD1-OH 3.04Å
115	F	88.8	Confident	90.1	Very high	27 Å²	27	26.5 Å²	26.5	12%	0.118	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-45.4	178.5	-70.7	-58.1	0	0	0	112.8	M111 S112 G113 L119 P169 L185 V195 L199	M111-F115 WeakPolarHBondContact O-CD2 3.31Å; M111-F115 PolarHBondContact O-N 3.5Å; S112-F115 PolarHBondContact O-N 3.05Å; G113-F115 PolarHBondContact O-N 3.36Å; F115-L119 WeakPolarHBondContact O-CB 3.39Å; F115-L119 PolarHBondContact O-N 3.46Å; F115-P169 HydrophobicContact CD2-CG 3.77Å; F115-P169 HydrophobicContact CE2-CG 4.01Å; F115-L185 HydrophobicContact CE2-CD1 4.13Å; F115-L185 HydrophobicContact CE2-CD2 3.23Å; F115-L185 HydrophobicContact CE2-CG 4.36Å; F115-L185 HydrophobicContact CZ-CD2 3.2Å; F115-V195 HydrophobicContact CE1-CG1 4.04Å; F115-L199 HydrophobicContact CB-CD1 4.4Å; F115-L199 HydrophobicContact CD1-CD1 3.16Å; F115-L199 HydrophobicContact CE1-CD1 3.57Å; F115-L199 HydrophobicContact CG-CD1 3.99Å
116	L	92.8	Very high	90.7	Very high	14 Å²	14	20.6 Å²	20.6	7%	0.073	10%	0.104	C	C	.	.	H	α-helix	trans	-54.2	-58.8	178.4	174.3	63.2	0	0	0	111.5	S112 G113 A120 A162 F163 I166	S112-L116 WeakPolarHBondContact O-CB 3.47Å; S112-L116 PolarHBondContact O-N 3.32Å; G113-L116 PolarHBondContact O-N 2.92Å; L116-A120 VanDerWaalsContact O-CB 3.25Å; L116-A120 WeakPolarHBondContact O-CB 3.24Å; L116-A120 PolarHBondContact O-N 3.43Å; L116-A162 VanDerWaalsContact CD1-C 3.44Å; L116-A162 HydrophobicContact CD1-CB 3.79Å; L116-A162 WeakPolarHBondContact CD1-O 3.44Å; L116-F163 HydrophobicContact CD1-CD1 3.96Å; L116-F163 HydrophobicContact CD1-CD2 4.37Å; L116-F163 HydrophobicContact CD1-CE1 4.14Å; L116-F163 HydrophobicContact CD1-CG 4.04Å; L116-F163 HydrophobicContact CD1-CZ 4.42Å; L116-F163 HydrophobicContact CD2-CD1 4.49Å; L116-F163 HydrophobicContact CD2-CE1 4.07Å; L116-I166 HydrophobicContact CB-CD1 4.32Å; L116-I166 HydrophobicContact CB-CG1 4.01Å; L116-I166 HydrophobicContact CD1-CD1 4.05Å; L116-I166 HydrophobicContact CD1-CG1 4.27Å; L116-I166 HydrophobicContact CD2-CD1 3.84Å; L116-I166 HydrophobicContact CD2-CG1 4.45Å; L116-I166 HydrophobicContact CG-CD1 4.28Å; L116-I166 HydrophobicContact CG-CG1 4.47Å
117	F	94.7	Very high	91.1	Very high	14 Å²	14	17.8 Å²	17.8	6%	0.061	9%	0.09	C	C	.	.	H	α-helix	trans	-76.1	-37.5	-170.6	-61.8	-57.1	0	0	0	112.6	L81 L82 L85 I86 G113 A120 S121	L81-F117 HydrophobicContact CB-CD1 3.81Å; L81-F117 HydrophobicContact CB-CE1 3.43Å; L81-F117 VanDerWaalsContact CB-CE1 3.43Å; L81-F117 HydrophobicContact CB-CE2 4.31Å; L81-F117 HydrophobicContact CB-CG 4.42Å; L81-F117 HydrophobicContact CB-CZ 3.72Å; L81-F117 HydrophobicContact CD1-CD1 4.42Å; L81-F117 HydrophobicContact CD1-CE1 3.65Å; L81-F117 HydrophobicContact CD1-CZ 4.29Å; L81-F117 HydrophobicContact CG-CE1 4.18Å; L82-F117 HydrophobicContact CB-CB 3.87Å; L82-F117 HydrophobicContact CB-CG 4.38Å; L82-F117 HydrophobicContact CD1-CB 4.07Å; L85-F117 HydrophobicContact CB-CE2 4.27Å; L85-F117 HydrophobicContact CD1-CE2 3.9Å; L85-F117 HydrophobicContact CD1-CZ 3.68Å; I86-F117 HydrophobicContact CD1-CD2 4.46Å; I86-F117 HydrophobicContact CD1-CE2 4.31Å; I86-F117 HydrophobicContact CG1-CD2 3.74Å; I86-F117 HydrophobicContact CG1-CE2 3.96Å; G113-F117 WeakPolarHBondContact O-CD2 3.29Å; G113-F117 PolarHBondContact O-N 3.28Å; F117-A120 PolarHBondContact O-N 2.89Å; F117-S121 VanDerWaalsContact O-CB 3.29Å; F117-S121 WeakPolarHBondContact O-CB 3.4Å; F117-S121 PolarHBondContact O-N 3.28Å
118	C	91.8	Very high	91.5	Very high	24 Å²	24	18 Å²	18	16%	0.162	9%	0.091	C	C	.	.	H	α-helix	trans	-64	-43.2	174.2	-69	0	0	0	0	111	N114 S121 V122	N114-C118 WeakPolarHBondContact O-CB 3.49Å; N114-C118 PolarHBondContact O-N 2.87Å; N114-C118 PolarHBondContact O-SG 3.28Å; C118-S121 PolarHBondContact O-N 2.78Å; C118-V122 WeakPolarHBondContact O-CG2 3.44Å; C118-V122 PolarHBondContact O-N 2.95Å
119	L	92.5	Very high	91.9	Very high	13 Å²	13	15.6 Å²	15.6	7%	0.068	8%	0.079	C	C	.	.	H	α-helix	trans	-67.7	-42.4	178	-173.8	60.3	0	0	0	111.7	F115 S121 V122 L123 A162 L199 P203	F115-L119 WeakPolarHBondContact O-CB 3.39Å; F115-L119 PolarHBondContact O-N 3.46Å; L119-S121 VanDerWaalsContact C-N 3.27Å; L119-S121 PolarHBondContact O-N 2.88Å; L119-V122 PolarHBondContact O-N 2.98Å; L119-L123 HydrophobicContact CD1-CD1 4.04Å; L119-L123 HydrophobicContact CD1-CD2 4.46Å; L119-L123 HydrophobicContact CD1-CG 3.89Å; L119-L123 HydrophobicContact CD2-CD1 4.24Å; L119-L123 HydrophobicContact CG-CD1 3.75Å; L119-L123 HydrophobicContact CG-CG 4.06Å; L119-L123 VanDerWaalsContact O-CB 3.29Å; L119-L123 WeakPolarHBondContact O-CB 3.39Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.4Å; L119-L123 PolarHBondContact O-N 3.13Å; L119-A162 HydrophobicContact CB-CB 4.38Å; L119-A162 HydrophobicContact CD2-CB 4.46Å; L119-A162 HydrophobicContact CG-CB 4.45Å; L119-L199 HydrophobicContact CB-CD2 4.46Å; L119-L199 HydrophobicContact CD1-CD2 3.89Å; L119-L199 HydrophobicContact CD2-CD2 3.39Å; L119-L199 HydrophobicContact CG-CD2 4.1Å; L119-P203 HydrophobicContact CD1-CG 4.45Å
120	A	95.8	Very high	92.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-58.8	-40.5	175.3	0	0	0	0	0	111.8	A78 L116 F117 S124 W159 A162	A78-A120 HydrophobicContact CB-CB 3.96Å; L116-A120 VanDerWaalsContact O-CB 3.25Å; L116-A120 WeakPolarHBondContact O-CB 3.24Å; L116-A120 PolarHBondContact O-N 3.43Å; F117-A120 PolarHBondContact O-N 2.89Å; A120-S124 VanDerWaalsContact O-CB 3.29Å; A120-S124 WeakPolarHBondContact O-CB 3.32Å; A120-S124 PolarHBondContact O-N 3.16Å; A120-S124 PolarHBondContact O-OG 3.4Å; A120-W159 HydrophobicContact CB-CE3 4.27Å; A120-W159 HydrophobicContact CB-CH2 4.23Å; A120-W159 HydrophobicContact CB-CZ2 4.49Å; A120-W159 HydrophobicContact CB-CZ3 4.1Å; A120-A162 HydrophobicContact CB-CB 3.87Å
121	S	94.3	Very high	92.4	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-62.9	-51	175.8	-174.8	0	0	0	0	111.3	L75 D79 F117 C118 L119 L123 S124 L125	L75-S121 WeakPolarHBondContact CD1-O 3.25Å; L75-S121 WeakPolarHBondContact CD1-OG 3.48Å; D79-S121 WeakPolarHBondContact OD1-CB 3.25Å; D79-S121 PolarHBondContact OD1-OG 2.96Å; F117-S121 VanDerWaalsContact O-CB 3.29Å; F117-S121 WeakPolarHBondContact O-CB 3.4Å; F117-S121 PolarHBondContact O-N 3.28Å; C118-S121 PolarHBondContact O-N 2.78Å; L119-S121 VanDerWaalsContact C-N 3.27Å; L119-S121 PolarHBondContact O-N 2.88Å; S121-L123 PolarHBondContact O-N 3.37Å; S121-S124 WeakPolarHBondContact O-CB 3.44Å; S121-S124 PolarHBondContact O-N 3.07Å; S121-L125 PolarHBondContact O-N 2.94Å
122	V	93.2	Very high	92.7	Very high	8 Å²	8	12.2 Å²	12.2	5%	0.048	7%	0.068	C	C	.	.	H	α-helix	trans	-68	-39.2	-178.9	178.1	0	0	0	0	112.8	C118 L119 S124 L125 C126 P203 F476	C118-V122 WeakPolarHBondContact O-CG2 3.44Å; C118-V122 PolarHBondContact O-N 2.95Å; L119-V122 PolarHBondContact O-N 2.98Å; V122-S124 VanDerWaalsContact C-N 3.3Å; V122-S124 PolarHBondContact O-N 3.47Å; V122-L125 WeakPolarHBondContact O-CB 3.33Å; V122-L125 PolarHBondContact O-N 3.34Å; V122-L125 VanDerWaalsContact O-N 3.16Å; V122-C126 PolarHBondContact O-N 3.07Å; V122-C126 PolarHBondContact O-SG 3.01Å; V122-P203 HydrophobicContact CG1-CB 3.41Å; V122-P203 VanDerWaalsContact CG1-CB 3.41Å; V122-P203 HydrophobicContact CG1-CG 4.17Å; V122-F476 HydrophobicContact CB-CE2 4.39Å; V122-F476 HydrophobicContact CB-CZ 4.48Å; V122-F476 HydrophobicContact CG1-CE1 4.33Å; V122-F476 HydrophobicContact CG1-CE2 4Å; V122-F476 HydrophobicContact CG1-CZ 3.62Å; V122-F476 HydrophobicContact CG2-CD2 4.25Å; V122-F476 HydrophobicContact CG2-CE2 3.45Å; V122-F476 VanDerWaalsContact CG2-CE2 3.45Å; V122-F476 HydrophobicContact CG2-CZ 3.95Å
123	L	94.7	Very high	93.1	Very high	21 Å²	21	15.2 Å²	15.2	11%	0.11	8%	0.078	C	C	.	.	H	α-helix	trans	-67.2	-32.7	173.9	-71.8	178.7	0	0	0	111.7	L119 S121 L125 C126 C127 T158 L161 P203	L119-L123 HydrophobicContact CD1-CD1 4.04Å; L119-L123 HydrophobicContact CD1-CD2 4.46Å; L119-L123 HydrophobicContact CD1-CG 3.89Å; L119-L123 HydrophobicContact CD2-CD1 4.24Å; L119-L123 HydrophobicContact CG-CD1 3.75Å; L119-L123 HydrophobicContact CG-CG 4.06Å; L119-L123 VanDerWaalsContact O-CB 3.29Å; L119-L123 WeakPolarHBondContact O-CB 3.39Å; L119-L123 VanDerWaalsContact O-CG 3.3Å; L119-L123 WeakPolarHBondContact O-CG 3.4Å; L119-L123 PolarHBondContact O-N 3.13Å; S121-L123 PolarHBondContact O-N 3.37Å; L123-L125 VanDerWaalsContact C-N 3.32Å; L123-L125 PolarHBondContact O-N 3.3Å; L123-C126 WeakPolarHBondContact O-CB 3.28Å; L123-C126 PolarHBondContact O-N 2.93Å; L123-C127 PolarHBondContact O-N 3.48Å; L123-C127 PolarHBondContact O-SG 3.49Å; L123-T158 HydrophobicContact CB-CG2 3.51Å; L123-T158 HydrophobicContact CD1-CG2 4.42Å; L123-L161 HydrophobicContact CD1-CB 3.77Å; L123-L161 HydrophobicContact CD1-CD1 4.24Å; L123-P203 HydrophobicContact CD2-CG 4.46Å
124	S	94.2	Very high	93.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.9	-38.7	170.4	-61.8	0	0	0	0	111.2	S74 A120 S121 V122 C127 I128	S74-S124 PolarHBondContact OG-OG 3.13Å; A120-S124 VanDerWaalsContact O-CB 3.29Å; A120-S124 WeakPolarHBondContact O-CB 3.32Å; A120-S124 PolarHBondContact O-N 3.16Å; A120-S124 PolarHBondContact O-OG 3.4Å; S121-S124 WeakPolarHBondContact O-CB 3.44Å; S121-S124 PolarHBondContact O-N 3.07Å; V122-S124 VanDerWaalsContact C-N 3.3Å; V122-S124 PolarHBondContact O-N 3.47Å; S124-C127 WeakPolarHBondContact O-CB 3.48Å; S124-C127 PolarHBondContact O-N 3Å; S124-I128 VanDerWaalsContact O-CG1 3.29Å; S124-I128 WeakPolarHBondContact O-CG1 3.4Å; S124-I128 PolarHBondContact O-N 2.78Å
125	L	93	Very high	93.2	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-64	-37.7	172.1	-67.3	175.8	0	0	0	112.8	L75 S121 V122 L123 C127 I128 S129 I207 V472 F476	L75-L125 HydrophobicContact CD1-CD2 4.37Å; L75-L125 HydrophobicContact CD1-CG 4.25Å; L75-L125 HydrophobicContact CD2-CD2 3.87Å; S121-L125 PolarHBondContact O-N 2.94Å; V122-L125 WeakPolarHBondContact O-CB 3.33Å; V122-L125 PolarHBondContact O-N 3.34Å; V122-L125 VanDerWaalsContact O-N 3.16Å; L123-L125 VanDerWaalsContact C-N 3.32Å; L123-L125 PolarHBondContact O-N 3.3Å; L125-C127 VanDerWaalsContact C-N 3.34Å; L125-I128 HydrophobicContact CD2-CD1 4.28Å; L125-I128 PolarHBondContact O-N 2.99Å; L125-S129 WeakPolarHBondContact O-CB 3.39Å; L125-S129 PolarHBondContact O-N 3.46Å; L125-S129 PolarHBondContact O-OG 3.33Å; L125-I207 HydrophobicContact CB-CD1 4.18Å; L125-V472 HydrophobicContact CD2-CG1 3.47Å; L125-V472 VanDerWaalsContact CD2-CG1 3.47Å; L125-F476 HydrophobicContact CD1-CB 3.95Å; L125-F476 HydrophobicContact CD1-CD2 4.17Å; L125-F476 HydrophobicContact CD1-CG 3.95Å
126	C	95.1	Very high	93.3	Very high	6 Å²	6	14.6 Å²	14.6	4%	0.041	7%	0.073	C	C	.	.	H	α-helix	trans	-60.6	-45.8	172.3	-62.2	0	0	0	0	110.8	V122 L123 S129 I130 I206	V122-C126 PolarHBondContact O-N 3.07Å; V122-C126 PolarHBondContact O-SG 3.01Å; L123-C126 WeakPolarHBondContact O-CB 3.28Å; L123-C126 PolarHBondContact O-N 2.93Å; C126-S129 WeakPolarHBondContact O-CB 3.48Å; C126-S129 PolarHBondContact O-N 3.36Å; C126-I130 WeakPolarHBondContact O-CG1 3.29Å; C126-I130 PolarHBondContact O-N 3.26Å; C126-I206 HydrophobicContact CB-CG2 4.06Å
127	C	95	Very high	93.3	Very high	9 Å²	9	16.4 Å²	16.4	6%	0.061	9%	0.085	C	C	.	.	H	α-helix	trans	-61	-45.6	177.2	-67.2	0	0	0	0	112.4	Y71 L123 S124 L125 S129 I130 D131 M154 T158	Y71-C127 HydrophobicContact CD1-CB 3.44Å; Y71-C127 VanDerWaalsContact CD1-CB 3.44Å; Y71-C127 HydrophobicContact CE1-CB 3.66Å; Y71-C127 HydrophobicContact CG-CB 4.16Å; L123-C127 PolarHBondContact O-N 3.48Å; L123-C127 PolarHBondContact O-SG 3.49Å; S124-C127 WeakPolarHBondContact O-CB 3.48Å; S124-C127 PolarHBondContact O-N 3Å; L125-C127 VanDerWaalsContact C-N 3.34Å; C127-S129 VanDerWaalsContact C-N 3.27Å; C127-S129 PolarHBondContact O-N 3.12Å; C127-I130 PolarHBondContact O-N 3.44Å; C127-D131 WeakPolarHBondContact O-CB 3.42Å; C127-D131 PolarHBondContact O-N 2.95Å; C127-M154 HydrophobicContact CB-CE 3.74Å; C127-T158 PolarHBondContact SG-OG1 2.92Å
128	I	92.1	Very high	93	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.026	10%	0.103	C	C	.	.	H	α-helix	trans	-55.6	-45.2	174.4	-71.8	167	0	0	0	110.6	Y71 I72 L75 S124 L125 D131 R132 M469	Y71-I128 VanDerWaalsContact CB-CG1 3.45Å; Y71-I128 HydrophobicContact CG-CG1 4.34Å; I72-I128 HydrophobicContact CG1-CD1 4.32Å; L75-I128 HydrophobicContact CD2-CD1 4.05Å; S124-I128 VanDerWaalsContact O-CG1 3.29Å; S124-I128 WeakPolarHBondContact O-CG1 3.4Å; S124-I128 PolarHBondContact O-N 2.78Å; L125-I128 HydrophobicContact CD2-CD1 4.28Å; L125-I128 PolarHBondContact O-N 2.99Å; I128-D131 PolarHBondContact O-N 3.06Å; I128-R132 WeakPolarHBondContact O-CG 2.98Å; I128-R132 PolarHBondContact O-N 3.36Å; I128-M469 HydrophobicContact CG2-CE 3.53Å; I128-M469 HydrophobicContact CG2-CG 3.92Å; I128-M469 HydrophobicContact CG2-SD 3.31Å; I128-M469 WeakPolarHBondContact CG2-SD 3.42Å
129	S	93.4	Very high	92.7	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.3	-47.7	-179.4	-54.7	0	0	0	0	111.7	L125 C126 C127 R132 Y133 V210 Y211	L125-S129 WeakPolarHBondContact O-CB 3.39Å; L125-S129 PolarHBondContact O-N 3.46Å; L125-S129 PolarHBondContact O-OG 3.33Å; C126-S129 WeakPolarHBondContact O-CB 3.48Å; C126-S129 PolarHBondContact O-N 3.36Å; C127-S129 VanDerWaalsContact C-N 3.27Å; C127-S129 PolarHBondContact O-N 3.12Å; S129-R132 PolarHBondContact O-N 3.11Å; S129-Y133 PolarHBondContact O-N 2.93Å; S129-Y133 VanDerWaalsContact O-N 3.08Å; S129-V210 VanDerWaalsContact C-CG1 3.46Å; S129-V210 VanDerWaalsContact O-CG1 3.24Å; S129-V210 WeakPolarHBondContact O-CG1 3.33Å; S129-Y211 WeakPolarHBondContact OG-CE2 3.43Å
130	I	94.5	Very high	92.5	Very high	58 Å²	58	21.3 Å²	21.3	30%	0.297	11%	0.107	S	C	.	.	H	α-helix	trans	-63	-46.2	179.3	-68.6	166.4	0	0	0	110.5	C126 C127 R132 Y133 I134 M154 V210	C126-I130 WeakPolarHBondContact O-CG1 3.29Å; C126-I130 PolarHBondContact O-N 3.26Å; C127-I130 PolarHBondContact O-N 3.44Å; I130-R132 VanDerWaalsContact C-N 3.28Å; I130-R132 PolarHBondContact O-N 3.42Å; I130-Y133 WeakPolarHBondContact O-CB 3.18Å; I130-Y133 PolarHBondContact O-N 2.92Å; I130-Y133 VanDerWaalsContact O-N 3.1Å; I130-I134 HydrophobicContact CG2-CD1 4.21Å; I130-I134 WeakPolarHBondContact O-CG1 3.48Å; I130-I134 PolarHBondContact O-N 2.94Å; I130-I134 VanDerWaalsContact O-N 3.1Å; I130-M154 HydrophobicContact CB-CE 3.98Å; I130-M154 HydrophobicContact CD1-CE 4.32Å; I130-M154 HydrophobicContact CG2-CE 3.93Å; I130-V210 HydrophobicContact CG1-CG2 3.92Å
131	D	92.4	Very high	92	Very high	4 Å²	4	27 Å²	27	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-60.8	-38.9	-180	-178.4	77.1	0	0	0	111.9	Y71 C127 I128 I134 A135 Y142 R150	Y71-D131 HydrophobicContact CD2-CB 4.12Å; Y71-D131 HydrophobicContact CE2-CB 3.51Å; Y71-D131 VanDerWaalsContact CE2-CG 3.47Å; C127-D131 WeakPolarHBondContact O-CB 3.42Å; C127-D131 PolarHBondContact O-N 2.95Å; I128-D131 PolarHBondContact O-N 3.06Å; D131-I134 PolarHBondContact O-N 3.42Å; D131-A135 PolarHBondContact O-N 3.16Å; D131-Y142 PolarHBondContact OD2-OH 2.95Å; D131-Y142 VanDerWaalsContact OD2-OH 3.11Å; D131-R150 IonicContact OD1-NE 2.92Å; D131-R150 IonicContact OD1-NH2 3.9Å; D131-R150 PolarHBondContact OD1-NH2 2.9Å
132	R	91.5	Very high	91.6	Very high	7 Å²	7	29.1 Å²	29.1	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-66.1	-37.7	172.5	-73.3	-47.8	92	164.5	17	114.6	D69 I128 S129 I130 I134 A135 V136 Y142 I214 E462 V466 M469	D69-R132 IonicContact OD1-NH2 3.44Å; D69-R132 PolarHBondContact OD1-NH2 3.1Å; D69-R132 IonicContact OD2-CZ 3.22Å; D69-R132 IonicContact OD2-NH2 3.95Å; D69-R132 PolarHBondContact OD2-NH2 3.04Å; I128-R132 WeakPolarHBondContact O-CG 2.98Å; I128-R132 PolarHBondContact O-N 3.36Å; S129-R132 PolarHBondContact O-N 3.11Å; I130-R132 VanDerWaalsContact C-N 3.28Å; I130-R132 PolarHBondContact O-N 3.42Å; R132-I134 PolarHBondContact O-N 3.4Å; R132-A135 PolarHBondContact O-N 2.92Å; R132-V136 WeakPolarHBondContact O-CB 3.36Å; R132-V136 VanDerWaalsContact O-CG2 3.3Å; R132-V136 WeakPolarHBondContact O-CG2 3.22Å; R132-V136 PolarHBondContact O-N 2.93Å; R132-Y142 PolarHBondContact NH2-OH 3.35Å; R132-I214 HydrophobicContact CB-CD1 4.23Å; R132-E462 IonicContact NH1-OE2 3.68Å; R132-E462 PolarHBondContact NH1-OE2 3.42Å; R132-V466 HydrophobicContact CB-CG2 4.4Å; R132-M469 HydrophobicContact CB-SD 4.36Å; R132-M469 WeakPolarHBondContact CD-SD 3.29Å; R132-M469 HydrophobicContact CG-CE 3.91Å; R132-M469 HydrophobicContact CG-SD 2.98Å; R132-M469 WeakPolarHBondContact CG-SD 3.46Å
133	Y	94.2	Very high	90.9	Very high	79 Å²	79	33 Å²	33	31%	0.31	16%	0.162	S	C	.	.	H	α-helix	trans	-57.7	-43.5	174.2	172	-99.3	0	0	0	111	S129 I130 V136 T137 A213 I214	S129-Y133 PolarHBondContact O-N 2.93Å; S129-Y133 VanDerWaalsContact O-N 3.08Å; I130-Y133 WeakPolarHBondContact O-CB 3.18Å; I130-Y133 PolarHBondContact O-N 2.92Å; I130-Y133 VanDerWaalsContact O-N 3.1Å; Y133-V136 PolarHBondContact O-N 3.07Å; Y133-T137 HydrophobicContact CD2-CG2 4.15Å; Y133-T137 HydrophobicContact CE1-CG2 4.26Å; Y133-T137 HydrophobicContact CE2-CG2 3.71Å; Y133-T137 WeakPolarHBondContact O-CB 3.16Å; Y133-T137 WeakPolarHBondContact O-CG2 3.37Å; Y133-T137 PolarHBondContact O-N 3.08Å; Y133-T137 PolarHBondContact O-OG1 3.08Å; Y133-A213 HydrophobicContact CD2-CB 3.81Å; Y133-A213 HydrophobicContact CE2-CB 3.55Å; Y133-I214 HydrophobicContact CD2-CG1 3.99Å; Y133-I214 HydrophobicContact CG-CG1 4.42Å
134	I	92.7	Very high	90.1	Very high	35 Å²	35	42.2 Å²	42.2	18%	0.179	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-48.9	175.5	-60.7	168.1	0	0	0	110.4	I130 D131 R132 V136 T137 Q138 Y142	I130-I134 HydrophobicContact CG2-CD1 4.21Å; I130-I134 WeakPolarHBondContact O-CG1 3.48Å; I130-I134 PolarHBondContact O-N 2.94Å; I130-I134 VanDerWaalsContact O-N 3.1Å; D131-I134 PolarHBondContact O-N 3.42Å; R132-I134 PolarHBondContact O-N 3.4Å; I134-V136 VanDerWaalsContact C-N 3.32Å; I134-V136 PolarHBondContact O-N 3.37Å; I134-T137 PolarHBondContact O-N 3.3Å; I134-T137 PolarHBondContact O-OG1 2.62Å; I134-T137 VanDerWaalsContact O-OG1 3.09Å; I134-Q138 PolarHBondContact O-N 3.41Å; I134-Y142 HydrophobicContact CG2-CD2 4.23Å
135	A	90.9	Very high	89.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.8	-40.1	-179.7	0	0	0	0	0	113.2	D131 R132 P139 Y142 E462	D131-A135 PolarHBondContact O-N 3.16Å; R132-A135 PolarHBondContact O-N 2.92Å; A135-P139 WeakPolarHBondContact O-CA 3.45Å; A135-Y142 HydrophobicContact CB-CD1 4.06Å; A135-Y142 HydrophobicContact CB-CD2 3.99Å; A135-Y142 HydrophobicContact CB-CE1 4.14Å; A135-Y142 HydrophobicContact CB-CE2 4.04Å; A135-Y142 HydrophobicContact CB-CG 4Å; A135-E462 HydrophobicContact CB-CG 4.3Å
136	V	91	Very high	88.1	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-73.2	-37.1	179.1	171.5	0	0	0	0	112.3	R132 Y133 I134 A217 I218 F459 E462 V466	R132-V136 WeakPolarHBondContact O-CB 3.36Å; R132-V136 VanDerWaalsContact O-CG2 3.3Å; R132-V136 WeakPolarHBondContact O-CG2 3.22Å; R132-V136 PolarHBondContact O-N 2.93Å; Y133-V136 PolarHBondContact O-N 3.07Å; I134-V136 VanDerWaalsContact C-N 3.32Å; I134-V136 PolarHBondContact O-N 3.37Å; V136-A217 HydrophobicContact CG1-CB 4.32Å; V136-I218 HydrophobicContact CG1-CG1 3.99Å; V136-F459 HydrophobicContact CG1-CE2 3.88Å; V136-E462 HydrophobicContact CG2-CB 4.44Å; V136-V466 HydrophobicContact CG2-CG2 3.47Å; V136-V466 VanDerWaalsContact CG2-CG2 3.47Å
137	T	91.5	Very high	87.5	Confident	52 Å²	52	55.4 Å²	55.4	32%	0.319	26%	0.26	S	S	.	.	H	α-helix	trans	-78	-25.2	-178.7	51.4	0	0	0	0	112.7	Y133 I134 A217	Y133-T137 HydrophobicContact CD2-CG2 4.15Å; Y133-T137 HydrophobicContact CE1-CG2 4.26Å; Y133-T137 HydrophobicContact CE2-CG2 3.71Å; Y133-T137 WeakPolarHBondContact O-CB 3.16Å; Y133-T137 WeakPolarHBondContact O-CG2 3.37Å; Y133-T137 PolarHBondContact O-N 3.08Å; Y133-T137 PolarHBondContact O-OG1 3.08Å; I134-T137 PolarHBondContact O-N 3.3Å; I134-T137 PolarHBondContact O-OG1 2.62Å; I134-T137 VanDerWaalsContact O-OG1 3.09Å; T137-A217 HydrophobicContact CG2-CB 3.86Å
138	Q	89.2	Confident	87	Confident	93 Å²	93	60.8 Å²	60.8	44%	0.435	28%	0.28	S	S	.	.			trans	-136.3	59.4	-175.6	-61.6	-179.7	-18.7	0	0	113	I134 L140 Q141 Y142	I134-Q138 PolarHBondContact O-N 3.41Å; Q138-L140 VanDerWaalsContact C-N 3.32Å; Q138-L140 PolarHBondContact O-N 3.22Å; Q138-Q141 HydrophobicContact CB-CB 4.34Å; Q138-Q141 PolarHBondContact O-N 3.28Å; Q138-Y142 VanDerWaalsContact O-CB 3.26Å; Q138-Y142 WeakPolarHBondContact O-CB 3.47Å; Q138-Y142 PolarHBondContact O-N 3.42Å
139	P	86.6	Confident	86.9	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-33.9	-167.6	24.2	-35.1	0	0	0	114.4	A135 N143 Y455 T458 F459	A135-P139 WeakPolarHBondContact O-CA 3.45Å; P139-N143 PolarHBondContact O-ND2 3.1Å; P139-N143 VanDerWaalsContact O-ND2 3.1Å; P139-Y455 HydrophobicContact CG-CD2 3.7Å; P139-Y455 HydrophobicContact CG-CE1 4.15Å; P139-Y455 HydrophobicContact CG-CE2 3.27Å; P139-Y455 HydrophobicContact CG-CG 4.33Å; P139-T458 HydrophobicContact CB-CG2 3.86Å; P139-T458 VanDerWaalsContact O-CG2 3.3Å; P139-T458 WeakPolarHBondContact O-CG2 3.2Å; P139-F459 HydrophobicContact CG-CB 4.48Å
140	L	87	Confident	86.8	Confident	61 Å²	61	70.3 Å²	70.3	32%	0.319	32%	0.322	S	S	.	.	H	α-helix	trans	-79	-42.8	179	-65.1	-178.8	0	0	0	112.4	Q138 N143 R144 R454 Y455	Q138-L140 VanDerWaalsContact C-N 3.32Å; Q138-L140 PolarHBondContact O-N 3.22Å; L140-N143 PolarHBondContact O-N 3.1Å; L140-R144 VanDerWaalsContact O-CB 3.25Å; L140-R144 WeakPolarHBondContact O-CB 3.27Å; L140-R144 PolarHBondContact O-N 3.31Å; L140-R144 VanDerWaalsContact O-N 3.08Å; L140-R454 HydrophobicContact CD2-CB 4.43Å; L140-R454 HydrophobicContact CD2-CG 3.85Å; L140-Y455 HydrophobicContact CD1-CD2 4.02Å; L140-Y455 HydrophobicContact CG-CD2 3.98Å
141	Q	86.2	Confident	86.7	Confident	120 Å²	120	68.2 Å²	68.2	56%	0.561	31%	0.312	S	S	*	.	H	α-helix	trans	-71.5	-39.5	-177.6	-68.1	174.3	-10.1	0	0	111.2	Q138 N143 R144 T145	Q138-Q141 HydrophobicContact CB-CB 4.34Å; Q138-Q141 PolarHBondContact O-N 3.28Å; Q141-N143 PolarHBondContact O-N 3.1Å; Q141-R144 PolarHBondContact O-N 2.93Å; Q141-R144 VanDerWaalsContact O-N 3.08Å; Q141-T145 PolarHBondContact O-N 3.49Å
142	Y	85.6	Confident	86.7	Confident	47 Å²	47	74 Å²	74	18%	0.184	34%	0.337	C	S	.	.	H	α-helix	trans	-53.9	-40	176.1	-176.6	-93.9	0	0	0	112.4	D131 R132 I134 A135 Q138	D131-Y142 PolarHBondContact OD2-OH 2.95Å; D131-Y142 VanDerWaalsContact OD2-OH 3.11Å; R132-Y142 PolarHBondContact NH2-OH 3.35Å; I134-Y142 HydrophobicContact CG2-CD2 4.23Å; A135-Y142 HydrophobicContact CB-CD1 4.06Å; A135-Y142 HydrophobicContact CB-CD2 3.99Å; A135-Y142 HydrophobicContact CB-CE1 4.14Å; A135-Y142 HydrophobicContact CB-CE2 4.04Å; A135-Y142 HydrophobicContact CB-CG 4Å; Q138-Y142 VanDerWaalsContact O-CB 3.26Å; Q138-Y142 WeakPolarHBondContact O-CB 3.47Å; Q138-Y142 PolarHBondContact O-N 3.42Å
143	N	77.6	Confident	86.9	Confident	88 Å²	88	76.2 Å²	76.2	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-89.3	-16.6	179.4	-73	-51	0	0	0	114.1	P139 L140 Q141 T458	P139-N143 PolarHBondContact O-ND2 3.1Å; P139-N143 VanDerWaalsContact O-ND2 3.1Å; L140-N143 PolarHBondContact O-N 3.1Å; Q141-N143 PolarHBondContact O-N 3.1Å; N143-T458 WeakPolarHBondContact ND2-CG2 3.37Å
144	R	78.2	Confident	87	Confident	215 Å²	215	74.2 Å²	74.2	81%	0.811	35%	0.348	S	S	*	.	H	α-helix	trans	-79.9	-40.4	-174.8	-175	175.8	-178.3	170.7	0.1	112.3	L140 Q141	L140-R144 VanDerWaalsContact O-CB 3.25Å; L140-R144 WeakPolarHBondContact O-CB 3.27Å; L140-R144 PolarHBondContact O-N 3.31Å; L140-R144 VanDerWaalsContact O-N 3.08Å; Q141-R144 PolarHBondContact O-N 2.93Å; Q141-R144 VanDerWaalsContact O-N 3.08Å
145	T	74.6	Confident	87.2	Confident	97 Å²	97	73.7 Å²	73.7	60%	0.595	35%	0.345	S	S	*	.	S	Bend	trans	-125	116.3	179.3	51.5	0	0	0	0	109.3	Q141 D147	Q141-T145 PolarHBondContact O-N 3.49Å; T145-D147 PolarHBondContact O-N 3.1Å
146	R	71	Confident	87.4	Confident	118 Å²	118	78 Å²	78	45%	0.445	37%	0.367	S	S	.	.			trans	-77.7	96.3	177.3	-167.2	161.4	166.1	95	-3.7	109.2	L66 Y148	L66-R146 PolarHBondContact O-NH1 3.27Å; L66-R146 PolarHBondContact O-NH2 3.25Å; R146-Y148 HydrophobicContact CB-CE2 4.19Å; R146-Y148 WeakPolarHBondContact CD-OH 3.38Å; R146-Y148 HydrophobicContact CG-CD1 4.45Å; R146-Y148 HydrophobicContact CG-CD2 4.49Å; R146-Y148 HydrophobicContact CG-CE1 3.84Å; R146-Y148 HydrophobicContact CG-CE2 3.88Å; R146-Y148 VanDerWaalsContact NE-CZ 3.31Å; R146-Y148 PolarHBondContact NE-OH 3.11Å; R146-Y148 WeakPolarHBondContact O-CD2 3.39Å
147	D	82.7	Confident	87.7	Confident	69 Å²	69	79.1 Å²	79.1	37%	0.369	38%	0.38	S	S	.	.			trans	-81.7	112.4	174.6	172.7	18.1	0	0	0	110.1	T145 H149 R150 P151	T145-D147 PolarHBondContact O-N 3.1Å; D147-H149 PolarHBondContact OD1-N 3.36Å; D147-R150 PolarHBondContact OD1-N 3.08Å; D147-R150 WeakPolarHBondContact OD2-CB 3.37Å; D147-R150 IonicContact OD2-CZ 2.68Å; D147-R150 IonicContact OD2-NH1 3.43Å; D147-R150 PolarHBondContact OD2-NH1 2.94Å; D147-P151 VanDerWaalsContact O-CD 3.29Å; D147-P151 WeakPolarHBondContact O-CD 3.29Å
148	Y	84.6	Confident	88	Confident	123 Å²	123	76.9 Å²	76.9	48%	0.482	37%	0.367	S	S	.	.			trans	-92.8	-18	176.9	-62.2	-78.5	0	0	0	113	M70 R146 P151 F152	M70-Y148 HydrophobicContact CE-CD1 3.98Å; M70-Y148 HydrophobicContact CE-CE1 4.5Å; R146-Y148 HydrophobicContact CB-CE2 4.19Å; R146-Y148 WeakPolarHBondContact CD-OH 3.38Å; R146-Y148 HydrophobicContact CG-CD1 4.45Å; R146-Y148 HydrophobicContact CG-CD2 4.49Å; R146-Y148 HydrophobicContact CG-CE1 3.84Å; R146-Y148 HydrophobicContact CG-CE2 3.88Å; R146-Y148 VanDerWaalsContact NE-CZ 3.31Å; R146-Y148 PolarHBondContact NE-OH 3.11Å; R146-Y148 WeakPolarHBondContact O-CD2 3.39Å; Y148-P151 WeakPolarHBondContact O-CD 3.49Å; Y148-P151 WeakPolarHBondContact O-CG 3.37Å; Y148-F152 VanDerWaalsContact O-CB 3.31Å; Y148-F152 WeakPolarHBondContact O-CB 3.34Å; Y148-F152 PolarHBondContact O-N 2.93Å
149	H	90.1	Very high	88.4	Confident	141 Å²	141	75 Å²	75	65%	0.653	36%	0.355	S	S	*	.	H	α-helix	trans	-74.5	-39.2	-172.6	-153.3	-75.8	0	0	0	111.1	D147 S153	D147-H149 PolarHBondContact OD1-N 3.36Å; H149-S153 PolarHBondContact ND1-OG 3.49Å; H149-S153 WeakPolarHBondContact O-CB 3.36Å; H149-S153 PolarHBondContact O-N 3.4Å; H149-S153 PolarHBondContact O-OG 3.45Å
150	R	91.2	Very high	88.8	Confident	64 Å²	64	79.4 Å²	79.4	24%	0.242	38%	0.379	C	S	.	.	H	α-helix	trans	-59.3	-58.7	175	-179.9	-178.3	76.7	-113.9	7.7	113.2	D131 D147 F152 S153 M154	D131-R150 IonicContact OD1-NE 2.92Å; D131-R150 IonicContact OD1-NH2 3.9Å; D131-R150 PolarHBondContact OD1-NH2 2.9Å; D147-R150 PolarHBondContact OD1-N 3.08Å; D147-R150 WeakPolarHBondContact OD2-CB 3.37Å; D147-R150 IonicContact OD2-CZ 2.68Å; D147-R150 IonicContact OD2-NH1 3.43Å; D147-R150 PolarHBondContact OD2-NH1 2.94Å; R150-F152 VanDerWaalsContact C-N 3.28Å; R150-F152 PolarHBondContact O-N 3.25Å; R150-S153 PolarHBondContact O-N 3.5Å; R150-M154 HydrophobicContact CG-CG 4.46Å; R150-M154 HydrophobicContact CG-SD 3.7Å; R150-M154 WeakPolarHBondContact O-CG 3.31Å; R150-M154 PolarHBondContact O-N 3.42Å
151	P	92.1	Very high	89.2	Confident	13 Å²	13	81.2 Å²	81.2	8%	0.084	39%	0.388	C	S	.	.	H	α-helix	trans	-60.4	-39.1	-179.6	22.4	-32.9	0	0	0	112.3	M70 Y71 D147 Y148 S153 M154 L155	M70-P151 HydrophobicContact SD-CB 4.09Å; M70-P151 HydrophobicContact SD-CG 4.19Å; Y71-P151 HydrophobicContact CE1-CB 4.11Å; Y71-P151 HydrophobicContact CE2-CB 4.25Å; Y71-P151 VanDerWaalsContact OH-CA 3.25Å; Y71-P151 WeakPolarHBondContact OH-CA 3.3Å; Y71-P151 WeakPolarHBondContact OH-CB 3.35Å; D147-P151 VanDerWaalsContact O-CD 3.29Å; D147-P151 WeakPolarHBondContact O-CD 3.29Å; Y148-P151 WeakPolarHBondContact O-CD 3.49Å; Y148-P151 WeakPolarHBondContact O-CG 3.37Å; P151-S153 PolarHBondContact O-N 3.38Å; P151-M154 PolarHBondContact O-N 2.88Å; P151-L155 VanDerWaalsContact O-CB 3.32Å; P151-L155 WeakPolarHBondContact O-CB 3.29Å; P151-L155 VanDerWaalsContact O-CG 3.24Å; P151-L155 WeakPolarHBondContact O-CG 3.44Å; P151-L155 PolarHBondContact O-N 3.41Å
