A0A3Q0KRN1_SCHMA Loading...

Putative rhodopsin-like orphan GPCR

AlphaFold DB , UniProt , Accession A0A3Q0KRN1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 631 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	36.8	Very low	41.4	Very low	235 Å²	235	118 Å²	118	100%	1.158	65%	0.645	S	S	*	*				0	15.6	0	-103.2	175	173.2	0	0	114.4
2	N	40.5	Very low	40.9	Very low	142 Å²	142	116.6 Å²	116.6	76%	0.759	64%	0.636	S	S	*	*			trans	-135.6	20.7	-177.3	-90.8	4.1	0	0	0	115.1
3	T	42.6	Very low	40.6	Very low	103 Å²	103	112.7 Å²	112.7	63%	0.632	62%	0.623	S	S	*	*	S	Bend	trans	-92.3	-8	-173.1	40.2	0	0	0	0	115.2
4	T	48.9	Very low	40.4	Very low	101 Å²	101	111.1 Å²	111.1	62%	0.62	61%	0.612	S	S	*	*	H	α-helix	trans	-90.9	-25.2	-170.9	47.2	0	0	0	0	114.6	I8	T4-I8 VanDerWaalsContact O-CD1 3.28Å; T4-I8 WeakPolarHBondContact O-CD1 3.36Å; T4-I8 VanDerWaalsContact O-CG1 3.29Å; T4-I8 WeakPolarHBondContact O-CG1 3.44Å
5	T	43.1	Very low	40.4	Very low	93 Å²	93	111.9 Å²	111.9	57%	0.571	61%	0.609	S	S	*	*	H	α-helix	trans	-82.3	-30.5	-177.7	32.4	0	0	0	0	113.5	L9	T5-L9 PolarHBondContact O-N 3.31Å
6	T	45.1	Very low	40.1	Very low	84 Å²	84	113.5 Å²	113.5	52%	0.515	61%	0.611	S	S	.	*	H	α-helix	trans	-70.7	-36.7	175.8	46.9	0	0	0	0	112	L9 L10	T6-L9 PolarHBondContact O-N 3.45Å; T6-L10 WeakPolarHBondContact O-CB 3.44Å; T6-L10 PolarHBondContact O-N 3.5Å
7	D	40.6	Very low	40.3	Very low	104 Å²	104	110.1 Å²	110.1	56%	0.556	60%	0.597	S	S	*	*	H	α-helix	trans	-72.6	-31	-177	-67.5	-9.2	0	0	0	112.2	N11	D7-N11 WeakPolarHBondContact O-CB 3.27Å; D7-N11 PolarHBondContact O-N 3.28Å
8	I	43.9	Very low	40.6	Very low	105 Å²	105	109.7 Å²	109.7	54%	0.538	60%	0.595	S	S	.	*	H	α-helix	trans	-74.4	-39.6	176.8	-63.4	167.5	0	0	0	111.2	T4 N11 N12	T4-I8 VanDerWaalsContact O-CD1 3.28Å; T4-I8 WeakPolarHBondContact O-CD1 3.36Å; T4-I8 VanDerWaalsContact O-CG1 3.29Å; T4-I8 WeakPolarHBondContact O-CG1 3.44Å; I8-N11 PolarHBondContact O-N 3.17Å; I8-N12 PolarHBondContact O-N 3.35Å
9	L	37.9	Very low	40.4	Very low	128 Å²	128	109.1 Å²	109.1	67%	0.67	59%	0.591	S	S	*	*	H	α-helix	trans	-69.2	-34.4	174.2	-99.5	155.2	0	0	0	112.4	T5 T6 S13	T5-L9 PolarHBondContact O-N 3.31Å; T6-L9 PolarHBondContact O-N 3.45Å; L9-S13 PolarHBondContact O-N 3.47Å; L9-S13 VanDerWaalsContact O-N 3.1Å; L9-S13 PolarHBondContact O-OG 2.94Å
10	L	38.7	Very low	40.2	Very low	97 Å²	97	110.8 Å²	110.8	51%	0.508	60%	0.599	S	S	.	*	H	α-helix	trans	-68.9	-38.4	173.5	-141.4	101.7	0	0	0	111.3	T6 S13 L14	T6-L10 WeakPolarHBondContact O-CB 3.44Å; T6-L10 PolarHBondContact O-N 3.5Å; L10-S13 WeakPolarHBondContact CA-OG 3.29Å; L10-S13 PolarHBondContact O-OG 3.49Å; L10-S13 VanDerWaalsContact O-OG 3.07Å; L10-L14 VanDerWaalsContact O-CB 3.31Å; L10-L14 WeakPolarHBondContact O-CB 3.36Å; L10-L14 PolarHBondContact O-N 3.36Å
11	N	36.8	Very low	40	Very low	106 Å²	106	111.8 Å²	111.8	57%	0.567	60%	0.6	S	S	*	*	H	α-helix	trans	-68.3	-37.4	177	-112.4	3.8	0	0	0	112.7	D7 I8 L14 H15	D7-N11 WeakPolarHBondContact O-CB 3.27Å; D7-N11 PolarHBondContact O-N 3.28Å; I8-N11 PolarHBondContact O-N 3.17Å; N11-L14 WeakPolarHBondContact O-CB 3.46Å; N11-L14 PolarHBondContact O-N 3.31Å; N11-H15 PolarHBondContact O-N 3.49Å
12	N	36.4	Very low	40.2	Very low	101 Å²	101	108.5 Å²	108.5	54%	0.54	58%	0.581	S	S	.	*	H	α-helix	trans	-72.6	-35.3	178	-77	-10.3	0	0	0	112.6	I8 H15 Q16	I8-N12 PolarHBondContact O-N 3.35Å; N12-H15 PolarHBondContact O-N 3.4Å; N12-Q16 PolarHBondContact O-N 3.42Å
13	S	36.2	Very low	40.2	Very low	66 Å²	66	107.4 Å²	107.4	46%	0.462	58%	0.58	S	S	.	*	H	α-helix	trans	-72.5	-32.3	171	50.1	0	0	0	0	112.5	L9 L10 H15 Q16	L9-S13 PolarHBondContact O-N 3.47Å; L9-S13 VanDerWaalsContact O-N 3.1Å; L9-S13 PolarHBondContact O-OG 2.94Å; L10-S13 WeakPolarHBondContact CA-OG 3.29Å; L10-S13 PolarHBondContact O-OG 3.49Å; L10-S13 VanDerWaalsContact O-OG 3.07Å; S13-H15 VanDerWaalsContact C-N 3.27Å; S13-H15 PolarHBondContact O-N 3.48Å; S13-Q16 PolarHBondContact O-N 3.46Å
14	L	38.3	Very low	40.2	Very low	90 Å²	90	109.3 Å²	109.3	47%	0.471	59%	0.586	S	S	.	*	H	α-helix	trans	-62	-34.9	171.2	-137.2	99.8	0	0	0	112.3	L10 N11 Q16	L10-L14 VanDerWaalsContact O-CB 3.31Å; L10-L14 WeakPolarHBondContact O-CB 3.36Å; L10-L14 PolarHBondContact O-N 3.36Å; N11-L14 WeakPolarHBondContact O-CB 3.46Å; N11-L14 PolarHBondContact O-N 3.31Å; L14-Q16 VanDerWaalsContact C-N 3.28Å; L14-Q16 PolarHBondContact O-N 3.01Å
15	H	40.6	Very low	40.3	Very low	123 Å²	123	113 Å²	113	57%	0.569	60%	0.596	S	S	*	*	H	α-helix	trans	-73.2	-20.7	179	-120.4	-48.9	0	0	0	113.3	N11 N12 S13 N19	N11-H15 PolarHBondContact O-N 3.49Å; N12-H15 PolarHBondContact O-N 3.4Å; S13-H15 VanDerWaalsContact C-N 3.27Å; S13-H15 PolarHBondContact O-N 3.48Å; H15-N19 PolarHBondContact ND1-ND2 3.17Å
16	Q	35.7	Very low	41.1	Very low	138 Å²	138	113.2 Å²	113.2	65%	0.645	59%	0.593	S	S	*	*	H	α-helix	trans	-88.5	-22	-172.6	-150.3	152.5	5	0	0	113.3	N12 S13 L14	N12-Q16 PolarHBondContact O-N 3.42Å; S13-Q16 PolarHBondContact O-N 3.46Å; L14-Q16 VanDerWaalsContact C-N 3.28Å; L14-Q16 PolarHBondContact O-N 3.01Å