152	F	93.2	Very high	89.5	Confident	126 Å²	126	75.5 Å²	75.5	55%	0.553	36%	0.361	S	S	*	.	H	α-helix	trans	-59.4	-48	175.2	-178.6	-98	0	0	0	112.2	Y148 R150 L155 L156	Y148-F152 VanDerWaalsContact O-CB 3.31Å; Y148-F152 WeakPolarHBondContact O-CB 3.34Å; Y148-F152 PolarHBondContact O-N 2.93Å; R150-F152 VanDerWaalsContact C-N 3.28Å; R150-F152 PolarHBondContact O-N 3.25Å; F152-L155 PolarHBondContact O-N 3.29Å; F152-L156 HydrophobicContact CE1-CD2 4.23Å; F152-L156 VanDerWaalsContact O-CB 3.28Å; F152-L156 WeakPolarHBondContact O-CB 3.44Å; F152-L156 PolarHBondContact O-N 2.95Å
153	S	95.5	Very high	89.9	Confident	54 Å²	54	78.4 Å²	78.4	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-65.4	-42.6	-179	-55.3	0	0	0	0	112.2	H149 R150 P151 L156 G157	H149-S153 PolarHBondContact ND1-OG 3.49Å; H149-S153 WeakPolarHBondContact O-CB 3.36Å; H149-S153 PolarHBondContact O-N 3.4Å; H149-S153 PolarHBondContact O-OG 3.45Å; R150-S153 PolarHBondContact O-N 3.5Å; P151-S153 PolarHBondContact O-N 3.38Å; S153-L156 PolarHBondContact O-N 3.44Å; S153-G157 PolarHBondContact O-N 2.98Å
154	M	95.8	Very high	90.5	Very high	37 Å²	37	79.3 Å²	79.3	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-64.6	-41.1	177.8	-71.7	174.6	63.5	0	0	111.9	Y71 C127 I130 R150 P151 T158	Y71-M154 HydrophobicContact CE1-CB 4.03Å; Y71-M154 HydrophobicContact CE1-CE 4.16Å; Y71-M154 HydrophobicContact CE1-SD 4.39Å; Y71-M154 PolarHBondContact OH-SD 2.84Å; C127-M154 HydrophobicContact CB-CE 3.74Å; I130-M154 HydrophobicContact CB-CE 3.98Å; I130-M154 HydrophobicContact CD1-CE 4.32Å; I130-M154 HydrophobicContact CG2-CE 3.93Å; R150-M154 HydrophobicContact CG-CG 4.46Å; R150-M154 HydrophobicContact CG-SD 3.7Å; R150-M154 WeakPolarHBondContact O-CG 3.31Å; R150-M154 PolarHBondContact O-N 3.42Å; P151-M154 PolarHBondContact O-N 2.88Å; M154-T158 WeakPolarHBondContact O-CB 3.47Å; M154-T158 PolarHBondContact O-N 3.3Å; M154-T158 PolarHBondContact O-OG1 3.33Å
155	L	96	Very high	90.9	Very high	23 Å²	23	69.1 Å²	69.1	12%	0.12	34%	0.341	C	S	.	.	H	α-helix	trans	-71	-41.6	176.9	-71.3	179.9	0	0	0	112.2	M70 Y71 S74 P151 F152 G157 T158 W159	M70-L155 HydrophobicContact CB-CD1 3.68Å; Y71-L155 HydrophobicContact CD1-CD1 4.36Å; Y71-L155 HydrophobicContact CD1-CD2 3.65Å; Y71-L155 HydrophobicContact CD1-CG 3.89Å; Y71-L155 HydrophobicContact CE1-CD2 4.28Å; Y71-L155 HydrophobicContact CE1-CG 4.11Å; S74-L155 VanDerWaalsContact CB-CD2 3.49Å; S74-L155 WeakPolarHBondContact OG-CD2 3.31Å; P151-L155 VanDerWaalsContact O-CB 3.32Å; P151-L155 WeakPolarHBondContact O-CB 3.29Å; P151-L155 VanDerWaalsContact O-CG 3.24Å; P151-L155 WeakPolarHBondContact O-CG 3.44Å; P151-L155 PolarHBondContact O-N 3.41Å; F152-L155 PolarHBondContact O-N 3.29Å; L155-G157 VanDerWaalsContact C-N 3.32Å; L155-G157 PolarHBondContact O-N 3.38Å; L155-T158 WeakPolarHBondContact O-CB 3.34Å; L155-T158 PolarHBondContact O-N 2.91Å; L155-T158 VanDerWaalsContact O-N 3.17Å; L155-W159 VanDerWaalsContact O-CD1 3.25Å; L155-W159 PolarHBondContact O-N 2.99Å
156	L	96.6	Very high	91.3	Very high	90 Å²	90	67.2 Å²	67.2	47%	0.471	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-47.8	173.8	-179.8	61.1	0	0	0	110.6	F152 S153 T158 W159 L160	F152-L156 HydrophobicContact CE1-CD2 4.23Å; F152-L156 VanDerWaalsContact O-CB 3.28Å; F152-L156 WeakPolarHBondContact O-CB 3.44Å; F152-L156 PolarHBondContact O-N 2.95Å; S153-L156 PolarHBondContact O-N 3.44Å; L156-T158 VanDerWaalsContact C-N 3.35Å; L156-T158 PolarHBondContact O-N 3.14Å; L156-W159 PolarHBondContact O-N 2.9Å; L156-L160 HydrophobicContact CD1-CD1 4.1Å; L156-L160 HydrophobicContact CD1-CG 4.2Å; L156-L160 HydrophobicContact CG-CD1 3.94Å; L156-L160 HydrophobicContact CG-CG 4.45Å; L156-L160 WeakPolarHBondContact O-CB 3.33Å; L156-L160 WeakPolarHBondContact O-CG 3.41Å; L156-L160 PolarHBondContact O-N 2.95Å
157	G	97.1	Very high	91.5	Very high	29 Å²	29	63.7 Å²	63.7	30%	0.299	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-41.3	174.7	0	0	0	0	0	113.2	S153 L155 L160 L161	S153-G157 PolarHBondContact O-N 2.98Å; L155-G157 VanDerWaalsContact C-N 3.32Å; L155-G157 PolarHBondContact O-N 3.38Å; G157-L160 PolarHBondContact O-N 2.71Å; G157-L161 WeakPolarHBondContact O-CB 3.42Å; G157-L161 VanDerWaalsContact O-CG 3.27Å; G157-L161 WeakPolarHBondContact O-CG 3.39Å; G157-L161 PolarHBondContact O-N 2.85Å
158	T	96.5	Very high	91	Very high	6 Å²	6	61.1 Å²	61.1	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-51.4	176.9	-68.9	0	0	0	0	111.8	L123 C127 M154 L155 L156 A162	L123-T158 HydrophobicContact CB-CG2 3.51Å; L123-T158 HydrophobicContact CD1-CG2 4.42Å; C127-T158 PolarHBondContact SG-OG1 2.92Å; M154-T158 WeakPolarHBondContact O-CB 3.47Å; M154-T158 PolarHBondContact O-N 3.3Å; M154-T158 PolarHBondContact O-OG1 3.33Å; L155-T158 WeakPolarHBondContact O-CB 3.34Å; L155-T158 PolarHBondContact O-N 2.91Å; L155-T158 VanDerWaalsContact O-N 3.17Å; L156-T158 VanDerWaalsContact C-N 3.35Å; L156-T158 PolarHBondContact O-N 3.14Å; T158-A162 WeakPolarHBondContact O-CB 3.34Å; T158-A162 PolarHBondContact O-N 3.37Å
159	W	97.6	Very high	90.1	Very high	52 Å²	52	55.3 Å²	55.3	20%	0.197	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-41.3	-180	-76.3	97.2	0	0	0	111.7	S74 V77 A78 A120 L155 L156 L161 A162 F163	S74-W159 PolarHBondContact OG-NE1 3.04Å; V77-W159 HydrophobicContact CB-CZ2 4.5Å; V77-W159 HydrophobicContact CG1-CH2 4.11Å; V77-W159 HydrophobicContact CG1-CZ2 4.07Å; A78-W159 HydrophobicContact CB-CH2 4.23Å; A78-W159 HydrophobicContact CB-CZ2 4.44Å; A120-W159 HydrophobicContact CB-CE3 4.27Å; A120-W159 HydrophobicContact CB-CH2 4.23Å; A120-W159 HydrophobicContact CB-CZ2 4.49Å; A120-W159 HydrophobicContact CB-CZ3 4.1Å; L155-W159 VanDerWaalsContact O-CD1 3.25Å; L155-W159 PolarHBondContact O-N 2.99Å; L156-W159 PolarHBondContact O-N 2.9Å; W159-L161 PolarHBondContact O-N 3.4Å; W159-A162 CarbonylContact O-C 3.58Å; W159-A162 PolarHBondContact O-N 3.07Å; W159-F163 HydrophobicContact CB-CD2 4.36Å; W159-F163 HydrophobicContact CB-CE2 4.4Å; W159-F163 AromaticContact CE3-CE2 3.88Å; W159-F163 HydrophobicContact CE3-CE2 3.88Å; W159-F163 HydrophobicContact CE3-CZ 4.49Å; W159-F163 WeakPolarHBondContact O-CB 3.19Å; W159-F163 WeakPolarHBondContact O-CD2 3.43Å; W159-F163 PolarHBondContact O-N 3.27Å
160	L	96.2	Very high	89.1	Confident	95 Å²	95	56.4 Å²	56.4	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-59	-46.2	175.9	-72.6	174.9	0	0	0	112.1	L156 G157 A162 F163 I164	L156-L160 HydrophobicContact CD1-CD1 4.1Å; L156-L160 HydrophobicContact CD1-CG 4.2Å; L156-L160 HydrophobicContact CG-CD1 3.94Å; L156-L160 HydrophobicContact CG-CG 4.45Å; L156-L160 WeakPolarHBondContact O-CB 3.33Å; L156-L160 WeakPolarHBondContact O-CG 3.41Å; L156-L160 PolarHBondContact O-N 2.95Å; G157-L160 PolarHBondContact O-N 2.71Å; L160-A162 VanDerWaalsContact C-N 3.32Å; L160-A162 PolarHBondContact O-N 3.49Å; L160-F163 PolarHBondContact O-N 3.18Å; L160-I164 WeakPolarHBondContact O-CB 3.22Å; L160-I164 WeakPolarHBondContact O-CD1 3.5Å; L160-I164 WeakPolarHBondContact O-CG1 3.49Å; L160-I164 PolarHBondContact O-N 2.94Å
161	L	94	Very high	87.8	Confident	99 Å²	99	57.9 Å²	57.9	52%	0.518	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-39.8	176.2	-72.3	171.5	0	0	0	111.9	L123 G157 W159 I164 S165	L123-L161 HydrophobicContact CD1-CB 3.77Å; L123-L161 HydrophobicContact CD1-CD1 4.24Å; G157-L161 WeakPolarHBondContact O-CB 3.42Å; G157-L161 VanDerWaalsContact O-CG 3.27Å; G157-L161 WeakPolarHBondContact O-CG 3.39Å; G157-L161 PolarHBondContact O-N 2.85Å; W159-L161 PolarHBondContact O-N 3.4Å; L161-I164 PolarHBondContact O-N 3.48Å; L161-S165 PolarHBondContact O-N 2.96Å; L161-S165 VanDerWaalsContact O-N 3.11Å
162	A	94.5	Very high	86.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-41.8	175.5	0	0	0	0	0	112.2	L116 L119 A120 T158 W159 L160 S165	L116-A162 VanDerWaalsContact CD1-C 3.44Å; L116-A162 HydrophobicContact CD1-CB 3.79Å; L116-A162 WeakPolarHBondContact CD1-O 3.44Å; L119-A162 HydrophobicContact CB-CB 4.38Å; L119-A162 HydrophobicContact CD2-CB 4.46Å; L119-A162 HydrophobicContact CG-CB 4.45Å; A120-A162 HydrophobicContact CB-CB 3.87Å; T158-A162 WeakPolarHBondContact O-CB 3.34Å; T158-A162 PolarHBondContact O-N 3.37Å; W159-A162 CarbonylContact O-C 3.58Å; W159-A162 PolarHBondContact O-N 3.07Å; L160-A162 VanDerWaalsContact C-N 3.32Å; L160-A162 PolarHBondContact O-N 3.49Å; A162-S165 WeakPolarHBondContact O-CB 3.43Å; A162-S165 PolarHBondContact O-N 3.3Å; A162-S165 VanDerWaalsContact O-N 3.15Å; A162-S165 PolarHBondContact O-OG 2.96Å
163	F	93.5	Very high	84.5	Confident	108 Å²	108	56.3 Å²	56.3	47%	0.474	30%	0.298	S	S	.	.	H	α-helix	trans	-65.9	-38.9	174.3	-83.5	-70.4	0	0	0	112.2	L116 W159 L160 S165 I166	L116-F163 HydrophobicContact CD1-CD1 3.96Å; L116-F163 HydrophobicContact CD1-CD2 4.37Å; L116-F163 HydrophobicContact CD1-CE1 4.14Å; L116-F163 HydrophobicContact CD1-CG 4.04Å; L116-F163 HydrophobicContact CD1-CZ 4.42Å; L116-F163 HydrophobicContact CD2-CD1 4.49Å; L116-F163 HydrophobicContact CD2-CE1 4.07Å; W159-F163 HydrophobicContact CB-CD2 4.36Å; W159-F163 HydrophobicContact CB-CE2 4.4Å; W159-F163 AromaticContact CE3-CE2 3.88Å; W159-F163 HydrophobicContact CE3-CE2 3.88Å; W159-F163 HydrophobicContact CE3-CZ 4.49Å; W159-F163 WeakPolarHBondContact O-CB 3.19Å; W159-F163 WeakPolarHBondContact O-CD2 3.43Å; W159-F163 PolarHBondContact O-N 3.27Å; L160-F163 PolarHBondContact O-N 3.18Å; F163-S165 PolarHBondContact O-N 3.34Å; F163-I166 HydrophobicContact CD1-CD1 3.48Å; F163-I166 VanDerWaalsContact CD1-CD1 3.48Å; F163-I166 HydrophobicContact CE1-CD1 4.07Å; F163-I166 HydrophobicContact CG-CD1 4.41Å; F163-I166 WeakPolarHBondContact O-CB 3.37Å; F163-I166 WeakPolarHBondContact O-CG1 3.34Å; F163-I166 PolarHBondContact O-N 2.81Å
164	I	89.9	Confident	82.4	Confident	106 Å²	106	62.4 Å²	62.4	54%	0.544	32%	0.319	S	S	.	.	H	α-helix	trans	-60.3	-33.1	173.6	-70.3	162.8	0	0	0	110.5	L160 L161 I166 A167	L160-I164 WeakPolarHBondContact O-CB 3.22Å; L160-I164 WeakPolarHBondContact O-CD1 3.5Å; L160-I164 WeakPolarHBondContact O-CG1 3.49Å; L160-I164 PolarHBondContact O-N 2.94Å; L161-I164 PolarHBondContact O-N 3.48Å; I164-I166 PolarHBondContact O-N 2.97Å; I164-A167 WeakPolarHBondContact O-CB 3.48Å; I164-A167 PolarHBondContact O-N 3.22Å
165	S	85.3	Confident	80.2	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.014	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-20.7	176.3	86.2	0	0	0	0	114	L161 A162 F163 A167 L168	L161-S165 PolarHBondContact O-N 2.96Å; L161-S165 VanDerWaalsContact O-N 3.11Å; A162-S165 WeakPolarHBondContact O-CB 3.43Å; A162-S165 PolarHBondContact O-N 3.3Å; A162-S165 VanDerWaalsContact O-N 3.15Å; A162-S165 PolarHBondContact O-OG 2.96Å; F163-S165 PolarHBondContact O-N 3.34Å; S165-A167 PolarHBondContact O-N 3.11Å; S165-L168 VanDerWaalsContact O-CB 3.24Å; S165-L168 WeakPolarHBondContact O-CB 3.33Å; S165-L168 WeakPolarHBondContact O-CD1 3.4Å; S165-L168 VanDerWaalsContact O-CG 3.22Å; S165-L168 WeakPolarHBondContact O-CG 3.22Å; S165-L168 PolarHBondContact O-N 2.92Å; S165-L168 VanDerWaalsContact O-N 3.09Å
166	I	84	Confident	78.2	Confident	56 Å²	56	63.7 Å²	63.7	29%	0.287	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-32.3	172.5	-60.6	175.2	0	0	0	111.1	L116 F163 I164 L168 P169	L116-I166 HydrophobicContact CB-CD1 4.32Å; L116-I166 HydrophobicContact CB-CG1 4.01Å; L116-I166 HydrophobicContact CD1-CD1 4.05Å; L116-I166 HydrophobicContact CD1-CG1 4.27Å; L116-I166 HydrophobicContact CD2-CD1 3.84Å; L116-I166 HydrophobicContact CD2-CG1 4.45Å; L116-I166 HydrophobicContact CG-CD1 4.28Å; L116-I166 HydrophobicContact CG-CG1 4.47Å; F163-I166 HydrophobicContact CD1-CD1 3.48Å; F163-I166 VanDerWaalsContact CD1-CD1 3.48Å; F163-I166 HydrophobicContact CE1-CD1 4.07Å; F163-I166 HydrophobicContact CG-CD1 4.41Å; F163-I166 WeakPolarHBondContact O-CB 3.37Å; F163-I166 WeakPolarHBondContact O-CG1 3.34Å; F163-I166 PolarHBondContact O-N 2.81Å; I164-I166 PolarHBondContact O-N 2.97Å; I166-L168 PolarHBondContact O-N 3.04Å; I166-L168 VanDerWaalsContact O-N 3.16Å; I166-P169 VanDerWaalsContact O-CD 3.31Å; I166-P169 WeakPolarHBondContact O-CD 3.31Å
167	A	76.2	Confident	76.2	Confident	45 Å²	45	64.2 Å²	64.2	37%	0.372	32%	0.324	S	S	.	.	H	α-helix	trans	-65.8	-16.8	177.8	0	0	0	0	0	111.7	I164 S165 Y170 V171	I164-A167 WeakPolarHBondContact O-CB 3.48Å; I164-A167 PolarHBondContact O-N 3.22Å; S165-A167 PolarHBondContact O-N 3.11Å; A167-Y170 PolarHBondContact O-N 3.3Å; A167-V171 HydrophobicContact CB-CG2 4.41Å; A167-V171 WeakPolarHBondContact O-CB 3.1Å; A167-V171 VanDerWaalsContact O-CG2 3.31Å; A167-V171 WeakPolarHBondContact O-CG2 3.41Å; A167-V171 PolarHBondContact O-N 3.37Å
168	L	70.8	Confident	74.2	Confident	15 Å²	15	64 Å²	64	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-67	-53.2	-174.4	-55.8	165.8	0	0	0	112.5	S165 I166 Y170 F172 F191 Y194 L199	S165-L168 VanDerWaalsContact O-CB 3.24Å; S165-L168 WeakPolarHBondContact O-CB 3.33Å; S165-L168 WeakPolarHBondContact O-CD1 3.4Å; S165-L168 VanDerWaalsContact O-CG 3.22Å; S165-L168 WeakPolarHBondContact O-CG 3.22Å; S165-L168 PolarHBondContact O-N 2.92Å; S165-L168 VanDerWaalsContact O-N 3.09Å; I166-L168 PolarHBondContact O-N 3.04Å; I166-L168 VanDerWaalsContact O-N 3.16Å; L168-Y170 PolarHBondContact O-N 3.46Å; L168-F172 HydrophobicContact CD2-CE2 4.15Å; L168-F172 WeakPolarHBondContact O-CB 3.33Å; L168-F172 VanDerWaalsContact O-CD2 3.23Å; L168-F172 WeakPolarHBondContact O-CD2 3.45Å; L168-F172 PolarHBondContact O-N 3.27Å; L168-F191 HydrophobicContact CB-CE2 4.27Å; L168-Y194 HydrophobicContact CD1-CD1 4.23Å; L168-Y194 HydrophobicContact CD1-CE1 3.31Å; L168-Y194 HydrophobicContact CD2-CD1 3.99Å; L168-Y194 HydrophobicContact CD2-CE1 3.24Å; L168-Y194 HydrophobicContact CD2-CE2 4.22Å; L168-Y194 WeakPolarHBondContact CD2-OH 3.4Å; L168-Y194 HydrophobicContact CG-CE1 3.83Å; L168-L199 HydrophobicContact CD1-CD1 4.39Å; L168-L199 HydrophobicContact CD1-CD2 4.45Å
169	P	66.5	Low	72.1	Confident	1 Å²	1	66 Å²	66	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-23.8	172.5	-24.6	36.9	0	0	0	113.8	F115 I166 S173 H176 L185	F115-P169 HydrophobicContact CD2-CG 3.77Å; F115-P169 HydrophobicContact CE2-CG 4.01Å; I166-P169 VanDerWaalsContact O-CD 3.31Å; I166-P169 WeakPolarHBondContact O-CD 3.31Å; P169-S173 WeakPolarHBondContact O-CA 3.38Å; P169-S173 WeakPolarHBondContact O-CB 2.95Å; P169-S173 PolarHBondContact O-N 2.74Å; P169-H176 WeakPolarHBondContact CA-NE2 3.49Å; P169-H176 PolarHBondContact O-CD2 3.37Å; P169-H176 PolarHBondContact O-NE2 3.4Å; P169-L185 HydrophobicContact CB-CD1 4.37Å; P169-L185 HydrophobicContact CG-CD1 4.4Å
170	Y	68.8	Low	70.2	Confident	164 Å²	164	69.2 Å²	69.2	64%	0.643	35%	0.346	S	S	*	.	H	α-helix	trans	-80.1	-50.4	-177	-168.6	-97.3	0	0	0	112.8	A167 L168 F172 S173	A167-Y170 PolarHBondContact O-N 3.3Å; L168-Y170 PolarHBondContact O-N 3.46Å; Y170-F172 VanDerWaalsContact C-N 3.34Å; Y170-F172 PolarHBondContact O-N 2.99Å; Y170-S173 WeakPolarHBondContact O-CB 3.04Å; Y170-S173 PolarHBondContact O-N 3.17Å; Y170-S173 PolarHBondContact O-OG 2.92Å
171	V	64.5	Low	68.8	Low	95 Å²	95	65.9 Å²	65.9	58%	0.576	34%	0.335	S	S	*	.	H	α-helix	trans	-67.3	-36.2	179.4	175.3	0	0	0	0	111.2	A167 S173	A167-V171 HydrophobicContact CB-CG2 4.41Å; A167-V171 WeakPolarHBondContact O-CB 3.1Å; A167-V171 VanDerWaalsContact O-CG2 3.31Å; A167-V171 WeakPolarHBondContact O-CG2 3.41Å; A167-V171 PolarHBondContact O-N 3.37Å; V171-S173 VanDerWaalsContact C-N 3.32Å
172	F	60.4	Low	67.7	Low	72 Å²	72	62.3 Å²	62.3	32%	0.316	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	10.5	178.9	-62.1	-74.6	0	0	0	113.5	L168 Y170 H174 Q175 F191	L168-F172 HydrophobicContact CD2-CE2 4.15Å; L168-F172 WeakPolarHBondContact O-CB 3.33Å; L168-F172 VanDerWaalsContact O-CD2 3.23Å; L168-F172 WeakPolarHBondContact O-CD2 3.45Å; L168-F172 PolarHBondContact O-N 3.27Å; Y170-F172 VanDerWaalsContact C-N 3.34Å; Y170-F172 PolarHBondContact O-N 2.99Å; F172-H174 PolarHBondContact O-N 3.47Å; F172-Q175 PolarHBondContact O-N 3Å; F172-F191 HydrophobicContact CB-CD2 3.89Å; F172-F191 HydrophobicContact CB-CE2 4.05Å; F172-F191 HydrophobicContact CD1-CD2 4.25Å; F172-F191 AromaticContact CD2-CD2 3.46Å; F172-F191 HydrophobicContact CD2-CD2 3.46Å; F172-F191 VanDerWaalsContact CD2-CD2 3.46Å; F172-F191 AromaticContact CD2-CE2 3.62Å; F172-F191 HydrophobicContact CD2-CE2 3.62Å; F172-F191 HydrophobicContact CE2-CD2 4.03Å; F172-F191 HydrophobicContact CE2-CE2 4.38Å; F172-F191 AromaticContact CG-CD2 3.59Å; F172-F191 HydrophobicContact CG-CD2 3.59Å; F172-F191 HydrophobicContact CG-CE2 4.01Å; F172-F191 HydrophobicContact CG-CG 4.46Å
173	S	53.9	Low	66.9	Low	34 Å²	34	62.6 Å²	62.6	24%	0.238	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-56.9	-24	-174.2	64.9	0	0	0	0	115.3	P169 Y170 V171 Q175 H176	P169-S173 WeakPolarHBondContact O-CA 3.38Å; P169-S173 WeakPolarHBondContact O-CB 2.95Å; P169-S173 PolarHBondContact O-N 2.74Å; Y170-S173 WeakPolarHBondContact O-CB 3.04Å; Y170-S173 PolarHBondContact O-N 3.17Å; Y170-S173 PolarHBondContact O-OG 2.92Å; V171-S173 VanDerWaalsContact C-N 3.32Å; S173-Q175 PolarHBondContact O-N 3.19Å; S173-H176 PolarHBondContact O-N 2.98Å; S173-H176 VanDerWaalsContact O-N 3.11Å
174	H	51.6	Low	65.8	Low	181 Å²	181	60.3 Å²	60.3	84%	0.838	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-60.4	-13.7	177.6	-65.9	-61.8	0	0	0	114.4	F172	F172-H174 PolarHBondContact O-N 3.47Å
175	Q	51.1	Low	64.8	Low	74 Å²	74	56.5 Å²	56.5	35%	0.346	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-115	3.5	-178.8	-70.4	156	8.4	0	0	113	F172 S173 G186 N188	F172-Q175 PolarHBondContact O-N 3Å; S173-Q175 PolarHBondContact O-N 3.19Å; Q175-G186 WeakPolarHBondContact O-CA 3.24Å; Q175-N188 PolarHBondContact NE2-ND2 3.37Å; Q175-N188 VanDerWaalsContact OE1-CB 3.25Å; Q175-N188 PolarHBondContact OE1-ND2 3.08Å; Q175-N188 PolarHBondContact OE1-OD1 3.23Å
176	H	54.2	Low	63.7	Low	14 Å²	14	56.5 Å²	56.5	7%	0.065	29%	0.288	C	S	.	.			trans	-95.1	122.1	-177.4	-61.8	-12.7	0	0	0	109.1	P169 S173 F178 G186 F191	P169-H176 WeakPolarHBondContact CA-NE2 3.49Å; P169-H176 PolarHBondContact O-CD2 3.37Å; P169-H176 PolarHBondContact O-NE2 3.4Å; S173-H176 PolarHBondContact O-N 2.98Å; S173-H176 VanDerWaalsContact O-N 3.11Å; H176-F178 VanDerWaalsContact C-N 3.28Å; H176-F178 HydrophobicContact CB-CD1 4.39Å; H176-F178 HydrophobicContact CB-CD2 3.8Å; H176-F178 HydrophobicContact CB-CE1 3.9Å; H176-F178 HydrophobicContact CB-CE2 3.24Å; H176-F178 HydrophobicContact CB-CG 4.36Å; H176-F178 HydrophobicContact CB-CZ 3.3Å; H176-F178 AromaticContact CD2-CZ 3.62Å; H176-F178 AromaticContact CG-CZ 3.82Å; H176-F178 PolarHBondContact O-N 3.35Å; H176-G186 PolarHBondContact CE1-N 3.29Å; H176-G186 WeakPolarHBondContact ND1-CA 3.18Å; H176-G186 PolarHBondContact ND1-N 3.11Å; H176-F191 AromaticContact CE1-CE1 4Å
177	H	54	Low	62.6	Low	101 Å²	101	57 Å²	57	47%	0.468	29%	0.287	S	S	.	.			trans	-80.3	85.1	177.3	-67.8	-103.7	0	0	0	108.6	S179 I182 Y184	H177-S179 VanDerWaalsContact C-N 3.28Å; H177-S179 PolarHBondContact O-N 3.36Å; H177-I182 HydrophobicContact CB-CG2 4.13Å; H177-I182 VanDerWaalsContact O-O 3.06Å; H177-Y184 HydrophobicContact CB-CE1 3.97Å; H177-Y184 HydrophobicContact CB-CE2 3.87Å; H177-Y184 VanDerWaalsContact CB-CZ 3.5Å; H177-Y184 WeakPolarHBondContact CB-OH 3.11Å; H177-Y184 AromaticContact CD2-CE2 3.4Å; H177-Y184 VanDerWaalsContact CD2-CE2 3.4Å; H177-Y184 WeakPolarHBondContact CD2-CE2 3.24Å; H177-Y184 AromaticContact CD2-CZ 3.43Å; H177-Y184 VanDerWaalsContact CD2-CZ 3.43Å; H177-Y184 PolarHBondContact CD2-OH 2.82Å; H177-Y184 AromaticContact CG-CE2 3.9Å; H177-Y184 AromaticContact CG-CZ 3.56Å; H177-Y184 PolarHBondContact NE2-OH 3.48Å
178	F	54.7	Low	62.5	Low	25 Å²	25	58.1 Å²	58.1	11%	0.11	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	70	167.3	-51.7	-63.1	0	0	0	108.3	N104 C107 Q108 H176	N104-F178 HydrophobicContact CB-CB 3.85Å; N104-F178 VanDerWaalsContact CG-CB 3.42Å; N104-F178 PolarHBondContact ND2-O 3.3Å; N104-F178 WeakPolarHBondContact OD1-CB 3.41Å; N104-F178 PolarHBondContact OD1-O 2.93Å; C107-F178 HydrophobicContact CB-CD1 3.92Å; C107-F178 HydrophobicContact CB-CE1 4.34Å; C107-F178 WeakPolarHBondContact SG-CD1 3.3Å; C107-F178 VanDerWaalsContact SG-CE1 3.56Å; Q108-F178 HydrophobicContact CG-CD1 4.25Å; Q108-F178 HydrophobicContact CG-CD2 4.46Å; Q108-F178 HydrophobicContact CG-CE1 3.65Å; Q108-F178 HydrophobicContact CG-CE2 3.86Å; Q108-F178 HydrophobicContact CG-CZ 3.41Å; Q108-F178 VanDerWaalsContact CG-CZ 3.41Å; H176-F178 VanDerWaalsContact C-N 3.28Å; H176-F178 HydrophobicContact CB-CD1 4.39Å; H176-F178 HydrophobicContact CB-CD2 3.8Å; H176-F178 HydrophobicContact CB-CE1 3.9Å; H176-F178 HydrophobicContact CB-CE2 3.24Å; H176-F178 HydrophobicContact CB-CG 4.36Å; H176-F178 HydrophobicContact CB-CZ 3.3Å; H176-F178 AromaticContact CD2-CZ 3.62Å; H176-F178 AromaticContact CG-CZ 3.82Å; H176-F178 PolarHBondContact O-N 3.35Å
179	S	52.9	Low	62.7	Low	47 Å²	47	60.6 Å²	60.6	33%	0.329	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	159.5	175	61.8	0	0	0	0	109.6	H177 G181 I182	H177-S179 VanDerWaalsContact C-N 3.28Å; H177-S179 PolarHBondContact O-N 3.36Å; S179-G181 PolarHBondContact O-N 2.87Å; S179-I182 CarbonylContact O-C 3.59Å; S179-I182 PolarHBondContact O-N 3.37Å; S179-I182 WeakPolarHBondContact OG-CD1 3.31Å
180	E	56.9	Low	63.3	Low	119 Å²	119	65 Å²	65	56%	0.556	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	130.7	175.8	-65.5	-171.3	161.3	0	0	110.9	Q102 I182	Q102-E180 HydrophobicContact CB-CG 4.24Å; Q102-E180 HydrophobicContact CG-CG 4.02Å; E180-I182 VanDerWaalsContact C-N 3.29Å; E180-I182 PolarHBondContact O-N 3.47Å
181	G	67.3	Low	63.6	Low	25 Å²	25	57.6 Å²	57.6	26%	0.258	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	84.8	-14.6	-175.7	0	0	0	0	0	115.5	Y98 W99 S179	Y98-G181 WeakPolarHBondContact CB-O 3.34Å; W99-G181 PolarHBondContact N-O 3.28Å; W99-G181 VanDerWaalsContact O-CA 3.24Å; W99-G181 WeakPolarHBondContact O-CA 3.45Å; W99-G181 PolarHBondContact O-N 3.28Å; S179-G181 PolarHBondContact O-N 2.87Å
182	I	70.7	Confident	64.2	Low	25 Å²	25	54.9 Å²	54.9	13%	0.128	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.5	-168	-51.2	-176.7	0	0	0	111	H177 S179 E180 Y184	H177-I182 HydrophobicContact CB-CG2 4.13Å; H177-I182 VanDerWaalsContact O-O 3.06Å; S179-I182 CarbonylContact O-C 3.59Å; S179-I182 PolarHBondContact O-N 3.37Å; S179-I182 WeakPolarHBondContact OG-CD1 3.31Å; E180-I182 VanDerWaalsContact C-N 3.29Å; E180-I182 PolarHBondContact O-N 3.47Å; I182-Y184 HydrophobicContact CG2-CD1 3.16Å; I182-Y184 HydrophobicContact CG2-CE1 3.05Å; I182-Y184 HydrophobicContact CG2-CG 4.3Å
183	C	77.3	Confident	65.2	Low	6 Å²	6	55.2 Å²	55.2	4%	0.041	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	92.5	173.4	178.7	0	0	0	0	109.1	W99 C107	W99-C183 HydrophobicContact CB-CB 3.57Å; W99-C183 HydrophobicContact CD2-CB 3.36Å; W99-C183 HydrophobicContact CE3-CB 3.71Å; W99-C183 HydrophobicContact CG-CB 3.29Å; C107-C183 WeakPolarHBondContact CA-SG 3.35Å; C107-C183 HydrophobicContact CB-CB 3.83Å; C107-C183 WeakPolarHBondContact CB-SG 3.22Å; C107-C183 WeakPolarHBondContact SG-CA 3.46Å; C107-C183 WeakPolarHBondContact SG-CB 3.32Å; C107-C183 CovalentContact SG-SG 2.02Å; C107-C183 PolarHBondContact SG-SG 3.4Å
184	Y	71.1	Confident	66.5	Low	59 Å²	59	56.9 Å²	56.9	23%	0.231	29%	0.29	C	S	.	.			trans	-140.7	158.2	174.2	63.1	-107.7	0	0	0	111.3	H177 I182 Y187	H177-Y184 HydrophobicContact CB-CE1 3.97Å; H177-Y184 HydrophobicContact CB-CE2 3.87Å; H177-Y184 VanDerWaalsContact CB-CZ 3.5Å; H177-Y184 WeakPolarHBondContact CB-OH 3.11Å; H177-Y184 AromaticContact CD2-CE2 3.4Å; H177-Y184 VanDerWaalsContact CD2-CE2 3.4Å; H177-Y184 WeakPolarHBondContact CD2-CE2 3.24Å; H177-Y184 AromaticContact CD2-CZ 3.43Å; H177-Y184 VanDerWaalsContact CD2-CZ 3.43Å; H177-Y184 PolarHBondContact CD2-OH 2.82Å; H177-Y184 AromaticContact CG-CE2 3.9Å; H177-Y184 AromaticContact CG-CZ 3.56Å; H177-Y184 PolarHBondContact NE2-OH 3.48Å; I182-Y184 HydrophobicContact CG2-CD1 3.16Å; I182-Y184 HydrophobicContact CG2-CE1 3.05Å; I182-Y184 HydrophobicContact CG2-CG 4.3Å; Y184-Y187 AromaticContact CD2-CD2 3.94Å; Y184-Y187 HydrophobicContact CD2-CD2 3.94Å; Y184-Y187 AromaticContact CD2-CE2 3.41Å; Y184-Y187 HydrophobicContact CD2-CE2 3.41Å; Y184-Y187 VanDerWaalsContact CD2-CE2 3.41Å; Y184-Y187 AromaticContact CE2-CD2 3.62Å; Y184-Y187 HydrophobicContact CE2-CD2 3.62Å; Y184-Y187 AromaticContact CE2-CE2 3.34Å; Y184-Y187 HydrophobicContact CE2-CE2 3.34Å; Y184-Y187 HydrophobicContact CG-CE2 4.1Å; Y184-Y187 AromaticContact CZ-CE2 3.95Å
185	L	68	Low	67.9	Low	27 Å²	27	49.1 Å²	49.1	14%	0.141	26%	0.255	C	S	.	.			trans	-78.9	133.6	174.5	-118.3	61.8	0	0	0	110.4	M111 F115 P169 F191	M111-L185 HydrophobicContact CB-CD1 3.71Å; M111-L185 HydrophobicContact CE-CB 3.9Å; M111-L185 HydrophobicContact CE-CD1 3.39Å; M111-L185 HydrophobicContact CE-CD2 4.37Å; M111-L185 HydrophobicContact CE-CG 4.08Å; M111-L185 HydrophobicContact CG-CD1 3.77Å; M111-L185 HydrophobicContact SD-CD1 4.4Å; F115-L185 HydrophobicContact CE2-CD1 4.13Å; F115-L185 HydrophobicContact CE2-CD2 3.23Å; F115-L185 HydrophobicContact CE2-CG 4.36Å; F115-L185 HydrophobicContact CZ-CD2 3.2Å; P169-L185 HydrophobicContact CB-CD1 4.37Å; P169-L185 HydrophobicContact CG-CD1 4.4Å; L185-F191 HydrophobicContact CB-CE1 4.14Å; L185-F191 HydrophobicContact CD2-CE1 3.36Å; L185-F191 HydrophobicContact CD2-CZ 3.49Å; L185-F191 VanDerWaalsContact CD2-CZ 3.49Å; L185-F191 HydrophobicContact CG-CE1 3.6Å; L185-F191 HydrophobicContact CG-CZ 3.89Å
186	G	62.8	Low	69.5	Low	2 Å²	2	45.9 Å²	45.9	2%	0.021	24%	0.241	C	C	.	.			trans	-50.9	135.7	178.4	0	0	0	0	0	113.1	Q175 H176 N188	Q175-G186 WeakPolarHBondContact O-CA 3.24Å; H176-G186 PolarHBondContact CE1-N 3.29Å; H176-G186 WeakPolarHBondContact ND1-CA 3.18Å; H176-G186 PolarHBondContact ND1-N 3.11Å; G186-N188 VanDerWaalsContact C-N 3.25Å; G186-N188 PolarHBondContact O-N 3.48Å
187	Y	61.6	Low	71	Confident	67 Å²	67	47.9 Å²	47.9	26%	0.263	25%	0.254	S	S	.	.			trans	-84.7	16.7	-165.5	-78.9	-70.6	0	0	0	114.8	Y184 T189 R192 I496	Y184-Y187 AromaticContact CD2-CD2 3.94Å; Y184-Y187 HydrophobicContact CD2-CD2 3.94Å; Y184-Y187 AromaticContact CD2-CE2 3.41Å; Y184-Y187 HydrophobicContact CD2-CE2 3.41Å; Y184-Y187 VanDerWaalsContact CD2-CE2 3.41Å; Y184-Y187 AromaticContact CE2-CD2 3.62Å; Y184-Y187 HydrophobicContact CE2-CD2 3.62Å; Y184-Y187 AromaticContact CE2-CE2 3.34Å; Y184-Y187 HydrophobicContact CE2-CE2 3.34Å; Y184-Y187 HydrophobicContact CG-CE2 4.1Å; Y184-Y187 AromaticContact CZ-CE2 3.95Å; Y187-T189 PolarHBondContact O-N 2.98Å; Y187-R192 VanDerWaalsContact O-CZ 3.29Å; Y187-R192 PolarHBondContact O-NE 2.91Å; Y187-R192 PolarHBondContact O-NH2 2.99Å; Y187-I496 HydrophobicContact CD1-CD1 3.96Å; Y187-I496 HydrophobicContact CD1-CG1 4.11Å; Y187-I496 HydrophobicContact CD2-CD1 4.04Å; Y187-I496 HydrophobicContact CE1-CD1 4Å; Y187-I496 HydrophobicContact CE1-CG1 4.1Å; Y187-I496 HydrophobicContact CE1-CG2 4.18Å; Y187-I496 HydrophobicContact CE2-CD1 4.07Å; Y187-I496 HydrophobicContact CG-CD1 3.99Å