17	C	42.5	Very low	42.2	Very low	55 Å²	55	112.1 Å²	112.1	37%	0.372	59%	0.589	S	S	.	*	S	Bend	trans	-77	-15.2	173.8	-87.3	0	0	0	0	114.5	C348	C17-C348 HydrophobicContact CB-CB 4.33Å; C17-C348 WeakPolarHBondContact CB-SG 3.42Å; C17-C348 WeakPolarHBondContact SG-CB 3.17Å; C17-C348 CovalentContact SG-SG 2.04Å; C17-C348 PolarHBondContact SG-SG 3.41Å
18	N	45.8	Very low	43.9	Very low	104 Å²	104	111.3 Å²	111.3	56%	0.556	58%	0.58	S	S	*	*	S	Bend	trans	-109.5	-5.6	-173.3	-82.7	-22	0	0	0	115.2
19	N	37	Very low	45.5	Very low	98 Å²	98	111.9 Å²	111.9	52%	0.524	58%	0.583	S	S	.	*	S	Bend	trans	-123.5	6.6	-165.4	-76.7	-13.5	0	0	0	115.7	H15	H15-N19 PolarHBondContact ND1-ND2 3.17Å
20	L	35.8	Very low	47.4	Very low	143 Å²	143	110.9 Å²	110.9	75%	0.749	58%	0.575	S	S	*	*	S	Bend	trans	-96.9	1.1	-171.6	-124.4	87.8	0	0	0	116.6
21	H	37.4	Very low	49.3	Very low	132 Å²	132	106.5 Å²	106.5	61%	0.611	55%	0.553	S	S	*	*	S	Bend	trans	-131.1	8.1	-171.1	-140.2	-59.7	0	0	0	116.8	F594	H21-F594 AromaticContact CE1-CE2 3.93Å; H21-F594 AromaticContact CE1-CZ 3.6Å; H21-F594 AromaticContact NE2-CZ 3.46Å; H21-F594 WeakPolarHBondContact NE2-CZ 3.23Å
22	E	40.7	Very low	51.5	Low	166 Å²	166	104.7 Å²	104.7	78%	0.776	54%	0.542	S	S	*	.			trans	-135.1	20.2	-173.1	-127.8	169.4	-166	0	0	115.8	D24	E22-D24 VanDerWaalsContact C-N 3.32Å; E22-D24 PolarHBondContact O-N 3.13Å
23	T	40.4	Very low	53.8	Low	119 Å²	119	104.1 Å²	104.1	73%	0.73	54%	0.538	S	S	*	.			trans	-95.9	36.5	171	56.1	0	0	0	0	112.8	H25	T23-H25 PolarHBondContact O-N 3.12Å
24	D	42.9	Very low	56	Low	142 Å²	142	102.8 Å²	102.8	76%	0.759	53%	0.529	S	S	*	.	S	Bend	trans	-86.8	93.8	169	-84.6	-14.3	0	0	0	109.2	E22 I26	E22-D24 VanDerWaalsContact C-N 3.32Å; E22-D24 PolarHBondContact O-N 3.13Å; D24-I26 PolarHBondContact O-N 3.08Å
25	H	51.2	Low	58.2	Low	178 Å²	178	100 Å²	100	82%	0.824	52%	0.516	S	S	*	.			trans	-1.7	82.9	164.4	-59.5	-71.5	0	0	0	117	T23	T23-H25 PolarHBondContact O-N 3.12Å
26	I	59	Low	60.5	Low	98 Å²	98	98.5 Å²	98.5	50%	0.503	51%	0.511	S	S	.	.			trans	-83.4	115.8	158.5	-68.6	171.3	0	0	0	106.7	D24 Q30	D24-I26 PolarHBondContact O-N 3.08Å; I26-Q30 HydrophobicContact CG2-CB 4.02Å; I26-Q30 HydrophobicContact CG2-CG 3.98Å
27	S	68.9	Low	63	Low	62 Å²	62	96.4 Å²	96.4	43%	0.434	50%	0.504	S	S	.	.			trans	-58.3	141.4	175.2	64.4	0	0	0	0	111.1	I29 Q30 S31	S27-I29 PolarHBondContact O-N 2.92Å; S27-I29 VanDerWaalsContact O-N 3.1Å; S27-Q30 WeakPolarHBondContact O-CA 3.45Å; S27-Q30 WeakPolarHBondContact O-CB 3.46Å; S27-Q30 PolarHBondContact O-N 3.4Å; S27-Q30 VanDerWaalsContact OG-CB 3.24Å; S27-Q30 WeakPolarHBondContact OG-CB 3.4Å; S27-Q30 PolarHBondContact OG-N 2.94Å; S27-S31 PolarHBondContact O-N 3.34Å
28	F	74.9	Confident	65.2	Low	87 Å²	87	95.5 Å²	95.5	38%	0.382	50%	0.495	S	S	.	.	H	α-helix	trans	-45.3	-42.7	173.8	177.9	-102	0	0	0	113.3	Q30 S31 I32 A155 T159	F28-Q30 PolarHBondContact O-N 3.47Å; F28-S31 WeakPolarHBondContact O-CB 3.4Å; F28-S31 PolarHBondContact O-N 3.23Å; F28-I32 HydrophobicContact CD1-CD1 3.82Å; F28-I32 HydrophobicContact CE1-CD1 3.22Å; F28-I32 HydrophobicContact CE1-CG1 4.28Å; F28-I32 HydrophobicContact CE2-CD1 4.24Å; F28-I32 HydrophobicContact CZ-CD1 3.47Å; F28-I32 VanDerWaalsContact CZ-CD1 3.47Å; F28-I32 HydrophobicContact CZ-CG1 4.31Å; F28-I32 PolarHBondContact O-N 3.31Å; F28-A155 HydrophobicContact CD2-CB 4.15Å; F28-A155 HydrophobicContact CE2-CB 4.11Å; F28-A155 WeakPolarHBondContact CE2-O 3.4Å; F28-T159 HydrophobicContact CE2-CG2 3.79Å; F28-T159 HydrophobicContact CZ-CG2 4.35Å
29	I	78.6	Confident	67.2	Low	116 Å²	116	92.5 Å²	92.5	60%	0.595	48%	0.482	S	S	*	.	H	α-helix	trans	-61.5	-45	176.9	-61.8	176.3	0	0	0	111.2	S27 S31 I32 I33	S27-I29 PolarHBondContact O-N 2.92Å; S27-I29 VanDerWaalsContact O-N 3.1Å; I29-S31 VanDerWaalsContact C-N 3.29Å; I29-S31 PolarHBondContact O-N 3.19Å; I29-I32 PolarHBondContact O-N 3.3Å; I29-I33 HydrophobicContact CG2-CD1 3.75Å; I29-I33 HydrophobicContact CG2-CG1 4.39Å; I29-I33 VanDerWaalsContact O-CG1 3.29Å; I29-I33 WeakPolarHBondContact O-CG1 3.32Å; I29-I33 PolarHBondContact O-N 2.96Å
30	Q	78.2	Confident	69.7	Low	107 Å²	107	92.3 Å²	92.3	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-36.8	176.7	179.7	180	-14.7	0	0	111.7	I26 S27 F28 S34	I26-Q30 HydrophobicContact CG2-CB 4.02Å; I26-Q30 HydrophobicContact CG2-CG 3.98Å; S27-Q30 WeakPolarHBondContact O-CA 3.45Å; S27-Q30 WeakPolarHBondContact O-CB 3.46Å; S27-Q30 PolarHBondContact O-N 3.4Å; S27-Q30 VanDerWaalsContact OG-CB 3.24Å; S27-Q30 WeakPolarHBondContact OG-CB 3.4Å; S27-Q30 PolarHBondContact OG-N 2.94Å; F28-Q30 PolarHBondContact O-N 3.47Å; Q30-S34 WeakPolarHBondContact O-CB 3.15Å; Q30-S34 PolarHBondContact O-N 3.38Å
31	S	78.4	Confident	72.3	Confident	6 Å²	6	90.3 Å²	90.3	4%	0.042	47%	0.47	C	S	.	.	H	α-helix	trans	-64	-46.7	175.1	-168.1	0	0	0	0	111.8	S27 F28 I29 I33 S34 V35 V151	S27-S31 PolarHBondContact O-N 3.34Å; F28-S31 WeakPolarHBondContact O-CB 3.4Å; F28-S31 PolarHBondContact O-N 3.23Å; I29-S31 VanDerWaalsContact C-N 3.29Å; I29-S31 PolarHBondContact O-N 3.19Å; S31-I33 PolarHBondContact O-N 2.87Å; S31-S34 WeakPolarHBondContact O-CB 3.46Å; S31-S34 PolarHBondContact O-N 2.96Å; S31-V35 WeakPolarHBondContact O-CG2 3.47Å; S31-V35 PolarHBondContact O-N 3.05Å; S31-V151 VanDerWaalsContact OG-CG1 3.23Å; S31-V151 WeakPolarHBondContact OG-CG1 3.48Å; S31-V151 PolarHBondContact OG-O 3.15Å; S31-V151 VanDerWaalsContact OG-O 3.07Å