188	N	72.4	Confident	72.4	Confident	68 Å²	68	47.9 Å²	47.9	36%	0.364	25%	0.253	S	S	.	.			trans	-64.3	131.7	-177.3	-86.8	35.5	0	0	0	112.4	Q175 G186 S190 F191 R192	Q175-N188 PolarHBondContact NE2-ND2 3.37Å; Q175-N188 VanDerWaalsContact OE1-CB 3.25Å; Q175-N188 PolarHBondContact OE1-ND2 3.08Å; Q175-N188 PolarHBondContact OE1-OD1 3.23Å; G186-N188 VanDerWaalsContact C-N 3.25Å; G186-N188 PolarHBondContact O-N 3.48Å; N188-S190 VanDerWaalsContact C-N 3.3Å; N188-S190 PolarHBondContact O-N 3.13Å; N188-F191 HydrophobicContact CB-CB 4.27Å; N188-F191 PolarHBondContact O-N 3.23Å; N188-R192 PolarHBondContact O-N 3.21Å
189	T	75.8	Confident	73.7	Confident	66 Å²	66	47.2 Å²	47.2	41%	0.405	25%	0.25	S	S	.	.	H	α-helix	trans	-55.4	-44.1	-177.5	-50	0	0	0	0	112.1	Y187 F191 R192 L193	Y187-T189 PolarHBondContact O-N 2.98Å; T189-F191 VanDerWaalsContact C-N 3.32Å; T189-F191 PolarHBondContact O-N 2.96Å; T189-R192 PolarHBondContact O-N 3.48Å; T189-L193 HydrophobicContact CG2-CD1 4.13Å; T189-L193 WeakPolarHBondContact O-CB 3.29Å; T189-L193 WeakPolarHBondContact O-CG 3.37Å; T189-L193 PolarHBondContact O-N 3.05Å
190	S	78.8	Confident	75.2	Confident	95 Å²	95	46 Å²	46	66%	0.664	24%	0.239	S	C	*	.	H	α-helix	trans	-61.6	-39.1	178.6	-48.4	0	0	0	0	112.7	N188 Y194	N188-S190 VanDerWaalsContact C-N 3.3Å; N188-S190 PolarHBondContact O-N 3.13Å; S190-Y194 WeakPolarHBondContact O-CB 3.15Å; S190-Y194 PolarHBondContact O-N 3.37Å
191	F	76.3	Confident	76.8	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.035	23%	0.229	C	C	.	.	H	α-helix	trans	-73.5	-40.5	178.6	176.9	-104.2	0	0	0	111.8	L168 F172 H176 L185 N188 T189 L193 Y194 V195	L168-F191 HydrophobicContact CB-CE2 4.27Å; F172-F191 HydrophobicContact CB-CD2 3.89Å; F172-F191 HydrophobicContact CB-CE2 4.05Å; F172-F191 HydrophobicContact CD1-CD2 4.25Å; F172-F191 AromaticContact CD2-CD2 3.46Å; F172-F191 HydrophobicContact CD2-CD2 3.46Å; F172-F191 VanDerWaalsContact CD2-CD2 3.46Å; F172-F191 AromaticContact CD2-CE2 3.62Å; F172-F191 HydrophobicContact CD2-CE2 3.62Å; F172-F191 HydrophobicContact CE2-CD2 4.03Å; F172-F191 HydrophobicContact CE2-CE2 4.38Å; F172-F191 AromaticContact CG-CD2 3.59Å; F172-F191 HydrophobicContact CG-CD2 3.59Å; F172-F191 HydrophobicContact CG-CE2 4.01Å; F172-F191 HydrophobicContact CG-CG 4.46Å; H176-F191 AromaticContact CE1-CE1 4Å; L185-F191 HydrophobicContact CB-CE1 4.14Å; L185-F191 HydrophobicContact CD2-CE1 3.36Å; L185-F191 HydrophobicContact CD2-CZ 3.49Å; L185-F191 VanDerWaalsContact CD2-CZ 3.49Å; L185-F191 HydrophobicContact CG-CE1 3.6Å; L185-F191 HydrophobicContact CG-CZ 3.89Å; N188-F191 HydrophobicContact CB-CB 4.27Å; N188-F191 PolarHBondContact O-N 3.23Å; T189-F191 VanDerWaalsContact C-N 3.32Å; T189-F191 PolarHBondContact O-N 2.96Å; F191-L193 VanDerWaalsContact C-N 3.32Å; F191-L193 PolarHBondContact O-N 2.85Å; F191-Y194 WeakPolarHBondContact O-CB 3.38Å; F191-Y194 PolarHBondContact O-N 2.68Å; F191-V195 HydrophobicContact CD1-CG2 4.48Å; F191-V195 HydrophobicContact CD2-CG2 4.43Å; F191-V195 HydrophobicContact CE1-CG2 4.01Å; F191-V195 HydrophobicContact CE2-CG2 3.94Å; F191-V195 HydrophobicContact CZ-CG2 3.71Å; F191-V195 PolarHBondContact O-N 3.11Å
192	R	76.3	Confident	77.9	Confident	37 Å²	37	46.1 Å²	46.1	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-43.9	172.2	-65.5	-169	-141.1	-178.2	9.3	111.4	Y187 N188 T189 V195 A196 I491 C495	Y187-R192 VanDerWaalsContact O-CZ 3.29Å; Y187-R192 PolarHBondContact O-NE 2.91Å; Y187-R192 PolarHBondContact O-NH2 2.99Å; N188-R192 PolarHBondContact O-N 3.21Å; T189-R192 PolarHBondContact O-N 3.48Å; R192-V195 PolarHBondContact O-N 3.12Å; R192-A196 WeakPolarHBondContact O-CB 3.32Å; R192-A196 PolarHBondContact O-N 3.29Å; R192-I491 HydrophobicContact CB-CD1 4.06Å; R192-I491 HydrophobicContact CB-CG1 3.86Å; R192-C495 PolarHBondContact NH1-O 2.02Å
193	L	81.9	Confident	79	Confident	80 Å²	80	45 Å²	45	42%	0.419	23%	0.227	S	C	.	.	H	α-helix	trans	-61.5	-46.2	174.9	-77.4	169.5	0	0	0	111.6	T189 F191 V195 A196 V197 I491	T189-L193 HydrophobicContact CG2-CD1 4.13Å; T189-L193 WeakPolarHBondContact O-CB 3.29Å; T189-L193 WeakPolarHBondContact O-CG 3.37Å; T189-L193 PolarHBondContact O-N 3.05Å; F191-L193 VanDerWaalsContact C-N 3.32Å; F191-L193 PolarHBondContact O-N 2.85Å; L193-V195 PolarHBondContact O-N 2.99Å; L193-A196 PolarHBondContact O-N 3.21Å; L193-V197 WeakPolarHBondContact O-CB 3.48Å; L193-V197 VanDerWaalsContact O-CG2 3.22Å; L193-V197 WeakPolarHBondContact O-CG2 3.25Å; L193-V197 PolarHBondContact O-N 3.03Å; L193-I491 HydrophobicContact CD2-CD1 4.25Å; L193-I491 HydrophobicContact CD2-CG2 3.78Å; L193-I491 HydrophobicContact CG-CG2 4.18Å
194	Y	81.2	Confident	79.6	Confident	69 Å²	69	45.8 Å²	45.8	27%	0.271	23%	0.232	S	C	.	.	H	α-helix	trans	-56.1	-53.6	176	174.3	-78.8	0	0	0	111	L168 S190 F191 V197 F198	L168-Y194 HydrophobicContact CD1-CD1 4.23Å; L168-Y194 HydrophobicContact CD1-CE1 3.31Å; L168-Y194 HydrophobicContact CD2-CD1 3.99Å; L168-Y194 HydrophobicContact CD2-CE1 3.24Å; L168-Y194 HydrophobicContact CD2-CE2 4.22Å; L168-Y194 WeakPolarHBondContact CD2-OH 3.4Å; L168-Y194 HydrophobicContact CG-CE1 3.83Å; S190-Y194 WeakPolarHBondContact O-CB 3.15Å; S190-Y194 PolarHBondContact O-N 3.37Å; F191-Y194 WeakPolarHBondContact O-CB 3.38Å; F191-Y194 PolarHBondContact O-N 2.68Å; Y194-V197 PolarHBondContact O-N 2.85Å; Y194-F198 HydrophobicContact CD1-CD2 4.31Å; Y194-F198 AromaticContact CD2-CD2 3.41Å; Y194-F198 HydrophobicContact CD2-CD2 3.41Å; Y194-F198 VanDerWaalsContact CD2-CD2 3.41Å; Y194-F198 AromaticContact CD2-CE2 3.54Å; Y194-F198 HydrophobicContact CD2-CE2 3.54Å; Y194-F198 HydrophobicContact CD2-CG 4.49Å; Y194-F198 HydrophobicContact CE1-CB 4.22Å; Y194-F198 HydrophobicContact CE1-CD2 4.11Å; Y194-F198 HydrophobicContact CE1-CG 4.44Å; Y194-F198 AromaticContact CE2-CD2 3.31Å; Y194-F198 HydrophobicContact CE2-CD2 3.31Å; Y194-F198 AromaticContact CE2-CE2 3.5Å; Y194-F198 HydrophobicContact CE2-CE2 3.5Å; Y194-F198 HydrophobicContact CE2-CG 4.04Å; Y194-F198 HydrophobicContact CE2-CZ 4.36Å; Y194-F198 AromaticContact CG-CD2 3.92Å; Y194-F198 HydrophobicContact CG-CD2 3.92Å; Y194-F198 HydrophobicContact CG-CE2 4.41Å; Y194-F198 AromaticContact CZ-CD2 3.66Å; Y194-F198 AromaticContact CZ-CG 3.99Å; Y194-F198 WeakPolarHBondContact O-CD2 3.06Å; Y194-F198 PolarHBondContact O-N 3.45Å
195	V	80.5	Confident	80.7	Confident	18 Å²	18	48.2 Å²	48.2	11%	0.109	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-51.1	-179.1	165	0	0	0	0	109.8	F115 F191 R192 L193 V197 L199	F115-V195 HydrophobicContact CE1-CG1 4.04Å; F191-V195 HydrophobicContact CD1-CG2 4.48Å; F191-V195 HydrophobicContact CD2-CG2 4.43Å; F191-V195 HydrophobicContact CE1-CG2 4.01Å; F191-V195 HydrophobicContact CE2-CG2 3.94Å; F191-V195 HydrophobicContact CZ-CG2 3.71Å; F191-V195 PolarHBondContact O-N 3.11Å; R192-V195 PolarHBondContact O-N 3.12Å; L193-V195 PolarHBondContact O-N 2.99Å; V195-V197 VanDerWaalsContact C-N 3.28Å; V195-V197 PolarHBondContact O-N 3.29Å; V195-L199 HydrophobicContact CG1-CD1 4.03Å; V195-L199 HydrophobicContact CG2-CD1 4.4Å; V195-L199 WeakPolarHBondContact O-CB 3.41Å; V195-L199 PolarHBondContact O-N 3.43Å
196	A	83.9	Confident	82	Confident	6 Å²	6	49.7 Å²	49.7	5%	0.05	26%	0.256	C	S	.	.	I	π-helix	trans	-49.2	-49.5	176.5	0	0	0	0	0	111.4	R192 L193 W200 F201 I491	R192-A196 WeakPolarHBondContact O-CB 3.32Å; R192-A196 PolarHBondContact O-N 3.29Å; L193-A196 PolarHBondContact O-N 3.21Å; A196-W200 WeakPolarHBondContact O-CB 3.35Å; A196-W200 PolarHBondContact O-N 2.68Å; A196-F201 HydrophobicContact CB-CD2 4.29Å; A196-F201 HydrophobicContact CB-CE2 4.25Å; A196-F201 VanDerWaalsContact O-CD2 3.22Å; A196-F201 WeakPolarHBondContact O-CD2 3.39Å; A196-F201 PolarHBondContact O-N 3.43Å; A196-I491 HydrophobicContact CB-CD1 4.08Å
197	V	86.4	Confident	83.5	Confident	56 Å²	56	49.6 Å²	49.6	34%	0.339	26%	0.255	S	S	.	.	I	π-helix	trans	-71.8	-56.6	-175.3	172.3	0	0	0	0	112	L193 Y194 V195 F201 I202	L193-V197 WeakPolarHBondContact O-CB 3.48Å; L193-V197 VanDerWaalsContact O-CG2 3.22Å; L193-V197 WeakPolarHBondContact O-CG2 3.25Å; L193-V197 PolarHBondContact O-N 3.03Å; Y194-V197 PolarHBondContact O-N 2.85Å; V195-V197 VanDerWaalsContact C-N 3.28Å; V195-V197 PolarHBondContact O-N 3.29Å; V197-F201 HydrophobicContact CG2-CD2 4.42Å; V197-F201 PolarHBondContact O-N 3.45Å; V197-I202 HydrophobicContact CG1-CD1 3.96Å; V197-I202 HydrophobicContact CG1-CG1 4.15Å; V197-I202 WeakPolarHBondContact O-CG1 3.44Å; V197-I202 PolarHBondContact O-N 2.92Å
198	F	83.7	Confident	85.1	Confident	101 Å²	101	49.5 Å²	49.5	44%	0.443	26%	0.261	S	S	.	.	I	π-helix	trans	-78.8	-38.3	-169	-74.5	-78.6	0	0	0	113.5	Y194 I202 P203	Y194-F198 HydrophobicContact CD1-CD2 4.31Å; Y194-F198 AromaticContact CD2-CD2 3.41Å; Y194-F198 HydrophobicContact CD2-CD2 3.41Å; Y194-F198 VanDerWaalsContact CD2-CD2 3.41Å; Y194-F198 AromaticContact CD2-CE2 3.54Å; Y194-F198 HydrophobicContact CD2-CE2 3.54Å; Y194-F198 HydrophobicContact CD2-CG 4.49Å; Y194-F198 HydrophobicContact CE1-CB 4.22Å; Y194-F198 HydrophobicContact CE1-CD2 4.11Å; Y194-F198 HydrophobicContact CE1-CG 4.44Å; Y194-F198 AromaticContact CE2-CD2 3.31Å; Y194-F198 HydrophobicContact CE2-CD2 3.31Å; Y194-F198 AromaticContact CE2-CE2 3.5Å; Y194-F198 HydrophobicContact CE2-CE2 3.5Å; Y194-F198 HydrophobicContact CE2-CG 4.04Å; Y194-F198 HydrophobicContact CE2-CZ 4.36Å; Y194-F198 AromaticContact CG-CD2 3.92Å; Y194-F198 HydrophobicContact CG-CD2 3.92Å; Y194-F198 HydrophobicContact CG-CE2 4.41Å; Y194-F198 AromaticContact CZ-CD2 3.66Å; Y194-F198 AromaticContact CZ-CG 3.99Å; Y194-F198 WeakPolarHBondContact O-CD2 3.06Å; Y194-F198 PolarHBondContact O-N 3.45Å; F198-I202 HydrophobicContact CD1-CD1 3.73Å; F198-I202 HydrophobicContact CE1-CD1 3.97Å; F198-I202 HydrophobicContact CG-CD1 4.41Å; F198-P203 WeakPolarHBondContact O-CD 3.23Å
199	L	82.4	Confident	86.3	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.052	27%	0.267	C	S	.	.	I	π-helix	trans	-87.4	-16.8	-176.3	-53.1	-171.4	0	0	0	112.3	F115 L119 L168 V195	F115-L199 HydrophobicContact CB-CD1 4.4Å; F115-L199 HydrophobicContact CD1-CD1 3.16Å; F115-L199 HydrophobicContact CE1-CD1 3.57Å; F115-L199 HydrophobicContact CG-CD1 3.99Å; L119-L199 HydrophobicContact CB-CD2 4.46Å; L119-L199 HydrophobicContact CD1-CD2 3.89Å; L119-L199 HydrophobicContact CD2-CD2 3.39Å; L119-L199 HydrophobicContact CG-CD2 4.1Å; L168-L199 HydrophobicContact CD1-CD1 4.39Å; L168-L199 HydrophobicContact CD1-CD2 4.45Å; V195-L199 HydrophobicContact CG1-CD1 4.03Å; V195-L199 HydrophobicContact CG2-CD1 4.4Å; V195-L199 WeakPolarHBondContact O-CB 3.41Å; V195-L199 PolarHBondContact O-N 3.43Å
200	W	83.8	Confident	87.3	Confident	23 Å²	23	47.6 Å²	47.6	9%	0.087	25%	0.254	C	S	.	.	I	π-helix	trans	-132.8	-58.8	-171.7	-41.5	95.1	0	0	0	115.4	A196 P203 V204 F480 F483 L509	A196-W200 WeakPolarHBondContact O-CB 3.35Å; A196-W200 PolarHBondContact O-N 2.68Å; W200-P203 WeakPolarHBondContact O-CD 3.42Å; W200-V204 WeakPolarHBondContact O-CB 3.33Å; W200-V204 WeakPolarHBondContact O-CG2 3.49Å; W200-V204 PolarHBondContact O-N 2.92Å; W200-F480 HydrophobicContact CB-CE2 3.65Å; W200-F480 HydrophobicContact CB-CZ 3.41Å; W200-F480 VanDerWaalsContact CB-CZ 3.41Å; W200-F480 HydrophobicContact CD2-CD2 4.28Å; W200-F480 AromaticContact CD2-CE2 3.47Å; W200-F480 HydrophobicContact CD2-CE2 3.47Å; W200-F480 VanDerWaalsContact CD2-CE2 3.47Å; W200-F480 HydrophobicContact CD2-CZ 4.22Å; W200-F480 AromaticContact CE3-CD2 3.4Å; W200-F480 HydrophobicContact CE3-CD2 3.4Å; W200-F480 AromaticContact CE3-CE2 3.01Å; W200-F480 HydrophobicContact CE3-CE2 3.01Å; W200-F480 HydrophobicContact CE3-CZ 4.02Å; W200-F480 AromaticContact CG-CE2 3.78Å; W200-F480 HydrophobicContact CG-CE2 3.78Å; W200-F480 HydrophobicContact CG-CZ 4.05Å; W200-F480 AromaticContact CZ3-CD2 3.75Å; W200-F480 HydrophobicContact CZ3-CD2 3.75Å; W200-F480 AromaticContact CZ3-CE2 3.78Å; W200-F480 HydrophobicContact CZ3-CE2 3.78Å; W200-F483 HydrophobicContact CH2-CD1 4.33Å; W200-F483 HydrophobicContact CH2-CE1 4.09Å; W200-F483 HydrophobicContact CZ2-CD1 4.38Å; W200-F483 AromaticContact CZ2-CE1 3.87Å; W200-F483 HydrophobicContact CZ2-CE1 3.87Å; W200-L509 HydrophobicContact CH2-CD1 4.46Å; W200-L509 HydrophobicContact CH2-CD2 3.33Å; W200-L509 HydrophobicContact CZ3-CD1 3.89Å; W200-L509 HydrophobicContact CZ3-CD2 3.64Å; W200-L509 HydrophobicContact CZ3-CG 4.41Å
201	F	89.8	Confident	88.1	Confident	78 Å²	78	44.7 Å²	44.7	34%	0.342	23%	0.229	S	C	.	.	I	π-helix	trans	-63.8	-46	-177	-81.5	-71.8	0	0	0	113.1	A196 V197 V204 L205 L484 L488	A196-F201 HydrophobicContact CB-CD2 4.29Å; A196-F201 HydrophobicContact CB-CE2 4.25Å; A196-F201 VanDerWaalsContact O-CD2 3.22Å; A196-F201 WeakPolarHBondContact O-CD2 3.39Å; A196-F201 PolarHBondContact O-N 3.43Å; V197-F201 HydrophobicContact CG2-CD2 4.42Å; V197-F201 PolarHBondContact O-N 3.45Å; F201-V204 PolarHBondContact O-N 3.41Å; F201-L205 WeakPolarHBondContact O-CB 3.22Å; F201-L205 PolarHBondContact O-N 3.45Å; F201-L484 HydrophobicContact CD1-CD2 4.45Å; F201-L484 HydrophobicContact CD2-CD1 4.4Å; F201-L484 HydrophobicContact CE1-CD2 4.02Å; F201-L484 HydrophobicContact CE2-CD1 3.92Å; F201-L484 HydrophobicContact CZ-CD1 4.03Å; F201-L484 HydrophobicContact CZ-CD2 4.26Å; F201-L488 HydrophobicContact CE1-CD1 4.38Å; F201-L488 HydrophobicContact CE2-CD1 4.34Å; F201-L488 HydrophobicContact CE2-CD2 3.71Å; F201-L488 HydrophobicContact CE2-CG 4.3Å; F201-L488 HydrophobicContact CZ-CD1 3.56Å; F201-L488 HydrophobicContact CZ-CD2 3.64Å; F201-L488 HydrophobicContact CZ-CG 3.99Å
202	I	91.9	Very high	89.1	Confident	67 Å²	67	47.8 Å²	47.8	34%	0.344	25%	0.25	S	S	.	.	H	α-helix	trans	-61	-51.9	-179.5	-72.3	175	0	0	0	110.5	V197 F198 V204 L205 I206	V197-I202 HydrophobicContact CG1-CD1 3.96Å; V197-I202 HydrophobicContact CG1-CG1 4.15Å; V197-I202 WeakPolarHBondContact O-CG1 3.44Å; V197-I202 PolarHBondContact O-N 2.92Å; F198-I202 HydrophobicContact CD1-CD1 3.73Å; F198-I202 HydrophobicContact CE1-CD1 3.97Å; F198-I202 HydrophobicContact CG-CD1 4.41Å; I202-V204 PolarHBondContact O-N 2.96Å; I202-L205 PolarHBondContact O-N 3.44Å; I202-I206 HydrophobicContact CG2-CD1 3.78Å; I202-I206 HydrophobicContact CG2-CG1 4.47Å; I202-I206 VanDerWaalsContact O-CG1 3.28Å; I202-I206 WeakPolarHBondContact O-CG1 3.11Å; I202-I206 PolarHBondContact O-N 2.92Å
203	P	92.3	Very high	90.1	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-41.7	176.9	-25.1	32.8	0	0	0	114.2	L119 V122 L123 F198 W200 I206 I207	L119-P203 HydrophobicContact CD1-CG 4.45Å; V122-P203 HydrophobicContact CG1-CB 3.41Å; V122-P203 VanDerWaalsContact CG1-CB 3.41Å; V122-P203 HydrophobicContact CG1-CG 4.17Å; L123-P203 HydrophobicContact CD2-CG 4.46Å; F198-P203 WeakPolarHBondContact O-CD 3.23Å; W200-P203 WeakPolarHBondContact O-CD 3.42Å; P203-I206 PolarHBondContact O-N 2.97Å; P203-I207 WeakPolarHBondContact O-CG1 3.34Å; P203-I207 PolarHBondContact O-N 3.06Å
204	V	91.4	Very high	90.8	Very high	24 Å²	24	43.9 Å²	43.9	15%	0.145	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-44.4	176.7	169.2	0	0	0	0	111.3	W200 F201 I202 I206 I207 V208 F476 L477 F480	W200-V204 WeakPolarHBondContact O-CB 3.33Å; W200-V204 WeakPolarHBondContact O-CG2 3.49Å; W200-V204 PolarHBondContact O-N 2.92Å; F201-V204 PolarHBondContact O-N 3.41Å; I202-V204 PolarHBondContact O-N 2.96Å; V204-I206 VanDerWaalsContact C-N 3.34Å; V204-I206 PolarHBondContact O-N 3.43Å; V204-I207 PolarHBondContact O-N 3.17Å; V204-V208 HydrophobicContact CG1-CG2 4.25Å; V204-V208 WeakPolarHBondContact O-CB 3.32Å; V204-V208 VanDerWaalsContact O-CG2 3.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.36Å; V204-V208 PolarHBondContact O-N 2.92Å; V204-F476 HydrophobicContact CG2-CE1 3.76Å; V204-F476 HydrophobicContact CG2-CZ 3.94Å; V204-L477 HydrophobicContact CG1-CD2 3.88Å; V204-L477 HydrophobicContact CG2-CD2 4.26Å; V204-F480 HydrophobicContact CG2-CD1 3.81Å; V204-F480 HydrophobicContact CG2-CE1 3.5Å; V204-F480 HydrophobicContact CG2-CZ 4.29Å
205	L	93.8	Very high	91.5	Very high	109 Å²	109	48 Å²	48	57%	0.571	25%	0.253	S	S	*	.	H	α-helix	trans	-60.2	-45.7	177.3	-179.2	65.4	0	0	0	110.9	F201 I202 I207 V208 C209	F201-L205 WeakPolarHBondContact O-CB 3.22Å; F201-L205 PolarHBondContact O-N 3.45Å; I202-L205 PolarHBondContact O-N 3.44Å; L205-I207 PolarHBondContact O-N 2.82Å; L205-V208 PolarHBondContact O-N 2.92Å; L205-C209 VanDerWaalsContact O-CB 3.3Å; L205-C209 WeakPolarHBondContact O-CB 3.01Å; L205-C209 PolarHBondContact O-N 3.48Å; L205-C209 PolarHBondContact O-SG 2.92Å
206	I	95.5	Very high	92.2	Very high	59 Å²	59	49.8 Å²	49.8	30%	0.303	27%	0.266	S	S	.	.	H	α-helix	trans	-56.6	-51.7	175.7	-69.7	165.7	0	0	0	110.2	C126 I202 P203 V204 V208 C209 V210	C126-I206 HydrophobicContact CB-CG2 4.06Å; I202-I206 HydrophobicContact CG2-CD1 3.78Å; I202-I206 HydrophobicContact CG2-CG1 4.47Å; I202-I206 VanDerWaalsContact O-CG1 3.28Å; I202-I206 WeakPolarHBondContact O-CG1 3.11Å; I202-I206 PolarHBondContact O-N 2.92Å; P203-I206 PolarHBondContact O-N 2.97Å; V204-I206 VanDerWaalsContact C-N 3.34Å; V204-I206 PolarHBondContact O-N 3.43Å; I206-V208 PolarHBondContact O-N 2.96Å; I206-C209 PolarHBondContact O-N 3.19Å; I206-V210 HydrophobicContact CG2-CG2 4.36Å; I206-V210 WeakPolarHBondContact O-CB 3.12Å; I206-V210 WeakPolarHBondContact O-CG2 3.27Å; I206-V210 PolarHBondContact O-N 3.42Å
207	I	94.3	Very high	92.8	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-50.9	180	-70.4	169	0	0	0	110.5	L125 P203 V204 L205 C209 V210 Y211 V473 F476	L125-I207 HydrophobicContact CB-CD1 4.18Å; P203-I207 WeakPolarHBondContact O-CG1 3.34Å; P203-I207 PolarHBondContact O-N 3.06Å; V204-I207 PolarHBondContact O-N 3.17Å; L205-I207 PolarHBondContact O-N 2.82Å; I207-C209 PolarHBondContact O-N 3.2Å; I207-V210 PolarHBondContact O-N 3.25Å; I207-Y211 HydrophobicContact CG2-CD2 3.97Å; I207-Y211 HydrophobicContact CG2-CE2 4.19Å; I207-Y211 VanDerWaalsContact O-CD2 3.29Å; I207-Y211 WeakPolarHBondContact O-CD2 3.47Å; I207-Y211 PolarHBondContact O-N 3.21Å; I207-V473 HydrophobicContact CG2-CB 4.26Å; I207-V473 HydrophobicContact CG2-CG1 3.37Å; I207-V473 HydrophobicContact CG2-CG2 3.86Å; I207-F476 HydrophobicContact CD1-CD1 4.03Å; I207-F476 HydrophobicContact CD1-CE1 3.82Å
208	V	94.4	Very high	93.1	Very high	65 Å²	65	49.1 Å²	49.1	39%	0.394	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-48.8	-179	171	0	0	0	0	111	V204 L205 I206 V210 Y211 C212	V204-V208 HydrophobicContact CG1-CG2 4.25Å; V204-V208 WeakPolarHBondContact O-CB 3.32Å; V204-V208 VanDerWaalsContact O-CG2 3.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.36Å; V204-V208 PolarHBondContact O-N 2.92Å; L205-V208 PolarHBondContact O-N 2.92Å; I206-V208 PolarHBondContact O-N 2.96Å; V208-V210 VanDerWaalsContact C-N 3.34Å; V208-V210 PolarHBondContact O-N 3.47Å; V208-Y211 PolarHBondContact O-N 3.31Å; V208-C212 PolarHBondContact O-N 3.16Å; V208-C212 PolarHBondContact O-SG 3.05Å
209	C	97.5	Very high	93.7	Very high	71 Å²	71	51.5 Å²	51.5	48%	0.48	27%	0.267	S	S	.	.	H	α-helix	trans	-59.3	-44.3	178.6	-72.6	0	0	0	0	112.1	L205 I206 I207 Y211 C212 A213	L205-C209 VanDerWaalsContact O-CB 3.3Å; L205-C209 WeakPolarHBondContact O-CB 3.01Å; L205-C209 PolarHBondContact O-N 3.48Å; L205-C209 PolarHBondContact O-SG 2.92Å; I206-C209 PolarHBondContact O-N 3.19Å; I207-C209 PolarHBondContact O-N 3.2Å; C209-Y211 PolarHBondContact O-N 3.49Å; C209-C212 PolarHBondContact O-N 3.28Å; C209-A213 PolarHBondContact O-N 2.94Å
210	V	96.9	Very high	94.1	Very high	23 Å²	23	57.6 Å²	57.6	14%	0.139	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-40.2	178.2	173.2	0	0	0	0	111	S129 I130 I206 I207 V208 A213 I214	S129-V210 VanDerWaalsContact C-CG1 3.46Å; S129-V210 VanDerWaalsContact O-CG1 3.24Å; S129-V210 WeakPolarHBondContact O-CG1 3.33Å; I130-V210 HydrophobicContact CG1-CG2 3.92Å; I206-V210 HydrophobicContact CG2-CG2 4.36Å; I206-V210 WeakPolarHBondContact O-CB 3.12Å; I206-V210 WeakPolarHBondContact O-CG2 3.27Å; I206-V210 PolarHBondContact O-N 3.42Å; I207-V210 PolarHBondContact O-N 3.25Å; V208-V210 VanDerWaalsContact C-N 3.34Å; V208-V210 PolarHBondContact O-N 3.47Å; V210-A213 CarbonylContact O-C 3.6Å; V210-A213 WeakPolarHBondContact O-CA 3.37Å; V210-A213 WeakPolarHBondContact O-CB 3.49Å; V210-A213 PolarHBondContact O-N 3.11Å; V210-A213 VanDerWaalsContact O-N 3.14Å; V210-I214 HydrophobicContact CG1-CD1 4.07Å; V210-I214 HydrophobicContact CG1-CG1 4.45Å; V210-I214 WeakPolarHBondContact O-CG1 3.45Å; V210-I214 PolarHBondContact O-N 3.42Å
211	Y	95.7	Very high	94.4	Very high	34 Å²	34	57.6 Å²	57.6	13%	0.133	29%	0.291	C	S	.	.	H	α-helix	trans	-68.3	-37.3	176.9	-91.4	-98.7	0	0	0	113.2	S129 I207 V208 C209 A213 I214 Y215 M469 T470 V473	S129-Y211 WeakPolarHBondContact OG-CE2 3.43Å; I207-Y211 HydrophobicContact CG2-CD2 3.97Å; I207-Y211 HydrophobicContact CG2-CE2 4.19Å; I207-Y211 VanDerWaalsContact O-CD2 3.29Å; I207-Y211 WeakPolarHBondContact O-CD2 3.47Å; I207-Y211 PolarHBondContact O-N 3.21Å; V208-Y211 PolarHBondContact O-N 3.31Å; C209-Y211 PolarHBondContact O-N 3.49Å; Y211-A213 VanDerWaalsContact C-N 3.26Å; Y211-A213 PolarHBondContact O-N 3.11Å; Y211-I214 PolarHBondContact O-N 3.37Å; Y211-Y215 WeakPolarHBondContact O-CB 3.24Å; Y211-Y215 PolarHBondContact O-N 3.5Å; Y211-M469 VanDerWaalsContact OH-CB 3.31Å; Y211-M469 WeakPolarHBondContact OH-CB 3.17Å; Y211-M469 PolarHBondContact OH-O 3.36Å; Y211-T470 HydrophobicContact CE1-CG2 4.4Å; Y211-T470 WeakPolarHBondContact CE1-OG1 3.33Å; Y211-T470 PolarHBondContact OH-N 3.01Å; Y211-V473 HydrophobicContact CD2-CG1 4.5Å; Y211-V473 HydrophobicContact CD2-CG2 4.49Å; Y211-V473 HydrophobicContact CE2-CB 4.19Å; Y211-V473 HydrophobicContact CE2-CG1 4.27Å; Y211-V473 HydrophobicContact CE2-CG2 3.57Å; Y211-V473 WeakPolarHBondContact OH-CG2 3.3Å
212	C	96.9	Very high	94.3	Very high	73 Å²	73	56.1 Å²	56.1	49%	0.493	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-40	169.4	-69.1	0	0	0	0	111.2	V208 C209 S216	V208-C212 PolarHBondContact O-N 3.16Å; V208-C212 PolarHBondContact O-SG 3.05Å; C209-C212 PolarHBondContact O-N 3.28Å; C212-S216 WeakPolarHBondContact O-CB 3.3Å; C212-S216 PolarHBondContact O-N 3.24Å; C212-S216 PolarHBondContact O-OG 2.97Å
213	A	97.5	Very high	94.1	Very high	31 Å²	31	56.2 Å²	56.2	26%	0.256	29%	0.29	S	S	.	.	H	α-helix	trans	-67.8	-41.2	176.6	0	0	0	0	0	112.4	Y133 C209 V210 Y211 S216 A217	Y133-A213 HydrophobicContact CD2-CB 3.81Å; Y133-A213 HydrophobicContact CE2-CB 3.55Å; C209-A213 PolarHBondContact O-N 2.94Å; V210-A213 CarbonylContact O-C 3.6Å; V210-A213 WeakPolarHBondContact O-CA 3.37Å; V210-A213 WeakPolarHBondContact O-CB 3.49Å; V210-A213 PolarHBondContact O-N 3.11Å; V210-A213 VanDerWaalsContact O-N 3.14Å; Y211-A213 VanDerWaalsContact C-N 3.26Å; Y211-A213 PolarHBondContact O-N 3.11Å; A213-S216 PolarHBondContact O-N 3.04Å; A213-A217 WeakPolarHBondContact O-CB 3.25Å; A213-A217 PolarHBondContact O-N 3.3Å
214	I	96.4	Very high	93.8	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.015	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-50.4	173.6	-69.7	167.9	0	0	0	110.2	R132 Y133 V210 Y211 S216 A217 I218 V466	R132-I214 HydrophobicContact CB-CD1 4.23Å; Y133-I214 HydrophobicContact CD2-CG1 3.99Å; Y133-I214 HydrophobicContact CG-CG1 4.42Å; V210-I214 HydrophobicContact CG1-CD1 4.07Å; V210-I214 HydrophobicContact CG1-CG1 4.45Å; V210-I214 WeakPolarHBondContact O-CG1 3.45Å; V210-I214 PolarHBondContact O-N 3.42Å; Y211-I214 PolarHBondContact O-N 3.37Å; I214-S216 VanDerWaalsContact C-N 3.3Å; I214-S216 PolarHBondContact O-N 2.92Å; I214-A217 WeakPolarHBondContact O-CB 3.5Å; I214-A217 PolarHBondContact O-N 2.91Å; I214-A217 VanDerWaalsContact O-N 3.13Å; I214-I218 HydrophobicContact CG2-CD1 3.74Å; I214-I218 HydrophobicContact CG2-CG1 4.46Å; I214-I218 WeakPolarHBondContact O-CG1 3.31Å; I214-I218 PolarHBondContact O-N 3.29Å; I214-V466 HydrophobicContact CG2-CG1 3.86Å; I214-V466 HydrophobicContact CG2-CG2 4.39Å
215	Y	96.1	Very high	93.2	Very high	157 Å²	157	63.6 Å²	63.6	62%	0.616	32%	0.317	S	S	*	.	H	α-helix	trans	-57.8	-45.3	177.9	176.8	-97.7	0	0	0	111.5	Y211 A217 I218 R219	Y211-Y215 WeakPolarHBondContact O-CB 3.24Å; Y211-Y215 PolarHBondContact O-N 3.5Å; Y215-A217 VanDerWaalsContact C-N 3.32Å; Y215-A217 PolarHBondContact O-N 2.89Å; Y215-I218 PolarHBondContact O-N 2.89Å; Y215-R219 WeakPolarHBondContact O-CB 3.45Å; Y215-R219 PolarHBondContact O-N 2.92Å
216	S	96.5	Very high	92.4	Very high	55 Å²	55	64.2 Å²	64.2	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-63.4	-36.7	177.2	-60.3	0	0	0	0	112.4	C212 A213 I214 R220	C212-S216 WeakPolarHBondContact O-CB 3.3Å; C212-S216 PolarHBondContact O-N 3.24Å; C212-S216 PolarHBondContact O-OG 2.97Å; A213-S216 PolarHBondContact O-N 3.04Å; I214-S216 VanDerWaalsContact C-N 3.3Å; I214-S216 PolarHBondContact O-N 2.92Å; S216-R220 WeakPolarHBondContact O-CB 3.35Å; S216-R220 VanDerWaalsContact O-CG 3.29Å; S216-R220 WeakPolarHBondContact O-CG 3.27Å; S216-R220 PolarHBondContact O-N 3.44Å; S216-R220 PolarHBondContact O-NE 2.85Å
217	A	95	Very high	91.4	Very high	11 Å²	11	66.9 Å²	66.9	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-65.5	-46.4	173.8	0	0	0	0	0	111.8	V136 T137 A213 I214 Y215 R219 R220 H221	V136-A217 HydrophobicContact CG1-CB 4.32Å; T137-A217 HydrophobicContact CG2-CB 3.86Å; A213-A217 WeakPolarHBondContact O-CB 3.25Å; A213-A217 PolarHBondContact O-N 3.3Å; I214-A217 WeakPolarHBondContact O-CB 3.5Å; I214-A217 PolarHBondContact O-N 2.91Å; I214-A217 VanDerWaalsContact O-N 3.13Å; Y215-A217 VanDerWaalsContact C-N 3.32Å; Y215-A217 PolarHBondContact O-N 2.89Å; A217-R219 PolarHBondContact O-N 3.26Å; A217-R220 PolarHBondContact O-N 3.05Å; A217-H221 PolarHBondContact O-N 3.28Å
218	I	94.2	Very high	90.3	Very high	37 Å²	37	71.7 Å²	71.7	19%	0.19	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-44.2	177.2	-66.1	164	0	0	0	110.8	V136 I214 Y215 R220 H221 S222 F459 L463	V136-I218 HydrophobicContact CG1-CG1 3.99Å; I214-I218 HydrophobicContact CG2-CD1 3.74Å; I214-I218 HydrophobicContact CG2-CG1 4.46Å; I214-I218 WeakPolarHBondContact O-CG1 3.31Å; I214-I218 PolarHBondContact O-N 3.29Å; Y215-I218 PolarHBondContact O-N 2.89Å; I218-R220 PolarHBondContact O-N 2.87Å; I218-H221 PolarHBondContact O-N 3.15Å; I218-S222 PolarHBondContact O-N 3.29Å; I218-F459 HydrophobicContact CG1-CZ 4.3Å; I218-L463 HydrophobicContact CD1-CD1 3.63Å; I218-L463 HydrophobicContact CG1-CD1 4.3Å
219	R	94.6	Very high	88.9	Confident	151 Å²	151	75.8 Å²	75.8	57%	0.57	36%	0.359	S	S	*	.	H	α-helix	trans	-62.8	-41.9	177.8	-173.6	177	178.2	-141.6	0.6	111.8	Y215 A217 S222 I223	Y215-R219 WeakPolarHBondContact O-CB 3.45Å; Y215-R219 PolarHBondContact O-N 2.92Å; A217-R219 PolarHBondContact O-N 3.26Å; R219-S222 PolarHBondContact O-N 3.39Å; R219-S222 PolarHBondContact O-OG 3.22Å; R219-I223 HydrophobicContact CG-CD1 4.07Å; R219-I223 VanDerWaalsContact O-CG1 3.27Å; R219-I223 WeakPolarHBondContact O-CG1 3.39Å; R219-I223 PolarHBondContact O-N 3.44Å
220	R	92.3	Very high	86.5	Confident	137 Å²	137	79.5 Å²	79.5	52%	0.517	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-43.4	175	-76.7	-178.8	-70.6	-178.5	0.5	111.7	S216 A217 I218 I223 R224	S216-R220 WeakPolarHBondContact O-CB 3.35Å; S216-R220 VanDerWaalsContact O-CG 3.29Å; S216-R220 WeakPolarHBondContact O-CG 3.27Å; S216-R220 PolarHBondContact O-N 3.44Å; S216-R220 PolarHBondContact O-NE 2.85Å; A217-R220 PolarHBondContact O-N 3.05Å; I218-R220 PolarHBondContact O-N 2.87Å; R220-I223 PolarHBondContact O-N 3.01Å; R220-R224 WeakPolarHBondContact O-CG 3.44Å; R220-R224 PolarHBondContact O-N 3.24Å
221	H	88.8	Confident	84.4	Confident	24 Å²	24	82.6 Å²	82.6	11%	0.111	39%	0.386	C	S	.	.	H	α-helix	trans	-63.8	-43.9	176.6	-179.8	65.5	0	0	0	112	A217 I218 I223 R224 C225 Y455 F459	A217-H221 PolarHBondContact O-N 3.28Å; I218-H221 PolarHBondContact O-N 3.15Å; H221-I223 VanDerWaalsContact C-N 3.32Å; H221-I223 PolarHBondContact O-N 3.27Å; H221-R224 PolarHBondContact O-N 2.89Å; H221-C225 PolarHBondContact CE1-SG 2.8Å; H221-C225 PolarHBondContact NE2-SG 3.46Å; H221-C225 PolarHBondContact O-N 3.27Å; H221-C225 PolarHBondContact O-SG 3.06Å; H221-C225 VanDerWaalsContact O-SG 3.37Å; H221-Y455 AromaticContact CE1-CE1 3.35Å; H221-Y455 WeakPolarHBondContact CE1-CE1 3.11Å; H221-Y455 AromaticContact ND1-CE1 3.77Å; H221-F459 HydrophobicContact CB-CE2 4.16Å; H221-F459 HydrophobicContact CB-CZ 4.04Å; H221-F459 AromaticContact CD2-CD1 3.58Å; H221-F459 AromaticContact CD2-CE1 3.23Å; H221-F459 WeakPolarHBondContact CD2-CE1 3.33Å; H221-F459 AromaticContact CD2-CE2 3.78Å; H221-F459 AromaticContact CD2-CZ 3.34Å; H221-F459 WeakPolarHBondContact CD2-CZ 3.34Å; H221-F459 AromaticContact CG-CE2 3.94Å; H221-F459 AromaticContact CG-CZ 3.84Å; H221-F459 AromaticContact NE2-CD1 3.64Å; H221-F459 AromaticContact NE2-CE1 3.8Å; H221-F459 AromaticContact NE2-CG 3.97Å
222	S	88	Confident	82.1	Confident	46 Å²	46	87.3 Å²	87.3	32%	0.322	41%	0.409	S	S	.	.	H	α-helix	trans	-63.4	-37.4	178.7	74.2	0	0	0	0	112.6	I218 R219 R226	I218-S222 PolarHBondContact O-N 3.29Å; R219-S222 PolarHBondContact O-N 3.39Å; R219-S222 PolarHBondContact O-OG 3.22Å; S222-R226 VanDerWaalsContact O-CG 3.27Å; S222-R226 WeakPolarHBondContact O-CG 3.25Å; S222-R226 PolarHBondContact O-N 3.04Å
223	I	87.5	Confident	79.3	Confident	70 Å²	70	87.5 Å²	87.5	36%	0.359	41%	0.408	S	S	.	.	H	α-helix	trans	-64.7	-46.5	173.8	-67.9	166.3	0	0	0	110.9	R219 R220 H221 C225 R226 Q227	R219-I223 HydrophobicContact CG-CD1 4.07Å; R219-I223 VanDerWaalsContact O-CG1 3.27Å; R219-I223 WeakPolarHBondContact O-CG1 3.39Å; R219-I223 PolarHBondContact O-N 3.44Å; R220-I223 PolarHBondContact O-N 3.01Å; H221-I223 VanDerWaalsContact C-N 3.32Å; H221-I223 PolarHBondContact O-N 3.27Å; I223-C225 PolarHBondContact O-N 3.33Å; I223-R226 WeakPolarHBondContact O-CB 3.32Å; I223-R226 PolarHBondContact O-N 3.28Å; I223-Q227 WeakPolarHBondContact O-CG 3.21Å; I223-Q227 PolarHBondContact O-N 2.79Å
224	R	85.5	Confident	76.2	Confident	166 Å²	166	89.9 Å²	89.9	63%	0.626	42%	0.42	S	S	*	.	H	α-helix	trans	-59.4	-45.9	177.3	-74.5	178.3	179.3	176.1	-1.3	111.9	R220 H221 R226 Q227 M228	R220-R224 WeakPolarHBondContact O-CG 3.44Å; R220-R224 PolarHBondContact O-N 3.24Å; H221-R224 PolarHBondContact O-N 2.89Å; R224-R226 VanDerWaalsContact C-N 3.34Å; R224-R226 PolarHBondContact O-N 2.66Å; R224-Q227 PolarHBondContact O-N 3.06Å; R224-M228 PolarHBondContact O-N 3.2Å
225	C	80.5	Confident	73.3	Confident	13 Å²	13	93.5 Å²	93.5	9%	0.088	44%	0.439	C	S	.	.	H	α-helix	trans	-59.2	-45.1	175.7	-69.4	0	0	0	0	111.4	H221 I223 Q227 M228 F229 Q456	H221-C225 PolarHBondContact CE1-SG 2.8Å; H221-C225 PolarHBondContact NE2-SG 3.46Å; H221-C225 PolarHBondContact O-N 3.27Å; H221-C225 PolarHBondContact O-SG 3.06Å; H221-C225 VanDerWaalsContact O-SG 3.37Å; I223-C225 PolarHBondContact O-N 3.33Å; C225-Q227 VanDerWaalsContact C-N 3.31Å; C225-Q227 PolarHBondContact O-N 3.43Å; C225-M228 PolarHBondContact O-N 3.03Å; C225-F229 HydrophobicContact CB-CE2 4.31Å; C225-F229 WeakPolarHBondContact O-CD2 3.34Å; C225-F229 PolarHBondContact O-N 3.37Å; C225-Q456 PolarHBondContact SG-NE2 3Å
226	R	76.4	Confident	70.6	Confident	122 Å²	122	89 Å²	89	46%	0.46	43%	0.428	S	S	.	.	H	α-helix	trans	-60.1	-39.4	176.7	-74.4	172.6	-179.1	-163.6	-1.2	112.7	S222 I223 R224 K230	S222-R226 VanDerWaalsContact O-CG 3.27Å; S222-R226 WeakPolarHBondContact O-CG 3.25Å; S222-R226 PolarHBondContact O-N 3.04Å; I223-R226 WeakPolarHBondContact O-CB 3.32Å; I223-R226 PolarHBondContact O-N 3.28Å; R224-R226 VanDerWaalsContact C-N 3.34Å; R224-R226 PolarHBondContact O-N 2.66Å; R226-K230 WeakPolarHBondContact O-CG 3.31Å; R226-K230 PolarHBondContact O-N 3.37Å; R226-K230 VanDerWaalsContact O-N 3.1Å
227	Q	75	Confident	67.5	Low	116 Å²	116	92.4 Å²	92.4	54%	0.542	44%	0.437	S	S	.	.	H	α-helix	trans	-66.5	-43.5	177	-73	173.2	-23.9	0	0	111.6	I223 R224 C225 F229 K230 V231	I223-Q227 WeakPolarHBondContact O-CG 3.21Å; I223-Q227 PolarHBondContact O-N 2.79Å; R224-Q227 PolarHBondContact O-N 3.06Å; C225-Q227 VanDerWaalsContact C-N 3.31Å; C225-Q227 PolarHBondContact O-N 3.43Å; Q227-F229 VanDerWaalsContact C-N 3.35Å; Q227-F229 PolarHBondContact O-N 2.97Å; Q227-K230 PolarHBondContact O-N 3.12Å; Q227-V231 WeakPolarHBondContact O-CG2 3.43Å; Q227-V231 PolarHBondContact O-N 2.82Å
228	M	70.9	Confident	64.5	Low	100 Å²	100	96.9 Å²	96.9	49%	0.493	46%	0.456	S	S	.	.	H	α-helix	trans	-60.5	-43.2	176.3	-69.9	-159.9	-72.3	0	0	112.1	R224 C225 K230 V231 H232	R224-M228 PolarHBondContact O-N 3.2Å; C225-M228 PolarHBondContact O-N 3.03Å; M228-K230 PolarHBondContact O-N 3.19Å; M228-V231 PolarHBondContact O-N 3.01Å; M228-H232 WeakPolarHBondContact O-CB 3.46Å; M228-H232 PolarHBondContact O-N 3.34Å
229	F	63.9	Low	61.6	Low	151 Å²	151	99.9 Å²	99.9	66%	0.662	47%	0.473	S	S	*	.	H	α-helix	trans	-64	-39.4	176.2	-71.9	-62.7	0	0	0	112.7	C225 Q227 H232 T233	C225-F229 HydrophobicContact CB-CE2 4.31Å; C225-F229 WeakPolarHBondContact O-CD2 3.34Å; C225-F229 PolarHBondContact O-N 3.37Å; Q227-F229 VanDerWaalsContact C-N 3.35Å; Q227-F229 PolarHBondContact O-N 2.97Å; F229-H232 PolarHBondContact O-N 3.23Å; F229-T233 WeakPolarHBondContact O-CG2 3.39Å; F229-T233 PolarHBondContact O-N 3.11Å; F229-T233 PolarHBondContact O-OG1 3.36Å; F229-T233 VanDerWaalsContact O-OG1 3.14Å
230	K	48.7	Very low	58.7	Low	150 Å²	150	98 Å²	98	65%	0.652	47%	0.47	S	S	*	.	H	α-helix	trans	-63	-46.2	175.3	-76.2	-177.6	178.5	-170.3	0	112.4	R226 Q227 M228 H232 T233 V234	R226-K230 WeakPolarHBondContact O-CG 3.31Å; R226-K230 PolarHBondContact O-N 3.37Å; R226-K230 VanDerWaalsContact O-N 3.1Å; Q227-K230 PolarHBondContact O-N 3.12Å; M228-K230 PolarHBondContact O-N 3.19Å; K230-H232 VanDerWaalsContact C-N 3.34Å; K230-H232 PolarHBondContact O-N 2.59Å; K230-T233 WeakPolarHBondContact CA-OG1 3.14Å; K230-T233 PolarHBondContact O-N 3.16Å; K230-T233 PolarHBondContact O-OG1 3.09Å; K230-V234 WeakPolarHBondContact O-CG2 3.43Å; K230-V234 PolarHBondContact O-N 2.71Å
231	V	51.3	Low	55.7	Low	87 Å²	87	95 Å²	95	53%	0.527	47%	0.47	S	S	.	.	H	α-helix	trans	-62.8	-43.4	179	174.1	0	0	0	0	110.5	Q227 M228 T233 V234 N235	Q227-V231 WeakPolarHBondContact O-CG2 3.43Å; Q227-V231 PolarHBondContact O-N 2.82Å; M228-V231 PolarHBondContact O-N 3.01Å; V231-T233 PolarHBondContact O-N 3.18Å; V231-V234 PolarHBondContact O-N 3.05Å; V231-N235 PolarHBondContact O-N 3.39Å
232	H	47.6	Very low	52.8	Low	133 Å²	133	102.3 Å²	102.3	62%	0.616	50%	0.497	S	S	*	.	H	α-helix	trans	-62.2	-41.7	177.2	-160.9	67.6	0	0	0	111.9	M228 F229 K230 V234 V236	M228-H232 WeakPolarHBondContact O-CB 3.46Å; M228-H232 PolarHBondContact O-N 3.34Å; F229-H232 PolarHBondContact O-N 3.23Å; K230-H232 VanDerWaalsContact C-N 3.34Å; K230-H232 PolarHBondContact O-N 2.59Å; H232-V234 PolarHBondContact O-N 3.15Å; H232-V236 VanDerWaalsContact O-CG2 3.25Å; H232-V236 WeakPolarHBondContact O-CG2 3.29Å; H232-V236 PolarHBondContact O-N 2.84Å; H232-V236 VanDerWaalsContact O-N 3.16Å
233	T	38.7	Very low	50.2	Low	78 Å²	78	105.5 Å²	105.5	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.6	48.7	0	0	0	0	113.5	F229 K230 V231 H237	F229-T233 WeakPolarHBondContact O-CG2 3.39Å; F229-T233 PolarHBondContact O-N 3.11Å; F229-T233 PolarHBondContact O-OG1 3.36Å; F229-T233 VanDerWaalsContact O-OG1 3.14Å; K230-T233 WeakPolarHBondContact CA-OG1 3.14Å; K230-T233 PolarHBondContact O-N 3.16Å; K230-T233 PolarHBondContact O-OG1 3.09Å; V231-T233 PolarHBondContact O-N 3.18Å; T233-H237 PolarHBondContact O-N 3.37Å; T233-H237 PolarHBondContact O-ND1 2.94Å
234	V	32.4	Very low	47.6	Very low	81 Å²	81	110 Å²	110	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-68.9	-43.1	180	172.3	0	0	0	0	111.4	K230 V231 H232 V236 H237 Q238	K230-V234 WeakPolarHBondContact O-CG2 3.43Å; K230-V234 PolarHBondContact O-N 2.71Å; V231-V234 PolarHBondContact O-N 3.05Å; H232-V234 PolarHBondContact O-N 3.15Å; V234-V236 VanDerWaalsContact C-N 3.34Å; V234-V236 PolarHBondContact O-N 3.46Å; V234-H237 PolarHBondContact O-N 3.46Å; V234-Q238 PolarHBondContact O-N 3.05Å
235	N	35	Very low	44.8	Very low	79 Å²	79	110.2 Å²	110.2	42%	0.422	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-39.6	178.8	-70	-9	0	0	0	111.7	V231 H237 Q238 D239	V231-N235 PolarHBondContact O-N 3.39Å; N235-H237 VanDerWaalsContact C-N 3.31Å; N235-H237 PolarHBondContact O-N 2.9Å; N235-Q238 PolarHBondContact O-N 3.31Å; N235-D239 PolarHBondContact O-N 3.33Å
236	V	40.6	Very low	42.3	Very low	63 Å²	63	119.7 Å²	119.7	38%	0.382	57%	0.57	S	S	.	*	H	α-helix	trans	-58.9	-42.9	174.1	172.7	0	0	0	0	110.9	H232 V234 H240	H232-V236 VanDerWaalsContact O-CG2 3.25Å; H232-V236 WeakPolarHBondContact O-CG2 3.29Å; H232-V236 PolarHBondContact O-N 2.84Å; H232-V236 VanDerWaalsContact O-N 3.16Å; V234-V236 VanDerWaalsContact C-N 3.34Å; V234-V236 PolarHBondContact O-N 3.46Å; V236-H240 PolarHBondContact O-CD2 2.93Å; V236-H240 PolarHBondContact O-N 2.91Å
237	H	30.3	Very low	39.9	Very low	125 Å²	125	121.4 Å²	121.4	58%	0.579	58%	0.583	S	S	*	*	H	α-helix	trans	-68.3	-37.7	176.7	-74	58.1	0	0	0	112.8	T233 V234 N235 H240 S241	T233-H237 PolarHBondContact O-N 3.37Å; T233-H237 PolarHBondContact O-ND1 2.94Å; V234-H237 PolarHBondContact O-N 3.46Å; N235-H237 VanDerWaalsContact C-N 3.31Å; N235-H237 PolarHBondContact O-N 2.9Å; H237-H240 PolarHBondContact O-N 2.92Å; H237-S241 PolarHBondContact O-N 2.96Å; H237-S241 PolarHBondContact O-OG 2.93Å
238	Q	31.7	Very low	37.9	Very low	106 Å²	106	121.7 Å²	121.7	50%	0.495	60%	0.595	S	S	.	*	H	α-helix	trans	-71.2	-37.2	178.4	-89	-175.3	-21.3	0	0	113.6	V234 N235 H240 S241 R242	V234-Q238 PolarHBondContact O-N 3.05Å; N235-Q238 PolarHBondContact O-N 3.31Å; Q238-H240 VanDerWaalsContact C-N 3.25Å; Q238-H240 PolarHBondContact O-N 3Å; Q238-S241 PolarHBondContact O-N 3.04Å; Q238-R242 PolarHBondContact O-N 2.83Å
239	D	33.9	Very low	36	Very low	100 Å²	100	122.2 Å²	122.2	54%	0.535	61%	0.608	S	S	.	*	H	α-helix	trans	-66.4	-29.4	174.2	-82	-21.9	0	0	0	111.7	N235 N243	N235-D239 PolarHBondContact O-N 3.33Å; D239-N243 PolarHBondContact O-N 3.16Å; D239-N243 PolarHBondContact O-ND2 2.89Å
240	H	34.6	Very low	34.2	Very low	110 Å²	110	122.2 Å²	122.2	51%	0.509	62%	0.615	S	S	.	*	H	α-helix	trans	-67.6	-48.6	168.3	-79	-61.7	0	0	0	112.2	V236 H237 Q238 N243 F244	V236-H240 PolarHBondContact O-CD2 2.93Å; V236-H240 PolarHBondContact O-N 2.91Å; H237-H240 PolarHBondContact O-N 2.92Å; Q238-H240 VanDerWaalsContact C-N 3.25Å; Q238-H240 PolarHBondContact O-N 3Å; H240-N243 PolarHBondContact O-N 3.05Å; H240-F244 PolarHBondContact O-N 3.45Å; H240-F244 VanDerWaalsContact O-N 3.11Å
241	S	27.6	Very low	33.2	Very low	75 Å²	75	121.2 Å²	121.2	52%	0.524	62%	0.622	S	S	.	*	H	α-helix	trans	-67.6	-36.6	-178.7	-68.5	0	0	0	0	114.2	H237 Q238 N243 F244 Q245	H237-S241 PolarHBondContact O-N 2.96Å; H237-S241 PolarHBondContact O-OG 2.93Å; Q238-S241 PolarHBondContact O-N 3.04Å; S241-N243 VanDerWaalsContact C-N 3.31Å; S241-N243 PolarHBondContact O-N 3.39Å; S241-F244 PolarHBondContact O-N 3.21Å; S241-Q245 PolarHBondContact O-N 3.5Å
242	R	28.4	Very low	32	Very low	177 Å²	177	123.5 Å²	123.5	67%	0.668	64%	0.636	S	S	*	*	H	α-helix	trans	-68.3	-29.7	176.7	-80.6	-175.8	176.1	175.7	0.4	113.1	Q238	Q238-R242 PolarHBondContact O-N 2.83Å
243	N	33.5	Very low	30.8	Very low	114 Å²	114	125.4 Å²	125.4	61%	0.61	65%	0.647	S	S	*	*	H	α-helix	trans	-80.5	-25.9	174.8	-76.4	-39.4	0	0	0	112.7	D239 H240 S241	D239-N243 PolarHBondContact O-N 3.16Å; D239-N243 PolarHBondContact O-ND2 2.89Å; H240-N243 PolarHBondContact O-N 3.05Å; S241-N243 VanDerWaalsContact C-N 3.31Å; S241-N243 PolarHBondContact O-N 3.39Å
244	F	32.2	Very low	30.1	Very low	163 Å²	163	128.4 Å²	128.4	72%	0.715	66%	0.661	S	S	*	*	H	α-helix	trans	-75.7	-31.7	176.5	-151.7	-97.2	0	0	0	113	H240 S241 R246	H240-F244 PolarHBondContact O-N 3.45Å; H240-F244 VanDerWaalsContact O-N 3.11Å; S241-F244 PolarHBondContact O-N 3.21Å; F244-R246 VanDerWaalsContact C-N 3.3Å; F244-R246 PolarHBondContact O-N 3.45Å
245	Q	26.8	Very low	29.9	Very low	171 Å²	171	129.1 Å²	129.1	80%	0.799	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-4.9	-179.8	-75.8	-172.8	-21.5	0	0	115.5	S241 Q247	S241-Q245 PolarHBondContact O-N 3.5Å; Q245-Q247 VanDerWaalsContact C-N 3.32Å; Q245-Q247 PolarHBondContact O-N 2.84Å
246	R	29.2	Very low	29.4	Very low	212 Å²	212	136.1 Å²	136.1	80%	0.8	69%	0.691	S	S	*	*			trans	-92.8	64.2	169.9	-71.9	-173.8	179.3	179.2	0.6	110.8	F244	F244-R246 VanDerWaalsContact C-N 3.3Å; F244-R246 PolarHBondContact O-N 3.45Å
247	Q	26.8	Very low	28.7	Very low	158 Å²	158	145.2 Å²	145.2	74%	0.738	72%	0.719	S	S	*	*			trans	-102	102.2	153.5	-79.1	-176.7	-14.4	0	0	106.9	Q245 S249	Q245-Q247 VanDerWaalsContact C-N 3.32Å; Q245-Q247 PolarHBondContact O-N 2.84Å; Q247-S249 PolarHBondContact O-N 3.44Å
248	P	31.8	Very low	28.6	Very low	122 Å²	122	148.9 Å²	148.9	79%	0.792	73%	0.733	S	S	*	*			trans	-71.7	118.6	169.1	0.1	16.6	0	0	0	107.6
249	S	30.7	Very low	28.5	Very low	111 Å²	111	149.3 Å²	149.3	78%	0.776	75%	0.747	S	S	*	*			trans	-52.6	143.9	161.1	24	0	0	0	0	110.7	Q247 T251	Q247-S249 PolarHBondContact O-N 3.44Å; S249-T251 PolarHBondContact O-N 3.35Å
250	D	25.8	Very low	28.3	Very low	151 Å²	151	149.3 Å²	149.3	81%	0.807	76%	0.755	S	S	*	*			trans	-34.4	124.3	-179.3	-56.4	-61.4	0	0	0	115
251	T	28.5	Very low	27.9	Very low	129 Å²	129	154 Å²	154	79%	0.791	77%	0.769	S	S	*	*				179.1	134.7	117.3	17.2	0	0	0	0	112.9	S249	S249-T251 PolarHBondContact O-N 3.35Å
252	T	25.2	Very low	27.7	Very low	135 Å²	135	159.3 Å²	159.3	83%	0.828	78%	0.782	S	S	*	*			trans	72.2	113.6	152	45.7	0	0	0	0	120.8	N254	T252-N254 PolarHBondContact O-N 2.93Å
253	M	22.4	Very low	27.5	Very low	173 Å²	173	155.6 Å²	155.6	85%	0.852	78%	0.781	S	S	*	*			trans	-34.9	126.7	153.4	-79.3	173.4	53.1	0	0	113.1
254	N	25.3	Very low	27.2	Very low	142 Å²	142	156.5 Å²	156.5	76%	0.759	79%	0.785	S	S	*	*				-169.2	131.1	119.2	-95.5	-20.1	0	0	0	112.7	T252	T252-N254 PolarHBondContact O-N 2.93Å
255	S	27	Very low	26.8	Very low	96 Å²	96	154.2 Å²	154.2	67%	0.671	79%	0.785	S	S	*	*			trans	28.3	101.7	151.8	61.4	0	0	0	0	119.2
256	Y	25.3	Very low	26.9	Very low	225 Å²	225	150.7 Å²	150.7	88%	0.882	77%	0.77	S	S	*	*				171	107.2	114.2	-102.4	-85.7	0	0	0	107.6	K258	Y256-K258 PolarHBondContact O-N 3.48Å
257	R	25.4	Very low	27	Very low	255 Å²	255	143.5 Å²	143.5	96%	0.962	76%	0.756	S	S	*	*			trans	-60.5	98.6	179.2	-87.5	175.4	169.1	161.4	-4	110.7
258	K	28.7	Very low	27.2	Very low	202 Å²	202	144.6 Å²	144.6	88%	0.878	76%	0.762	S	S	*	*			trans	-89.9	113.1	151.1	-86.9	-177.8	176.5	177	0	108.1	Y256 S260	Y256-K258 PolarHBondContact O-N 3.48Å; K258-S260 PolarHBondContact O-N 3.24Å
259	S	29.7	Very low	27.3	Very low	114 Å²	114	146 Å²	146	80%	0.797	75%	0.752	S	S	*	*			trans	-59.7	99.8	175.1	-176.5	0	0	0	0	110	R261	S259-R261 PolarHBondContact O-N 2.84Å
260	S	28.8	Very low	27.2	Very low	100 Å²	100	143.7 Å²	143.7	70%	0.699	74%	0.736	S	S	*	*			trans	-85.5	96.5	173	-179.8	0	0	0	0	108.5	K258 K262	K258-S260 PolarHBondContact O-N 3.24Å; S260-K262 PolarHBondContact O-N 3.44Å
261	R	26.9	Very low	27.7	Very low	209 Å²	209	140.6 Å²	140.6	79%	0.789	72%	0.719	S	S	*	*			trans	-64.8	96.8	165.4	-73.1	-178.6	178.9	163.1	2.8	107.7	S259	S259-R261 PolarHBondContact O-N 2.84Å
262	K	24.3	Very low	27.8	Very low	186 Å²	186	138.9 Å²	138.9	81%	0.809	71%	0.712	S	S	*	*			trans	-66.3	129.3	170.8	-70.7	-175.6	-179.9	-178.3	0	108.9	S260	S260-K262 PolarHBondContact O-N 3.44Å
263	P	23.4	Very low	28	Very low	100 Å²	100	138.8 Å²	138.8	65%	0.649	71%	0.707	S	S	*	*			trans	-64.6	144.8	179.9	25.2	-32	0	0	0	111.3	V265	P263-V265 PolarHBondContact O-N 3.19Å; P263-V265 VanDerWaalsContact O-N 3.08Å
264	L	26.1	Very low	28.7	Very low	133 Å²	133	133.6 Å²	133.6	70%	0.696	68%	0.682	S	S	*	*			trans	-62.5	105.2	176.7	-165.7	86.1	0	0	0	109.3	L266 L289	L264-L266 PolarHBondContact O-N 3.13Å; L264-L289 HydrophobicContact CD2-CD2 4.18Å
265	V	25.7	Very low	29	Very low	115 Å²	115	130.1 Å²	130.1	70%	0.697	68%	0.679	S	S	*	*			trans	-77.3	113.8	176.7	-179.4	0	0	0	0	108.4	P263 A267	P263-V265 PolarHBondContact O-N 3.19Å; P263-V265 VanDerWaalsContact O-N 3.08Å; V265-A267 PolarHBondContact O-N 3.4Å
266	L	28.7	Very low	29.5	Very low	96 Å²	96	128.3 Å²	128.3	50%	0.503	66%	0.662	S	S	.	*			trans	-68.6	117.4	165.3	-164.3	81	0	0	0	106.7	L264 E268 L289	L264-L266 PolarHBondContact O-N 3.13Å; L266-E268 PolarHBondContact O-N 3.27Å; L266-L289 HydrophobicContact CD1-CD1 4.05Å; L266-L289 HydrophobicContact CD1-CD2 3.51Å; L266-L289 HydrophobicContact CD1-CG 3.81Å
267	A	31.5	Very low	29.9	Very low	61 Å²	61	122.4 Å²	122.4	50%	0.504	65%	0.651	S	S	.	*			trans	-53.6	135.3	-179.4	0	0	0	0	0	111	V265 Y269	V265-A267 PolarHBondContact O-N 3.4Å; A267-Y269 HydrophobicContact CB-CE2 4.33Å; A267-Y269 VanDerWaalsContact O-CD2 3.26Å; A267-Y269 WeakPolarHBondContact O-CD2 2.93Å; A267-Y269 PolarHBondContact O-N 2.93Å
268	E	29	Very low	30.5	Very low	182 Å²	182	114.3 Å²	114.3	85%	0.85	63%	0.625	S	S	*	*			trans	-71.7	113.7	178.4	-144.3	171.9	-156.9	0	0	108.5	L266	L266-E268 PolarHBondContact O-N 3.27Å
269	Y	34.7	Very low	30.9	Very low	151 Å²	151	109.6 Å²	109.6	59%	0.592	62%	0.618	S	S	*	*			trans	-98.2	113	173.3	-69.6	-89.1	0	0	0	109.4	A267 L274 F287	A267-Y269 HydrophobicContact CB-CE2 4.33Å; A267-Y269 VanDerWaalsContact O-CD2 3.26Å; A267-Y269 WeakPolarHBondContact O-CD2 2.93Å; A267-Y269 PolarHBondContact O-N 2.93Å; Y269-L274 HydrophobicContact CG-CD1 4.48Å; Y269-F287 HydrophobicContact CD2-CE1 4.24Å
270	S	29.6	Very low	31	Very low	63 Å²	63	107.9 Å²	107.9	44%	0.441	60%	0.602	S	S	.	*			trans	-66.9	131.8	166.7	-179.9	0	0	0	0	109.6	S272 N273	S270-S272 WeakPolarHBondContact CB-OG 3.44Å; S270-S272 PolarHBondContact O-N 2.9Å; S270-S272 VanDerWaalsContact O-N 3.08Å; S270-S272 PolarHBondContact OG-N 3.28Å; S270-S272 PolarHBondContact OG-OG 3.1Å; S270-N273 PolarHBondContact O-N 3.33Å
271	L	35.4	Very low	31.4	Very low	86 Å²	86	109 Å²	109	45%	0.45	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-57.7	-24.4	178.2	-132	81.5	0	0	0	112.4	N273 L274 L283	L271-N273 PolarHBondContact O-N 2.89Å; L271-L274 PolarHBondContact O-N 3.1Å; L271-L283 HydrophobicContact CD1-CD2 4.03Å; L271-L283 HydrophobicContact CD2-CD2 4.49Å
272	S	31.5	Very low	31.7	Very low	92 Å²	92	102.2 Å²	102.2	64%	0.643	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-60.5	-28.9	173.5	60.2	0	0	0	0	113.1	S270	S270-S272 WeakPolarHBondContact CB-OG 3.44Å; S270-S272 PolarHBondContact O-N 2.9Å; S270-S272 VanDerWaalsContact O-N 3.08Å; S270-S272 PolarHBondContact OG-N 3.28Å; S270-S272 PolarHBondContact OG-OG 3.1Å
273	N	28.7	Very low	32.4	Very low	133 Å²	133	94.9 Å²	94.9	71%	0.711	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-95.3	-8.1	-172.5	-62.7	3.8	0	0	0	113	S270 L271	S270-N273 PolarHBondContact O-N 3.33Å; L271-N273 PolarHBondContact O-N 2.89Å
274	L	36.2	Very low	32.8	Very low	65 Å²	65	94.4 Å²	94.4	34%	0.34	55%	0.546	S	S	.	.	S	Bend	trans	-87.1	-4.1	179.9	-82.8	109	0	0	0	114.2	Y269 L271 I276 L285	Y269-L274 HydrophobicContact CG-CD1 4.48Å; L271-L274 PolarHBondContact O-N 3.1Å; L274-I276 HydrophobicContact CB-CD1 3.84Å; L274-I276 HydrophobicContact CB-CG1 3.77Å; L274-I276 HydrophobicContact CD2-CD1 4.01Å; L274-I276 WeakPolarHBondContact O-CG1 3.31Å; L274-I276 PolarHBondContact O-N 3.34Å; L274-L285 HydrophobicContact CD2-CD2 3.81Å
275	G	31.9	Very low	33.3	Very low	68 Å²	68	89.5 Å²	89.5	70%	0.701	52%	0.52	S	S	*	.			trans	57.5	20.5	176.1	0	0	0	0	0	115	P277	G275-P277 VanDerWaalsContact O-CD 3.27Å; G275-P277 WeakPolarHBondContact O-CD 3.14Å
276	I	37.6	Very low	33.5	Very low	58 Å²	58	92.6 Å²	92.6	30%	0.297	52%	0.519	S	S	.	.			trans	-78.4	118	-173.7	-54.4	176.1	0	0	0	109	L274 M278 L283 L285	L274-I276 HydrophobicContact CB-CD1 3.84Å; L274-I276 HydrophobicContact CB-CG1 3.77Å; L274-I276 HydrophobicContact CD2-CD1 4.01Å; L274-I276 WeakPolarHBondContact O-CG1 3.31Å; L274-I276 PolarHBondContact O-N 3.34Å; I276-M278 PolarHBondContact O-N 3.26Å; I276-L283 HydrophobicContact CD1-CD1 3.82Å; I276-L283 HydrophobicContact CD1-CD2 4.35Å; I276-L283 HydrophobicContact CG2-CD1 3.84Å; I276-L285 HydrophobicContact CD1-CD2 4.19Å
277	P	33.8	Very low	33.8	Very low	102 Å²	102	90.2 Å²	90.2	66%	0.662	51%	0.505	S	S	*	.			trans	-63.4	113	174.7	22.1	-28.8	0	0	0	110	G275 S279	G275-P277 VanDerWaalsContact O-CD 3.27Å; G275-P277 WeakPolarHBondContact O-CD 3.14Å; P277-S279 PolarHBondContact O-N 2.94Å
278	M	39.1	Very low	33.6	Very low	84 Å²	84	94.8 Å²	94.8	41%	0.414	51%	0.514	S	S	.	.	S	Bend	trans	-73	35.8	-169.4	-77.9	-151.1	-84.2	0	0	115.8	I276 V335	I276-M278 PolarHBondContact O-N 3.26Å; M278-V335 HydrophobicContact CE-CG1 4.41Å; M278-V335 HydrophobicContact CE-CG2 4.43Å
279	S	35.4	Very low	33.7	Very low	104 Å²	104	88.4 Å²	88.4	73%	0.727	49%	0.485	S	S	*	.			trans	-86.8	-3	179.2	64.9	0	0	0	0	114.8	P277	P277-S279 PolarHBondContact O-N 2.94Å
280	T	32.9	Very low	33.4	Very low	77 Å²	77	87.6 Å²	87.6	47%	0.472	49%	0.485	S	S	.	.			trans	-106.1	135.4	-176.5	59.9	0	0	0	0	113.7	S282	T280-S282 PolarHBondContact O-N 3.47Å
281	N	37.1	Very low	33.3	Very low	124 Å²	124	87 Å²	87	66%	0.663	48%	0.48	S	S	*	.	S	Bend	trans	-74.7	0.2	-178.8	-75.5	-24.2	0	0	0	114.4
282	S	32.9	Very low	32.9	Very low	67 Å²	67	92.3 Å²	92.3	47%	0.469	49%	0.494	S	S	.	.			trans	-148.7	117.2	176.3	60.7	0	0	0	0	108.9	T280	T280-S282 PolarHBondContact O-N 3.47Å
283	L	38.7	Very low	32.7	Very low	32 Å²	32	95.9 Å²	95.9	17%	0.168	50%	0.503	C	S	.	.			trans	-92.8	119.3	173.2	-168.5	74	0	0	0	108.6	L271 I276 L285	L271-L283 HydrophobicContact CD1-CD2 4.03Å; L271-L283 HydrophobicContact CD2-CD2 4.49Å; I276-L283 HydrophobicContact CD1-CD1 3.82Å; I276-L283 HydrophobicContact CD1-CD2 4.35Å; I276-L283 HydrophobicContact CG2-CD1 3.84Å; L283-L285 HydrophobicContact CD2-CD1 3.73Å; L283-L285 HydrophobicContact CD2-CD2 4.2Å; L283-L285 HydrophobicContact CD2-CG 3.75Å; L283-L285 HydrophobicContact CG-CG 4.08Å
284	I	33.2	Very low	32.7	Very low	89 Å²	89	94.5 Å²	94.5	46%	0.456	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	91.7	171.7	-58	174.7	0	0	0	106.9	R286	I284-R286 HydrophobicContact CG2-CG 4.33Å
285	L	36	Very low	32.5	Very low	31 Å²	31	97 Å²	97	16%	0.162	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	127.9	170.8	-73.5	158.4	0	0	0	108.5	L274 I276 L283 F287	L274-L285 HydrophobicContact CD2-CD2 3.81Å; I276-L285 HydrophobicContact CD1-CD2 4.19Å; L283-L285 HydrophobicContact CD2-CD1 3.73Å; L283-L285 HydrophobicContact CD2-CD2 4.2Å; L283-L285 HydrophobicContact CD2-CG 3.75Å; L283-L285 HydrophobicContact CG-CG 4.08Å; L285-F287 HydrophobicContact CB-CD2 4.49Å; L285-F287 HydrophobicContact CB-CE2 3.71Å; L285-F287 HydrophobicContact CB-CZ 4.04Å; L285-F287 HydrophobicContact CD1-CZ 4.36Å
286	R	29.4	Very low	32.5	Very low	179 Å²	179	98.8 Å²	98.8	68%	0.675	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	109.2	174.5	-68.8	-177.2	-177.5	-149.7	4.5	108.5	I284	I284-R286 HydrophobicContact CG2-CG 4.33Å
287	F	35.5	Very low	32.2	Very low	46 Å²	46	102.8 Å²	102.8	20%	0.202	55%	0.545	C	S	.	.			trans	-88	144.7	173.5	-59.2	-86.2	0	0	0	110	Y269 L285 V319	Y269-F287 HydrophobicContact CD2-CE1 4.24Å; L285-F287 HydrophobicContact CB-CD2 4.49Å; L285-F287 HydrophobicContact CB-CE2 3.71Å; L285-F287 HydrophobicContact CB-CZ 4.04Å; L285-F287 HydrophobicContact CD1-CZ 4.36Å; F287-V319 HydrophobicContact CD2-CB 4.22Å
288	K	26.9	Very low	32.1	Very low	158 Å²	158	107.5 Å²	107.5	69%	0.687	56%	0.555	S	S	*	*			trans	-111.2	100.7	161.6	-82.4	-175.3	178.5	176.8	0	106.9	F290	K288-F290 HydrophobicContact CB-CE2 4.08Å; K288-F290 HydrophobicContact CB-CZ 4.44Å
289	L	31.4	Very low	31.9	Very low	47 Å²	47	108.6 Å²	108.6	25%	0.246	57%	0.571	C	S	.	*			trans	-79.3	116.6	175.9	-94.1	140.1	0	0	0	110.2	L264 L266 Y315 S316 A317	L264-L289 HydrophobicContact CD2-CD2 4.18Å; L266-L289 HydrophobicContact CD1-CD1 4.05Å; L266-L289 HydrophobicContact CD1-CD2 3.51Å; L266-L289 HydrophobicContact CD1-CG 3.81Å; L289-Y315 CarbonylContact O-C 3.6Å; L289-S316 WeakPolarHBondContact O-CA 3.19Å; L289-A317 HydrophobicContact CB-CB 4.43Å; L289-A317 HydrophobicContact CD1-CB 4.39Å
290	F	29	Very low	31.6	Very low	135 Å²	135	110.7 Å²	110.7	59%	0.592	57%	0.574	S	S	*	*			trans	-97.6	109.9	171	-63.7	-85.9	0	0	0	109.6	K288 K314	K288-F290 HydrophobicContact CB-CE2 4.08Å; K288-F290 HydrophobicContact CB-CZ 4.44Å; F290-K314 HydrophobicContact CD1-CG 4.39Å; F290-K314 HydrophobicContact CE1-CD 4.4Å
291	C	27.1	Very low	31.4	Very low	51 Å²	51	114.2 Å²	114.2	35%	0.345	59%	0.59	S	S	.	*			trans	-88.8	125.1	173.3	-75.9	0	0	0	0	110.6
292	R	26.6	Very low	31	Very low	196 Å²	196	113.9 Å²	113.9	74%	0.74	60%	0.597	S	S	*	*			trans	-99.4	104.4	170.1	-168.4	177.2	-171.4	156.2	2.4	108.2
293	M	26.2	Very low	31.6	Very low	168 Å²	168	119.2 Å²	119.2	83%	0.828	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-92.2	124.3	172.7	-68.8	179.8	95.3	0	0	109.3
294	S	28.6	Very low	31.2	Very low	103 Å²	103	125 Å²	125	72%	0.72	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-85.7	119	168.9	162.6	0	0	0	0	107.8
295	T	33.7	Very low	31.2	Very low	119 Å²	119	124.7 Å²	124.7	73%	0.73	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-82.5	122.3	166.3	51.2	0	0	0	0	107.6	D297	T295-D297 VanDerWaalsContact C-N 3.27Å; T295-D297 PolarHBondContact O-N 2.9Å
296	S	31.9	Very low	30.8	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	69%	0.693	S	S	*	*			trans	-81.6	70.4	178.8	64.5	0	0	0	0	110.5	K298	S296-K298 PolarHBondContact O-N 3.46Å
297	D	31.6	Very low	30.6	Very low	143 Å²	143	125.3 Å²	125.3	77%	0.765	69%	0.692	S	S	*	*			trans	-82.4	99.5	164.1	-75	-25	0	0	0	107.8	T295 S299	T295-D297 VanDerWaalsContact C-N 3.27Å; T295-D297 PolarHBondContact O-N 2.9Å; D297-S299 VanDerWaalsContact C-N 3.25Å; D297-S299 PolarHBondContact O-N 2.89Å
298	K	31	Very low	30.2	Very low	201 Å²	201	132.6 Å²	132.6	87%	0.874	72%	0.724	S	S	*	*			trans	-67.4	86.1	167.3	-72	178.7	179.2	171.5	0	108.2	S296	S296-K298 PolarHBondContact O-N 3.46Å
299	S	34.2	Very low	30.2	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	72%	0.718	S	S	*	*			trans	-116	101	151.6	58.6	0	0	0	0	107.1	D297	D297-S299 VanDerWaalsContact C-N 3.25Å; D297-S299 PolarHBondContact O-N 2.89Å
300	N	28.6	Very low	30	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	74%	0.743	S	S	*	*			trans	-54.2	153	163.7	-81.3	-14	0	0	0	109.8
301	D	29.7	Very low	30.1	Very low	152 Å²	152	133.5 Å²	133.5	81%	0.813	74%	0.743	S	S	*	*			trans	99.6	90.1	164	-55.8	-17.8	0	0	0	116.3
302	S	28.3	Very low	30.3	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	76%	0.764	S	S	*	*				178	155.5	105.7	44.6	0	0	0	0	111.4	D304	S302-D304 PolarHBondContact O-N 3.33Å
303	I	45.8	Very low	30.4	Very low	179 Å²	179	135.2 Å²	135.2	92%	0.918	75%	0.751	S	S	*	*			trans	-84.3	6.5	-146.6	-79	165.9	0	0	0	115.7
304	D	31.1	Very low	30.4	Very low	153 Å²	153	135.3 Å²	135.3	82%	0.818	75%	0.747	S	S	*	*			trans	-110.5	75.4	-173.3	-152.6	12	0	0	0	114.5	S302 S306	S302-D304 PolarHBondContact O-N 3.33Å; D304-S306 VanDerWaalsContact C-N 3.3Å; D304-S306 PolarHBondContact O-N 2.86Å
305	G	33.4	Very low	30.6	Very low	83 Å²	83	136.5 Å²	136.5	86%	0.856	74%	0.737	S	S	*	*	S	Bend	trans	54.8	-14.2	136.2	0	0	0	0	0	124
306	S	26.1	Very low	30.3	Very low	95 Å²	95	134.7 Å²	134.7	66%	0.664	73%	0.729	S	S	*	*			trans	-140	71.7	-173.5	69.4	0	0	0	0	114.2	D304 K308	D304-S306 VanDerWaalsContact C-N 3.3Å; D304-S306 PolarHBondContact O-N 2.86Å; S306-K308 PolarHBondContact O-N 3.48Å