32	I	81.9	Confident	74.7	Confident	67 Å²	67	84.6 Å²	84.6	34%	0.344	44%	0.444	S	S	.	.	H	α-helix	trans	-60.5	-48	175.8	-69.9	177	0	0	0	111.6	F28 I29 S34 V35 I36	F28-I32 HydrophobicContact CD1-CD1 3.82Å; F28-I32 HydrophobicContact CE1-CD1 3.22Å; F28-I32 HydrophobicContact CE1-CG1 4.28Å; F28-I32 HydrophobicContact CE2-CD1 4.24Å; F28-I32 HydrophobicContact CZ-CD1 3.47Å; F28-I32 VanDerWaalsContact CZ-CD1 3.47Å; F28-I32 HydrophobicContact CZ-CG1 4.31Å; F28-I32 PolarHBondContact O-N 3.31Å; I29-I32 PolarHBondContact O-N 3.3Å; I32-S34 VanDerWaalsContact C-N 3.26Å; I32-S34 PolarHBondContact O-N 3.4Å; I32-V35 PolarHBondContact O-N 3.04Å; I32-I36 HydrophobicContact CG2-CD1 3.89Å; I32-I36 WeakPolarHBondContact O-CG1 3.27Å; I32-I36 PolarHBondContact O-N 2.96Å
33	I	84.9	Confident	77.1	Confident	89 Å²	89	81.2 Å²	81.2	46%	0.456	43%	0.431	S	S	.	.	H	α-helix	trans	-59.7	-42.6	178.7	-69.2	169.8	0	0	0	110	I29 S31 I36 L37	I29-I33 HydrophobicContact CG2-CD1 3.75Å; I29-I33 HydrophobicContact CG2-CG1 4.39Å; I29-I33 VanDerWaalsContact O-CG1 3.29Å; I29-I33 WeakPolarHBondContact O-CG1 3.32Å; I29-I33 PolarHBondContact O-N 2.96Å; S31-I33 PolarHBondContact O-N 2.87Å; I33-I36 PolarHBondContact O-N 3.48Å; I33-L37 HydrophobicContact CG2-CD1 3.79Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.25Å; I33-L37 VanDerWaalsContact O-CG 3.32Å; I33-L37 WeakPolarHBondContact O-CG 3.41Å; I33-L37 PolarHBondContact O-N 3.19Å
34	S	83.6	Confident	79.5	Confident	38 Å²	38	81.4 Å²	81.4	27%	0.266	43%	0.426	S	S	.	.	H	α-helix	trans	-59.2	-49.1	175.8	-173	0	0	0	0	111.3	Q30 S31 I32 I36 L37 L38	Q30-S34 WeakPolarHBondContact O-CB 3.15Å; Q30-S34 PolarHBondContact O-N 3.38Å; S31-S34 WeakPolarHBondContact O-CB 3.46Å; S31-S34 PolarHBondContact O-N 2.96Å; I32-S34 VanDerWaalsContact C-N 3.26Å; I32-S34 PolarHBondContact O-N 3.4Å; S34-I36 VanDerWaalsContact C-N 3.34Å; S34-I36 PolarHBondContact O-N 3.33Å; S34-L37 PolarHBondContact O-N 3.04Å; S34-L38 WeakPolarHBondContact O-CB 3.27Å; S34-L38 WeakPolarHBondContact O-CD1 3.48Å; S34-L38 PolarHBondContact O-N 3.25Å; S34-L38 WeakPolarHBondContact OG-CD1 3.44Å
35	V	84.9	Confident	81.6	Confident	32 Å²	32	75.4 Å²	75.4	19%	0.194	40%	0.398	C	S	.	.	H	α-helix	trans	-56.5	-45.6	177.1	168.5	0	0	0	0	111.9	S31 I32 S39 I148 V151 A152	S31-V35 WeakPolarHBondContact O-CG2 3.47Å; S31-V35 PolarHBondContact O-N 3.05Å; I32-V35 PolarHBondContact O-N 3.04Å; V35-S39 VanDerWaalsContact O-CB 3.28Å; V35-S39 WeakPolarHBondContact O-CB 3.41Å; V35-S39 PolarHBondContact O-N 2.92Å; V35-S39 PolarHBondContact O-OG 3.2Å; V35-I148 HydrophobicContact CG1-CG2 4.17Å; V35-V151 HydrophobicContact CG2-CB 4.06Å; V35-V151 HydrophobicContact CG2-CG1 3.69Å; V35-A152 HydrophobicContact CG2-CB 4.1Å
36	I	87.7	Confident	83.5	Confident	92 Å²	92	69.8 Å²	69.8	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-48.9	178.8	-66.1	168.4	0	0	0	110.6	I32 I33 S34 S39 L40	I32-I36 HydrophobicContact CG2-CD1 3.89Å; I32-I36 WeakPolarHBondContact O-CG1 3.27Å; I32-I36 PolarHBondContact O-N 2.96Å; I33-I36 PolarHBondContact O-N 3.48Å; S34-I36 VanDerWaalsContact C-N 3.34Å; S34-I36 PolarHBondContact O-N 3.33Å; I36-S39 PolarHBondContact O-N 2.96Å; I36-L40 HydrophobicContact CG2-CD1 4.29Å; I36-L40 WeakPolarHBondContact O-CG 3.5Å; I36-L40 PolarHBondContact O-N 3.02Å
37	L	89.2	Confident	85	Confident	94 Å²	94	70 Å²	70	49%	0.492	38%	0.375	S	S	.	.	H	α-helix	trans	-63.9	-45.3	-179.2	-71.5	175.8	0	0	0	111.9	I33 S34 S39 L40 I41	I33-L37 HydrophobicContact CG2-CD1 3.79Å; I33-L37 HydrophobicContact CG2-CG 4.28Å; I33-L37 WeakPolarHBondContact O-CB 3.25Å; I33-L37 VanDerWaalsContact O-CG 3.32Å; I33-L37 WeakPolarHBondContact O-CG 3.41Å; I33-L37 PolarHBondContact O-N 3.19Å; S34-L37 PolarHBondContact O-N 3.04Å; L37-S39 VanDerWaalsContact C-N 3.29Å; L37-S39 PolarHBondContact O-N 3.22Å; L37-L40 PolarHBondContact O-N 3.12Å; L37-I41 VanDerWaalsContact O-CG1 3.27Å; L37-I41 WeakPolarHBondContact O-CG1 3.39Å; L37-I41 PolarHBondContact O-N 2.93Å
38	L	87.4	Confident	86	Confident	36 Å²	36	68.6 Å²	68.6	19%	0.188	37%	0.37	C	S	.	.	H	α-helix	trans	-61.7	-39.2	176.3	-89.6	79.6	0	0	0	111.2	S34 I41 C42 D147 I148	S34-L38 WeakPolarHBondContact O-CB 3.27Å; S34-L38 WeakPolarHBondContact O-CD1 3.48Å; S34-L38 PolarHBondContact O-N 3.25Å; S34-L38 WeakPolarHBondContact OG-CD1 3.44Å; L38-I41 PolarHBondContact O-N 3.27Å; L38-C42 VanDerWaalsContact O-CB 3.23Å; L38-C42 WeakPolarHBondContact O-CB 3.42Å; L38-C42 PolarHBondContact O-N 3.46Å; L38-D147 HydrophobicContact CD2-CB 4.05Å; L38-I148 HydrophobicContact CB-CD1 4.23Å; L38-I148 HydrophobicContact CB-CG1 3.65Å; L38-I148 HydrophobicContact CD2-CG1 4.22Å
39	S	88.9	Confident	86.6	Confident	40 Å²	40	65.6 Å²	65.6	28%	0.28	36%	0.358	S	S	.	.	H	α-helix	trans	-63.7	-43.2	176.5	-60.9	0	0	0	0	111.9	V35 I36 L37 C42 I43	V35-S39 VanDerWaalsContact O-CB 3.28Å; V35-S39 WeakPolarHBondContact O-CB 3.41Å; V35-S39 PolarHBondContact O-N 2.92Å; V35-S39 PolarHBondContact O-OG 3.2Å; I36-S39 PolarHBondContact O-N 2.96Å; L37-S39 VanDerWaalsContact C-N 3.29Å; L37-S39 PolarHBondContact O-N 3.22Å; S39-C42 WeakPolarHBondContact O-CB 3.42Å; S39-C42 PolarHBondContact O-N 3.1Å; S39-I43 WeakPolarHBondContact O-CG1 3.3Å; S39-I43 PolarHBondContact O-N 3.5Å
40	L	89.3	Confident	87.1	Confident	94 Å²	94	61.8 Å²	61.8	49%	0.492	34%	0.342	S	S	.	.	H	α-helix	trans	-64.5	-44.4	175.8	-71.3	175.7	0	0	0	112	I36 L37 C42 I43 L44	I36-L40 HydrophobicContact CG2-CD1 4.29Å; I36-L40 WeakPolarHBondContact O-CG 3.5Å; I36-L40 PolarHBondContact O-N 3.02Å; L37-L40 PolarHBondContact O-N 3.12Å; L40-C42 VanDerWaalsContact C-N 3.29Å; L40-C42 PolarHBondContact O-N 3.46Å; L40-I43 PolarHBondContact O-N 3.16Å; L40-L44 WeakPolarHBondContact O-CB 3.25Å; L40-L44 VanDerWaalsContact O-CG 3.27Å; L40-L44 WeakPolarHBondContact O-CG 3.33Å; L40-L44 PolarHBondContact O-N 3.41Å
41	I	89.6	Confident	87.6	Confident	102 Å²	102	61.5 Å²	61.5	52%	0.523	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-42.2	175.7	-68.8	164.6	0	0	0	110.4	L37 L38 L44 G45 L144	L37-I41 VanDerWaalsContact O-CG1 3.27Å; L37-I41 WeakPolarHBondContact O-CG1 3.39Å; L37-I41 PolarHBondContact O-N 2.93Å; L38-I41 PolarHBondContact O-N 3.27Å; I41-L44 PolarHBondContact O-N 3.15Å; I41-G45 PolarHBondContact O-N 3.14Å; I41-L144 HydrophobicContact CG2-CD1 4.33Å
42	C	89.2	Confident	88.1	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.074	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-50.2	177.5	-178.1	0	0	0	0	111.8	L38 S39 L40 L44 G45 I46 C140 L144 I148	L38-C42 VanDerWaalsContact O-CB 3.23Å; L38-C42 WeakPolarHBondContact O-CB 3.42Å; L38-C42 PolarHBondContact O-N 3.46Å; S39-C42 WeakPolarHBondContact O-CB 3.42Å; S39-C42 PolarHBondContact O-N 3.1Å; L40-C42 VanDerWaalsContact C-N 3.29Å; L40-C42 PolarHBondContact O-N 3.46Å; C42-L44 PolarHBondContact O-N 3.32Å; C42-G45 PolarHBondContact O-N 3.24Å; C42-I46 VanDerWaalsContact O-CG1 3.32Å; C42-I46 WeakPolarHBondContact O-CG1 3.25Å; C42-I46 PolarHBondContact O-N 2.89Å; C42-C140 PolarHBondContact SG-O 3.21Å; C42-L144 HydrophobicContact CB-CB 4.07Å; C42-L144 HydrophobicContact CB-CD1 3.76Å; C42-I148 HydrophobicContact CB-CD1 4.29Å
43	I	89.9	Confident	88.4	Confident	96 Å²	96	61.8 Å²	61.8	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-47.4	178.4	-67.5	166.1	0	0	0	110.8	S39 L40 G45 I46 I47	S39-I43 WeakPolarHBondContact O-CG1 3.3Å; S39-I43 PolarHBondContact O-N 3.5Å; L40-I43 PolarHBondContact O-N 3.16Å; I43-G45 VanDerWaalsContact C-N 3.3Å; I43-G45 PolarHBondContact O-N 2.98Å; I43-I46 PolarHBondContact O-N 3.08Å; I43-I47 HydrophobicContact CG2-CD1 3.65Å; I43-I47 HydrophobicContact CG2-CG1 4.43Å; I43-I47 WeakPolarHBondContact O-CB 3.5Å; I43-I47 VanDerWaalsContact O-CG1 3.27Å; I43-I47 WeakPolarHBondContact O-CG1 3.43Å; I43-I47 PolarHBondContact O-N 3.15Å
44	L	90.2	Very high	88.5	Confident	123 Å²	123	61.9 Å²	61.9	64%	0.644	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-39	177.8	-72.9	172	0	0	0	111.9	L40 I41 C42 G48	L40-L44 WeakPolarHBondContact O-CB 3.25Å; L40-L44 VanDerWaalsContact O-CG 3.27Å; L40-L44 WeakPolarHBondContact O-CG 3.33Å; L40-L44 PolarHBondContact O-N 3.41Å; I41-L44 PolarHBondContact O-N 3.15Å; C42-L44 PolarHBondContact O-N 3.32Å; L44-G48 WeakPolarHBondContact O-CA 3.2Å; L44-G48 PolarHBondContact O-N 2.75Å
45	G	87.8	Confident	88.5	Confident	16 Å²	16	64 Å²	64	17%	0.165	36%	0.357	C	S	.	.	H	α-helix	trans	-64	-48.2	175.9	0	0	0	0	0	111.9	I41 C42 I43 G48 N49	I41-G45 PolarHBondContact O-N 3.14Å; C42-G45 PolarHBondContact O-N 3.24Å; I43-G45 VanDerWaalsContact C-N 3.3Å; I43-G45 PolarHBondContact O-N 2.98Å; G45-G48 PolarHBondContact O-N 3.11Å; G45-N49 WeakPolarHBondContact O-CB 3.21Å; G45-N49 VanDerWaalsContact O-CG 3.3Å; G45-N49 PolarHBondContact O-N 3.01Å; G45-N49 PolarHBondContact O-ND2 3Å
46	I	90.3	Very high	88.2	Confident	60 Å²	60	66.4 Å²	66.4	31%	0.308	36%	0.364	S	S	.	.	H	α-helix	trans	-60	-50.2	176.6	-67.4	167.1	0	0	0	110.3	C42 I43 S50 L137 C140	C42-I46 VanDerWaalsContact O-CG1 3.32Å; C42-I46 WeakPolarHBondContact O-CG1 3.25Å; C42-I46 PolarHBondContact O-N 2.89Å; I43-I46 PolarHBondContact O-N 3.08Å; I46-S50 WeakPolarHBondContact O-CB 3.49Å; I46-S50 PolarHBondContact O-N 2.91Å; I46-S50 PolarHBondContact O-OG 2.74Å; I46-L137 HydrophobicContact CB-CD1 4.48Å; I46-L137 HydrophobicContact CG1-CD1 4.43Å; I46-L137 HydrophobicContact CG2-CD1 4.3Å; I46-C140 HydrophobicContact CG1-CB 3.76Å
47	I	91	Very high	87.8	Confident	102 Å²	102	66.3 Å²	66.3	52%	0.523	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-49.4	-178.7	-66.8	169.3	0	0	0	110.6	I43 L51	I43-I47 HydrophobicContact CG2-CD1 3.65Å; I43-I47 HydrophobicContact CG2-CG1 4.43Å; I43-I47 WeakPolarHBondContact O-CB 3.5Å; I43-I47 VanDerWaalsContact O-CG1 3.27Å; I43-I47 WeakPolarHBondContact O-CG1 3.43Å; I43-I47 PolarHBondContact O-N 3.15Å; I47-L51 VanDerWaalsContact O-CB 3.3Å; I47-L51 WeakPolarHBondContact O-CB 3.41Å; I47-L51 PolarHBondContact O-N 3.34Å