307	L	26.8	Very low	30.2	Very low	128 Å²	128	132.3 Å²	132.3	67%	0.67	72%	0.715	S	S	*	*			trans	-66.4	99.7	172.3	-117	83.5	0	0	0	111.1	Y309	L307-Y309 HydrophobicContact CB-CE1 4.23Å; L307-Y309 HydrophobicContact CB-CE2 4.1Å; L307-Y309 HydrophobicContact CD2-CD1 4.11Å; L307-Y309 HydrophobicContact CD2-CE1 3.36Å; L307-Y309 HydrophobicContact CG-CE1 4.33Å; L307-Y309 WeakPolarHBondContact O-CD2 3.4Å; L307-Y309 VanDerWaalsContact O-CE2 3.31Å; L307-Y309 WeakPolarHBondContact O-CE2 3.42Å; L307-Y309 PolarHBondContact O-N 3.43Å
308	K	25.1	Very low	29.9	Very low	199 Å²	199	131.3 Å²	131.3	87%	0.865	71%	0.706	S	S	*	*			trans	-82.6	97.6	165.7	-77.8	-178.8	178.8	174.4	0	109.6	S306 P310	S306-K308 PolarHBondContact O-N 3.48Å; K308-P310 WeakPolarHBondContact O-CD 3.44Å
309	Y	28.7	Very low	29.9	Very low	142 Å²	142	125 Å²	125	56%	0.557	68%	0.684	S	S	*	*			trans	-74.2	123	174.4	-45.2	-92	0	0	0	111.1	L307 V311	L307-Y309 HydrophobicContact CB-CE1 4.23Å; L307-Y309 HydrophobicContact CB-CE2 4.1Å; L307-Y309 HydrophobicContact CD2-CD1 4.11Å; L307-Y309 HydrophobicContact CD2-CE1 3.36Å; L307-Y309 HydrophobicContact CG-CE1 4.33Å; L307-Y309 WeakPolarHBondContact O-CD2 3.4Å; L307-Y309 VanDerWaalsContact O-CE2 3.31Å; L307-Y309 WeakPolarHBondContact O-CE2 3.42Å; L307-Y309 PolarHBondContact O-N 3.43Å; Y309-V311 PolarHBondContact O-N 2.99Å
310	P	26.7	Very low	29.5	Very low	120 Å²	120	123.2 Å²	123.2	78%	0.779	67%	0.672	S	S	*	*			trans	-72.8	127.4	176	26.8	-30.7	0	0	0	111.6	K308 K312	K308-P310 WeakPolarHBondContact O-CD 3.44Å; P310-K312 PolarHBondContact O-N 3.24Å
311	V	31.2	Very low	29.7	Very low	98 Å²	98	119.1 Å²	119.1	59%	0.594	65%	0.652	S	S	*	*			trans	-80.3	105.1	-178.7	179.3	0	0	0	0	109.3	Y309	Y309-V311 PolarHBondContact O-N 2.99Å
312	K	30.3	Very low	29.7	Very low	181 Å²	181	119.2 Å²	119.2	79%	0.787	65%	0.647	S	S	*	*			trans	-85	-27.2	-178.9	-95.8	-175.3	175.5	179.2	0	115.8	P310	P310-K312 PolarHBondContact O-N 3.24Å
313	H	29.8	Very low	30.1	Very low	102 Å²	102	116 Å²	116	47%	0.472	62%	0.623	S	S	.	*			trans	-143.1	121.1	-178.1	-61	-62.4	0	0	0	113.8	Y315	H313-Y315 HydrophobicContact CB-CD2 4.34Å; H313-Y315 HydrophobicContact CB-CE2 3.56Å
314	K	26.7	Very low	29.6	Very low	170 Å²	170	112 Å²	112	74%	0.739	60%	0.6	S	S	*	*			trans	-94.7	107	168.4	-80.9	179.1	178	173.6	0	108.8	F290	F290-K314 HydrophobicContact CD1-CG 4.39Å; F290-K314 HydrophobicContact CE1-CD 4.4Å
315	Y	31.2	Very low	29.9	Very low	128 Å²	128	108 Å²	108	50%	0.502	58%	0.582	S	S	.	*			trans	-90	146.1	166	-58.7	-79.7	0	0	0	109	L289 H313	L289-Y315 CarbonylContact O-C 3.6Å; H313-Y315 HydrophobicContact CB-CD2 4.34Å; H313-Y315 HydrophobicContact CB-CE2 3.56Å
316	S	27.6	Very low	30.1	Very low	81 Å²	81	109.4 Å²	109.4	57%	0.566	57%	0.567	S	S	*	*			trans	-130.5	116	169.4	65.9	0	0	0	0	109	L289	L289-S316 WeakPolarHBondContact O-CA 3.19Å
317	A	29.3	Very low	30.7	Very low	53 Å²	53	109 Å²	109	44%	0.438	56%	0.56	S	S	.	*			trans	-102.4	132.3	174.9	0	0	0	0	0	110.6	L289	L289-A317 HydrophobicContact CB-CB 4.43Å; L289-A317 HydrophobicContact CD1-CB 4.39Å
318	Q	25.7	Very low	31.3	Very low	123 Å²	123	104 Å²	104	58%	0.575	54%	0.535	S	S	*	.			trans	-98.9	106.1	-178.4	-166.1	178.8	7.8	0	0	109.9
319	V	30.8	Very low	31.9	Very low	67 Å²	67	98.5 Å²	98.5	41%	0.406	52%	0.515	S	S	.	.			trans	-98.1	133.1	174.5	-179.5	0	0	0	0	108.5	F287 V321	F287-V319 HydrophobicContact CD2-CB 4.22Å; V319-V321 HydrophobicContact CG1-CG2 4.19Å
320	S	26.4	Very low	32.4	Very low	69 Å²	69	97.6 Å²	97.6	48%	0.483	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.2	177.1	-51.7	0	0	0	0	109.1
321	V	33.6	Very low	33.1	Very low	63 Å²	63	93.5 Å²	93.5	38%	0.382	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.9	179.7	-176.3	0	0	0	0	109.4	V319 V323	V319-V321 HydrophobicContact CG1-CG2 4.19Å; V321-V323 HydrophobicContact CG1-CG2 4.09Å
322	H	29.1	Very low	33.4	Very low	153 Å²	153	92 Å²	92	71%	0.708	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	106.6	171.8	-83.8	-83.5	0	0	0	109.9
323	V	36.4	Very low	33.7	Very low	50 Å²	50	89.3 Å²	89.3	30%	0.303	46%	0.464	S	S	.	.			trans	-87.3	129.7	176.6	-173.2	0	0	0	0	110.2	V321 V327 V328	V321-V323 HydrophobicContact CG1-CG2 4.09Å; V323-V327 HydrophobicContact CG1-CB 3.93Å; V323-V327 HydrophobicContact CG1-CG1 3.97Å; V323-V328 HydrophobicContact CB-CG2 4.38Å; V323-V328 HydrophobicContact CG1-CG2 3.93Å
324	H	35.1	Very low	34.1	Very low	93 Å²	93	89 Å²	89	43%	0.431	46%	0.463	S	S	.	.			trans	-69.3	139.6	-178.9	-175.6	-88.2	0	0	0	111.5	Q326 V327 V328	H324-Q326 VanDerWaalsContact C-N 3.26Å; H324-Q326 PolarHBondContact ND1-N 3.43Å; H324-Q326 PolarHBondContact O-N 3.07Å; H324-Q326 VanDerWaalsContact O-N 3.07Å; H324-V327 HydrophobicContact CB-CG2 4.44Å; H324-V327 WeakPolarHBondContact O-CB 3.5Å; H324-V327 PolarHBondContact O-N 2.96Å; H324-V328 PolarHBondContact O-N 2.87Å
325	P	37	Very low	34.5	Very low	69 Å²	69	84.1 Å²	84.1	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-56.6	-31.7	-172.4	-27.6	34.2	0	0	0	115.6	V327 V328 N329	P325-V327 VanDerWaalsContact C-N 3.32Å; P325-V327 PolarHBondContact O-N 3.43Å; P325-V328 WeakPolarHBondContact O-CB 3.49Å; P325-V328 PolarHBondContact O-N 3.39Å; P325-N329 PolarHBondContact O-N 3.35Å
326	Q	39.1	Very low	34.6	Very low	113 Å²	113	87.5 Å²	87.5	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-68.5	-30.9	177.4	-69	-173.9	-49.4	0	0	113	H324 K330	H324-Q326 VanDerWaalsContact C-N 3.26Å; H324-Q326 PolarHBondContact ND1-N 3.43Å; H324-Q326 PolarHBondContact O-N 3.07Å; H324-Q326 VanDerWaalsContact O-N 3.07Å; Q326-K330 WeakPolarHBondContact O-CB 3.17Å; Q326-K330 PolarHBondContact O-N 3.26Å
327	V	38	Very low	34.8	Very low	88 Å²	88	89.5 Å²	89.5	53%	0.533	46%	0.459	S	S	.	.	H	α-helix	trans	-69.3	-42.3	173.9	-179.1	0	0	0	0	109.2	V323 H324 P325 N329 K330 S331	V323-V327 HydrophobicContact CG1-CB 3.93Å; V323-V327 HydrophobicContact CG1-CG1 3.97Å; H324-V327 HydrophobicContact CB-CG2 4.44Å; H324-V327 WeakPolarHBondContact O-CB 3.5Å; H324-V327 PolarHBondContact O-N 2.96Å; P325-V327 VanDerWaalsContact C-N 3.32Å; P325-V327 PolarHBondContact O-N 3.43Å; V327-N329 VanDerWaalsContact C-N 3.35Å; V327-N329 PolarHBondContact O-N 3.45Å; V327-K330 PolarHBondContact O-N 3.38Å; V327-S331 PolarHBondContact O-N 2.86Å; V327-S331 PolarHBondContact O-OG 3.47Å
328	V	39.4	Very low	35.1	Very low	22 Å²	22	90.7 Å²	90.7	13%	0.133	46%	0.461	C	S	.	.	H	α-helix	trans	-60.5	-42.2	175.5	-178.2	0	0	0	0	111.8	V323 H324 P325 S331 K332	V323-V328 HydrophobicContact CB-CG2 4.38Å; V323-V328 HydrophobicContact CG1-CG2 3.93Å; H324-V328 PolarHBondContact O-N 2.87Å; P325-V328 WeakPolarHBondContact O-CB 3.49Å; P325-V328 PolarHBondContact O-N 3.39Å; V328-S331 VanDerWaalsContact C-OG 3.3Å; V328-S331 VanDerWaalsContact CA-OG 3.32Å; V328-S331 WeakPolarHBondContact CA-OG 3.39Å; V328-S331 PolarHBondContact O-OG 2.88Å; V328-K332 WeakPolarHBondContact O-CG 3.37Å; V328-K332 PolarHBondContact O-N 3.49Å
329	N	38.5	Very low	35.3	Very low	83 Å²	83	89.8 Å²	89.8	44%	0.444	46%	0.459	S	S	.	.	H	α-helix	trans	-71.4	-40.3	179	-75.1	-4.7	0	0	0	112.4	P325 V327 S331 K332 E333	P325-N329 PolarHBondContact O-N 3.35Å; V327-N329 VanDerWaalsContact C-N 3.35Å; V327-N329 PolarHBondContact O-N 3.45Å; N329-S331 VanDerWaalsContact C-N 3.32Å; N329-S331 PolarHBondContact O-N 3.18Å; N329-K332 WeakPolarHBondContact O-CB 3.05Å; N329-K332 PolarHBondContact O-N 2.97Å; N329-K332 VanDerWaalsContact O-N 3.12Å; N329-E333 PolarHBondContact O-N 3.39Å
330	K	38.5	Very low	35.3	Very low	123 Å²	123	89.7 Å²	89.7	54%	0.535	46%	0.462	S	S	.	.	H	α-helix	trans	-62.5	-41.6	175.1	-163	-175.7	-177.2	-120.9	0	111.3	Q326 V327 K332 E333 E334	Q326-K330 WeakPolarHBondContact O-CB 3.17Å; Q326-K330 PolarHBondContact O-N 3.26Å; V327-K330 PolarHBondContact O-N 3.38Å; K330-K332 VanDerWaalsContact C-N 3.33Å; K330-K332 PolarHBondContact O-N 2.99Å; K330-E333 PolarHBondContact O-N 2.88Å; K330-E334 VanDerWaalsContact CE-OE1 3.25Å; K330-E334 WeakPolarHBondContact CE-OE1 3.38Å; K330-E334 IonicContact NZ-OE1 2.75Å; K330-E334 PolarHBondContact NZ-OE1 3.47Å; K330-E334 WeakPolarHBondContact O-CG 3.07Å; K330-E334 PolarHBondContact O-N 3.45Å
331	S	40.9	Very low	35.4	Very low	35 Å²	35	91 Å²	91	25%	0.245	46%	0.464	C	S	.	.	H	α-helix	trans	-65.7	-33.6	173.1	54.1	0	0	0	0	112.7	V327 V328 N329 V335	V327-S331 PolarHBondContact O-N 2.86Å; V327-S331 PolarHBondContact O-OG 3.47Å; V328-S331 VanDerWaalsContact C-OG 3.3Å; V328-S331 VanDerWaalsContact CA-OG 3.32Å; V328-S331 WeakPolarHBondContact CA-OG 3.39Å; V328-S331 PolarHBondContact O-OG 2.88Å; N329-S331 VanDerWaalsContact C-N 3.32Å; N329-S331 PolarHBondContact O-N 3.18Å; S331-V335 WeakPolarHBondContact O-CB 3.47Å; S331-V335 VanDerWaalsContact O-CG2 3.22Å; S331-V335 WeakPolarHBondContact O-CG2 3.4Å; S331-V335 PolarHBondContact O-N 3.12Å
332	K	37.3	Very low	35.2	Very low	65 Å²	65	93.1 Å²	93.1	28%	0.283	47%	0.472	S	S	.	.	H	α-helix	trans	-64.1	-39.1	173.2	-80.1	176.3	178	-179.1	0	112.1	V328 N329 K330 R336	V328-K332 WeakPolarHBondContact O-CG 3.37Å; V328-K332 PolarHBondContact O-N 3.49Å; N329-K332 WeakPolarHBondContact O-CB 3.05Å; N329-K332 PolarHBondContact O-N 2.97Å; N329-K332 VanDerWaalsContact O-N 3.12Å; K330-K332 VanDerWaalsContact C-N 3.33Å; K330-K332 PolarHBondContact O-N 2.99Å; K332-R336 WeakPolarHBondContact O-CG 3.48Å; K332-R336 PolarHBondContact O-N 3.38Å; K332-R336 VanDerWaalsContact O-N 3.11Å
333	E	38	Very low	35.2	Very low	126 Å²	126	95.1 Å²	95.1	59%	0.589	48%	0.479	S	S	*	.	H	α-helix	trans	-69.3	-46.5	175.7	-74.8	172	175.6	0	0	111.4	N329 K330 V335 R336 H337	N329-E333 PolarHBondContact O-N 3.39Å; K330-E333 PolarHBondContact O-N 2.88Å; E333-V335 PolarHBondContact O-N 3.12Å; E333-R336 WeakPolarHBondContact O-CB 3.25Å; E333-R336 PolarHBondContact O-N 2.93Å; E333-R336 VanDerWaalsContact O-N 3.16Å; E333-H337 PolarHBondContact O-CD2 3.34Å; E333-H337 PolarHBondContact O-N 3.15Å
334	E	36.9	Very low	34.8	Very low	96 Å²	96	97.1 Å²	97.1	45%	0.449	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-41.1	177.3	-72.6	170.3	-177.4	0	0	111.4	K330 H337 V338	K330-E334 VanDerWaalsContact CE-OE1 3.25Å; K330-E334 WeakPolarHBondContact CE-OE1 3.38Å; K330-E334 IonicContact NZ-OE1 2.75Å; K330-E334 PolarHBondContact NZ-OE1 3.47Å; K330-E334 WeakPolarHBondContact O-CG 3.07Å; K330-E334 PolarHBondContact O-N 3.45Å; E334-H337 WeakPolarHBondContact O-CB 3.48Å; E334-H337 PolarHBondContact O-N 3.04Å; E334-V338 WeakPolarHBondContact O-CG2 3.22Å; E334-V338 PolarHBondContact O-N 3.44Å
335	V	36.4	Very low	34.4	Very low	66 Å²	66	97.1 Å²	97.1	40%	0.4	51%	0.506	S	S	.	.	H	α-helix	trans	-69.4	-32.8	175.3	172.9	0	0	0	0	112.6	M278 S331 E333 H337 V338 N339	M278-V335 HydrophobicContact CE-CG1 4.41Å; M278-V335 HydrophobicContact CE-CG2 4.43Å; S331-V335 WeakPolarHBondContact O-CB 3.47Å; S331-V335 VanDerWaalsContact O-CG2 3.22Å; S331-V335 WeakPolarHBondContact O-CG2 3.4Å; S331-V335 PolarHBondContact O-N 3.12Å; E333-V335 PolarHBondContact O-N 3.12Å; V335-H337 VanDerWaalsContact C-N 3.32Å; V335-V338 PolarHBondContact O-N 3.39Å; V335-N339 WeakPolarHBondContact O-CB 3.44Å; V335-N339 PolarHBondContact O-N 3.39Å
336	R	32.7	Very low	33.8	Very low	199 Å²	199	101.3 Å²	101.3	75%	0.751	52%	0.524	S	S	*	.	H	α-helix	trans	-63.8	-39.5	172.6	-84	-178.3	-177.3	177.5	0.3	111.7	K332 E333 S340	K332-R336 WeakPolarHBondContact O-CG 3.48Å; K332-R336 PolarHBondContact O-N 3.38Å; K332-R336 VanDerWaalsContact O-N 3.11Å; E333-R336 WeakPolarHBondContact O-CB 3.25Å; E333-R336 PolarHBondContact O-N 2.93Å; E333-R336 VanDerWaalsContact O-N 3.16Å; R336-S340 PolarHBondContact O-N 3.26Å; R336-S340 PolarHBondContact O-OG 3.43Å
337	H	31.5	Very low	32.9	Very low	124 Å²	124	101.1 Å²	101.1	57%	0.574	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-44.6	173.9	-85.3	-75.1	0	0	0	111.7	E333 E334 V335 N339 S340 D341	E333-H337 PolarHBondContact O-CD2 3.34Å; E333-H337 PolarHBondContact O-N 3.15Å; E334-H337 WeakPolarHBondContact O-CB 3.48Å; E334-H337 PolarHBondContact O-N 3.04Å; V335-H337 VanDerWaalsContact C-N 3.32Å; H337-N339 VanDerWaalsContact C-N 3.34Å; H337-N339 PolarHBondContact O-N 2.92Å; H337-S340 PolarHBondContact O-N 2.86Å; H337-S340 PolarHBondContact O-OG 3.43Å; H337-D341 PolarHBondContact O-N 3.19Å
338	V	36.6	Very low	32.2	Very low	78 Å²	78	103.2 Å²	103.2	47%	0.473	55%	0.548	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177.6	174.2	0	0	0	0	112	E334 V335 D341 L342	E334-V338 WeakPolarHBondContact O-CG2 3.22Å; E334-V338 PolarHBondContact O-N 3.44Å; V335-V338 PolarHBondContact O-N 3.39Å; V338-D341 PolarHBondContact O-N 3.01Å; V338-L342 HydrophobicContact CG1-CD1 3.62Å; V338-L342 HydrophobicContact CG1-CG 4.36Å; V338-L342 WeakPolarHBondContact O-CB 3.38Å; V338-L342 WeakPolarHBondContact O-CD1 3.26Å; V338-L342 WeakPolarHBondContact O-CG 3.2Å; V338-L342 PolarHBondContact O-N 3.19Å
339	N	29.7	Very low	31.4	Very low	103 Å²	103	111.4 Å²	111.4	55%	0.551	59%	0.585	S	S	*	*	H	α-helix	trans	-73.5	-25	176	-98.8	1.3	0	0	0	114.2	V335 H337	V335-N339 WeakPolarHBondContact O-CB 3.44Å; V335-N339 PolarHBondContact O-N 3.39Å; H337-N339 VanDerWaalsContact C-N 3.34Å; H337-N339 PolarHBondContact O-N 2.92Å
340	S	29.4	Very low	30.6	Very low	66 Å²	66	115.8 Å²	115.8	46%	0.462	60%	0.603	S	S	.	*	H	α-helix	trans	-72.8	-36.9	169.8	57.2	0	0	0	0	111.3	R336 H337	R336-S340 PolarHBondContact O-N 3.26Å; R336-S340 PolarHBondContact O-OG 3.43Å; H337-S340 PolarHBondContact O-N 2.86Å; H337-S340 PolarHBondContact O-OG 3.43Å
341	D	29.3	Very low	29.7	Very low	97 Å²	97	117.7 Å²	117.7	52%	0.519	62%	0.619	S	S	.	*	H	α-helix	trans	-74.6	-37.9	-178.5	-62.3	-14	0	0	0	111.4	H337 V338 K343 S344	H337-D341 PolarHBondContact O-N 3.19Å; V338-D341 PolarHBondContact O-N 3.01Å; D341-K343 VanDerWaalsContact C-N 3.3Å; D341-K343 PolarHBondContact O-N 2.83Å; D341-S344 PolarHBondContact O-N 3.47Å; D341-S344 PolarHBondContact O-OG 3.14Å
342	L	30.3	Very low	28.8	Very low	107 Å²	107	124.7 Å²	124.7	56%	0.56	65%	0.652	S	S	*	*	H	α-helix	trans	-67.6	-23.1	177.2	-80	161.8	0	0	0	114.2	V338 S344	V338-L342 HydrophobicContact CG1-CD1 3.62Å; V338-L342 HydrophobicContact CG1-CG 4.36Å; V338-L342 WeakPolarHBondContact O-CB 3.38Å; V338-L342 WeakPolarHBondContact O-CD1 3.26Å; V338-L342 WeakPolarHBondContact O-CG 3.2Å; V338-L342 PolarHBondContact O-N 3.19Å; L342-S344 PolarHBondContact O-N 3.01Å
343	K	28.6	Very low	28	Very low	195 Å²	195	124.7 Å²	124.7	85%	0.848	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-8.6	171.2	-81.1	-172.3	177.4	-173.6	0	113.3	D341	D341-K343 VanDerWaalsContact C-N 3.3Å; D341-K343 PolarHBondContact O-N 2.83Å
344	S	28.2	Very low	27.2	Very low	92 Å²	92	127.3 Å²	127.3	64%	0.643	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	4.2	-178.6	73.6	0	0	0	0	114.6	D341 L342	D341-S344 PolarHBondContact O-N 3.47Å; D341-S344 PolarHBondContact O-OG 3.14Å; L342-S344 PolarHBondContact O-N 3.01Å
345	S	26.8	Very low	26.5	Very low	93 Å²	93	130.5 Å²	130.5	65%	0.65	70%	0.703	S	S	*	*			trans	-128	104.5	-179.6	-70.5	0	0	0	0	111.9
346	D	23.3	Very low	25.7	Very low	157 Å²	157	134.7 Å²	134.7	84%	0.84	72%	0.723	S	S	*	*			trans	-63	141.5	173.9	-73.5	-47.2	0	0	0	113.2
347	S	21.2	Very low	25.2	Very low	108 Å²	108	132.5 Å²	132.5	76%	0.755	72%	0.724	S	S	*	*			trans	42.7	98.6	151	64	0	0	0	0	119.6
348	V	23.4	Very low	24.6	Very low	133 Å²	133	133.6 Å²	133.6	81%	0.806	73%	0.733	S	S	*	*			trans	-143.8	101.5	136.1	-175.6	0	0	0	0	108.9
349	E	20.9	Very low	23.9	Very low	194 Å²	194	137.5 Å²	137.5	91%	0.907	75%	0.751	S	S	*	*			trans	-73.3	119.5	159.6	-76.8	175.7	138	0	0	108.5
350	Q	22.2	Very low	23.4	Very low	175 Å²	175	139.2 Å²	139.2	82%	0.818	76%	0.76	S	S	*	*			trans	-152.1	112.9	161.7	-125.1	174.2	-8.6	0	0	111.4
351	D	20.1	Very low	23	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	78%	0.777	S	S	*	*			trans	39.5	91.9	153.7	-100	-20.9	0	0	0	118.8
352	L	23	Very low	22.7	Very low	181 Å²	181	145.6 Å²	145.6	95%	0.948	79%	0.788	S	S	*	*			trans	-105.4	85.7	161.2	-148.7	86.7	0	0	0	109.4	E354	L352-E354 PolarHBondContact O-N 2.85Å
353	G	20.6	Very low	22.2	Very low	66 Å²	66	144.2 Å²	144.2	68%	0.68	80%	0.799	S	S	*	*			trans	-68.6	116.7	172.6	0	0	0	0	0	112.5
354	E	20.9	Very low	21.9	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	80%	0.799	S	S	*	*	S	Bend	trans	36.6	86.6	146.3	-62.8	-173.4	159.8	0	0	118.7	L352	L352-E354 PolarHBondContact O-N 2.85Å
355	N	21.3	Very low	21.5	Very low	163 Å²	163	145.6 Å²	145.6	87%	0.872	80%	0.804	S	S	*	*			trans	-146.3	62.8	140.8	-87.2	-58.7	0	0	0	108.3	I357	N355-I357 PolarHBondContact O-N 3.5Å; N355-I357 VanDerWaalsContact O-N 3.16Å
356	L	20.1	Very low	21.2	Very low	153 Å²	153	148 Å²	148	80%	0.801	81%	0.809	S	S	*	*			trans	-76.7	96.3	177.8	-161.2	76.5	0	0	0	108.7	L358	L356-L358 HydrophobicContact CD2-CD1 4.11Å; L356-L358 PolarHBondContact O-N 3.29Å; L356-L358 VanDerWaalsContact O-N 3.07Å
357	I	21.1	Very low	21.2	Very low	154 Å²	154	147.8 Å²	147.8	79%	0.79	81%	0.807	S	S	*	*			trans	-73.9	97.1	168.3	-61.6	175	0	0	0	106.5	N355 L359	N355-I357 PolarHBondContact O-N 3.5Å; N355-I357 VanDerWaalsContact O-N 3.16Å; I357-L359 PolarHBondContact O-N 3.17Å
358	L	19.7	Very low	21.1	Very low	146 Å²	146	152.7 Å²	152.7	76%	0.764	81%	0.814	S	S	*	*			trans	-56.3	110.9	170.9	-110.6	93.7	0	0	0	109.1	L356 D360	L356-L358 HydrophobicContact CD2-CD1 4.11Å; L356-L358 PolarHBondContact O-N 3.29Å; L356-L358 VanDerWaalsContact O-N 3.07Å; L358-D360 PolarHBondContact O-N 3.28Å
359	L	21.3	Very low	21.2	Very low	161 Å²	161	154.7 Å²	154.7	84%	0.843	82%	0.815	S	S	*	*			trans	-79.5	101.4	160.7	-80.9	158.5	0	0	0	106.6	I357 Q361	I357-L359 PolarHBondContact O-N 3.17Å; L359-Q361 PolarHBondContact O-N 2.92Å
360	D	20.8	Very low	21.2	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	81%	0.813	S	S	*	*			trans	-64	98.9	173.2	-174.9	14.7	0	0	0	109.7	L358 T362	L358-D360 PolarHBondContact O-N 3.28Å; D360-T362 PolarHBondContact OD1-N 3.01Å
361	Q	20.6	Very low	21.4	Very low	176 Å²	176	152.3 Å²	152.3	82%	0.822	82%	0.816	S	S	*	*			trans	-121	84.1	157.8	-77.7	-168.8	-14.5	0	0	107.1	L359	L359-Q361 PolarHBondContact O-N 2.92Å
362	T	22	Very low	21.6	Very low	120 Å²	120	150 Å²	150	74%	0.736	81%	0.812	S	S	*	*			trans	-162.7	117.6	136.1	36.5	0	0	0	0	108.8	D360 N364	D360-T362 PolarHBondContact OD1-N 3.01Å; T362-N364 PolarHBondContact O-N 3.4Å
363	G	20.3	Very low	22	Very low	78 Å²	78	148.9 Å²	148.9	80%	0.804	81%	0.806	S	S	*	*			trans	-57.2	138	164	0	0	0	0	0	110.2
364	N	21.8	Very low	22.2	Very low	158 Å²	158	154.2 Å²	154.2	85%	0.845	81%	0.813	S	S	*	*			trans	-147.7	147.7	137.8	-137.5	-2.9	0	0	0	110.8	T362	T362-N364 PolarHBondContact O-N 3.4Å
365	E	20.6	Very low	22.4	Very low	159 Å²	159	155.6 Å²	155.6	74%	0.743	81%	0.812	S	S	*	*			trans	-70.5	157.5	-163.5	-58.2	172.1	145.5	0	0	113.8
366	N	20.5	Very low	22.8	Very low	143 Å²	143	152.6 Å²	152.6	77%	0.765	80%	0.799	S	S	*	*			trans	72.5	110.6	159	-54.3	-40.6	0	0	0	117.6
367	I	23	Very low	23.2	Very low	153 Å²	153	154 Å²	154	79%	0.785	80%	0.802	S	S	*	*				-163	115.3	118.3	-85	140.8	0	0	0	107.6	E369	I367-E369 HydrophobicContact CG2-CB 4.4Å; I367-E369 HydrophobicContact CG2-CG 3.97Å
368	K	19.4	Very low	23.4	Very low	210 Å²	210	154.6 Å²	154.6	91%	0.913	80%	0.801	S	S	*	*			trans	-80.1	116.3	161.9	-71	171.8	175.4	175	0	106.8
369	E	24.6	Very low	23.7	Very low	175 Å²	175	152 Å²	152	82%	0.818	79%	0.794	S	S	*	*			trans	-138.9	115.3	157.7	-78.8	-168.4	162.7	0	0	110.6	I367	I367-E369 HydrophobicContact CG2-CB 4.4Å; I367-E369 HydrophobicContact CG2-CG 3.97Å
370	Q	21.4	Very low	24.1	Very low	187 Å²	187	150.8 Å²	150.8	87%	0.874	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70.8	139.7	170.3	-72.8	166.3	-52.5	0	0	109.4	S372	Q370-S372 PolarHBondContact O-N 2.94Å
371	P	25.8	Very low	24.3	Very low	133 Å²	133	152.7 Å²	152.7	86%	0.864	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.8	126.7	174.2	28.1	-29.9	0	0	0	110.4
372	S	24.5	Very low	24.7	Very low	113 Å²	113	151.1 Å²	151.1	79%	0.79	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.5	140.4	-177.7	46.8	0	0	0	0	113.1	Q370 Q374	Q370-S372 PolarHBondContact O-N 2.94Å; S372-Q374 PolarHBondContact O-N 3.01Å
373	L	31.5	Very low	25	Very low	158 Å²	158	150.5 Å²	150.5	83%	0.827	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	63.8	-171.6	-172.4	75.8	0	0	0	113	V376	L373-V376 HydrophobicContact CD1-CG2 4.3Å
374	Q	26.1	Very low	25.4	Very low	179 Å²	179	155 Å²	155	84%	0.836	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	-1.4	175.1	-146.3	171.6	-3.8	0	0	115.2	S372	S372-Q374 PolarHBondContact O-N 3.01Å
375	Y	24.7	Very low	25.6	Very low	210 Å²	210	155.2 Å²	155.2	82%	0.824	79%	0.79	S	S	*	*	S	Bend	trans	-94.9	0.3	175.1	-136.2	-97.8	0	0	0	114
376	V	29.4	Very low	26.1	Very low	99 Å²	99	159.4 Å²	159.4	60%	0.6	80%	0.799	S	S	*	*	S	Bend	trans	-88.8	-14.3	-171.7	179.6	0	0	0	0	113.4	L373	L373-V376 HydrophobicContact CD1-CG2 4.3Å
377	Q	27.9	Very low	26.2	Very low	182 Å²	182	155.4 Å²	155.4	85%	0.85	79%	0.792	S	S	*	*	S	Bend	trans	-99.2	-4.2	-170.3	-79.1	-177.2	-22.7	0	0	116.9
378	E	26.7	Very low	26.2	Very low	167 Å²	167	160.1 Å²	160.1	78%	0.78	80%	0.799	S	S	*	*	S	Bend	trans	-89.7	-11.6	175.2	-99.1	-179.1	161.9	0	0	114.2
379	C	24.4	Very low	26.4	Very low	92 Å²	92	153 Å²	153	62%	0.622	79%	0.786	S	S	*	*	S	Bend	trans	-86.6	-15.8	-177.7	-74.5	0	0	0	0	114.8
380	D	29.6	Very low	26.2	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	79%	0.787	S	S	*	*	S	Bend	trans	-84	-14.7	-173.9	-95.2	-10.4	0	0	0	114.8
381	Q	26.7	Very low	26.1	Very low	180 Å²	180	147 Å²	147	84%	0.841	78%	0.778	S	S	*	*	S	Bend	trans	-87.8	-20.7	179.6	-99.2	177.4	-20.8	0	0	114.6
382	I	28.4	Very low	25.8	Very low	143 Å²	143	149.7 Å²	149.7	73%	0.733	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-15.9	-172.5	-59.4	177.5	0	0	0	112
383	C	27.8	Very low	25.7	Very low	107 Å²	107	149.4 Å²	149.4	72%	0.723	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-6.6	-173.1	-72.4	0	0	0	0	115.7
384	Q	28.2	Very low	25.1	Very low	172 Å²	172	149.9 Å²	149.9	80%	0.804	77%	0.772	S	S	*	*	S	Bend	trans	-94.3	-16	-174.9	-74	-168.6	-5.3	0	0	116.1
385	D	27.5	Very low	24.8	Very low	162 Å²	162	151.1 Å²	151.1	87%	0.866	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	2.3	-173.7	-99.7	-7.3	0	0	0	115.6	G387	D385-G387 VanDerWaalsContact C-N 3.26Å; D385-G387 PolarHBondContact O-N 2.87Å
386	R	29.3	Very low	24.6	Very low	247 Å²	247	147.3 Å²	147.3	93%	0.932	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	13.8	179.6	-81.5	-173.9	175.9	167.6	1.3	115.3
387	G	23.7	Very low	24.2	Very low	60 Å²	60	149.8 Å²	149.8	62%	0.619	78%	0.78	S	S	*	*			trans	-113.1	69.5	-177	0	0	0	0	0	115.1	D385	D385-G387 VanDerWaalsContact C-N 3.26Å; D385-G387 PolarHBondContact O-N 2.87Å
388	R	21.8	Very low	24	Very low	252 Å²	252	147.7 Å²	147.7	95%	0.951	78%	0.779	S	S	*	*			trans	-173.6	134.2	151.4	-122.6	170.4	-88.3	-157.3	-3.5	116.2
389	G	23.8	Very low	23.8	Very low	61 Å²	61	145.1 Å²	145.1	63%	0.629	78%	0.775	S	S	*	*			trans	99.1	92.8	146.5	0	0	0	0	0	115.4
390	T	20.7	Very low	23.8	Very low	138 Å²	138	148 Å²	148	85%	0.847	78%	0.784	S	S	*	*				62.5	117.8	73.9	68.5	0	0	0	0	116.9
391	S	20.4	Very low	23.5	Very low	98 Å²	98	147.9 Å²	147.9	69%	0.685	78%	0.783	S	S	*	*			trans	81.4	123.6	133.7	135	0	0	0	0	120.8
392	K	19.4	Very low	23.7	Very low	188 Å²	188	145.1 Å²	145.1	82%	0.817	78%	0.781	S	S	*	*			trans	89.5	140.6	135.6	-77.5	179.2	176.1	-179.8	0	120.5
393	S	21.5	Very low	23.5	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	78%	0.784	S	S	*	*			trans	69.5	149	152.7	56.2	0	0	0	0	117.4
394	E	19.5	Very low	23.2	Very low	167 Å²	167	143.8 Å²	143.8	78%	0.78	79%	0.785	S	S	*	*			cis	174.2	137.5	-13	-174	160.7	-170.9	0	0	102.5
395	Y	19.4	Very low	23	Very low	205 Å²	205	142.2 Å²	142.2	80%	0.804	79%	0.792	S	S	*	*			trans	26.9	121.6	160.9	-84.5	-92.6	0	0	0	120.9
396	T	20.9	Very low	22.8	Very low	131 Å²	131	137.2 Å²	137.2	80%	0.804	78%	0.778	S	S	*	*				168.2	151.4	98.2	32.7	0	0	0	0	112.1
397	D	20.5	Very low	22.6	Very low	151 Å²	151	131.7 Å²	131.7	81%	0.807	77%	0.774	S	S	*	*			trans	-20.7	133.3	171.5	-77.4	-49.3	0	0	0	118
398	V	24.6	Very low	22.5	Very low	137 Å²	137	137.6 Å²	137.6	83%	0.83	79%	0.786	S	S	*	*				-158.9	136.6	118.3	174	0	0	0	0	109
399	T	22.4	Very low	22.5	Very low	113 Å²	113	130.8 Å²	130.8	69%	0.693	78%	0.776	S	S	*	*			trans	-53.5	155.7	172.9	42.8	0	0	0	0	116.5
400	D	22.6	Very low	22.4	Very low	152 Å²	152	134.7 Å²	134.7	81%	0.813	78%	0.781	S	S	*	*			trans	67.5	90	154.1	-62.1	-26.9	0	0	0	120.3
401	N	23.8	Very low	22.5	Very low	133 Å²	133	133.3 Å²	133.3	71%	0.711	78%	0.777	S	S	*	*				-168.1	114.3	120	-165.5	-2	0	0	0	110.9	N403	N401-N403 VanDerWaalsContact C-N 3.33Å; N401-N403 PolarHBondContact O-N 3.34Å
402	P	31.4	Very low	22.7	Very low	123 Å²	123	137.3 Å²	137.3	80%	0.799	79%	0.785	S	S	*	*			trans	-80.1	6.9	-172.5	-11.3	27.7	0	0	0	116.8
403	N	24.3	Very low	22.9	Very low	149 Å²	149	135 Å²	135	80%	0.797	78%	0.782	S	S	*	*			trans	-113.7	79.7	-174.7	-64.8	-30.2	0	0	0	111.5	N401	N401-N403 VanDerWaalsContact C-N 3.33Å; N401-N403 PolarHBondContact O-N 3.34Å
404	G	22.1	Very low	23.3	Very low	72 Å²	72	134.9 Å²	134.9	74%	0.742	78%	0.779	S	S	*	*			trans	-150.4	57.7	-178.4	0	0	0	0	0	113.5
405	C	23.3	Very low	23.5	Very low	140 Å²	140	135.5 Å²	135.5	95%	0.946	78%	0.781	S	S	*	*			trans	-91.2	103	164.9	-78.5	0	0	0	0	109.6
406	G	23.1	Very low	23.6	Very low	56 Å²	56	133.8 Å²	133.8	58%	0.577	78%	0.78	S	S	*	*			trans	-68.4	176	168.9	0	0	0	0	0	114
407	P	25	Very low	23.7	Very low	131 Å²	131	135.8 Å²	135.8	85%	0.851	79%	0.785	S	S	*	*			trans	-94.7	118.4	-151.2	34.1	-29.8	0	0	0	112.1	S409	P407-S409 PolarHBondContact O-N 2.69Å
408	H	22.6	Very low	23.7	Very low	185 Å²	185	136 Å²	136	86%	0.856	78%	0.781	S	S	*	*			trans	-87.4	108.5	165.5	-86.6	-72.4	0	0	0	110.9	I410	H408-I410 PolarHBondContact O-N 3.04Å
409	S	21.9	Very low	23.5	Very low	108 Å²	108	139 Å²	139	76%	0.755	78%	0.784	S	S	*	*			trans	-38.4	118.7	169.7	50.7	0	0	0	0	114.6	P407	P407-S409 PolarHBondContact O-N 2.69Å
410	I	20.8	Very low	23.4	Very low	144 Å²	144	144.3 Å²	144.3	74%	0.738	79%	0.791	S	S	*	*			trans	-87	110.4	165.3	-62.7	172.9	0	0	0	106.7	H408	H408-I410 PolarHBondContact O-N 3.04Å
411	S	23.1	Very low	23.4	Very low	109 Å²	109	145.7 Å²	145.7	76%	0.762	79%	0.79	S	S	*	*			trans	-79.3	130.1	171.9	162.5	0	0	0	0	110
412	E	23.7	Very low	23.3	Very low	181 Å²	181	147.8 Å²	147.8	85%	0.846	79%	0.793	S	S	*	*			trans	-77.3	125.8	169.3	-63.7	173.3	154	0	0	109.8
413	N	25.1	Very low	22.8	Very low	140 Å²	140	147.2 Å²	147.2	75%	0.749	78%	0.783	S	S	*	*			trans	-154.2	119.1	146.2	-140.5	-18.5	0	0	0	110.6	H415	N413-H415 PolarHBondContact O-N 3.34Å
414	P	29.4	Very low	22.9	Very low	106 Å²	106	146.3 Å²	146.3	69%	0.688	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	7.8	-162.3	-6.4	26.3	0	0	0	116.4
415	H	23.4	Very low	23.2	Very low	179 Å²	179	147.1 Å²	147.1	83%	0.829	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	8.1	-168	-87	-72.8	0	0	0	117.3	N413	N413-H415 PolarHBondContact O-N 3.34Å
416	E	21.8	Very low	23.4	Very low	169 Å²	169	148.7 Å²	148.7	79%	0.79	77%	0.765	S	S	*	*			trans	-128.3	74.4	176.1	-120.4	174.3	-175.3	0	0	111.1	E418	E416-E418 PolarHBondContact O-N 3.29Å
417	L	23	Very low	23.8	Very low	174 Å²	174	151.6 Å²	151.6	91%	0.911	77%	0.772	S	S	*	*			trans	-75.3	54.4	159.8	-99.9	143.9	0	0	0	109.1	F419	L417-F419 PolarHBondContact O-N 3.18Å
418	E	20.4	Very low	23.9	Very low	154 Å²	154	151.6 Å²	151.6	72%	0.72	76%	0.764	S	S	*	*			trans	-62.7	130.6	158.7	-151.6	-177.2	-165.3	0	0	105.6	E416 R420	E416-E418 PolarHBondContact O-N 3.29Å; E418-R420 PolarHBondContact O-N 3.21Å
419	F	21.1	Very low	24.6	Very low	202 Å²	202	147.2 Å²	147.2	89%	0.886	76%	0.76	S	S	*	*			trans	-57.8	84.6	171.7	-110.4	-95.3	0	0	0	107.3	L417 K421	L417-F419 PolarHBondContact O-N 3.18Å; F419-K421 VanDerWaalsContact C-N 3.27Å; F419-K421 PolarHBondContact O-N 3.14Å