48	G	89.3	Confident	87.1	Confident	33 Å²	33	67.8 Å²	67.8	34%	0.34	38%	0.377	S	S	.	.	H	α-helix	trans	-62	-50.3	-177.7	0	0	0	0	0	112.3	L44 G45 L51 V52	L44-G48 WeakPolarHBondContact O-CA 3.2Å; L44-G48 PolarHBondContact O-N 2.75Å; G45-G48 PolarHBondContact O-N 3.11Å; G48-L51 PolarHBondContact O-N 2.87Å; G48-V52 WeakPolarHBondContact O-CG2 3.33Å; G48-V52 PolarHBondContact O-N 3.18Å
49	N	89	Confident	85.5	Confident	24 Å²	24	72.7 Å²	72.7	13%	0.128	40%	0.397	C	S	.	.	H	α-helix	trans	-69.1	-38.3	-179.2	-69.3	-40.9	0	0	0	112.1	G45 L51 V52 I53 A133 D136 L137	G45-N49 WeakPolarHBondContact O-CB 3.21Å; G45-N49 VanDerWaalsContact O-CG 3.3Å; G45-N49 PolarHBondContact O-N 3.01Å; G45-N49 PolarHBondContact O-ND2 3Å; N49-L51 PolarHBondContact O-N 3.25Å; N49-V52 PolarHBondContact O-N 3.43Å; N49-I53 VanDerWaalsContact O-CG1 3.28Å; N49-I53 WeakPolarHBondContact O-CG1 3.49Å; N49-I53 PolarHBondContact O-N 3.46Å; N49-A133 WeakPolarHBondContact CB-O 3.49Å; N49-D136 WeakPolarHBondContact ND2-CB 3.49Å; N49-L137 HydrophobicContact CB-CB 4.15Å; N49-L137 HydrophobicContact CB-CD1 4.45Å
50	S	88.7	Confident	83.3	Confident	36 Å²	36	75.2 Å²	75.2	25%	0.252	41%	0.412	S	S	.	.	H	α-helix	trans	-61.7	-43.8	172.7	-61.2	0	0	0	0	111.4	I46 V52 I53 I54	I46-S50 WeakPolarHBondContact O-CB 3.49Å; I46-S50 PolarHBondContact O-N 2.91Å; I46-S50 PolarHBondContact O-OG 2.74Å; S50-V52 VanDerWaalsContact C-N 3.34Å; S50-V52 PolarHBondContact O-N 2.97Å; S50-I53 PolarHBondContact O-N 3.4Å; S50-I54 VanDerWaalsContact O-CB 3.3Å; S50-I54 WeakPolarHBondContact O-CB 3.49Å; S50-I54 WeakPolarHBondContact O-CD1 3.21Å; S50-I54 WeakPolarHBondContact O-CG1 3.39Å; S50-I54 PolarHBondContact O-N 2.88Å
51	L	89.5	Confident	81.2	Confident	100 Å²	100	80.1 Å²	80.1	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-60.7	-44.5	176.9	-172.5	159.1	0	0	0	111	I47 G48 N49 I54 V55	I47-L51 VanDerWaalsContact O-CB 3.3Å; I47-L51 WeakPolarHBondContact O-CB 3.41Å; I47-L51 PolarHBondContact O-N 3.34Å; G48-L51 PolarHBondContact O-N 2.87Å; N49-L51 PolarHBondContact O-N 3.25Å; L51-I54 PolarHBondContact O-N 3.01Å; L51-V55 HydrophobicContact CD2-CG2 3.69Å; L51-V55 HydrophobicContact CG-CG2 4.35Å; L51-V55 WeakPolarHBondContact O-CB 3.25Å; L51-V55 VanDerWaalsContact O-CG2 3.25Å; L51-V55 WeakPolarHBondContact O-CG2 3.48Å; L51-V55 PolarHBondContact O-N 3.39Å
52	V	88.6	Confident	78.6	Confident	44 Å²	44	79.2 Å²	79.2	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-58.2	-51.3	176	172.8	0	0	0	0	110.3	G48 N49 S50 I54 V55 Y56 I129 A133	G48-V52 WeakPolarHBondContact O-CG2 3.33Å; G48-V52 PolarHBondContact O-N 3.18Å; N49-V52 PolarHBondContact O-N 3.43Å; S50-V52 VanDerWaalsContact C-N 3.34Å; S50-V52 PolarHBondContact O-N 2.97Å; V52-I54 PolarHBondContact O-N 3.17Å; V52-V55 PolarHBondContact O-N 3.4Å; V52-Y56 HydrophobicContact CG1-CD2 3.65Å; V52-Y56 HydrophobicContact CG1-CE2 3.8Å; V52-Y56 WeakPolarHBondContact O-CB 3.4Å; V52-Y56 WeakPolarHBondContact O-CD2 3.46Å; V52-Y56 PolarHBondContact O-N 3.25Å; V52-I129 HydrophobicContact CG1-CG2 4.44Å; V52-A133 HydrophobicContact CB-CB 4.06Å; V52-A133 HydrophobicContact CG1-CB 3.64Å
53	I	87	Confident	76.1	Confident	36 Å²	36	84.7 Å²	84.7	19%	0.185	46%	0.461	C	S	.	.	H	α-helix	trans	-58.2	-49.2	178.6	-66.8	163.9	0	0	0	110.6	N49 S50 V55 Y56 C57 A133 L137	N49-I53 VanDerWaalsContact O-CG1 3.28Å; N49-I53 WeakPolarHBondContact O-CG1 3.49Å; N49-I53 PolarHBondContact O-N 3.46Å; S50-I53 PolarHBondContact O-N 3.4Å; I53-V55 PolarHBondContact O-N 3.15Å; I53-Y56 PolarHBondContact O-N 3.37Å; I53-C57 WeakPolarHBondContact O-CB 3.45Å; I53-C57 PolarHBondContact O-N 3.42Å; I53-C57 PolarHBondContact O-SG 2.87Å; I53-A133 HydrophobicContact CG1-CB 4.02Å; I53-L137 HydrophobicContact CD1-CD2 3.9Å
54	I	86.8	Confident	73.6	Confident	90 Å²	90	84.9 Å²	84.9	46%	0.462	47%	0.467	S	S	.	.	H	α-helix	trans	-58.9	-49.3	178.9	-71.1	167.6	0	0	0	110.8	S50 L51 V52 Y56 C57 I58	S50-I54 VanDerWaalsContact O-CB 3.3Å; S50-I54 WeakPolarHBondContact O-CB 3.49Å; S50-I54 WeakPolarHBondContact O-CD1 3.21Å; S50-I54 WeakPolarHBondContact O-CG1 3.39Å; S50-I54 PolarHBondContact O-N 2.88Å; L51-I54 PolarHBondContact O-N 3.01Å; V52-I54 PolarHBondContact O-N 3.17Å; I54-Y56 VanDerWaalsContact C-N 3.34Å; I54-Y56 PolarHBondContact O-N 3.11Å; I54-C57 PolarHBondContact O-N 3.27Å; I54-I58 HydrophobicContact CG2-CD1 3.43Å; I54-I58 VanDerWaalsContact CG2-CD1 3.43Å; I54-I58 HydrophobicContact CG2-CG1 4.16Å; I54-I58 VanDerWaalsContact O-CB 3.25Å; I54-I58 WeakPolarHBondContact O-CB 3.2Å; I54-I58 VanDerWaalsContact O-CG1 3.27Å; I54-I58 WeakPolarHBondContact O-CG1 3.44Å; I54-I58 PolarHBondContact O-N 2.96Å
55	V	85.3	Confident	70.9	Confident	82 Å²	82	85.9 Å²	85.9	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-63.9	-38.9	-179.1	169	0	0	0	0	111.7	L51 V52 I53 K59	L51-V55 HydrophobicContact CD2-CG2 3.69Å; L51-V55 HydrophobicContact CG-CG2 4.35Å; L51-V55 WeakPolarHBondContact O-CB 3.25Å; L51-V55 VanDerWaalsContact O-CG2 3.25Å; L51-V55 WeakPolarHBondContact O-CG2 3.48Å; L51-V55 PolarHBondContact O-N 3.39Å; V52-V55 PolarHBondContact O-N 3.4Å; I53-V55 PolarHBondContact O-N 3.15Å; V55-K59 WeakPolarHBondContact O-CB 3.25Å; V55-K59 PolarHBondContact O-N 3.36Å
56	Y	78.6	Confident	68.1	Low	84 Å²	84	95.3 Å²	95.3	33%	0.329	50%	0.503	S	S	.	.	H	α-helix	trans	-75.3	-33	177.9	-82.2	-74.8	0	0	0	112.8	V52 I53 I54 Q126 I129	V52-Y56 HydrophobicContact CG1-CD2 3.65Å; V52-Y56 HydrophobicContact CG1-CE2 3.8Å; V52-Y56 WeakPolarHBondContact O-CB 3.4Å; V52-Y56 WeakPolarHBondContact O-CD2 3.46Å; V52-Y56 PolarHBondContact O-N 3.25Å; I53-Y56 PolarHBondContact O-N 3.37Å; I54-Y56 VanDerWaalsContact C-N 3.34Å; I54-Y56 PolarHBondContact O-N 3.11Å; Y56-Q126 HydrophobicContact CD1-CB 4.4Å; Y56-Q126 HydrophobicContact CD1-CG 4.24Å; Y56-Q126 HydrophobicContact CE1-CB 4.37Å; Y56-Q126 HydrophobicContact CE1-CG 3.88Å; Y56-I129 HydrophobicContact CE2-CG2 3.85Å
57	C	78.5	Confident	65.4	Low	89 Å²	89	101 Å²	101	60%	0.601	53%	0.526	S	S	*	.	H	α-helix	trans	-76.7	-41.2	177.2	-72.3	0	0	0	0	113	I53 I54 K59	I53-C57 WeakPolarHBondContact O-CB 3.45Å; I53-C57 PolarHBondContact O-N 3.42Å; I53-C57 PolarHBondContact O-SG 2.87Å; I54-C57 PolarHBondContact O-N 3.27Å; C57-K59 VanDerWaalsContact C-N 3.32Å
58	I	73.9	Confident	62.7	Low	125 Å²	125	101.4 Å²	101.4	64%	0.641	53%	0.528	S	S	*	.	H	α-helix	trans	-76.1	-21.6	-178.2	-67	-178.1	0	0	0	111.8	I54 P60	I54-I58 HydrophobicContact CG2-CD1 3.43Å; I54-I58 VanDerWaalsContact CG2-CD1 3.43Å; I54-I58 HydrophobicContact CG2-CG1 4.16Å; I54-I58 VanDerWaalsContact O-CB 3.25Å; I54-I58 WeakPolarHBondContact O-CB 3.2Å; I54-I58 VanDerWaalsContact O-CG1 3.27Å; I54-I58 WeakPolarHBondContact O-CG1 3.44Å; I54-I58 PolarHBondContact O-N 2.96Å; I58-P60 WeakPolarHBondContact O-CD 3.21Å
59	K	54.3	Low	60.2	Low	140 Å²	140	105.9 Å²	105.9	61%	0.609	54%	0.543	S	S	*	.	S	Bend	trans	-56.5	111.6	-176.5	-162.7	168.6	-170.9	166.9	0	110.2	V55 C57 K61	V55-K59 WeakPolarHBondContact O-CB 3.25Å; V55-K59 PolarHBondContact O-N 3.36Å; C57-K59 VanDerWaalsContact C-N 3.32Å; K59-K61 PolarHBondContact O-N 3.28Å
60	P	41.9	Very low	57.4	Low	93 Å²	93	110.6 Å²	110.6	60%	0.604	57%	0.568	S	S	*	*			trans	-63.6	134.9	-171.5	22.5	-31.1	0	0	0	108.8	I58 S62	I58-P60 WeakPolarHBondContact O-CD 3.21Å; P60-S62 PolarHBondContact O-N 3.09Å
61	K	45.4	Very low	54.8	Low	196 Å²	196	116.3 Å²	116.3	85%	0.852	59%	0.59	S	S	*	*			trans	-61.4	31.4	162.8	-88.2	177	176.4	167.1	0	111.8	K59 N63	K59-K61 PolarHBondContact O-N 3.28Å; K61-N63 VanDerWaalsContact C-N 3.33Å; K61-N63 PolarHBondContact O-N 3.5Å
62	S	36.3	Very low	52.3	Low	83 Å²	83	117 Å²	117	58%	0.58	60%	0.599	S	S	*	*			trans	-75.9	82.8	-178.7	61.4	0	0	0	0	110.6	P60	P60-S62 PolarHBondContact O-N 3.09Å
63	N	36.4	Very low	49.7	Very low	126 Å²	126	122.1 Å²	122.1	67%	0.674	62%	0.623	S	S	*	*			trans	163.9	78.4	138.7	-81.4	-29.3	0	0	0	109.2	K61 R119	K61-N63 VanDerWaalsContact C-N 3.33Å; K61-N63 PolarHBondContact O-N 3.5Å; N63-R119 PolarHBondContact O-NH2 3.13Å; N63-R119 VanDerWaalsContact O-NH2 3.11Å
64	T	37.6	Very low	47.2	Very low	101 Å²	101	127.9 Å²	127.9	62%	0.62	65%	0.651	S	S	*	*	S	Bend	trans	-108.1	5.4	166.1	31.5	0	0	0	0	113.9
65	N	32.8	Very low	44.6	Very low	143 Å²	143	129.2 Å²	129.2	77%	0.765	66%	0.659	S	S	*	*			trans	-120.7	15.1	-179.7	-91.6	0.1	0	0	0	116.9	F67	N65-F67 VanDerWaalsContact C-N 3.27Å; N65-F67 PolarHBondContact O-N 3.3Å
66	R	29.6	Very low	42.1	Very low	214 Å²	214	131.3 Å²	131.3	81%	0.808	67%	0.668	S	S	*	*			trans	-81.6	79.5	167.6	-137.7	176.5	-168.1	-179	3.8	110.1	I68	R66-I68 HydrophobicContact CG-CG1 4.33Å; R66-I68 PolarHBondContact O-N 3.44Å
67	F	32.8	Very low	40	Very low	181 Å²	181	134.2 Å²	134.2	79%	0.794	69%	0.689	S	S	*	*			trans	-56.9	94	152.7	-84.9	-93.8	0	0	0	107	N65 I69	N65-F67 VanDerWaalsContact C-N 3.27Å; N65-F67 PolarHBondContact O-N 3.3Å; F67-I69 VanDerWaalsContact C-N 3.26Å; F67-I69 PolarHBondContact O-N 3.43Å
68	I	34	Very low	38.1	Very low	110 Å²	110	135.5 Å²	135.5	56%	0.564	70%	0.695	S	S	*	*			trans	-74.7	94.3	164.5	-61.5	174.3	0	0	0	104.8	R66 N70	R66-I68 HydrophobicContact CG-CG1 4.33Å; R66-I68 PolarHBondContact O-N 3.44Å; I68-N70 VanDerWaalsContact C-N 3.28Å; I68-N70 PolarHBondContact O-N 3.14Å
69	I	37.1	Very low	36	Very low	127 Å²	127	139.3 Å²	139.3	65%	0.651	71%	0.707	S	S	*	*			trans	-57.5	99.9	159.7	-61.6	171.5	0	0	0	105	F67 H71	F67-I69 VanDerWaalsContact C-N 3.26Å; F67-I69 PolarHBondContact O-N 3.43Å; I69-H71 PolarHBondContact O-N 2.76Å
70	N	30.9	Very low	35.1	Very low	122 Å²	122	141.4 Å²	141.4	65%	0.652	72%	0.719	S	S	*	*			trans	-69.2	94	163.6	-80.8	-20.9	0	0	0	105.8	I68 T72	I68-N70 VanDerWaalsContact C-N 3.28Å; I68-N70 PolarHBondContact O-N 3.14Å; N70-T72 PolarHBondContact O-N 2.99Å
71	H	34.3	Very low	34.5	Very low	156 Å²	156	144.7 Å²	144.7	72%	0.722	73%	0.731	S	S	*	*			trans	-61.3	90.2	154.9	-85.8	-86.9	0	0	0	107	I69 I73	I69-H71 PolarHBondContact O-N 2.76Å; H71-I73 PolarHBondContact O-N 3.31Å; H71-I73 VanDerWaalsContact O-N 3.08Å