420	R	20.7	Very low	25	Very low	223 Å²	223	148.5 Å²	148.5	84%	0.842	76%	0.759	S	S	*	*			trans	-62	102.1	173.5	-140.8	-178.3	-158.8	-170.2	5.5	103.4	E418 F422	E418-R420 PolarHBondContact O-N 3.21Å; R420-F422 PolarHBondContact O-N 3.22Å
421	K	20.8	Very low	26	Very low	181 Å²	181	146 Å²	146	79%	0.787	75%	0.747	S	S	*	*			trans	-47.1	110.5	167.3	-74.4	171.8	-179.8	167.8	0	104.1	F419 N423	F419-K421 VanDerWaalsContact C-N 3.27Å; F419-K421 PolarHBondContact O-N 3.14Å; K421-N423 PolarHBondContact O-N 3.31Å
422	F	21.8	Very low	27.1	Very low	177 Å²	177	149.9 Å²	149.9	78%	0.776	75%	0.75	S	S	*	*			trans	-61	93.2	167.7	-102.9	-90.7	0	0	0	105.5	R420 L424	R420-F422 PolarHBondContact O-N 3.22Å; F422-L424 VanDerWaalsContact C-N 3.32Å; F422-L424 PolarHBondContact O-N 3.06Å; F422-L424 VanDerWaalsContact O-N 3.08Å
423	N	21.1	Very low	28.1	Very low	111 Å²	111	148.3 Å²	148.3	59%	0.594	75%	0.747	S	S	*	*			trans	-68	100.8	163.3	-89.8	-6.3	0	0	0	104.3	K421 S425 E426	K421-N423 PolarHBondContact O-N 3.31Å; N423-S425 PolarHBondContact O-N 2.71Å; N423-E426 PolarHBondContact O-N 3.03Å
424	L	26.9	Very low	29	Very low	131 Å²	131	146.7 Å²	146.7	69%	0.686	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	12.4	172.6	-141.7	91.5	0	0	0	112.6	F422	F422-L424 VanDerWaalsContact C-N 3.32Å; F422-L424 PolarHBondContact O-N 3.06Å; F422-L424 VanDerWaalsContact O-N 3.08Å
425	S	27.7	Very low	30.3	Very low	88 Å²	88	145.2 Å²	145.2	62%	0.615	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-6.2	178.6	51.9	0	0	0	0	113.9	N423	N423-S425 PolarHBondContact O-N 2.71Å
426	E	27.2	Very low	32.1	Very low	174 Å²	174	142.2 Å²	142.2	81%	0.813	71%	0.711	S	S	*	*			trans	-105.8	12.2	175.8	-90.6	179.3	174.4	0	0	113.9	N423 D428	N423-E426 PolarHBondContact O-N 3.03Å; E426-D428 PolarHBondContact O-N 3.37Å
427	V	31.9	Very low	33.9	Very low	117 Å²	117	137.5 Å²	137.5	71%	0.709	70%	0.7	S	S	*	*	S	Bend	trans	-65.1	108.7	156	177.8	0	0	0	0	105.4	A429	V427-A429 PolarHBondContact O-N 2.82Å
428	D	26.7	Very low	35.5	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	67%	0.672	S	S	*	*			trans	-21.2	99.4	-179.2	-87.4	-49.6	0	0	0	112.5	E426 N430 D431	E426-D428 PolarHBondContact O-N 3.37Å; D428-N430 PolarHBondContact O-N 2.91Å; D428-D431 PolarHBondContact O-N 3.29Å
429	A	38.4	Very low	37.4	Very low	93 Å²	93	126.5 Å²	126.5	77%	0.769	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	7.3	173.8	0	0	0	0	0	112.7	V427	V427-A429 PolarHBondContact O-N 2.82Å
430	N	30.6	Very low	39.5	Very low	136 Å²	136	120 Å²	120	73%	0.727	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-3	178	-76.5	-20.5	0	0	0	114	D428 K432	D428-N430 PolarHBondContact O-N 2.91Å; N430-K432 PolarHBondContact O-N 3.17Å
431	D	41.2	Very low	41.9	Very low	92 Å²	92	114.8 Å²	114.8	49%	0.492	61%	0.61	S	S	.	*			trans	-76.5	81	163.1	-152.6	-0.1	0	0	0	108.2	D428 D433 F434	D428-D431 PolarHBondContact O-N 3.29Å; D431-D433 PolarHBondContact O-N 3.42Å; D431-F434 PolarHBondContact O-N 3.38Å
432	K	45.3	Very low	44.1	Very low	190 Å²	190	110 Å²	110	83%	0.826	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-8.9	-175.3	-75.4	-175.7	177.8	176.7	0	114.2	N430	N430-K432 PolarHBondContact O-N 3.17Å
433	D	46.2	Very low	45.9	Very low	148 Å²	148	107.8 Å²	107.8	79%	0.791	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-2.5	178.7	-74.1	-24.2	0	0	0	114.4	D431 P435	D431-D433 PolarHBondContact O-N 3.42Å; D433-P435 VanDerWaalsContact O-CD 3.24Å; D433-P435 WeakPolarHBondContact O-CD 2.97Å
434	F	44.4	Very low	48.1	Very low	106 Å²	106	111.3 Å²	111.3	47%	0.465	59%	0.588	S	S	.	*	S	Bend	trans	-77.3	114	171.8	-160.2	-98.7	0	0	0	109.9	D431 Q436 V438 V439	D431-F434 PolarHBondContact O-N 3.38Å; F434-Q436 PolarHBondContact O-N 3.24Å; F434-Q436 VanDerWaalsContact O-N 3.16Å; F434-V438 HydrophobicContact CE1-CB 3.7Å; F434-V438 HydrophobicContact CE1-CG1 3.69Å; F434-V438 HydrophobicContact CE2-CG1 4.48Å; F434-V438 HydrophobicContact CZ-CB 3.91Å; F434-V438 HydrophobicContact CZ-CG1 3.46Å; F434-V438 VanDerWaalsContact CZ-CG1 3.46Å; F434-V439 HydrophobicContact CD1-CG2 3.64Å; F434-V439 HydrophobicContact CE1-CG2 3.68Å
435	P	55.9	Low	50.1	Low	74 Å²	74	109 Å²	109	48%	0.481	58%	0.577	S	S	.	*			trans	-65.5	124.4	-172	-17.8	30.5	0	0	0	110.2	D433 A437 V438	D433-P435 VanDerWaalsContact O-CD 3.24Å; D433-P435 WeakPolarHBondContact O-CD 2.97Å; P435-A437 PolarHBondContact O-N 3.34Å; P435-V438 HydrophobicContact CB-CG2 4.28Å; P435-V438 HydrophobicContact CG-CG2 4.36Å; P435-V438 WeakPolarHBondContact O-CB 3.06Å; P435-V438 PolarHBondContact O-N 3.31Å
436	Q	61.9	Low	51.8	Low	117 Å²	117	111.2 Å²	111.2	55%	0.547	58%	0.575	S	S	.	*	H	α-helix	trans	-47.2	-33	175	-176.8	61.5	30.9	0	0	112.6	F434 V438 V439 D440	F434-Q436 PolarHBondContact O-N 3.24Å; F434-Q436 VanDerWaalsContact O-N 3.16Å; Q436-V438 VanDerWaalsContact C-N 3.31Å; Q436-V438 PolarHBondContact O-N 3.44Å; Q436-V439 WeakPolarHBondContact O-CB 3.27Å; Q436-V439 PolarHBondContact O-N 2.84Å; Q436-V439 VanDerWaalsContact O-N 3.17Å; Q436-D440 PolarHBondContact NE2-OD1 3.32Å; Q436-D440 PolarHBondContact NE2-OD2 3.18Å; Q436-D440 PolarHBondContact O-N 3Å
437	A	59.1	Low	53.9	Low	70 Å²	70	109 Å²	109	58%	0.579	56%	0.563	S	S	*	*	H	α-helix	trans	-54.9	-39.7	174.3	0	0	0	0	0	113.8	P435 D440 E441	P435-A437 PolarHBondContact O-N 3.34Å; A437-D440 PolarHBondContact O-N 2.88Å; A437-E441 VanDerWaalsContact O-CB 3.32Å; A437-E441 WeakPolarHBondContact O-CB 3.34Å; A437-E441 PolarHBondContact O-N 2.92Å
438	V	56.7	Low	56.1	Low	51 Å²	51	106.3 Å²	106.3	31%	0.309	55%	0.549	S	S	.	.	H	α-helix	trans	-71.9	-36.5	179.5	-178.4	0	0	0	0	110.9	F434 P435 Q436 N442	F434-V438 HydrophobicContact CE1-CB 3.7Å; F434-V438 HydrophobicContact CE1-CG1 3.69Å; F434-V438 HydrophobicContact CE2-CG1 4.48Å; F434-V438 HydrophobicContact CZ-CB 3.91Å; F434-V438 HydrophobicContact CZ-CG1 3.46Å; F434-V438 VanDerWaalsContact CZ-CG1 3.46Å; P435-V438 HydrophobicContact CB-CG2 4.28Å; P435-V438 HydrophobicContact CG-CG2 4.36Å; P435-V438 WeakPolarHBondContact O-CB 3.06Å; P435-V438 PolarHBondContact O-N 3.31Å; Q436-V438 VanDerWaalsContact C-N 3.31Å; Q436-V438 PolarHBondContact O-N 3.44Å; V438-N442 WeakPolarHBondContact O-CB 3.13Å; V438-N442 PolarHBondContact O-N 3.05Å; V438-N442 PolarHBondContact O-ND2 3.13Å
439	V	60.1	Low	58.6	Low	45 Å²	45	105 Å²	105	27%	0.273	54%	0.542	S	S	.	.	H	α-helix	trans	-64.1	-45.9	174.6	-179.8	0	0	0	0	110.3	F434 Q436 N442 K443	F434-V439 HydrophobicContact CD1-CG2 3.64Å; F434-V439 HydrophobicContact CE1-CG2 3.68Å; Q436-V439 WeakPolarHBondContact O-CB 3.27Å; Q436-V439 PolarHBondContact O-N 2.84Å; Q436-V439 VanDerWaalsContact O-N 3.17Å; V439-N442 PolarHBondContact O-N 2.88Å; V439-K443 HydrophobicContact CG1-CD 4.33Å; V439-K443 WeakPolarHBondContact O-CG 3.22Å; V439-K443 PolarHBondContact O-N 3.27Å
440	D	65.8	Low	60.6	Low	67 Å²	67	103.8 Å²	103.8	36%	0.358	53%	0.525	S	S	.	.	H	α-helix	trans	-68.4	-35.5	-179.9	-67.4	-26	0	0	0	112	Q436 A437 K443 R444	Q436-D440 PolarHBondContact NE2-OD1 3.32Å; Q436-D440 PolarHBondContact NE2-OD2 3.18Å; Q436-D440 PolarHBondContact O-N 3Å; A437-D440 PolarHBondContact O-N 2.88Å; D440-K443 PolarHBondContact O-N 2.07Å; D440-R444 WeakPolarHBondContact O-CB 3.42Å; D440-R444 PolarHBondContact O-N 2.91Å
441	E	70	Confident	63.1	Low	112 Å²	112	101.4 Å²	101.4	52%	0.523	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-46.6	172.6	-173.8	173.6	-170.1	0	0	112	A437 K443 R444 N445	A437-E441 VanDerWaalsContact O-CB 3.32Å; A437-E441 WeakPolarHBondContact O-CB 3.34Å; A437-E441 PolarHBondContact O-N 2.92Å; E441-K443 VanDerWaalsContact C-N 3.34Å; E441-K443 PolarHBondContact O-N 3.19Å; E441-R444 WeakPolarHBondContact O-CB 3.15Å; E441-R444 PolarHBondContact O-N 3.14Å; E441-R444 VanDerWaalsContact O-N 3.15Å; E441-N445 WeakPolarHBondContact O-CB 3.42Å; E441-N445 PolarHBondContact O-N 3.44Å; E441-N445 PolarHBondContact O-ND2 2.82Å
442	N	66.5	Low	65.1	Low	82 Å²	82	100.4 Å²	100.4	44%	0.439	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-40.6	175.8	-81.3	-29.1	0	0	0	112.4	V438 V439 R444 N445 K446	V438-N442 WeakPolarHBondContact O-CB 3.13Å; V438-N442 PolarHBondContact O-N 3.05Å; V438-N442 PolarHBondContact O-ND2 3.13Å; V439-N442 PolarHBondContact O-N 2.88Å; N442-R444 VanDerWaalsContact C-N 3.35Å; N442-N445 PolarHBondContact O-N 3.24Å; N442-K446 WeakPolarHBondContact O-CB 3.32Å; N442-K446 PolarHBondContact O-N 3.16Å
443	K	60.2	Low	66.9	Low	129 Å²	129	95.9 Å²	95.9	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-61.1	-43.9	173.2	-75.6	174.4	-177.4	170	0	111.2	V439 D440 E441 K446 F447	V439-K443 HydrophobicContact CG1-CD 4.33Å; V439-K443 WeakPolarHBondContact O-CG 3.22Å; V439-K443 PolarHBondContact O-N 3.27Å; D440-K443 PolarHBondContact O-N 2.07Å; E441-K443 VanDerWaalsContact C-N 3.34Å; E441-K443 PolarHBondContact O-N 3.19Å; K443-K446 PolarHBondContact O-N 3.17Å; K443-F447 WeakPolarHBondContact O-CB 3.38Å; K443-F447 PolarHBondContact O-N 2.85Å
444	R	67	Low	68.7	Low	185 Å²	185	96.1 Å²	96.1	70%	0.698	48%	0.476	S	S	*	.	H	α-helix	trans	-63.9	-43.6	178.2	-163	-176.9	-62	-179.1	1.2	112	D440 E441 N442 F447 S448	D440-R444 WeakPolarHBondContact O-CB 3.42Å; D440-R444 PolarHBondContact O-N 2.91Å; E441-R444 WeakPolarHBondContact O-CB 3.15Å; E441-R444 PolarHBondContact O-N 3.14Å; E441-R444 VanDerWaalsContact O-N 3.15Å; N442-R444 VanDerWaalsContact C-N 3.35Å; R444-F447 PolarHBondContact O-N 3.45Å; R444-S448 PolarHBondContact O-N 3.4Å; R444-S448 PolarHBondContact O-OG 3.31Å
445	N	68.8	Low	70.7	Confident	82 Å²	82	93.8 Å²	93.8	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-66.4	-38.4	176.9	-71.5	-20.1	0	0	0	112.5	E441 N442 S448 L449	E441-N445 WeakPolarHBondContact O-CB 3.42Å; E441-N445 PolarHBondContact O-N 3.44Å; E441-N445 PolarHBondContact O-ND2 2.82Å; N442-N445 PolarHBondContact O-N 3.24Å; N445-S448 WeakPolarHBondContact CA-OG 3.09Å; N445-S448 PolarHBondContact O-OG 3.44Å; N445-L449 VanDerWaalsContact O-CB 3.28Å; N445-L449 WeakPolarHBondContact O-CB 3.46Å; N445-L449 PolarHBondContact O-N 2.97Å
446	K	64.6	Low	72.1	Confident	136 Å²	136	93 Å²	93	59%	0.591	45%	0.454	S	S	*	.	H	α-helix	trans	-66.4	-41.6	174.5	-174	177	-178.9	178	0	111.6	N442 K443 T450	N442-K446 WeakPolarHBondContact O-CB 3.32Å; N442-K446 PolarHBondContact O-N 3.16Å; K443-K446 PolarHBondContact O-N 3.17Å; K446-T450 WeakPolarHBondContact O-CB 3.07Å; K446-T450 PolarHBondContact O-N 3.17Å; K446-T450 PolarHBondContact O-OG1 3.01Å
447	F	69.5	Low	73.1	Confident	127 Å²	127	91 Å²	91	56%	0.557	45%	0.45	S	S	*	.	H	α-helix	trans	-62.7	-49.2	176.1	-179.5	-98.4	0	0	0	111.2	K443 R444 L449 T450 E451	K443-F447 WeakPolarHBondContact O-CB 3.38Å; K443-F447 PolarHBondContact O-N 2.85Å; R444-F447 PolarHBondContact O-N 3.45Å; F447-L449 PolarHBondContact O-N 3.19Å; F447-T450 WeakPolarHBondContact O-CB 3.48Å; F447-T450 PolarHBondContact O-N 2.03Å; F447-T450 VanDerWaalsContact O-N 3.13Å; F447-E451 HydrophobicContact CD1-CG 4.43Å; F447-E451 HydrophobicContact CE1-CG 3.98Å; F447-E451 WeakPolarHBondContact CE1-OE1 3.43Å; F447-E451 WeakPolarHBondContact CE1-OE2 3.48Å; F447-E451 HydrophobicContact CE2-CG 4.46Å; F447-E451 VanDerWaalsContact CZ-CD 3.46Å; F447-E451 HydrophobicContact CZ-CG 3.99Å; F447-E451 VanDerWaalsContact CZ-OE1 3.22Å; F447-E451 WeakPolarHBondContact CZ-OE1 3.35Å; F447-E451 PolarHBondContact O-N 3.26Å
448	S	78.4	Confident	74.3	Confident	60 Å²	60	88.2 Å²	88.2	42%	0.42	43%	0.426	S	S	.	.	H	α-helix	trans	-62.1	-41.2	178.3	65.4	0	0	0	0	112.6	R444 N445 T450 E451 E452	R444-S448 PolarHBondContact O-N 3.4Å; R444-S448 PolarHBondContact O-OG 3.31Å; N445-S448 WeakPolarHBondContact CA-OG 3.09Å; N445-S448 PolarHBondContact O-OG 3.44Å; S448-T450 VanDerWaalsContact C-N 3.32Å; S448-T450 PolarHBondContact O-N 3.17Å; S448-E451 PolarHBondContact O-N 2.85Å; S448-E452 WeakPolarHBondContact O-CB 3.1Å; S448-E452 PolarHBondContact O-N 3.22Å
449	L	80.4	Confident	75.8	Confident	104 Å²	104	86.6 Å²	86.6	55%	0.545	41%	0.414	S	S	.	.	H	α-helix	trans	-62.2	-39.8	174.5	-179.3	62.7	0	0	0	111.9	N445 F447 E452 I453	N445-L449 VanDerWaalsContact O-CB 3.28Å; N445-L449 WeakPolarHBondContact O-CB 3.46Å; N445-L449 PolarHBondContact O-N 2.97Å; F447-L449 PolarHBondContact O-N 3.19Å; L449-E452 PolarHBondContact O-N 3.44Å; L449-I453 HydrophobicContact CD1-CD1 4.17Å; L449-I453 HydrophobicContact CD1-CG1 4.37Å; L449-I453 HydrophobicContact CG-CD1 3.95Å; L449-I453 VanDerWaalsContact O-CG1 3.26Å; L449-I453 WeakPolarHBondContact O-CG1 3.4Å; L449-I453 PolarHBondContact O-N 3.2Å
450	T	80.6	Confident	77.1	Confident	66 Å²	66	91.2 Å²	91.2	41%	0.405	43%	0.431	S	S	.	.	H	α-helix	trans	-66.1	-41.4	178.2	-56.5	0	0	0	0	111.3	K446 F447 S448 R454	K446-T450 WeakPolarHBondContact O-CB 3.07Å; K446-T450 PolarHBondContact O-N 3.17Å; K446-T450 PolarHBondContact O-OG1 3.01Å; F447-T450 WeakPolarHBondContact O-CB 3.48Å; F447-T450 PolarHBondContact O-N 2.03Å; F447-T450 VanDerWaalsContact O-N 3.13Å; S448-T450 VanDerWaalsContact C-N 3.32Å; S448-T450 PolarHBondContact O-N 3.17Å; T450-R454 VanDerWaalsContact O-CB 3.31Å; T450-R454 WeakPolarHBondContact O-CB 3.44Å; T450-R454 PolarHBondContact O-N 3.46Å
451	E	83.1	Confident	78	Confident	86 Å²	86	94.1 Å²	94.1	40%	0.402	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-40.6	174.8	-70.4	-164.1	135.8	0	0	112.2	F447 S448 R454 Y455	F447-E451 HydrophobicContact CD1-CG 4.43Å; F447-E451 HydrophobicContact CE1-CG 3.98Å; F447-E451 WeakPolarHBondContact CE1-OE1 3.43Å; F447-E451 WeakPolarHBondContact CE1-OE2 3.48Å; F447-E451 HydrophobicContact CE2-CG 4.46Å; F447-E451 VanDerWaalsContact CZ-CD 3.46Å; F447-E451 HydrophobicContact CZ-CG 3.99Å; F447-E451 VanDerWaalsContact CZ-OE1 3.22Å; F447-E451 WeakPolarHBondContact CZ-OE1 3.35Å; F447-E451 PolarHBondContact O-N 3.26Å; S448-E451 PolarHBondContact O-N 2.85Å; E451-R454 PolarHBondContact O-N 3.44Å; E451-Y455 WeakPolarHBondContact O-CB 3.1Å; E451-Y455 PolarHBondContact O-N 2.92Å
452	E	82.6	Confident	78.8	Confident	71 Å²	71	89.3 Å²	89.3	33%	0.332	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-46.8	176.2	-174.9	58.7	-148.8	0	0	111.3	S448 L449 R454 Y455 Q456	S448-E452 WeakPolarHBondContact O-CB 3.1Å; S448-E452 PolarHBondContact O-N 3.22Å; L449-E452 PolarHBondContact O-N 3.44Å; E452-R454 VanDerWaalsContact C-N 3.28Å; E452-R454 PolarHBondContact O-N 2.65Å; E452-Y455 WeakPolarHBondContact O-CB 3.23Å; E452-Y455 PolarHBondContact O-N 3.06Å; E452-Y455 VanDerWaalsContact O-N 3.17Å; E452-Q456 HydrophobicContact CG-CG 4.49Å; E452-Q456 VanDerWaalsContact O-CG 3.25Å; E452-Q456 WeakPolarHBondContact O-CG 3.07Å; E452-Q456 PolarHBondContact O-N 3.4Å; E452-Q456 PolarHBondContact OE1-NE2 2.91Å
453	I	83	Confident	79.9	Confident	96 Å²	96	87.5 Å²	87.5	49%	0.492	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-42.2	175.5	-69.4	167.1	0	0	0	110.8	L449 Q456 T457	L449-I453 HydrophobicContact CD1-CD1 4.17Å; L449-I453 HydrophobicContact CD1-CG1 4.37Å; L449-I453 HydrophobicContact CG-CD1 3.95Å; L449-I453 VanDerWaalsContact O-CG1 3.26Å; L449-I453 WeakPolarHBondContact O-CG1 3.4Å; L449-I453 PolarHBondContact O-N 3.2Å; I453-Q456 PolarHBondContact O-N 2.79Å; I453-T457 WeakPolarHBondContact O-CB 3.42Å; I453-T457 PolarHBondContact O-N 3.42Å; I453-T457 PolarHBondContact O-OG1 3.18Å
454	R	84.1	Confident	81.1	Confident	153 Å²	153	87 Å²	87	58%	0.577	40%	0.404	S	S	*	.	H	α-helix	trans	-63.3	-44	176.7	-174.4	-175.5	-65.8	-174.5	-0.7	111	L140 T450 E451 E452 T458	L140-R454 HydrophobicContact CD2-CB 4.43Å; L140-R454 HydrophobicContact CD2-CG 3.85Å; T450-R454 VanDerWaalsContact O-CB 3.31Å; T450-R454 WeakPolarHBondContact O-CB 3.44Å; T450-R454 PolarHBondContact O-N 3.46Å; E451-R454 PolarHBondContact O-N 3.44Å; E452-R454 VanDerWaalsContact C-N 3.28Å; E452-R454 PolarHBondContact O-N 2.65Å; R454-T458 VanDerWaalsContact O-CB 3.31Å; R454-T458 WeakPolarHBondContact O-CB 3.28Å; R454-T458 PolarHBondContact O-N 2.94Å; R454-T458 PolarHBondContact O-OG1 3.42Å
455	Y	86.7	Confident	82	Confident	56 Å²	56	79.7 Å²	79.7	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-58.3	-53.4	175.9	-179.5	-76.9	0	0	0	110.4	P139 L140 H221 E451 E452 T457 T458 F459	P139-Y455 HydrophobicContact CG-CD2 3.7Å; P139-Y455 HydrophobicContact CG-CE1 4.15Å; P139-Y455 HydrophobicContact CG-CE2 3.27Å; P139-Y455 HydrophobicContact CG-CG 4.33Å; L140-Y455 HydrophobicContact CD1-CD2 4.02Å; L140-Y455 HydrophobicContact CG-CD2 3.98Å; H221-Y455 AromaticContact CE1-CE1 3.35Å; H221-Y455 WeakPolarHBondContact CE1-CE1 3.11Å; H221-Y455 AromaticContact ND1-CE1 3.77Å; E451-Y455 WeakPolarHBondContact O-CB 3.1Å; E451-Y455 PolarHBondContact O-N 2.92Å; E452-Y455 WeakPolarHBondContact O-CB 3.23Å; E452-Y455 PolarHBondContact O-N 3.06Å; E452-Y455 VanDerWaalsContact O-N 3.17Å; Y455-T457 PolarHBondContact O-N 3.11Å; Y455-T458 PolarHBondContact O-N 3.29Å; Y455-F459 HydrophobicContact CD1-CB 4.46Å; Y455-F459 HydrophobicContact CE1-CB 4.13Å; Y455-F459 HydrophobicContact CE1-CG 4.46Å; Y455-F459 WeakPolarHBondContact O-CB 3.46Å; Y455-F459 PolarHBondContact O-N 3.43Å
456	Q	84.5	Confident	83	Confident	59 Å²	59	76 Å²	76	28%	0.276	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-43.3	-177.4	-68	-69.2	-15.9	0	0	112.2	C225 E452 I453 K460	C225-Q456 PolarHBondContact SG-NE2 3Å; E452-Q456 HydrophobicContact CG-CG 4.49Å; E452-Q456 VanDerWaalsContact O-CG 3.25Å; E452-Q456 WeakPolarHBondContact O-CG 3.07Å; E452-Q456 PolarHBondContact O-N 3.4Å; E452-Q456 PolarHBondContact OE1-NE2 2.91Å; I453-Q456 PolarHBondContact O-N 2.79Å; Q456-K460 WeakPolarHBondContact O-CB 3.3Å; Q456-K460 PolarHBondContact O-N 2.87Å
457	T	83.5	Confident	84.2	Confident	73 Å²	73	75 Å²	75	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-64.3	-42.8	178.1	-56.5	0	0	0	0	111.3	I453 Y455 K460 R461	I453-T457 WeakPolarHBondContact O-CB 3.42Å; I453-T457 PolarHBondContact O-N 3.42Å; I453-T457 PolarHBondContact O-OG1 3.18Å; Y455-T457 PolarHBondContact O-N 3.11Å; T457-K460 PolarHBondContact O-N 2.9Å; T457-R461 PolarHBondContact O-N 3.03Å; T457-R461 VanDerWaalsContact O-N 3.11Å
458	T	84.6	Confident	85	Confident	13 Å²	13	69.6 Å²	69.6	8%	0.08	33%	0.334	C	S	.	.	H	α-helix	trans	-68.3	-46.4	179.1	-53.3	0	0	0	0	111	P139 N143 R454 Y455 K460 R461 E462	P139-T458 HydrophobicContact CB-CG2 3.86Å; P139-T458 VanDerWaalsContact O-CG2 3.3Å; P139-T458 WeakPolarHBondContact O-CG2 3.2Å; N143-T458 WeakPolarHBondContact ND2-CG2 3.37Å; R454-T458 VanDerWaalsContact O-CB 3.31Å; R454-T458 WeakPolarHBondContact O-CB 3.28Å; R454-T458 PolarHBondContact O-N 2.94Å; R454-T458 PolarHBondContact O-OG1 3.42Å; Y455-T458 PolarHBondContact O-N 3.29Å; T458-K460 VanDerWaalsContact C-N 3.32Å; T458-K460 PolarHBondContact O-N 2.71Å; T458-R461 WeakPolarHBondContact O-CB 3.44Å; T458-R461 PolarHBondContact O-N 2.87Å; T458-R461 VanDerWaalsContact O-N 3.1Å; T458-E462 PolarHBondContact O-N 3.45Å
459	F	88.1	Confident	85.4	Confident	16 Å²	16	67 Å²	67	7%	0.07	32%	0.315	C	S	.	.	H	α-helix	trans	-57.1	-44	174.8	179.4	-92.2	0	0	0	112	V136 P139 I218 H221 Y455 R461 E462 L463	V136-F459 HydrophobicContact CG1-CE2 3.88Å; P139-F459 HydrophobicContact CG-CB 4.48Å; I218-F459 HydrophobicContact CG1-CZ 4.3Å; H221-F459 HydrophobicContact CB-CE2 4.16Å; H221-F459 HydrophobicContact CB-CZ 4.04Å; H221-F459 AromaticContact CD2-CD1 3.58Å; H221-F459 AromaticContact CD2-CE1 3.23Å; H221-F459 WeakPolarHBondContact CD2-CE1 3.33Å; H221-F459 AromaticContact CD2-CE2 3.78Å; H221-F459 AromaticContact CD2-CZ 3.34Å; H221-F459 WeakPolarHBondContact CD2-CZ 3.34Å; H221-F459 AromaticContact CG-CE2 3.94Å; H221-F459 AromaticContact CG-CZ 3.84Å; H221-F459 AromaticContact NE2-CD1 3.64Å; H221-F459 AromaticContact NE2-CE1 3.8Å; H221-F459 AromaticContact NE2-CG 3.97Å; Y455-F459 HydrophobicContact CD1-CB 4.46Å; Y455-F459 HydrophobicContact CE1-CB 4.13Å; Y455-F459 HydrophobicContact CE1-CG 4.46Å; Y455-F459 WeakPolarHBondContact O-CB 3.46Å; Y455-F459 PolarHBondContact O-N 3.43Å; F459-R461 VanDerWaalsContact C-N 3.31Å; F459-R461 PolarHBondContact O-N 3.48Å; F459-E462 PolarHBondContact O-N 3.49Å; F459-L463 WeakPolarHBondContact O-CB 3.5Å; F459-L463 PolarHBondContact O-N 3.47Å
460	K	86.4	Confident	85.9	Confident	142 Å²	142	65.2 Å²	65.2	62%	0.617	31%	0.309	S	S	*	.	H	α-helix	trans	-61.9	-38.4	176.7	-174.8	177.9	179.6	-179.6	0	112.1	Q456 T457 T458 Q464	Q456-K460 WeakPolarHBondContact O-CB 3.3Å; Q456-K460 PolarHBondContact O-N 2.87Å; T457-K460 PolarHBondContact O-N 2.9Å; T458-K460 VanDerWaalsContact C-N 3.32Å; T458-K460 PolarHBondContact O-N 2.71Å; K460-Q464 WeakPolarHBondContact O-CG 3.35Å; K460-Q464 PolarHBondContact O-N 3.14Å
461	R	85.8	Confident	86.4	Confident	128 Å²	128	65.1 Å²	65.1	48%	0.483	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-48.2	174.4	-174.3	-174.1	-63.5	144	0.1	111	T457 T458 F459 L463 Q464 T465	T457-R461 PolarHBondContact O-N 3.03Å; T457-R461 VanDerWaalsContact O-N 3.11Å; T458-R461 WeakPolarHBondContact O-CB 3.44Å; T458-R461 PolarHBondContact O-N 2.87Å; T458-R461 VanDerWaalsContact O-N 3.1Å; F459-R461 VanDerWaalsContact C-N 3.31Å; F459-R461 PolarHBondContact O-N 3.48Å; R461-L463 VanDerWaalsContact C-N 3.29Å; R461-L463 PolarHBondContact O-N 3.49Å; R461-Q464 WeakPolarHBondContact O-CB 3.42Å; R461-Q464 PolarHBondContact O-N 3.09Å; R461-Q464 VanDerWaalsContact O-N 3.08Å; R461-T465 PolarHBondContact O-N 2.84Å; R461-T465 PolarHBondContact O-OG1 2.89Å
462	E	87.3	Confident	86.6	Confident	11 Å²	11	61 Å²	61	5%	0.051	29%	0.286	C	S	.	.	H	α-helix	trans	-61.4	-37.5	177.6	-64.4	-47	135.8	0	0	112.2	R132 A135 V136 T458 F459 Q464 T465 V466	R132-E462 IonicContact NH1-OE2 3.68Å; R132-E462 PolarHBondContact NH1-OE2 3.42Å; A135-E462 HydrophobicContact CB-CG 4.3Å; V136-E462 HydrophobicContact CG2-CB 4.44Å; T458-E462 PolarHBondContact O-N 3.45Å; F459-E462 PolarHBondContact O-N 3.49Å; E462-Q464 VanDerWaalsContact C-N 3.3Å; E462-Q464 PolarHBondContact O-N 3.49Å; E462-T465 WeakPolarHBondContact O-CB 3.44Å; E462-T465 PolarHBondContact O-N 3.49Å; E462-T465 VanDerWaalsContact O-N 3.11Å; E462-V466 WeakPolarHBondContact O-CG2 3.23Å; E462-V466 PolarHBondContact O-N 3.24Å
463	L	88.5	Confident	86.9	Confident	45 Å²	45	58.2 Å²	58.2	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-34.4	175.2	-177.9	62	0	0	0	112.8	I218 F459 R461 T465 V466 K467	I218-L463 HydrophobicContact CD1-CD1 3.63Å; I218-L463 HydrophobicContact CG1-CD1 4.3Å; F459-L463 WeakPolarHBondContact O-CB 3.5Å; F459-L463 PolarHBondContact O-N 3.47Å; R461-L463 VanDerWaalsContact C-N 3.29Å; R461-L463 PolarHBondContact O-N 3.49Å; L463-T465 VanDerWaalsContact C-N 3.32Å; L463-V466 PolarHBondContact O-N 3.06Å; L463-K467 WeakPolarHBondContact O-CG 3.33Å; L463-K467 PolarHBondContact O-N 3.38Å; L463-K467 VanDerWaalsContact O-N 3.13Å
464	Q	86.3	Confident	87.3	Confident	117 Å²	117	55.3 Å²	55.3	55%	0.547	27%	0.267	S	S	.	.	H	α-helix	trans	-63.9	-41.2	173.9	-70.7	175	-28.1	0	0	110.8	K460 R461 E462 K467 V468	K460-Q464 WeakPolarHBondContact O-CG 3.35Å; K460-Q464 PolarHBondContact O-N 3.14Å; R461-Q464 WeakPolarHBondContact O-CB 3.42Å; R461-Q464 PolarHBondContact O-N 3.09Å; R461-Q464 VanDerWaalsContact O-N 3.08Å; E462-Q464 VanDerWaalsContact C-N 3.3Å; E462-Q464 PolarHBondContact O-N 3.49Å; Q464-K467 PolarHBondContact O-N 2.9Å; Q464-V468 PolarHBondContact O-N 3.36Å
465	T	84.6	Confident	87.7	Confident	32 Å²	32	48.9 Å²	48.9	20%	0.196	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-44.5	175.8	-49.4	0	0	0	0	111.9	R461 E462 L463 K467 V468 M469	R461-T465 PolarHBondContact O-N 2.84Å; R461-T465 PolarHBondContact O-OG1 2.89Å; E462-T465 WeakPolarHBondContact O-CB 3.44Å; E462-T465 PolarHBondContact O-N 3.49Å; E462-T465 VanDerWaalsContact O-N 3.11Å; L463-T465 VanDerWaalsContact C-N 3.32Å; T465-K467 VanDerWaalsContact C-N 3.28Å; T465-K467 PolarHBondContact O-N 2.66Å; T465-V468 WeakPolarHBondContact O-CB 3.44Å; T465-V468 PolarHBondContact O-N 3.15Å; T465-M469 HydrophobicContact CG2-CE 3.73Å; T465-M469 HydrophobicContact CG2-SD 4.2Å; T465-M469 PolarHBondContact O-N 3.11Å; T465-M469 VanDerWaalsContact O-N 3.11Å
466	V	89.8	Confident	87.8	Confident	6 Å²	6	46.2 Å²	46.2	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-54.9	-44.1	175.5	170.8	0	0	0	0	111.3	R132 V136 I214 E462 L463 V468 M469 T470	R132-V466 HydrophobicContact CB-CG2 4.4Å; V136-V466 HydrophobicContact CG2-CG2 3.47Å; V136-V466 VanDerWaalsContact CG2-CG2 3.47Å; I214-V466 HydrophobicContact CG2-CG1 3.86Å; I214-V466 HydrophobicContact CG2-CG2 4.39Å; E462-V466 WeakPolarHBondContact O-CG2 3.23Å; E462-V466 PolarHBondContact O-N 3.24Å; L463-V466 PolarHBondContact O-N 3.06Å; V466-V468 VanDerWaalsContact C-N 3.26Å; V466-V468 PolarHBondContact O-N 3Å; V466-M469 PolarHBondContact O-N 2.94Å; V466-M469 VanDerWaalsContact O-N 3.11Å; V466-T470 PolarHBondContact O-N 2.84Å; V466-T470 PolarHBondContact O-OG1 2.93Å
467	K	89.4	Confident	88.2	Confident	114 Å²	114	46 Å²	46	50%	0.496	24%	0.235	S	C	.	.	H	α-helix	trans	-59	-36.7	178.3	-71.8	173.4	-178.4	-175.1	0	112.9	L463 Q464 T465 I471	L463-K467 WeakPolarHBondContact O-CG 3.33Å; L463-K467 PolarHBondContact O-N 3.38Å; L463-K467 VanDerWaalsContact O-N 3.13Å; Q464-K467 PolarHBondContact O-N 2.9Å; T465-K467 VanDerWaalsContact C-N 3.28Å; T465-K467 PolarHBondContact O-N 2.66Å; K467-I471 WeakPolarHBondContact O-CG1 3.18Å
468	V	88.1	Confident	88.6	Confident	13 Å²	13	49.5 Å²	49.5	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-46.9	175.7	-178.3	0	0	0	0	109.8	Q464 T465 V466 T470 I471 V472 I519 Y520 R523	Q464-V468 PolarHBondContact O-N 3.36Å; T465-V468 WeakPolarHBondContact O-CB 3.44Å; T465-V468 PolarHBondContact O-N 3.15Å; V466-V468 VanDerWaalsContact C-N 3.26Å; V466-V468 PolarHBondContact O-N 3Å; V468-T470 PolarHBondContact O-N 3.01Å; V468-I471 WeakPolarHBondContact O-CB 3.46Å; V468-I471 PolarHBondContact O-N 3.11Å; V468-V472 PolarHBondContact O-N 3Å; V468-V472 VanDerWaalsContact O-N 3.13Å; V468-I519 HydrophobicContact CG1-CG2 3.55Å; V468-Y520 HydrophobicContact CG1-CD1 4.48Å; V468-R523 HydrophobicContact CB-CB 4.4Å; V468-R523 HydrophobicContact CG1-CB 4.01Å; V468-R523 HydrophobicContact CG2-CB 3.65Å
469	M	86.3	Confident	88.9	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-70.1	-32	-178	-65.2	173.2	174.9	0	0	112.7	I128 R132 Y211 T465 V466 I471 V472 V473	I128-M469 HydrophobicContact CG2-CE 3.53Å; I128-M469 HydrophobicContact CG2-CG 3.92Å; I128-M469 HydrophobicContact CG2-SD 3.31Å; I128-M469 WeakPolarHBondContact CG2-SD 3.42Å; R132-M469 HydrophobicContact CB-SD 4.36Å; R132-M469 WeakPolarHBondContact CD-SD 3.29Å; R132-M469 HydrophobicContact CG-CE 3.91Å; R132-M469 HydrophobicContact CG-SD 2.98Å; R132-M469 WeakPolarHBondContact CG-SD 3.46Å; Y211-M469 VanDerWaalsContact OH-CB 3.31Å; Y211-M469 WeakPolarHBondContact OH-CB 3.17Å; Y211-M469 PolarHBondContact OH-O 3.36Å; T465-M469 HydrophobicContact CG2-CE 3.73Å; T465-M469 HydrophobicContact CG2-SD 4.2Å; T465-M469 PolarHBondContact O-N 3.11Å; T465-M469 VanDerWaalsContact O-N 3.11Å; V466-M469 PolarHBondContact O-N 2.94Å; V466-M469 VanDerWaalsContact O-N 3.11Å; M469-I471 PolarHBondContact O-N 2.9Å; M469-V472 WeakPolarHBondContact O-CB 3.49Å; M469-V472 PolarHBondContact O-N 2.82Å; M469-V472 VanDerWaalsContact O-N 3.15Å; M469-V473 WeakPolarHBondContact O-CB 3.3Å; M469-V473 PolarHBondContact O-N 3.07Å
470	T	90.7	Very high	88.9	Confident	68 Å²	68	48.5 Å²	48.5	42%	0.417	24%	0.24	S	C	.	.	H	α-helix	trans	-55.5	-36.3	169.4	-55.5	0	0	0	0	111.5	Y211 V466 V468 G474	Y211-T470 HydrophobicContact CE1-CG2 4.4Å; Y211-T470 WeakPolarHBondContact CE1-OG1 3.33Å; Y211-T470 PolarHBondContact OH-N 3.01Å; V466-T470 PolarHBondContact O-N 2.84Å; V466-T470 PolarHBondContact O-OG1 2.93Å; V468-T470 PolarHBondContact O-N 3.01Å; T470-G474 PolarHBondContact O-N 3.29Å