72	T	35.6	Very low	34	Very low	116 Å²	116	141.8 Å²	141.8	71%	0.712	73%	0.729	S	S	*	*			trans	-67.3	95.9	150	38.6	0	0	0	0	105.8	N70 M74	N70-T72 PolarHBondContact O-N 2.99Å; T72-M74 VanDerWaalsContact C-N 3.26Å; T72-M74 PolarHBondContact O-N 3.26Å
73	I	35.4	Very low	34	Very low	150 Å²	150	144.5 Å²	144.5	77%	0.769	74%	0.743	S	S	*	*			trans	-58.5	98.8	160.9	-63.2	171.6	0	0	0	105.2	H71 N75	H71-I73 PolarHBondContact O-N 3.31Å; H71-I73 VanDerWaalsContact O-N 3.08Å; I73-N75 PolarHBondContact O-N 3.08Å; I73-N75 VanDerWaalsContact O-N 3.12Å
74	M	34.8	Very low	33.8	Very low	157 Å²	157	142.2 Å²	142.2	77%	0.773	75%	0.748	S	S	*	*			trans	-64.9	103.7	163.4	-84.7	-78.4	-167.8	0	0	105.9	T72 N76	T72-M74 VanDerWaalsContact C-N 3.26Å; T72-M74 PolarHBondContact O-N 3.26Å; M74-N76 PolarHBondContact O-N 2.88Å
75	N	31.2	Very low	33.5	Very low	118 Å²	118	145.6 Å²	145.6	63%	0.631	76%	0.763	S	S	*	*			trans	-72.1	79	168.9	-171.8	21.4	0	0	0	108.2	I73 N77	I73-N75 PolarHBondContact O-N 3.08Å; I73-N75 VanDerWaalsContact O-N 3.12Å; N75-N77 PolarHBondContact O-N 2.89Å; N75-N77 VanDerWaalsContact OD1-CG 3.29Å; N75-N77 PolarHBondContact OD1-ND2 2.91Å; N75-N77 PolarHBondContact OD1-OD1 3.39Å
76	N	33.5	Very low	33.6	Very low	127 Å²	127	148 Å²	148	68%	0.679	77%	0.766	S	S	*	*			trans	-92.5	80.9	162.8	-81.5	1.1	0	0	0	107.4	M74 T78	M74-N76 PolarHBondContact O-N 2.88Å; N76-T78 PolarHBondContact O-N 3.49Å
77	N	33.5	Very low	33.6	Very low	144 Å²	144	144 Å²	144	77%	0.77	76%	0.761	S	S	*	*			trans	-71.3	77	159.8	-79	-19.9	0	0	0	108.3	N75	N75-N77 PolarHBondContact O-N 2.89Å; N75-N77 VanDerWaalsContact OD1-CG 3.29Å; N75-N77 PolarHBondContact OD1-ND2 2.91Å; N75-N77 PolarHBondContact OD1-OD1 3.39Å
78	T	37.9	Very low	33.6	Very low	117 Å²	117	141.2 Å²	141.2	72%	0.718	75%	0.754	S	S	*	*			trans	-119.9	101.6	160.7	-0	0	0	0	0	106.5	N76 Q80	N76-T78 PolarHBondContact O-N 3.49Å; T78-Q80 PolarHBondContact O-N 3.05Å; T78-Q80 VanDerWaalsContact O-N 3.17Å
79	K	30.4	Very low	33.4	Very low	205 Å²	205	142 Å²	142	89%	0.891	76%	0.764	S	S	*	*			trans	-54.4	114.2	172.8	-70.8	175.8	174.8	179.8	0	109.1
80	Q	35.9	Very low	33.1	Very low	184 Å²	184	143.6 Å²	143.6	86%	0.86	77%	0.773	S	S	*	*			trans	-131.3	106.6	153.8	-85.3	-172.2	-10.7	0	0	108.4	T78 V82	T78-Q80 PolarHBondContact O-N 3.05Å; T78-Q80 VanDerWaalsContact O-N 3.17Å; Q80-V82 PolarHBondContact O-N 3.26Å
81	N	28.9	Very low	33	Very low	162 Å²	162	143.2 Å²	143.2	87%	0.866	78%	0.775	S	S	*	*			trans	-67.3	117.9	165.3	-79	-15.1	0	0	0	108.3
82	V	36	Very low	33.2	Very low	135 Å²	135	142.5 Å²	142.5	82%	0.818	78%	0.775	S	S	*	*			trans	-142.5	101.7	151.2	-173.3	0	0	0	0	108.4	Q80	Q80-V82 PolarHBondContact O-N 3.26Å
83	T	35.5	Very low	33.1	Very low	140 Å²	140	146 Å²	146	86%	0.859	78%	0.781	S	S	*	*			trans	-67.8	141	159.8	31.3	0	0	0	0	110.5
84	G	32.3	Very low	33.2	Very low	77 Å²	77	146 Å²	146	79%	0.794	78%	0.782	S	S	*	*			trans	142.3	111.4	159.9	0	0	0	0	0	114.2
85	N	31.7	Very low	33.2	Very low	172 Å²	172	144.2 Å²	144.2	92%	0.92	78%	0.782	S	S	*	*			trans	-64.3	156.9	177.4	-74.7	-30.7	0	0	0	113.6
86	K	34.8	Very low	33.2	Very low	193 Å²	193	142.1 Å²	142.1	84%	0.839	79%	0.789	S	S	*	*			trans	107.2	124.2	147.4	-139.3	179.6	-174	-178.7	0	116.3
87	L	30	Very low	33.3	Very low	132 Å²	132	141.9 Å²	141.9	69%	0.691	80%	0.797	S	S	*	*			trans	91.7	113.8	142.8	-138.8	64.4	0	0	0	119.2
88	D	32.5	Very low	33.3	Very low	122 Å²	122	142.3 Å²	142.3	65%	0.652	80%	0.799	S	S	*	*			trans	53.9	125.5	136.2	-55	-14.1	0	0	0	121.8
89	T	28.8	Very low	32.9	Very low	126 Å²	126	142.9 Å²	142.9	77%	0.773	81%	0.805	S	S	*	*			trans	44.6	88.1	141.2	-38.1	0	0	0	0	117
90	L	31.7	Very low	32.8	Very low	161 Å²	161	138.1 Å²	138.1	84%	0.843	80%	0.797	S	S	*	*			trans	-107.4	92	168.4	-93.7	156.6	0	0	0	112	I92	L90-I92 PolarHBondContact O-N 3.42Å
91	T	29.1	Very low	32.6	Very low	113 Å²	113	135.3 Å²	135.3	69%	0.693	79%	0.793	S	S	*	*			trans	-66.8	112.9	156.8	-44.7	0	0	0	0	108.6	K93	T91-K93 PolarHBondContact O-N 2.98Å
92	I	37.5	Very low	32.6	Very low	142 Å²	142	137.6 Å²	137.6	73%	0.728	80%	0.796	S	S	*	*			trans	-90.7	95.2	174.9	-57.9	176.8	0	0	0	108.7	L90	L90-I92 PolarHBondContact O-N 3.42Å
93	K	33.6	Very low	32.4	Very low	190 Å²	190	137.3 Å²	137.3	83%	0.826	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-79.5	116	156.5	-82.6	-178.2	175.7	178.6	0	107.6	T91	T91-K93 PolarHBondContact O-N 2.98Å
94	N	37.3	Very low	32.4	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-91	129	161.2	-103	-9.4	0	0	0	109
95	P	34.9	Very low	32.3	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.2	135.6	176.1	32.7	-29.9	0	0	0	110.3
96	G	32	Very low	32.5	Very low	75 Å²	75	142.6 Å²	142.6	77%	0.773	78%	0.778	S	S	*	*	S	Bend	trans	70.5	76.5	152.9	0	0	0	0	0	117.6
97	S	35	Very low	32.4	Very low	122 Å²	122	143.6 Å²	143.6	85%	0.853	78%	0.783	S	S	*	*	S	Bend	trans	173.6	127.1	130.7	57.9	0	0	0	0	110.1
98	N	34.3	Very low	32.4	Very low	152 Å²	152	143.9 Å²	143.9	81%	0.813	79%	0.786	S	S	*	*			trans	-14	139.9	-176.5	-64.2	-21.1	0	0	0	120.4	S100	N98-S100 PolarHBondContact O-N 3Å
99	P	28.4	Very low	32.6	Very low	130 Å²	130	143.9 Å²	143.9	84%	0.844	79%	0.785	S	S	*	*			trans	-75	99.5	-178.9	32.7	-31.5	0	0	0	109.6