471	I	90.3	Very high	89.1	Confident	63 Å²	63	46 Å²	46	32%	0.323	23%	0.233	S	C	.	.	H	α-helix	trans	-73.3	-42.6	176.9	-61.9	163.8	0	0	0	110.6	K467 V468 M469 V473 G474 C475 I519	K467-I471 WeakPolarHBondContact O-CG1 3.18Å; V468-I471 WeakPolarHBondContact O-CB 3.46Å; V468-I471 PolarHBondContact O-N 3.11Å; M469-I471 PolarHBondContact O-N 2.9Å; I471-V473 VanDerWaalsContact C-N 3.35Å; I471-V473 PolarHBondContact O-N 3.4Å; I471-G474 PolarHBondContact O-N 3.21Å; I471-C475 PolarHBondContact O-N 3.25Å; I471-I519 HydrophobicContact CG2-CD1 4.01Å; I471-I519 HydrophobicContact CG2-CG1 4.16Å; I471-I519 HydrophobicContact CG2-CG2 4.45Å
472	V	88.5	Confident	89.4	Confident	1 Å²	1	42 Å²	42	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-56	-51	174.4	178.7	0	0	0	0	110.5	L125 V468 M469 G474 C475 F476 N516 I519 Y520	L125-V472 HydrophobicContact CD2-CG1 3.47Å; L125-V472 VanDerWaalsContact CD2-CG1 3.47Å; V468-V472 PolarHBondContact O-N 3Å; V468-V472 VanDerWaalsContact O-N 3.13Å; M469-V472 WeakPolarHBondContact O-CB 3.49Å; M469-V472 PolarHBondContact O-N 2.82Å; M469-V472 VanDerWaalsContact O-N 3.15Å; V472-G474 VanDerWaalsContact C-N 3.32Å; V472-G474 PolarHBondContact O-N 3.4Å; V472-C475 PolarHBondContact O-N 3.41Å; V472-F476 PolarHBondContact O-N 3.43Å; V472-N516 WeakPolarHBondContact CG1-OD1 3.47Å; V472-I519 HydrophobicContact CB-CD1 4.41Å; V472-I519 HydrophobicContact CG2-CB 4.13Å; V472-I519 HydrophobicContact CG2-CD1 3.93Å; V472-I519 HydrophobicContact CG2-CG2 3.52Å; V472-Y520 HydrophobicContact CG2-CE1 4.27Å
473	V	88.7	Confident	89.4	Confident	11 Å²	11	42.4 Å²	42.4	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-38.7	176.8	165.6	0	0	0	0	111.9	I207 Y211 M469 I471 F476 L477	I207-V473 HydrophobicContact CG2-CB 4.26Å; I207-V473 HydrophobicContact CG2-CG1 3.37Å; I207-V473 HydrophobicContact CG2-CG2 3.86Å; Y211-V473 HydrophobicContact CD2-CG1 4.5Å; Y211-V473 HydrophobicContact CD2-CG2 4.49Å; Y211-V473 HydrophobicContact CE2-CB 4.19Å; Y211-V473 HydrophobicContact CE2-CG1 4.27Å; Y211-V473 HydrophobicContact CE2-CG2 3.57Å; Y211-V473 WeakPolarHBondContact OH-CG2 3.3Å; M469-V473 WeakPolarHBondContact O-CB 3.3Å; M469-V473 PolarHBondContact O-N 3.07Å; I471-V473 VanDerWaalsContact C-N 3.35Å; I471-V473 PolarHBondContact O-N 3.4Å; V473-F476 PolarHBondContact O-N 2.84Å; V473-L477 HydrophobicContact CG1-CD1 4.02Å; V473-L477 HydrophobicContact CG1-CG 4.32Å; V473-L477 VanDerWaalsContact O-CG 3.31Å; V473-L477 WeakPolarHBondContact O-CG 3.29Å; V473-L477 PolarHBondContact O-N 2.85Å
474	G	91.3	Very high	89.2	Confident	35 Å²	35	40.9 Å²	40.9	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-60.4	-44.9	173.6	0	0	0	0	0	112.8	T470 I471 V472 L477 F478	T470-G474 PolarHBondContact O-N 3.29Å; I471-G474 PolarHBondContact O-N 3.21Å; V472-G474 VanDerWaalsContact C-N 3.32Å; V472-G474 PolarHBondContact O-N 3.4Å; G474-L477 PolarHBondContact O-N 3.34Å; G474-F478 VanDerWaalsContact O-CB 3.27Å; G474-F478 WeakPolarHBondContact O-CB 3.37Å; G474-F478 PolarHBondContact O-N 3.24Å
475	C	91.9	Very high	89.4	Confident	19 Å²	19	40.1 Å²	40.1	13%	0.128	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-44.8	175.2	179.2	0	0	0	0	110.6	I471 V472 L477 F478 C479 C515 I519	I471-C475 PolarHBondContact O-N 3.25Å; V472-C475 PolarHBondContact O-N 3.41Å; C475-L477 PolarHBondContact O-N 3.13Å; C475-F478 PolarHBondContact O-N 3.48Å; C475-C479 WeakPolarHBondContact O-CB 3.15Å; C475-C479 PolarHBondContact O-N 2.71Å; C475-C515 HydrophobicContact CB-CB 3.89Å; C475-C515 WeakPolarHBondContact CB-SG 3.47Å; C475-C515 WeakPolarHBondContact SG-CB 3.49Å; C475-C515 CovalentContact SG-SG 2.07Å; C475-C515 PolarHBondContact SG-SG 3.45Å; C475-I519 HydrophobicContact CB-CD1 4.41Å
476	F	90.1	Very high	89.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54	-55.8	174.3	166.9	-112.5	0	0	0	111.6	V122 L125 V204 I207 V472 V473 F478 C479 F480 N512	V122-F476 HydrophobicContact CB-CE2 4.39Å; V122-F476 HydrophobicContact CB-CZ 4.48Å; V122-F476 HydrophobicContact CG1-CE1 4.33Å; V122-F476 HydrophobicContact CG1-CE2 4Å; V122-F476 HydrophobicContact CG1-CZ 3.62Å; V122-F476 HydrophobicContact CG2-CD2 4.25Å; V122-F476 HydrophobicContact CG2-CE2 3.45Å; V122-F476 VanDerWaalsContact CG2-CE2 3.45Å; V122-F476 HydrophobicContact CG2-CZ 3.95Å; L125-F476 HydrophobicContact CD1-CB 3.95Å; L125-F476 HydrophobicContact CD1-CD2 4.17Å; L125-F476 HydrophobicContact CD1-CG 3.95Å; V204-F476 HydrophobicContact CG2-CE1 3.76Å; V204-F476 HydrophobicContact CG2-CZ 3.94Å; I207-F476 HydrophobicContact CD1-CD1 4.03Å; I207-F476 HydrophobicContact CD1-CE1 3.82Å; V472-F476 PolarHBondContact O-N 3.43Å; V473-F476 PolarHBondContact O-N 2.84Å; F476-F478 VanDerWaalsContact C-N 3.3Å; F476-F478 PolarHBondContact O-N 2.71Å; F476-C479 PolarHBondContact O-N 2.96Å; F476-F480 HydrophobicContact CD2-CB 4.32Å; F476-F480 HydrophobicContact CE2-CB 4.06Å; F476-F480 HydrophobicContact CE2-CG 4.23Å; F476-F480 HydrophobicContact CZ-CB 4.41Å; F476-F480 HydrophobicContact CZ-CD1 4.38Å; F476-F480 HydrophobicContact CZ-CG 4.22Å; F476-F480 WeakPolarHBondContact O-CB 3.34Å; F476-F480 PolarHBondContact O-N 3.33Å; F476-N512 VanDerWaalsContact CA-OD1 3.32Å; F476-N512 WeakPolarHBondContact CA-OD1 3.49Å; F476-N512 WeakPolarHBondContact CD2-ND2 2.91Å
477	L	91.2	Very high	89.1	Confident	53 Å²	53	41.5 Å²	41.5	28%	0.277	22%	0.221	S	C	.	.	H	α-helix	trans	-60.9	-38.7	-179.2	-67.5	175.8	0	0	0	112.2	V204 V473 G474 C475 L481	V204-L477 HydrophobicContact CG1-CD2 3.88Å; V204-L477 HydrophobicContact CG2-CD2 4.26Å; V473-L477 HydrophobicContact CG1-CD1 4.02Å; V473-L477 HydrophobicContact CG1-CG 4.32Å; V473-L477 VanDerWaalsContact O-CG 3.31Å; V473-L477 WeakPolarHBondContact O-CG 3.29Å; V473-L477 PolarHBondContact O-N 2.85Å; G474-L477 PolarHBondContact O-N 3.34Å; C475-L477 PolarHBondContact O-N 3.13Å; L477-L481 WeakPolarHBondContact O-CB 3.4Å; L477-L481 PolarHBondContact O-N 3.22Å
478	F	92.3	Very high	88.9	Confident	148 Å²	148	38.1 Å²	38.1	65%	0.649	21%	0.208	S	C	*	.	H	α-helix	trans	-66	-47.5	177.8	175.7	-95.8	0	0	0	112.6	G474 C475 F476 F480 P482 L508	G474-F478 VanDerWaalsContact O-CB 3.27Å; G474-F478 WeakPolarHBondContact O-CB 3.37Å; G474-F478 PolarHBondContact O-N 3.24Å; C475-F478 PolarHBondContact O-N 3.48Å; F476-F478 VanDerWaalsContact C-N 3.3Å; F476-F478 PolarHBondContact O-N 2.71Å; F478-F480 VanDerWaalsContact C-N 3.27Å; F478-F480 PolarHBondContact O-N 3.29Å; F478-P482 WeakPolarHBondContact O-CD 3.48Å; F478-L508 HydrophobicContact CE1-CD1 4.44Å
479	C	91.3	Very high	88.9	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.034	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-32.7	177.9	-78.3	0	0	0	0	112.2	C475 F476 L508 N512	C475-C479 WeakPolarHBondContact O-CB 3.15Å; C475-C479 PolarHBondContact O-N 2.71Å; F476-C479 PolarHBondContact O-N 2.96Å; C479-L508 WeakPolarHBondContact CB-O 3.25Å; C479-L508 PolarHBondContact SG-O 3.29Å; C479-N512 HydrophobicContact CB-CB 4.06Å
480	F	88.7	Confident	88.5	Confident	3 Å²	3	38.3 Å²	38.3	1%	0.013	21%	0.214	C	C	.	.	H	α-helix	trans	-87.1	-42.9	-172.8	167.8	-105.6	0	0	0	113.8	W200 V204 F476 F478 F483 L484 L509	W200-F480 HydrophobicContact CB-CE2 3.65Å; W200-F480 HydrophobicContact CB-CZ 3.41Å; W200-F480 VanDerWaalsContact CB-CZ 3.41Å; W200-F480 HydrophobicContact CD2-CD2 4.28Å; W200-F480 AromaticContact CD2-CE2 3.47Å; W200-F480 HydrophobicContact CD2-CE2 3.47Å; W200-F480 VanDerWaalsContact CD2-CE2 3.47Å; W200-F480 HydrophobicContact CD2-CZ 4.22Å; W200-F480 AromaticContact CE3-CD2 3.4Å; W200-F480 HydrophobicContact CE3-CD2 3.4Å; W200-F480 AromaticContact CE3-CE2 3.01Å; W200-F480 HydrophobicContact CE3-CE2 3.01Å; W200-F480 HydrophobicContact CE3-CZ 4.02Å; W200-F480 AromaticContact CG-CE2 3.78Å; W200-F480 HydrophobicContact CG-CE2 3.78Å; W200-F480 HydrophobicContact CG-CZ 4.05Å; W200-F480 AromaticContact CZ3-CD2 3.75Å; W200-F480 HydrophobicContact CZ3-CD2 3.75Å; W200-F480 AromaticContact CZ3-CE2 3.78Å; W200-F480 HydrophobicContact CZ3-CE2 3.78Å; V204-F480 HydrophobicContact CG2-CD1 3.81Å; V204-F480 HydrophobicContact CG2-CE1 3.5Å; V204-F480 HydrophobicContact CG2-CZ 4.29Å; F476-F480 HydrophobicContact CD2-CB 4.32Å; F476-F480 HydrophobicContact CE2-CB 4.06Å; F476-F480 HydrophobicContact CE2-CG 4.23Å; F476-F480 HydrophobicContact CZ-CB 4.41Å; F476-F480 HydrophobicContact CZ-CD1 4.38Å; F476-F480 HydrophobicContact CZ-CG 4.22Å; F476-F480 WeakPolarHBondContact O-CB 3.34Å; F476-F480 PolarHBondContact O-N 3.33Å; F478-F480 VanDerWaalsContact C-N 3.27Å; F478-F480 PolarHBondContact O-N 3.29Å; F480-F483 PolarHBondContact O-N 2.85Å; F480-F483 VanDerWaalsContact O-N 3.1Å; F480-L484 HydrophobicContact CE1-CB 3.78Å; F480-L484 HydrophobicContact CE1-CD2 3.51Å; F480-L484 HydrophobicContact CE1-CG 4.13Å; F480-L484 HydrophobicContact CE2-CB 3.92Å; F480-L484 HydrophobicContact CZ-CB 3.41Å; F480-L484 VanDerWaalsContact CZ-CB 3.41Å; F480-L484 HydrophobicContact CZ-CD1 3.91Å; F480-L484 HydrophobicContact CZ-CD2 3.61Å; F480-L484 HydrophobicContact CZ-CG 3.79Å; F480-L484 PolarHBondContact O-N 3.44Å; F480-L484 VanDerWaalsContact O-N 3.1Å; F480-L509 HydrophobicContact CB-CD1 4.31Å; F480-L509 HydrophobicContact CD2-CD1 4.18Å
481	L	90.6	Very high	88.1	Confident	90 Å²	90	36.3 Å²	36.3	47%	0.471	20%	0.2	S	C	.	.	H	α-helix	trans	-55	-43.8	-170	178.9	67.1	0	0	0	113.7	L477 F483 L484 L485	L477-L481 WeakPolarHBondContact O-CB 3.4Å; L477-L481 PolarHBondContact O-N 3.22Å; L481-F483 VanDerWaalsContact C-N 3.33Å; L481-F483 PolarHBondContact O-N 3.46Å; L481-L484 PolarHBondContact O-N 2.82Å; L481-L485 HydrophobicContact CD1-CD1 4.26Å; L481-L485 HydrophobicContact CD1-CD2 4.41Å; L481-L485 HydrophobicContact CD1-CG 4.08Å; L481-L485 HydrophobicContact CG-CD1 4.03Å; L481-L485 HydrophobicContact CG-CG 4.29Å; L481-L485 VanDerWaalsContact O-CG 3.3Å; L481-L485 WeakPolarHBondContact O-CG 3.45Å; L481-L485 PolarHBondContact O-N 3.31Å
482	P	92	Very high	87.9	Confident	42 Å²	42	40 Å²	40	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-60.5	-40.1	178.7	-27.6	39	0	0	0	113.5	F478 L485 V486 L505 L508	F478-P482 WeakPolarHBondContact O-CD 3.48Å; P482-L485 PolarHBondContact O-N 3.27Å; P482-V486 PolarHBondContact O-N 3.08Å; P482-L505 HydrophobicContact CB-CD2 3.59Å; P482-L508 HydrophobicContact CB-CD2 4.24Å; P482-L508 HydrophobicContact CG-CD2 3.93Å
483	F	86.5	Confident	87.8	Confident	20 Å²	20	42.4 Å²	42.4	9%	0.088	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-41.5	177.8	-172.9	-104.9	0	0	0	111.4	W200 F480 L481 L485 V486 H487 L505 L509	W200-F483 HydrophobicContact CH2-CD1 4.33Å; W200-F483 HydrophobicContact CH2-CE1 4.09Å; W200-F483 HydrophobicContact CZ2-CD1 4.38Å; W200-F483 AromaticContact CZ2-CE1 3.87Å; W200-F483 HydrophobicContact CZ2-CE1 3.87Å; F480-F483 PolarHBondContact O-N 2.85Å; F480-F483 VanDerWaalsContact O-N 3.1Å; L481-F483 VanDerWaalsContact C-N 3.33Å; L481-F483 PolarHBondContact O-N 3.46Å; F483-L485 PolarHBondContact O-N 3.31Å; F483-V486 PolarHBondContact O-N 3.28Å; F483-H487 AromaticContact CD1-CD2 3.76Å; F483-H487 AromaticContact CE1-CD2 3.34Å; F483-H487 WeakPolarHBondContact CE1-CD2 3.16Å; F483-H487 AromaticContact CE1-NE2 3.27Å; F483-H487 VanDerWaalsContact CE1-NE2 3.27Å; F483-H487 WeakPolarHBondContact CE1-NE2 3.45Å; F483-H487 AromaticContact CE2-NE2 3.6Å; F483-H487 AromaticContact CZ-CD2 3.55Å; F483-H487 AromaticContact CZ-NE2 2.97Å; F483-H487 WeakPolarHBondContact CZ-NE2 3.45Å; F483-H487 PolarHBondContact O-N 3.49Å; F483-H487 VanDerWaalsContact O-N 3.16Å; F483-L505 HydrophobicContact CB-CB 4.37Å; F483-L505 HydrophobicContact CD2-CB 3.89Å; F483-L509 HydrophobicContact CD1-CD2 4.49Å
484	L	85.8	Confident	87.3	Confident	13 Å²	13	47.2 Å²	47.2	7%	0.068	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-47.1	173.9	179.3	59.2	0	0	0	112.4	F201 F480 L481 V486 H487 L488	F201-L484 HydrophobicContact CD1-CD2 4.45Å; F201-L484 HydrophobicContact CD2-CD1 4.4Å; F201-L484 HydrophobicContact CE1-CD2 4.02Å; F201-L484 HydrophobicContact CE2-CD1 3.92Å; F201-L484 HydrophobicContact CZ-CD1 4.03Å; F201-L484 HydrophobicContact CZ-CD2 4.26Å; F480-L484 HydrophobicContact CE1-CB 3.78Å; F480-L484 HydrophobicContact CE1-CD2 3.51Å; F480-L484 HydrophobicContact CE1-CG 4.13Å; F480-L484 HydrophobicContact CE2-CB 3.92Å; F480-L484 HydrophobicContact CZ-CB 3.41Å; F480-L484 VanDerWaalsContact CZ-CB 3.41Å; F480-L484 HydrophobicContact CZ-CD1 3.91Å; F480-L484 HydrophobicContact CZ-CD2 3.61Å; F480-L484 HydrophobicContact CZ-CG 3.79Å; F480-L484 PolarHBondContact O-N 3.44Å; F480-L484 VanDerWaalsContact O-N 3.1Å; L481-L484 PolarHBondContact O-N 2.82Å; L484-V486 VanDerWaalsContact C-N 3.28Å; L484-V486 PolarHBondContact O-N 3.31Å; L484-H487 PolarHBondContact O-N 2.91Å; L484-L488 HydrophobicContact CD1-CD1 4.14Å; L484-L488 HydrophobicContact CD1-CG 4.1Å; L484-L488 HydrophobicContact CD2-CD1 4.42Å; L484-L488 HydrophobicContact CG-CD1 3.92Å; L484-L488 HydrophobicContact CG-CG 4.32Å; L484-L488 WeakPolarHBondContact O-CB 3.21Å; L484-L488 WeakPolarHBondContact O-CG 3.33Å; L484-L488 PolarHBondContact O-N 3.35Å
485	L	89.7	Confident	86.6	Confident	102 Å²	102	46.6 Å²	46.6	53%	0.534	26%	0.255	S	S	.	.	H	α-helix	trans	-62.3	-37.9	-177.8	-70.9	175.1	0	0	0	111.8	L481 P482 F483 L488 G489	L481-L485 HydrophobicContact CD1-CD1 4.26Å; L481-L485 HydrophobicContact CD1-CD2 4.41Å; L481-L485 HydrophobicContact CD1-CG 4.08Å; L481-L485 HydrophobicContact CG-CD1 4.03Å; L481-L485 HydrophobicContact CG-CG 4.29Å; L481-L485 VanDerWaalsContact O-CG 3.3Å; L481-L485 WeakPolarHBondContact O-CG 3.45Å; L481-L485 PolarHBondContact O-N 3.31Å; P482-L485 PolarHBondContact O-N 3.27Å; F483-L485 PolarHBondContact O-N 3.31Å; L485-L488 PolarHBondContact O-N 2.91Å; L485-G489 PolarHBondContact O-N 2.98Å
486	V	85.7	Confident	85.8	Confident	15 Å²	15	50.3 Å²	50.3	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-49.8	174.6	154	0	0	0	0	111.3	P482 F483 L484 L488 G489 E490 F497 L501 H502 L505	P482-V486 PolarHBondContact O-N 3.08Å; F483-V486 PolarHBondContact O-N 3.28Å; L484-V486 VanDerWaalsContact C-N 3.28Å; L484-V486 PolarHBondContact O-N 3.31Å; V486-L488 VanDerWaalsContact C-N 3.34Å; V486-L488 PolarHBondContact O-N 3.47Å; V486-G489 PolarHBondContact O-N 2.93Å; V486-E490 WeakPolarHBondContact O-CG 3.36Å; V486-E490 PolarHBondContact O-N 3.36Å; V486-F497 HydrophobicContact CG1-CD2 4.11Å; V486-L501 HydrophobicContact CG1-CD2 4.44Å; V486-L501 HydrophobicContact CG2-CD1 4.39Å; V486-L501 HydrophobicContact CG2-CD2 3.57Å; V486-L501 HydrophobicContact CG2-CG 3.89Å; V486-H502 VanDerWaalsContact CG1-CE1 3.42Å; V486-H502 WeakPolarHBondContact CG1-CE1 3.46Å; V486-L505 HydrophobicContact CB-CD1 4.04Å; V486-L505 HydrophobicContact CG1-CD1 4.46Å; V486-L505 HydrophobicContact CG2-CD1 3.45Å; V486-L505 VanDerWaalsContact CG2-CD1 3.45Å
487	H	81.3	Confident	85.3	Confident	51 Å²	51	53.4 Å²	53.4	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-35.1	178	-80.2	-47.2	0	0	0	113.6	F483 L484 E490 I491 H502	F483-H487 AromaticContact CD1-CD2 3.76Å; F483-H487 AromaticContact CE1-CD2 3.34Å; F483-H487 WeakPolarHBondContact CE1-CD2 3.16Å; F483-H487 AromaticContact CE1-NE2 3.27Å; F483-H487 VanDerWaalsContact CE1-NE2 3.27Å; F483-H487 WeakPolarHBondContact CE1-NE2 3.45Å; F483-H487 AromaticContact CE2-NE2 3.6Å; F483-H487 AromaticContact CZ-CD2 3.55Å; F483-H487 AromaticContact CZ-NE2 2.97Å; F483-H487 WeakPolarHBondContact CZ-NE2 3.45Å; F483-H487 PolarHBondContact O-N 3.49Å; F483-H487 VanDerWaalsContact O-N 3.16Å; L484-H487 PolarHBondContact O-N 2.91Å; H487-E490 IonicContact CE1-OE2 2.88Å; H487-E490 IonicContact ND1-OE2 2.68Å; H487-E490 PolarHBondContact ND1-OE2 3.05Å; H487-E490 VanDerWaalsContact ND1-OE2 3.14Å; H487-E490 PolarHBondContact O-N 3.44Å; H487-I491 WeakPolarHBondContact O-CD1 3.42Å; H487-I491 VanDerWaalsContact O-CG1 3.24Å; H487-I491 WeakPolarHBondContact O-CG1 3.41Å; H487-I491 PolarHBondContact O-N 3.05Å; H487-H502 AromaticContact CE1-CE1 3.79Å
488	L	86.3	Confident	84.7	Confident	43 Å²	43	52.3 Å²	52.3	23%	0.225	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-44.1	171.7	-77.1	175.5	0	0	0	112.1	F201 L484 L485 V486 E490 I491 I492	F201-L488 HydrophobicContact CE1-CD1 4.38Å; F201-L488 HydrophobicContact CE2-CD1 4.34Å; F201-L488 HydrophobicContact CE2-CD2 3.71Å; F201-L488 HydrophobicContact CE2-CG 4.3Å; F201-L488 HydrophobicContact CZ-CD1 3.56Å; F201-L488 HydrophobicContact CZ-CD2 3.64Å; F201-L488 HydrophobicContact CZ-CG 3.99Å; L484-L488 HydrophobicContact CD1-CD1 4.14Å; L484-L488 HydrophobicContact CD1-CG 4.1Å; L484-L488 HydrophobicContact CD2-CD1 4.42Å; L484-L488 HydrophobicContact CG-CD1 3.92Å; L484-L488 HydrophobicContact CG-CG 4.32Å; L484-L488 WeakPolarHBondContact O-CB 3.21Å; L484-L488 WeakPolarHBondContact O-CG 3.33Å; L484-L488 PolarHBondContact O-N 3.35Å; L485-L488 PolarHBondContact O-N 2.91Å; V486-L488 VanDerWaalsContact C-N 3.34Å; V486-L488 PolarHBondContact O-N 3.47Å; L488-E490 VanDerWaalsContact C-N 3.3Å; L488-E490 PolarHBondContact O-N 3.31Å; L488-I491 PolarHBondContact O-N 3.47Å; L488-I492 WeakPolarHBondContact O-CD1 3.11Å; L488-I492 VanDerWaalsContact O-CG1 3.25Å; L488-I492 WeakPolarHBondContact O-CG1 3.39Å; L488-I492 PolarHBondContact O-N 3.21Å
489	G	86.8	Confident	83.9	Confident	21 Å²	21	47.6 Å²	47.6	22%	0.216	26%	0.262	C	S	.	.	H	α-helix	trans	-54.9	-48.9	173.8	0	0	0	0	0	111.1	L485 V486 I491 I492 C493	L485-G489 PolarHBondContact O-N 2.98Å; V486-G489 PolarHBondContact O-N 2.93Å; G489-I491 PolarHBondContact O-N 2.87Å; G489-I492 PolarHBondContact O-N 2.91Å; G489-C493 PolarHBondContact O-N 3.47Å; G489-C493 PolarHBondContact O-SG 3.2Å
490	E	79.2	Confident	83.2	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-38	177.9	-71.9	-173.5	145.2	0	0	114.1	V486 H487 L488 C493 T494 C495 F497 H502	V486-E490 WeakPolarHBondContact O-CG 3.36Å; V486-E490 PolarHBondContact O-N 3.36Å; H487-E490 IonicContact CE1-OE2 2.88Å; H487-E490 IonicContact ND1-OE2 2.68Å; H487-E490 PolarHBondContact ND1-OE2 3.05Å; H487-E490 VanDerWaalsContact ND1-OE2 3.14Å; H487-E490 PolarHBondContact O-N 3.44Å; L488-E490 VanDerWaalsContact C-N 3.3Å; L488-E490 PolarHBondContact O-N 3.31Å; E490-C493 VanDerWaalsContact CA-SG 3.53Å; E490-T494 WeakPolarHBondContact O-CA 3.3Å; E490-T494 PolarHBondContact O-N 2.9Å; E490-C495 PolarHBondContact O-N 3.25Å; E490-F497 HydrophobicContact CG-CB 4.43Å; E490-F497 HydrophobicContact CG-CD2 3.64Å; E490-F497 HydrophobicContact CG-CE2 4.04Å; E490-F497 HydrophobicContact CG-CG 4.08Å; E490-F497 PolarHBondContact OE1-N 3.03Å; E490-H502 IonicContact OE1-CD2 3.42Å; E490-H502 IonicContact OE1-CE1 3.65Å; E490-H502 PolarHBondContact OE1-CE1 3.2Å; E490-H502 VanDerWaalsContact OE1-CE1 3.29Å; E490-H502 IonicContact OE1-NE2 3.11Å; E490-H502 PolarHBondContact OE1-NE2 2.93Å; E490-H502 IonicContact OE2-CE1 3.95Å; E490-H502 PolarHBondContact OE2-CE1 3.44Å; E490-H502 IonicContact OE2-NE2 3.29Å
491	I	82.6	Confident	82.9	Confident	26 Å²	26	52.4 Å²	52.4	13%	0.133	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-44.4	174.5	-70.1	163.4	0	0	0	110.3	R192 L193 A196 H487 L488 G489	R192-I491 HydrophobicContact CB-CD1 4.06Å; R192-I491 HydrophobicContact CB-CG1 3.86Å; L193-I491 HydrophobicContact CD2-CD1 4.25Å; L193-I491 HydrophobicContact CD2-CG2 3.78Å; L193-I491 HydrophobicContact CG-CG2 4.18Å; A196-I491 HydrophobicContact CB-CD1 4.08Å; H487-I491 WeakPolarHBondContact O-CD1 3.42Å; H487-I491 VanDerWaalsContact O-CG1 3.24Å; H487-I491 WeakPolarHBondContact O-CG1 3.41Å; H487-I491 PolarHBondContact O-N 3.05Å; L488-I491 PolarHBondContact O-N 3.47Å; G489-I491 PolarHBondContact O-N 2.87Å
492	I	86.1	Confident	82.5	Confident	141 Å²	141	48.9 Å²	48.9	72%	0.723	27%	0.268	S	S	*	.	H	α-helix	trans	-70.9	-47.1	-176.8	-66.9	164.4	0	0	0	111.6	L488 G489 T494	L488-I492 WeakPolarHBondContact O-CD1 3.11Å; L488-I492 VanDerWaalsContact O-CG1 3.25Å; L488-I492 WeakPolarHBondContact O-CG1 3.39Å; L488-I492 PolarHBondContact O-N 3.21Å; G489-I492 PolarHBondContact O-N 2.91Å; I492-T494 VanDerWaalsContact C-N 3.28Å; I492-T494 PolarHBondContact O-N 3.32Å
493	C	85.3	Confident	82.2	Confident	51 Å²	51	47.3 Å²	47.3	35%	0.345	26%	0.257	S	S	.	.	H	α-helix	trans	-79.5	-10.3	-178.9	64.3	0	0	0	0	113.2	G489 E490 C495	G489-C493 PolarHBondContact O-N 3.47Å; G489-C493 PolarHBondContact O-SG 3.2Å; E490-C493 VanDerWaalsContact CA-SG 3.53Å; C493-C495 HydrophobicContact CB-CB 3.95Å; C493-C495 WeakPolarHBondContact CB-SG 3.34Å; C493-C495 PolarHBondContact O-N 2.94Å; C493-C495 VanDerWaalsContact O-N 3.17Å; C493-C495 VanDerWaalsContact SG-CA 3.56Å; C493-C495 WeakPolarHBondContact SG-CB 3.4Å; C493-C495 PolarHBondContact SG-N 2.82Å; C493-C495 CovalentContact SG-SG 2.03Å; C493-C495 PolarHBondContact SG-SG 3.08Å
494	T	78.2	Confident	82.3	Confident	111 Å²	111	48.7 Å²	48.7	68%	0.681	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	31	-167.7	58.9	0	0	0	0	113.1	E490 I492	E490-T494 WeakPolarHBondContact O-CA 3.3Å; E490-T494 PolarHBondContact O-N 2.9Å; I492-T494 VanDerWaalsContact C-N 3.28Å; I492-T494 PolarHBondContact O-N 3.32Å
495	C	77.5	Confident	82.5	Confident	23 Å²	23	49.2 Å²	49.2	16%	0.155	27%	0.271	C	S	.	.			trans	-112.7	173.7	-176.1	72	0	0	0	0	111.1	F3 R192 E490 C493 F497	F3-C495 HydrophobicContact CZ-CB 4.39Å; R192-C495 PolarHBondContact NH1-O 2.02Å; E490-C495 PolarHBondContact O-N 3.25Å; C493-C495 HydrophobicContact CB-CB 3.95Å; C493-C495 WeakPolarHBondContact CB-SG 3.34Å; C493-C495 PolarHBondContact O-N 2.94Å; C493-C495 VanDerWaalsContact O-N 3.17Å; C493-C495 VanDerWaalsContact SG-CA 3.56Å; C493-C495 WeakPolarHBondContact SG-CB 3.4Å; C493-C495 PolarHBondContact SG-N 2.82Å; C493-C495 CovalentContact SG-SG 2.03Å; C493-C495 PolarHBondContact SG-SG 3.08Å; C495-F497 VanDerWaalsContact SG-CE1 3.53Å
496	I	74.1	Confident	82.3	Confident	96 Å²	96	45.9 Å²	45.9	49%	0.492	26%	0.256	S	S	.	.			trans	-122.5	119.1	176.2	-60.5	174.1	0	0	0	106.6	Y187	Y187-I496 HydrophobicContact CD1-CD1 3.96Å; Y187-I496 HydrophobicContact CD1-CG1 4.11Å; Y187-I496 HydrophobicContact CD2-CD1 4.04Å; Y187-I496 HydrophobicContact CE1-CD1 4Å; Y187-I496 HydrophobicContact CE1-CG1 4.1Å; Y187-I496 HydrophobicContact CE1-CG2 4.18Å; Y187-I496 HydrophobicContact CE2-CD1 4.07Å; Y187-I496 HydrophobicContact CG-CD1 3.99Å
497	F	79.8	Confident	82.6	Confident	66 Å²	66	45.5 Å²	45.5	29%	0.289	25%	0.253	S	S	.	.			trans	-78.8	150.3	173.1	-66.7	-34.3	0	0	0	110.3	V486 E490 C495 L501 H502	V486-F497 HydrophobicContact CG1-CD2 4.11Å; E490-F497 HydrophobicContact CG-CB 4.43Å; E490-F497 HydrophobicContact CG-CD2 3.64Å; E490-F497 HydrophobicContact CG-CE2 4.04Å; E490-F497 HydrophobicContact CG-CG 4.08Å; E490-F497 PolarHBondContact OE1-N 3.03Å; C495-F497 VanDerWaalsContact SG-CE1 3.53Å; F497-L501 HydrophobicContact CB-CD2 4.02Å; F497-L501 HydrophobicContact CD2-CD2 4.12Å; F497-L501 HydrophobicContact CG-CD2 4.24Å; F497-H502 PolarHBondContact O-CD2 2.95Å; F497-H502 VanDerWaalsContact O-CD2 3.29Å; F497-H502 PolarHBondContact O-NE2 3.27Å
498	P	78.5	Confident	83.1	Confident	29 Å²	29	44.9 Å²	44.9	19%	0.188	25%	0.251	C	S	.	.			trans	-68.2	151.6	-173.6	28.3	-36.9	0	0	0	112.2	V10 F16 I500 L501 H502	V10-P498 HydrophobicContact CG2-CG 4.4Å; F16-P498 HydrophobicContact CE2-CB 4.08Å; F16-P498 HydrophobicContact CZ-CB 3.64Å; P498-I500 HydrophobicContact CB-CG2 3.71Å; P498-I500 HydrophobicContact CG-CG2 3.51Å; P498-I500 PolarHBondContact O-N 3.17Å; P498-L501 WeakPolarHBondContact O-CB 3.38Å; P498-L501 PolarHBondContact O-N 3.18Å; P498-H502 PolarHBondContact O-N 3.33Å
499	E	75.7	Confident	83.3	Confident	49 Å²	49	43.7 Å²	43.7	23%	0.229	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-23.5	179.6	-68.3	-76.4	130.5	0	0	113.3	V26 R93 L501 H502 V503	V26-E499 HydrophobicContact CG2-CB 3.82Å; V26-E499 HydrophobicContact CG2-CG 4.2Å; R93-E499 IonicContact NH2-OE2 3.02Å; R93-E499 PolarHBondContact NH2-OE2 3.4Å; E499-L501 PolarHBondContact O-N 2.93Å; E499-L501 VanDerWaalsContact O-N 3.1Å; E499-H502 PolarHBondContact O-N 3.48Å; E499-V503 HydrophobicContact CB-CG2 4.33Å; E499-V503 VanDerWaalsContact O-CB 3.26Å; E499-V503 WeakPolarHBondContact O-CB 3.48Å; E499-V503 WeakPolarHBondContact O-CG2 2.96Å; E499-V503 PolarHBondContact O-N 3.48Å
500	I	76.7	Confident	83.6	Confident	43 Å²	43	43.8 Å²	43.8	22%	0.221	24%	0.239	C	C	.	.	H	α-helix	trans	-53.2	-28.1	170.8	-174	59.9	0	0	0	112.8	L13 W28 P498 P504	L13-I500 HydrophobicContact CB-CD1 4.03Å; L13-I500 HydrophobicContact CB-CG1 4.19Å; L13-I500 HydrophobicContact CD1-CD1 4.11Å; L13-I500 HydrophobicContact CD1-CG1 3.97Å; W28-I500 HydrophobicContact CE3-CD1 3.76Å; W28-I500 HydrophobicContact CH2-CB 4.17Å; W28-I500 HydrophobicContact CH2-CD1 3.28Å; W28-I500 HydrophobicContact CH2-CG1 4.26Å; W28-I500 HydrophobicContact CZ2-CD1 4.27Å; W28-I500 HydrophobicContact CZ3-CD1 2.97Å; W28-I500 HydrophobicContact CZ3-CG1 4.3Å; P498-I500 HydrophobicContact CB-CG2 3.71Å; P498-I500 HydrophobicContact CG-CG2 3.51Å; P498-I500 PolarHBondContact O-N 3.17Å; I500-P504 WeakPolarHBondContact O-CD 3.44Å; I500-P504 VanDerWaalsContact O-CG 3.26Å; I500-P504 WeakPolarHBondContact O-CG 3.37Å
501	L	83.1	Confident	84.1	Confident	67 Å²	67	45.9 Å²	45.9	35%	0.351	25%	0.25	S	S	.	.	H	α-helix	trans	-92.7	-45.3	176.3	-172.6	60.1	0	0	0	111.5	V486 F497 P498 E499 V503 L505	V486-L501 HydrophobicContact CG1-CD2 4.44Å; V486-L501 HydrophobicContact CG2-CD1 4.39Å; V486-L501 HydrophobicContact CG2-CD2 3.57Å; V486-L501 HydrophobicContact CG2-CG 3.89Å; F497-L501 HydrophobicContact CB-CD2 4.02Å; F497-L501 HydrophobicContact CD2-CD2 4.12Å; F497-L501 HydrophobicContact CG-CD2 4.24Å; P498-L501 WeakPolarHBondContact O-CB 3.38Å; P498-L501 PolarHBondContact O-N 3.18Å; E499-L501 PolarHBondContact O-N 2.93Å; E499-L501 VanDerWaalsContact O-N 3.1Å; L501-V503 PolarHBondContact O-N 2.88Å; L501-L505 HydrophobicContact CD1-CD1 3.91Å; L501-L505 HydrophobicContact CD1-CG 4.48Å; L501-L505 HydrophobicContact CG-CD1 3.98Å; L501-L505 WeakPolarHBondContact O-CB 3.42Å; L501-L505 WeakPolarHBondContact O-CD1 3.32Å; L501-L505 WeakPolarHBondContact O-CG 3.05Å; L501-L505 PolarHBondContact O-N 3.3Å
502	H	82.6	Confident	84.4	Confident	16 Å²	16	44.9 Å²	44.9	7%	0.074	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-40.5	-177.9	-76.2	-68.7	0	0	0	113.6	V486 H487 E490 F497 P498 E499 L505 S506	V486-H502 VanDerWaalsContact CG1-CE1 3.42Å; V486-H502 WeakPolarHBondContact CG1-CE1 3.46Å; H487-H502 AromaticContact CE1-CE1 3.79Å; E490-H502 IonicContact OE1-CD2 3.42Å; E490-H502 IonicContact OE1-CE1 3.65Å; E490-H502 PolarHBondContact OE1-CE1 3.2Å; E490-H502 VanDerWaalsContact OE1-CE1 3.29Å; E490-H502 IonicContact OE1-NE2 3.11Å; E490-H502 PolarHBondContact OE1-NE2 2.93Å; E490-H502 IonicContact OE2-CE1 3.95Å; E490-H502 PolarHBondContact OE2-CE1 3.44Å; E490-H502 IonicContact OE2-NE2 3.29Å; F497-H502 PolarHBondContact O-CD2 2.95Å; F497-H502 VanDerWaalsContact O-CD2 3.29Å; F497-H502 PolarHBondContact O-NE2 3.27Å; P498-H502 PolarHBondContact O-N 3.33Å; E499-H502 PolarHBondContact O-N 3.48Å; H502-L505 PolarHBondContact O-N 3.41Å; H502-S506 WeakPolarHBondContact O-CB 3.48Å; H502-S506 PolarHBondContact O-N 2.94Å; H502-S506 PolarHBondContact O-OG 3.33Å
503	V	84.9	Confident	84.6	Confident	9 Å²	9	38.5 Å²	38.5	6%	0.055	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-56.1	-175.1	160.5	0	0	0	0	111.8	W28 M36 E499 L501 L505 S506 W507	W28-V503 HydrophobicContact CH2-CB 4.33Å; W28-V503 HydrophobicContact CH2-CG1 4.35Å; W28-V503 HydrophobicContact CZ2-CB 4.05Å; W28-V503 HydrophobicContact CZ2-CG1 4.23Å; W28-V503 HydrophobicContact CZ2-CG2 4.2Å; M36-V503 HydrophobicContact CE-CG1 3.71Å; E499-V503 HydrophobicContact CB-CG2 4.33Å; E499-V503 VanDerWaalsContact O-CB 3.26Å; E499-V503 WeakPolarHBondContact O-CB 3.48Å; E499-V503 WeakPolarHBondContact O-CG2 2.96Å; E499-V503 PolarHBondContact O-N 3.48Å; L501-V503 PolarHBondContact O-N 2.88Å; V503-L505 VanDerWaalsContact C-N 3.27Å; V503-L505 PolarHBondContact O-N 3.02Å; V503-S506 PolarHBondContact O-N 2.87Å; V503-W507 VanDerWaalsContact O-CD1 3.29Å; V503-W507 PolarHBondContact O-N 2.88Å; V503-W507 VanDerWaalsContact O-N 3.13Å
504	P	87.8	Confident	84.7	Confident	49 Å²	49	36.7 Å²	36.7	32%	0.318	20%	0.2	S	C	.	.	H	α-helix	trans	-60.8	-36.9	178	-21.9	32.5	0	0	0	113	M36 I500 W507 L508	M36-P504 HydrophobicContact CE-CB 4.05Å; M36-P504 HydrophobicContact CE-CG 3.79Å; I500-P504 WeakPolarHBondContact O-CD 3.44Å; I500-P504 VanDerWaalsContact O-CG 3.26Å; I500-P504 WeakPolarHBondContact O-CG 3.37Å; P504-W507 PolarHBondContact O-N 3.05Å; P504-L508 WeakPolarHBondContact O-CB 3.41Å; P504-L508 PolarHBondContact O-N 2.67Å
505	L	89.7	Confident	85.1	Confident	24 Å²	24	33.1 Å²	33.1	13%	0.126	18%	0.179	C	C	.	.	H	α-helix	trans	-70.1	-34	179.1	-66.3	-178.2	0	0	0	112.7	P482 F483 V486 L501 H502 V503 L508 L509	P482-L505 HydrophobicContact CB-CD2 3.59Å; F483-L505 HydrophobicContact CB-CB 4.37Å; F483-L505 HydrophobicContact CD2-CB 3.89Å; V486-L505 HydrophobicContact CB-CD1 4.04Å; V486-L505 HydrophobicContact CG1-CD1 4.46Å; V486-L505 HydrophobicContact CG2-CD1 3.45Å; V486-L505 VanDerWaalsContact CG2-CD1 3.45Å; L501-L505 HydrophobicContact CD1-CD1 3.91Å; L501-L505 HydrophobicContact CD1-CG 4.48Å; L501-L505 HydrophobicContact CG-CD1 3.98Å; L501-L505 WeakPolarHBondContact O-CB 3.42Å; L501-L505 WeakPolarHBondContact O-CD1 3.32Å; L501-L505 WeakPolarHBondContact O-CG 3.05Å; L501-L505 PolarHBondContact O-N 3.3Å; H502-L505 PolarHBondContact O-N 3.41Å; V503-L505 VanDerWaalsContact C-N 3.27Å; V503-L505 PolarHBondContact O-N 3.02Å; L505-L508 HydrophobicContact CD2-CD2 4.22Å; L505-L508 WeakPolarHBondContact O-CB 3.39Å; L505-L508 PolarHBondContact O-N 2.74Å; L505-L509 PolarHBondContact O-N 3.44Å
506	S	87.4	Confident	85.3	Confident	31 Å²	31	32 Å²	32	22%	0.217	17%	0.172	C	C	.	.	H	α-helix	trans	-64.4	-41.8	172.5	-58.7	0	0	0	0	111	H502 V503 L509 Y510	H502-S506 WeakPolarHBondContact O-CB 3.48Å; H502-S506 PolarHBondContact O-N 2.94Å; H502-S506 PolarHBondContact O-OG 3.33Å; V503-S506 PolarHBondContact O-N 2.87Å; S506-L509 WeakPolarHBondContact O-CB 3.32Å; S506-L509 PolarHBondContact O-N 3.5Å; S506-Y510 VanDerWaalsContact O-CD2 3.29Å; S506-Y510 WeakPolarHBondContact O-CD2 3.48Å; S506-Y510 PolarHBondContact O-N 3.37Å; S506-Y510 VanDerWaalsContact O-N 3.11Å
507	W	91.4	Very high	85.7	Confident	8 Å²	8	27.9 Å²	27.9	3%	0.03	15%	0.151	C	C	.	.	H	α-helix	trans	-69	-35.2	174.3	-77.4	103.7	0	0	0	113	F39 S40 V43 L87 A90 I91 V503 P504 L509 Y510 L511	F39-W507 HydrophobicContact CE1-CB 4.12Å; S40-W507 WeakPolarHBondContact O-CZ3 3.22Å; S40-W507 WeakPolarHBondContact OG-CZ2 3.48Å; S40-W507 PolarHBondContact OG-NE1 3.49Å; V43-W507 HydrophobicContact CB-CE3 4.33Å; V43-W507 HydrophobicContact CB-CZ3 4.32Å; V43-W507 HydrophobicContact CG1-CE3 4Å; V43-W507 HydrophobicContact CG1-CZ3 4.05Å; L87-W507 HydrophobicContact CD2-CH2 4.41Å; L87-W507 HydrophobicContact CD2-CZ3 4.44Å; A90-W507 HydrophobicContact CB-CH2 4.45Å; A90-W507 HydrophobicContact CB-CZ2 4.16Å; I91-W507 HydrophobicContact CD1-CH2 4.46Å; I91-W507 HydrophobicContact CG1-CH2 3.72Å; I91-W507 HydrophobicContact CG1-CZ2 4.09Å; V503-W507 VanDerWaalsContact O-CD1 3.29Å; V503-W507 PolarHBondContact O-N 2.88Å; V503-W507 VanDerWaalsContact O-N 3.13Å; P504-W507 PolarHBondContact O-N 3.05Å; W507-L509 PolarHBondContact O-N 3.1Å; W507-Y510 HydrophobicContact CD2-CD2 4.03Å; W507-Y510 AromaticContact CE3-CD2 3.77Å; W507-Y510 HydrophobicContact CE3-CD2 3.77Å; W507-Y510 HydrophobicContact CH2-CD2 4.46Å; W507-Y510 HydrophobicContact CZ3-CD2 4.02Å; W507-Y510 PolarHBondContact O-N 2.86Å; W507-L511 PolarHBondContact O-N 3Å
508	L	91.7	Very high	85.8	Confident	38 Å²	38	29.4 Å²	29.4	20%	0.199	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-36	171.4	-178.5	63.4	0	0	0	111.6	F478 C479 P482 P504 L505 L511	F478-L508 HydrophobicContact CE1-CD1 4.44Å; C479-L508 WeakPolarHBondContact CB-O 3.25Å; C479-L508 PolarHBondContact SG-O 3.29Å; P482-L508 HydrophobicContact CB-CD2 4.24Å; P482-L508 HydrophobicContact CG-CD2 3.93Å; P504-L508 WeakPolarHBondContact O-CB 3.41Å; P504-L508 PolarHBondContact O-N 2.67Å; L505-L508 HydrophobicContact CD2-CD2 4.22Å; L505-L508 WeakPolarHBondContact O-CB 3.39Å; L505-L508 PolarHBondContact O-N 2.74Å; L508-L511 HydrophobicContact CD1-CD1 3.96Å; L508-L511 WeakPolarHBondContact O-CB 3.4Å; L508-L511 PolarHBondContact O-N 3.38Å
509	L	90.2	Very high	85.9	Confident	17 Å²	17	28.9 Å²	28.9	9%	0.089	15%	0.154	C	C	.	.	H	α-helix	trans	-65.7	-46	172.9	177.8	68.9	0	0	0	111.7	W200 F480 F483 L505 S506 W507 L511 N512	W200-L509 HydrophobicContact CH2-CD1 4.46Å; W200-L509 HydrophobicContact CH2-CD2 3.33Å; W200-L509 HydrophobicContact CZ3-CD1 3.89Å; W200-L509 HydrophobicContact CZ3-CD2 3.64Å; W200-L509 HydrophobicContact CZ3-CG 4.41Å; F480-L509 HydrophobicContact CB-CD1 4.31Å; F480-L509 HydrophobicContact CD2-CD1 4.18Å; F483-L509 HydrophobicContact CD1-CD2 4.49Å; L505-L509 PolarHBondContact O-N 3.44Å; S506-L509 WeakPolarHBondContact O-CB 3.32Å; S506-L509 PolarHBondContact O-N 3.5Å; W507-L509 PolarHBondContact O-N 3.1Å; L509-L511 PolarHBondContact O-N 3.03Å; L509-N512 WeakPolarHBondContact O-CB 3.26Å; L509-N512 PolarHBondContact O-N 3.24Å
510	Y	92.8	Very high	85.9	Confident	24 Å²	24	27 Å²	27	9%	0.094	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-28.5	176.5	-61.1	-45.6	0	0	0	112.9	I47 L82 L87 N114 S506 W507 N512 S513	I47-Y510 WeakPolarHBondContact CD1-O 3.44Å; L82-Y510 HydrophobicContact CD1-CE1 4.42Å; L82-Y510 HydrophobicContact CD2-CD1 4.07Å; L82-Y510 HydrophobicContact CD2-CE1 4.48Å; L87-Y510 HydrophobicContact CD2-CD1 4.01Å; L87-Y510 HydrophobicContact CD2-CD2 3.88Å; L87-Y510 HydrophobicContact CD2-CE1 4.1Å; L87-Y510 HydrophobicContact CD2-CE2 4Å; L87-Y510 HydrophobicContact CD2-CG 3.91Å; N114-Y510 PolarHBondContact OD1-OH 3.04Å; S506-Y510 VanDerWaalsContact O-CD2 3.29Å; S506-Y510 WeakPolarHBondContact O-CD2 3.48Å; S506-Y510 PolarHBondContact O-N 3.37Å; S506-Y510 VanDerWaalsContact O-N 3.11Å; W507-Y510 HydrophobicContact CD2-CD2 4.03Å; W507-Y510 AromaticContact CE3-CD2 3.77Å; W507-Y510 HydrophobicContact CE3-CD2 3.77Å; W507-Y510 HydrophobicContact CH2-CD2 4.46Å; W507-Y510 HydrophobicContact CZ3-CD2 4.02Å; W507-Y510 PolarHBondContact O-N 2.86Å; Y510-N512 PolarHBondContact O-N 3.43Å; Y510-N512 VanDerWaalsContact O-N 3.13Å; Y510-S513 WeakPolarHBondContact O-CB 3.41Å; Y510-S513 PolarHBondContact O-N 3.39Å
511	L	90.7	Very high	85.8	Confident	46 Å²	46	26 Å²	26	24%	0.241	14%	0.143	C	C	.	.	H	α-helix	trans	-58.6	-22.1	173.4	-77.7	177	0	0	0	113.5	F39 V43 W507 L508 L509 S513 C514 C515	F39-L511 HydrophobicContact CZ-CD1 4Å; F39-L511 HydrophobicContact CZ-CD2 4.21Å; F39-L511 HydrophobicContact CZ-CG 4.3Å; V43-L511 HydrophobicContact CB-CD2 4.5Å; V43-L511 HydrophobicContact CG1-CD2 4.15Å; V43-L511 HydrophobicContact CG2-CD2 3.56Å; V43-L511 HydrophobicContact CG2-CG 4.41Å; W507-L511 PolarHBondContact O-N 3Å; L508-L511 HydrophobicContact CD1-CD1 3.96Å; L508-L511 WeakPolarHBondContact O-CB 3.4Å; L508-L511 PolarHBondContact O-N 3.38Å; L509-L511 PolarHBondContact O-N 3.03Å; L511-S513 VanDerWaalsContact C-N 3.26Å; L511-S513 PolarHBondContact O-N 2.88Å; L511-C514 HydrophobicContact CD2-CB 4.38Å; L511-C514 WeakPolarHBondContact O-CA 3.1Å; L511-C514 VanDerWaalsContact O-CB 3.25Å; L511-C514 WeakPolarHBondContact O-CB 3.26Å; L511-C514 PolarHBondContact O-N 2.88Å; L511-C515 PolarHBondContact O-N 2.86Å
512	N	88.6	Confident	85.4	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.027	16%	0.161	C	C	.	.	H	α-helix	trans	-56.4	-43.1	172.2	179	39.7	0	0	0	111.4	F476 C479 L509 Y510 C514 C515	F476-N512 VanDerWaalsContact CA-OD1 3.32Å; F476-N512 WeakPolarHBondContact CA-OD1 3.49Å; F476-N512 WeakPolarHBondContact CD2-ND2 2.91Å; C479-N512 HydrophobicContact CB-CB 4.06Å; L509-N512 WeakPolarHBondContact O-CB 3.26Å; L509-N512 PolarHBondContact O-N 3.24Å; Y510-N512 PolarHBondContact O-N 3.43Å; Y510-N512 VanDerWaalsContact O-N 3.13Å; N512-C514 PolarHBondContact O-N 3.21Å; N512-C515 WeakPolarHBondContact O-CB 3.37Å; N512-C515 PolarHBondContact O-N 3.39Å
513	S	90	Very high	84.9	Confident	7 Å²	7	36.3 Å²	36.3	5%	0.049	18%	0.182	C	C	.	.	H	α-helix	trans	-68.7	-18.7	177	-58.8	0	0	0	0	113	N51 D79 Y510 L511	N51-S513 PolarHBondContact ND2-O 3.16Å; D79-S513 VanDerWaalsContact CG-CB 3.43Å; D79-S513 VanDerWaalsContact CG-OG 3.26Å; D79-S513 WeakPolarHBondContact OD1-CB 3.32Å; D79-S513 PolarHBondContact OD1-OG 3.01Å; Y510-S513 WeakPolarHBondContact O-CB 3.41Å; Y510-S513 PolarHBondContact O-N 3.39Å; L511-S513 VanDerWaalsContact C-N 3.26Å; L511-S513 PolarHBondContact O-N 2.88Å
514	C	87.8	Confident	84.3	Confident	12 Å²	12	37.7 Å²	37.7	8%	0.081	19%	0.189	C	C	.	.	H	α-helix	trans	-76.1	-39.5	170.9	-59.9	0	0	0	0	112.3	V46 I47 L511 N512 N516 P517 F518	V46-C514 HydrophobicContact CG1-CB 4.09Å; I47-C514 HydrophobicContact CG1-CB 4.39Å; I47-C514 WeakPolarHBondContact CG1-SG 3.38Å; L511-C514 HydrophobicContact CD2-CB 4.38Å; L511-C514 WeakPolarHBondContact O-CA 3.1Å; L511-C514 VanDerWaalsContact O-CB 3.25Å; L511-C514 WeakPolarHBondContact O-CB 3.26Å; L511-C514 PolarHBondContact O-N 2.88Å; N512-C514 PolarHBondContact O-N 3.21Å; C514-N516 PolarHBondContact O-N 2.87Å; C514-P517 WeakPolarHBondContact O-CD 3.43Å; C514-F518 WeakPolarHBondContact O-CD2 3.19Å
515	C	86	Confident	83.7	Confident	36 Å²	36	43.4 Å²	43.4	24%	0.243	21%	0.208	C	C	.	.	H	α-helix	trans	-58.6	-36.7	-176	-90.5	0	0	0	0	112.2	C475 L511 N512 F518 I519	C475-C515 HydrophobicContact CB-CB 3.89Å; C475-C515 WeakPolarHBondContact CB-SG 3.47Å; C475-C515 WeakPolarHBondContact SG-CB 3.49Å; C475-C515 CovalentContact SG-SG 2.07Å; C475-C515 PolarHBondContact SG-SG 3.45Å; L511-C515 PolarHBondContact O-N 2.86Å; N512-C515 WeakPolarHBondContact O-CB 3.37Å; N512-C515 PolarHBondContact O-N 3.39Å; C515-F518 PolarHBondContact O-N 3.23Å; C515-I519 HydrophobicContact CB-CD1 3.82Å; C515-I519 WeakPolarHBondContact O-CD1 3.45Å; C515-I519 VanDerWaalsContact O-CG1 3.22Å; C515-I519 WeakPolarHBondContact O-CG1 3.25Å; C515-I519 PolarHBondContact O-N 3.42Å
516	N	82.5	Confident	82.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.4	-58.9	-167.2	-68.4	-24.9	0	0	0	113.2	L75 D79 V472 C514 F518 I519 Y520	L75-N516 HydrophobicContact CD2-CB 4.48Å; D79-N516 PolarHBondContact OD2-ND2 2.79Å; V472-N516 WeakPolarHBondContact CG1-OD1 3.47Å; C514-N516 PolarHBondContact O-N 2.87Å; N516-F518 VanDerWaalsContact C-N 3.35Å; N516-F518 PolarHBondContact O-N 3.01Å; N516-I519 PolarHBondContact O-N 3.24Å; N516-Y520 HydrophobicContact CB-CE2 4.05Å; N516-Y520 WeakPolarHBondContact O-CD2 3.45Å; N516-Y520 WeakPolarHBondContact O-CE2 3.29Å; N516-Y520 PolarHBondContact O-N 2.95Å; N516-Y520 VanDerWaalsContact O-N 3.17Å
517	P	81.7	Confident	82.2	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-56.4	-43	179.1	-27.4	35.5	0	0	0	114.1	G50 V54 C514 Y520 A521	G50-P517 WeakPolarHBondContact O-CG 3.38Å; V54-P517 HydrophobicContact CG2-CB 4.11Å; V54-P517 HydrophobicContact CG2-CG 4.26Å; C514-P517 WeakPolarHBondContact O-CD 3.43Å; P517-Y520 PolarHBondContact O-N 3.39Å; P517-A521 VanDerWaalsContact O-CB 3.25Å; P517-A521 WeakPolarHBondContact O-CB 3.24Å; P517-A521 PolarHBondContact O-N 2.63Å
518	F	82	Confident	81.6	Confident	99 Å²	99	47.7 Å²	47.7	43%	0.434	22%	0.221	S	C	.	.	H	α-helix	trans	-65.6	-41.8	-179.7	-63.9	-67	0	0	0	111.7	V46 C514 C515 N516 Y520 A521 F522	V46-F518 HydrophobicContact CG1-CE2 3.52Å; V46-F518 HydrophobicContact CG1-CZ 3.84Å; C514-F518 WeakPolarHBondContact O-CD2 3.19Å; C515-F518 PolarHBondContact O-N 3.23Å; N516-F518 VanDerWaalsContact C-N 3.35Å; N516-F518 PolarHBondContact O-N 3.01Å; F518-Y520 VanDerWaalsContact C-N 3.31Å; F518-Y520 PolarHBondContact O-N 3.19Å; F518-A521 PolarHBondContact O-N 2.88Å; F518-F522 HydrophobicContact CB-CD2 4.03Å; F518-F522 HydrophobicContact CB-CE2 3.99Å; F518-F522 AromaticContact CD1-CE2 3.74Å; F518-F522 HydrophobicContact CD1-CE2 3.74Å; F518-F522 HydrophobicContact CD1-CZ 4.5Å; F518-F522 HydrophobicContact CG-CE2 4.3Å; F518-F522 WeakPolarHBondContact O-CD2 3.42Å; F518-F522 PolarHBondContact O-N 3.47Å
519	I	81.2	Confident	81.2	Confident	18 Å²	18	49.3 Å²	49.3	9%	0.092	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-43	179.1	-67	165.3	0	0	0	110.3	V468 I471 V472 C475 C515 N516 R523	V468-I519 HydrophobicContact CG1-CG2 3.55Å; I471-I519 HydrophobicContact CG2-CD1 4.01Å; I471-I519 HydrophobicContact CG2-CG1 4.16Å; I471-I519 HydrophobicContact CG2-CG2 4.45Å; V472-I519 HydrophobicContact CB-CD1 4.41Å; V472-I519 HydrophobicContact CG2-CB 4.13Å; V472-I519 HydrophobicContact CG2-CD1 3.93Å; V472-I519 HydrophobicContact CG2-CG2 3.52Å; C475-I519 HydrophobicContact CB-CD1 4.41Å; C515-I519 HydrophobicContact CB-CD1 3.82Å; C515-I519 WeakPolarHBondContact O-CD1 3.45Å; C515-I519 VanDerWaalsContact O-CG1 3.22Å; C515-I519 WeakPolarHBondContact O-CG1 3.25Å; C515-I519 PolarHBondContact O-N 3.42Å; N516-I519 PolarHBondContact O-N 3.24Å; I519-R523 VanDerWaalsContact O-CB 3.22Å; I519-R523 WeakPolarHBondContact O-CB 3.31Å; I519-R523 WeakPolarHBondContact O-CG 3.28Å; I519-R523 PolarHBondContact O-N 3.49Å; I519-R523 VanDerWaalsContact O-N 3.16Å
520	Y	76	Confident	80.6	Confident	8 Å²	8	48.6 Å²	48.6	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-67.5	-44.1	176.3	-57.8	-53.6	0	0	0	112.2	I72 V468 V472 N516 P517 F518 N524 Y527	I72-Y520 HydrophobicContact CD1-CE1 4.09Å; I72-Y520 HydrophobicContact CG1-CE1 4.39Å; I72-Y520 HydrophobicContact CG2-CD2 4.3Å; I72-Y520 HydrophobicContact CG2-CE2 3.97Å; V468-Y520 HydrophobicContact CG1-CD1 4.48Å; V472-Y520 HydrophobicContact CG2-CE1 4.27Å; N516-Y520 HydrophobicContact CB-CE2 4.05Å; N516-Y520 WeakPolarHBondContact O-CD2 3.45Å; N516-Y520 WeakPolarHBondContact O-CE2 3.29Å; N516-Y520 PolarHBondContact O-N 2.95Å; N516-Y520 VanDerWaalsContact O-N 3.17Å; P517-Y520 PolarHBondContact O-N 3.39Å; F518-Y520 VanDerWaalsContact C-N 3.31Å; F518-Y520 PolarHBondContact O-N 3.19Å; Y520-N524 PolarHBondContact O-N 2.95Å; Y520-Y527 WeakPolarHBondContact O-CB 3.23Å
521	A	73.5	Confident	80	Confident	24 Å²	24	48 Å²	48	20%	0.198	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-44.8	-179.4	0	0	0	0	0	113.2	P517 F518 A528 F531	P517-A521 VanDerWaalsContact O-CB 3.25Å; P517-A521 WeakPolarHBondContact O-CB 3.24Å; P517-A521 PolarHBondContact O-N 2.63Å; F518-A521 PolarHBondContact O-N 2.88Å; A521-A528 WeakPolarHBondContact O-CB 3.46Å; A521-F531 HydrophobicContact CB-CD2 3.61Å; A521-F531 HydrophobicContact CB-CE2 3.52Å
522	F	75.1	Confident	79.6	Confident	165 Å²	165	52 Å²	52	72%	0.724	24%	0.236	S	C	*	.	H	α-helix	trans	-86.4	-27.5	-174.4	-67.1	-61.6	0	0	0	113.8	F518	F518-F522 HydrophobicContact CB-CD2 4.03Å; F518-F522 HydrophobicContact CB-CE2 3.99Å; F518-F522 AromaticContact CD1-CE2 3.74Å; F518-F522 HydrophobicContact CD1-CE2 3.74Å; F518-F522 HydrophobicContact CD1-CZ 4.5Å; F518-F522 HydrophobicContact CG-CE2 4.3Å; F518-F522 WeakPolarHBondContact O-CD2 3.42Å; F518-F522 PolarHBondContact O-N 3.47Å
523	R	72.4	Confident	79.2	Confident	134 Å²	134	58.2 Å²	58.2	51%	0.506	26%	0.259	S	S	.	.	H	α-helix	trans	-105.7	-16.7	-168.8	-57.3	-64.1	-64	-101.6	-12.5	114.3	V468 I519	V468-R523 HydrophobicContact CB-CB 4.4Å; V468-R523 HydrophobicContact CG1-CB 4.01Å; V468-R523 HydrophobicContact CG2-CB 3.65Å; I519-R523 VanDerWaalsContact O-CB 3.22Å; I519-R523 WeakPolarHBondContact O-CB 3.31Å; I519-R523 WeakPolarHBondContact O-CG 3.28Å; I519-R523 PolarHBondContact O-N 3.49Å; I519-R523 VanDerWaalsContact O-N 3.16Å
524	N	72.8	Confident	78.6	Confident	38 Å²	38	59.5 Å²	59.5	20%	0.203	27%	0.266	C	S	.	.			trans	-112.6	106.1	174.2	-168.9	-25.9	0	0	0	109.7	Y520 R526 Y527 A528	Y520-N524 PolarHBondContact O-N 2.95Å; N524-R526 PolarHBondContact O-N 2.93Å; N524-R526 VanDerWaalsContact OD1-CB 3.3Å; N524-R526 WeakPolarHBondContact OD1-CB 3.3Å; N524-R526 WeakPolarHBondContact OD1-CG 3.41Å; N524-R526 PolarHBondContact OD1-N 3.46Å; N524-Y527 HydrophobicContact CB-CD2 3.65Å; N524-Y527 HydrophobicContact CB-CG 4.38Å; N524-Y527 VanDerWaalsContact CG-CD2 3.48Å; N524-Y527 VanDerWaalsContact ND2-CD2 3.35Å; N524-Y527 WeakPolarHBondContact ND2-CD2 3.4Å; N524-Y527 PolarHBondContact O-N 3.46Å; N524-A528 PolarHBondContact O-N 3.27Å
525	K	74.1	Confident	78.1	Confident	169 Å²	169	64.7 Å²	64.7	74%	0.735	29%	0.292	S	S	*	.	H	α-helix	trans	-50.1	-35.7	178.6	-70.4	-170.9	177.2	-173.1	0	112	A528 D529	K525-A528 WeakPolarHBondContact O-CB 3.37Å; K525-A528 PolarHBondContact O-N 2.87Å; K525-D529 WeakPolarHBondContact O-CB 3.46Å; K525-D529 PolarHBondContact O-N 3.48Å; K525-D529 VanDerWaalsContact O-OD2 3.12Å
526	R	73.4	Confident	77.7	Confident	126 Å²	126	67 Å²	67	48%	0.475	30%	0.302	S	S	.	.	H	α-helix	trans	-65.5	-41.1	179.2	-48.6	-174.8	78.6	169.6	19.3	112.4	E67 N524 A530	E67-R526 VanDerWaalsContact CD-CZ 3.4Å; E67-R526 VanDerWaalsContact CD-NH1 3.33Å; E67-R526 IonicContact OE1-CZ 3.84Å; E67-R526 IonicContact OE1-NH1 3.7Å; E67-R526 PolarHBondContact OE1-NH1 3.4Å; E67-R526 IonicContact OE1-NH2 3.14Å; E67-R526 PolarHBondContact OE1-NH2 2.98Å; E67-R526 IonicContact OE2-CZ 2.97Å; E67-R526 IonicContact OE2-NE 3.59Å; E67-R526 IonicContact OE2-NH1 2.69Å; E67-R526 PolarHBondContact OE2-NH1 2.98Å; E67-R526 VanDerWaalsContact OE2-NH1 3.11Å; E67-R526 IonicContact OE2-NH2 3.55Å; E67-R526 PolarHBondContact OE2-NH2 2.72Å; N524-R526 PolarHBondContact O-N 2.93Å; N524-R526 VanDerWaalsContact OD1-CB 3.3Å; N524-R526 WeakPolarHBondContact OD1-CB 3.3Å; N524-R526 WeakPolarHBondContact OD1-CG 3.41Å; N524-R526 PolarHBondContact OD1-N 3.46Å; R526-A530 WeakPolarHBondContact O-CB 3.38Å; R526-A530 PolarHBondContact O-N 3.41Å; R526-A530 VanDerWaalsContact O-N 3.12Å
527	Y	72.8	Confident	76.5	Confident	14 Å²	14	72.6 Å²	72.6	6%	0.055	34%	0.336	C	S	.	.	H	α-helix	trans	-69.9	-44.6	173.8	-81	-92.4	0	0	0	110.6	I68 I72 Y520 N524 D529 A530 F531	I68-Y527 HydrophobicContact CD1-CE1 4.44Å; I72-Y527 VanDerWaalsContact CD1-OH 3.24Å; I72-Y527 WeakPolarHBondContact CD1-OH 3.45Å; Y520-Y527 WeakPolarHBondContact O-CB 3.23Å; N524-Y527 HydrophobicContact CB-CD2 3.65Å; N524-Y527 HydrophobicContact CB-CG 4.38Å; N524-Y527 VanDerWaalsContact CG-CD2 3.48Å; N524-Y527 VanDerWaalsContact ND2-CD2 3.35Å; N524-Y527 WeakPolarHBondContact ND2-CD2 3.4Å; N524-Y527 PolarHBondContact O-N 3.46Å; Y527-D529 VanDerWaalsContact C-N 3.29Å; Y527-D529 PolarHBondContact O-N 3.15Å; Y527-A530 PolarHBondContact O-N 3.02Å; Y527-A530 VanDerWaalsContact O-N 3.14Å; Y527-F531 HydrophobicContact CD1-CE2 4.26Å; Y527-F531 HydrophobicContact CD1-CZ 4.12Å; Y527-F531 WeakPolarHBondContact O-CD2 2.96Å; Y527-F531 VanDerWaalsContact O-CG 3.31Å; Y527-F531 WeakPolarHBondContact O-CG 3.23Å; Y527-F531 PolarHBondContact O-N 3.3Å
528	A	79.4	Confident	75.3	Confident	13 Å²	13	80.6 Å²	80.6	11%	0.107	37%	0.373	C	S	.	.	H	α-helix	trans	-55.1	-45.4	176.5	0	0	0	0	0	112	A521 N524 K525 F531 R532	A521-A528 WeakPolarHBondContact O-CB 3.46Å; N524-A528 PolarHBondContact O-N 3.27Å; K525-A528 WeakPolarHBondContact O-CB 3.37Å; K525-A528 PolarHBondContact O-N 2.87Å; A528-F531 PolarHBondContact O-N 2.88Å; A528-R532 WeakPolarHBondContact O-CB 3.38Å; A528-R532 WeakPolarHBondContact O-CG 3.21Å; A528-R532 PolarHBondContact O-N 2.72Å
529	D	81.5	Confident	73.8	Confident	71 Å²	71	79.1 Å²	79.1	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-67.7	-37.6	178.7	-66.4	-23.1	0	0	0	111.8	K525 Y527 R532 R533	K525-D529 WeakPolarHBondContact O-CB 3.46Å; K525-D529 PolarHBondContact O-N 3.48Å; K525-D529 VanDerWaalsContact O-OD2 3.12Å; Y527-D529 VanDerWaalsContact C-N 3.29Å; Y527-D529 PolarHBondContact O-N 3.15Å; D529-R532 IonicContact OD1-CZ 2.99Å; D529-R532 IonicContact OD1-NE 2.71Å; D529-R532 IonicContact OD1-NH2 3.17Å; D529-R532 PolarHBondContact OD1-NH2 3.39Å; D529-R533 WeakPolarHBondContact O-CB 3.35Å; D529-R533 WeakPolarHBondContact O-CG 3.5Å; D529-R533 PolarHBondContact O-N 3.27Å
530	A	77.8	Confident	72.2	Confident	3 Å²	3	81.4 Å²	81.4	3%	0.025	39%	0.386	C	S	.	.	H	α-helix	trans	-68.5	-42.1	176	0	0	0	0	0	112	T57 L64 R526 Y527 R533 L534	T57-A530 HydrophobicContact CG2-CB 3.49Å; T57-A530 VanDerWaalsContact CG2-CB 3.49Å; L64-A530 HydrophobicContact CD1-CB 4.44Å; L64-A530 HydrophobicContact CD2-CB 3.37Å; R526-A530 WeakPolarHBondContact O-CB 3.38Å; R526-A530 PolarHBondContact O-N 3.41Å; R526-A530 VanDerWaalsContact O-N 3.12Å; Y527-A530 PolarHBondContact O-N 3.02Å; Y527-A530 VanDerWaalsContact O-N 3.14Å; A530-R533 PolarHBondContact O-N 2.91Å; A530-L534 WeakPolarHBondContact O-CG 3.49Å; A530-L534 PolarHBondContact O-N 3.43Å
531	F	81	Confident	70.7	Confident	12 Å²	12	86.1 Å²	86.1	5%	0.053	42%	0.419	C	S	.	.	H	α-helix	trans	-62.7	-45.6	173.7	-66.5	-42.8	0	0	0	111.5	L53 V54 T57 A521 Y527 A528 R533 L534 L535	L53-F531 HydrophobicContact CD1-CD1 3.92Å; L53-F531 HydrophobicContact CD1-CE1 4.31Å; L53-F531 HydrophobicContact CD2-CD1 3.76Å; L53-F531 HydrophobicContact CD2-CE1 3.99Å; L53-F531 HydrophobicContact CD2-CG 4.27Å; L53-F531 HydrophobicContact CG-CD1 3.58Å; L53-F531 HydrophobicContact CG-CE1 3.59Å; V54-F531 HydrophobicContact CG2-CZ 4.1Å; T57-F531 HydrophobicContact CG2-CD1 3.99Å; T57-F531 HydrophobicContact CG2-CE1 3.95Å; T57-F531 WeakPolarHBondContact OG1-CD1 3.41Å; T57-F531 WeakPolarHBondContact OG1-CE1 3.41Å; A521-F531 HydrophobicContact CB-CD2 3.61Å; A521-F531 HydrophobicContact CB-CE2 3.52Å; Y527-F531 HydrophobicContact CD1-CE2 4.26Å; Y527-F531 HydrophobicContact CD1-CZ 4.12Å; Y527-F531 WeakPolarHBondContact O-CD2 2.96Å; Y527-F531 VanDerWaalsContact O-CG 3.31Å; Y527-F531 WeakPolarHBondContact O-CG 3.23Å; Y527-F531 PolarHBondContact O-N 3.3Å; A528-F531 PolarHBondContact O-N 2.88Å; F531-R533 PolarHBondContact O-N 2.69Å; F531-L534 PolarHBondContact O-N 3.04Å; F531-L534 VanDerWaalsContact O-N 3.11Å; F531-L535 WeakPolarHBondContact O-CG 3.3Å; F531-L535 PolarHBondContact O-N 3.38Å
532	R	81.6	Confident	69.1	Low	128 Å²	128	86.9 Å²	86.9	48%	0.483	43%	0.429	S	S	.	.	H	α-helix	trans	-56.4	-48.4	174.9	-82.2	-172.6	-79	-97.7	2.4	112	A528 D529 L534 L535 D536	A528-R532 WeakPolarHBondContact O-CB 3.38Å; A528-R532 WeakPolarHBondContact O-CG 3.21Å; A528-R532 PolarHBondContact O-N 2.72Å; D529-R532 IonicContact OD1-CZ 2.99Å; D529-R532 IonicContact OD1-NE 2.71Å; D529-R532 IonicContact OD1-NH2 3.17Å; D529-R532 PolarHBondContact OD1-NH2 3.39Å; R532-L534 PolarHBondContact O-N 3.42Å; R532-L535 CarbonylContact O-C 3.54Å; R532-L535 PolarHBondContact O-N 2.98Å; R532-D536 WeakPolarHBondContact O-CB 3.39Å; R532-D536 PolarHBondContact O-N 3.44Å
533	R	80.3	Confident	67.5	Low	136 Å²	136	84.3 Å²	84.3	51%	0.513	42%	0.418	S	S	.	.	H	α-helix	trans	-59.7	-22.2	178.3	-75	170.3	-179.8	-159.5	-1.3	114.6	D529 A530 F531	D529-R533 WeakPolarHBondContact O-CB 3.35Å; D529-R533 WeakPolarHBondContact O-CG 3.5Å; D529-R533 PolarHBondContact O-N 3.27Å; A530-R533 PolarHBondContact O-N 2.91Å; F531-R533 PolarHBondContact O-N 2.69Å
534	L	77.1	Confident	65.9	Low	34 Å²	34	85.5 Å²	85.5	18%	0.178	43%	0.431	C	S	.	.	H	α-helix	trans	-89	-31	176	-69	166.1	0	0	0	112.4	T57 M60 A530 F531 R532 C540	T57-L534 HydrophobicContact CG2-CD1 3.95Å; T57-L534 WeakPolarHBondContact OG1-CD1 3.24Å; M60-L534 HydrophobicContact CB-CD2 4.03Å; M60-L534 HydrophobicContact CG-CD2 4.32Å; M60-L534 HydrophobicContact SD-CD2 3.35Å; M60-L534 WeakPolarHBondContact SD-CD2 3.49Å; A530-L534 WeakPolarHBondContact O-CG 3.49Å; A530-L534 PolarHBondContact O-N 3.43Å; F531-L534 PolarHBondContact O-N 3.04Å; F531-L534 VanDerWaalsContact O-N 3.11Å; R532-L534 PolarHBondContact O-N 3.42Å; L534-C540 PolarHBondContact O-SG 2.98Å
535	L	77.3	Confident	64	Low	122 Å²	122	91.5 Å²	91.5	64%	0.639	46%	0.455	S	S	*	.	H	α-helix	trans	-82.8	-28	176.9	-66	174.7	0	0	0	112.5	F531 R532 T537	F531-L535 WeakPolarHBondContact O-CG 3.3Å; F531-L535 PolarHBondContact O-N 3.38Å; R532-L535 CarbonylContact O-C 3.54Å; R532-L535 PolarHBondContact O-N 2.98Å; L535-T537 PolarHBondContact O-N 3Å
536	D	78.5	Confident	62.3	Low	84 Å²	84	90.4 Å²	90.4	45%	0.449	46%	0.457	S	S	.	.			trans	-66.4	97.2	175	-67.5	-23.3	0	0	0	109	R532 E538 N539	R532-D536 WeakPolarHBondContact O-CB 3.39Å; R532-D536 PolarHBondContact O-N 3.44Å; D536-E538 PolarHBondContact O-N 3.38Å; D536-E538 VanDerWaalsContact O-N 3.08Å; D536-N539 PolarHBondContact O-N 2.89Å
537	T	57.8	Low	60.7	Low	117 Å²	117	90.7 Å²	90.7	72%	0.718	47%	0.472	S	S	*	.	H	α-helix	trans	-53.5	-27.4	-176.2	19	0	0	0	0	113.7	L535 N539 C540	L535-T537 PolarHBondContact O-N 3Å; T537-N539 PolarHBondContact O-N 3.03Å; T537-C540 PolarHBondContact O-N 3.09Å
538	E	56.1	Low	58.8	Low	178 Å²	178	95.2 Å²	95.2	83%	0.832	50%	0.502	S	S	*	.	H	α-helix	trans	-61.1	-29.7	175.9	-68.7	-174.1	165.9	0	0	112.8	D536	D536-E538 PolarHBondContact O-N 3.38Å; D536-E538 VanDerWaalsContact O-N 3.08Å
539	N	49.8	Very low	56.6	Low	68 Å²	68	103.9 Å²	103.9	36%	0.364	56%	0.559	S	S	.	*	H	α-helix	trans	-92.4	-20.2	178.8	-81.6	-50.2	0	0	0	114.3	D536 T537 C541 G542 K543	D536-N539 PolarHBondContact O-N 2.89Å; T537-N539 PolarHBondContact O-N 3.03Å; N539-C541 VanDerWaalsContact C-N 3.32Å; N539-G542 PolarHBondContact O-N 2.93Å; N539-K543 WeakPolarHBondContact O-CB 3.41Å; N539-K543 PolarHBondContact O-N 3.42Å
540	C	47.2	Very low	55.4	Low	65 Å²	65	105.5 Å²	105.5	44%	0.439	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-35.6	176.5	-80.8	0	0	0	0	111.8	L534 T537	L534-C540 PolarHBondContact O-SG 2.98Å; T537-C540 PolarHBondContact O-N 3.09Å
541	C	45.9	Very low	54.2	Low	107 Å²	107	110.9 Å²	110.9	72%	0.723	60%	0.596	S	S	*	*	H	α-helix	trans	-75	-30	175.4	-146.2	0	0	0	0	112.5	N539	N539-C541 VanDerWaalsContact C-N 3.32Å
542	G	40	Very low	52.7	Low	40 Å²	40	116.4 Å²	116.4	41%	0.412	63%	0.627	S	S	.	*	H	α-helix	trans	-82.6	-38.1	-179.4	0	0	0	0	0	115	N539	N539-G542 PolarHBondContact O-N 2.93Å
543	K	39.9	Very low	51	Low	111 Å²	111	115.7 Å²	115.7	48%	0.483	64%	0.635	S	S	.	*	H	α-helix	trans	-87.3	-21.1	-175.4	-77.2	-178	-179.2	167.6	0	114.8	N539 K545 L546	N539-K543 WeakPolarHBondContact O-CB 3.41Å; N539-K543 PolarHBondContact O-N 3.42Å; K543-K545 PolarHBondContact O-N 3.3Å; K543-L546 PolarHBondContact O-N 2.92Å
544	M	39.9	Very low	49.2	Very low	160 Å²	160	114.4 Å²	114.4	79%	0.788	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-63.4	-24.6	171	-147.8	170.3	-143.7	0	0	111.3
545	K	31.6	Very low	47.4	Very low	164 Å²	164	119.8 Å²	119.8	71%	0.713	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-74.4	-16.6	171.5	-74.5	-173.9	174.5	-179	0	114.9	K543	K543-K545 PolarHBondContact O-N 3.3Å
546	L	40	Very low	45.2	Very low	145 Å²	145	119.6 Å²	119.6	76%	0.759	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-100.4	-3.1	-173.5	-125.8	125.9	0	0	0	114.2	K543	K543-L546 PolarHBondContact O-N 2.92Å
547	V	39.9	Very low	42.7	Very low	133 Å²	133	122.4 Å²	122.4	81%	0.806	69%	0.694	S	S	*	*	S	Bend	trans	-95.3	-10.1	171.2	-176.5	0	0	0	0	111.7
548	T	32.6	Very low	41.4	Very low	109 Å²	109	122.8 Å²	122.8	67%	0.669	69%	0.692	S	S	*	*			trans	-112.5	70.5	170.4	53.8	0	0	0	0	110.5
549	C	33.9	Very low	40.1	Very low	194 Å²	194	117.8 Å²	117.8	100%	1.311	68%	0.679	S	S	*	*			trans	-158.8	0	156.3	-93.4	0	0	0	0	108.2

Retrieved 549 of 549 residues in 170.3 ms (Link to these results)

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