100	S	29.4	Very low	32.9	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	79%	0.788	S	S	*	*			trans	-88.9	111.9	161	55.5	0	0	0	0	108.7	N98 F102	N98-S100 PolarHBondContact O-N 3Å; S100-F102 PolarHBondContact O-N 3.46Å; S100-F102 VanDerWaalsContact O-N 3.1Å
101	T	30.8	Very low	33.3	Very low	125 Å²	125	146.1 Å²	146.1	77%	0.767	78%	0.783	S	S	*	*			trans	-31.4	105.6	167.3	22.4	0	0	0	0	112.5	N103	T101-N103 VanDerWaalsContact C-N 3.29Å; T101-N103 PolarHBondContact O-N 3.08Å
102	F	29.5	Very low	33.8	Very low	211 Å²	211	147 Å²	147	93%	0.925	78%	0.777	S	S	*	*			trans	-68.6	92	167.7	-125.1	-92.4	0	0	0	108	S100 K104	S100-F102 PolarHBondContact O-N 3.46Å; S100-F102 VanDerWaalsContact O-N 3.1Å; F102-K104 PolarHBondContact O-N 3.07Å
103	N	31.5	Very low	34.1	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	77%	0.766	S	S	*	*			trans	-56.3	120.9	177.6	-98.8	-19.2	0	0	0	110	T101 D105	T101-N103 VanDerWaalsContact C-N 3.29Å; T101-N103 PolarHBondContact O-N 3.08Å; N103-D105 PolarHBondContact O-N 3.47Å
104	K	36	Very low	34.4	Very low	207 Å²	207	140.4 Å²	140.4	90%	0.9	76%	0.758	S	S	*	*	S	Bend	trans	-67.6	21.5	175.9	-93.1	177.3	175	170.7	0	114.2	F102	F102-K104 PolarHBondContact O-N 3.07Å
105	D	30.7	Very low	34.4	Very low	120 Å²	120	141.6 Å²	141.6	64%	0.642	76%	0.757	S	S	*	*			trans	-124.6	67.1	-165.5	-66.2	-24.4	0	0	0	111.3	N103	N103-D105 PolarHBondContact O-N 3.47Å
106	H	35.2	Very low	34.5	Very low	173 Å²	173	141 Å²	141	80%	0.801	75%	0.746	S	S	*	*			trans	-153.9	2.6	164.5	-113.6	-72	0	0	0	118.2	N108	H106-N108 VanDerWaalsContact C-N 3.31Å; H106-N108 PolarHBondContact O-N 2.97Å
107	F	31.7	Very low	35	Very low	214 Å²	214	141.4 Å²	141.4	94%	0.939	73%	0.73	S	S	*	*			trans	-91.2	65.6	168.9	-88.5	-85.1	0	0	0	111.5	L109	F107-L109 PolarHBondContact O-N 3.08Å
108	N	30.9	Very low	35.3	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	72%	0.716	S	S	*	*			trans	-68	104	175.3	-100.9	-32.1	0	0	0	111	H106 T110	H106-N108 VanDerWaalsContact C-N 3.31Å; H106-N108 PolarHBondContact O-N 2.97Å; N108-T110 PolarHBondContact O-N 2.82Å; N108-T110 PolarHBondContact O-OG1 3.47Å
109	L	36.1	Very low	35.4	Very low	122 Å²	122	139.8 Å²	139.8	64%	0.639	70%	0.701	S	S	*	*			trans	-56.9	61.2	178.9	-155.2	76.1	0	0	0	113.8	F107 R111 K112	F107-L109 PolarHBondContact O-N 3.08Å; L109-R111 PolarHBondContact O-N 3.33Å; L109-R111 VanDerWaalsContact O-N 3.14Å; L109-K112 HydrophobicContact CD2-CD 3.58Å; L109-K112 HydrophobicContact CD2-CG 4.24Å; L109-K112 HydrophobicContact CG-CD 4.34Å; L109-K112 HydrophobicContact CG-CG 4.48Å
110	T	36	Very low	36.1	Very low	135 Å²	135	140.9 Å²	140.9	83%	0.828	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	27.2	-175.4	34.9	0	0	0	0	114.2	N108	N108-T110 PolarHBondContact O-N 2.82Å; N108-T110 PolarHBondContact O-OG1 3.47Å
111	R	39.5	Very low	37.2	Very low	199 Å²	199	137.5 Å²	137.5	75%	0.751	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.8	6.7	177.9	-146.8	174.5	-174.9	-176.1	0.5	115.1	L109 L468	L109-R111 PolarHBondContact O-N 3.33Å; L109-R111 VanDerWaalsContact O-N 3.14Å; R111-L468 VanDerWaalsContact NH2-CD1 3.34Å
112	K	39.2	Very low	38.3	Very low	130 Å²	130	134.8 Å²	134.8	57%	0.565	65%	0.646	S	S	*	*	S	Bend	trans	-90.3	-9.2	-179.5	-99.3	-169.3	-171.6	169.9	0	115.9	L109 L116	L109-K112 HydrophobicContact CD2-CD 3.58Å; L109-K112 HydrophobicContact CD2-CG 4.24Å; L109-K112 HydrophobicContact CG-CD 4.34Å; L109-K112 HydrophobicContact CG-CG 4.48Å; K112-L116 HydrophobicContact CB-CD1 4.44Å; K112-L116 WeakPolarHBondContact O-CD1 3.29Å
113	S	45.2	Very low	39.4	Very low	72 Å²	72	129 Å²	129	50%	0.503	62%	0.624	S	S	.	*	H	α-helix	trans	-77.3	-42	-168.5	65.9	0	0	0	0	115	K115 L116 L117	S113-K115 PolarHBondContact O-N 3.38Å; S113-L116 PolarHBondContact O-N 3.41Å; S113-L117 WeakPolarHBondContact O-CB 3.35Å; S113-L117 PolarHBondContact O-N 3.32Å
114	N	39.6	Very low	40.8	Very low	123 Å²	123	123.9 Å²	123.9	66%	0.658	60%	0.598	S	S	*	*	H	α-helix	trans	-71.9	-34	-168.1	-71.9	-19.9	0	0	0	114.8	L118	N114-L118 WeakPolarHBondContact O-CB 3.37Å; N114-L118 PolarHBondContact O-N 3.24Å
115	K	37	Very low	42.3	Very low	173 Å²	173	115.9 Å²	115.9	75%	0.752	56%	0.564	S	S	*	*	H	α-helix	trans	-76.4	-34.9	177	-86.1	-175	176.9	179.2	0	112.4	S113 R119	S113-K115 PolarHBondContact O-N 3.38Å; K115-R119 PolarHBondContact O-N 2.95Å; K115-R119 VanDerWaalsContact O-N 3.13Å
116	L	36.9	Very low	44.2	Very low	106 Å²	106	113.2 Å²	113.2	56%	0.555	55%	0.548	S	S	*	.	H	α-helix	trans	-70.6	-38.9	176.7	-76.1	170.3	0	0	0	111.5	K112 S113 L118 R119 R120	K112-L116 HydrophobicContact CB-CD1 4.44Å; K112-L116 WeakPolarHBondContact O-CD1 3.29Å; S113-L116 PolarHBondContact O-N 3.41Å; L116-L118 VanDerWaalsContact C-N 3.34Å; L116-L118 PolarHBondContact O-N 3.43Å; L116-R119 PolarHBondContact O-N 3.13Å; L116-R120 WeakPolarHBondContact O-CB 3.27Å; L116-R120 PolarHBondContact O-N 2.83Å
117	L	41.3	Very low	46.1	Very low	85 Å²	85	109.5 Å²	109.5	45%	0.445	53%	0.534	S	S	.	.	H	α-helix	trans	-63.5	-41.3	175.4	-135.2	127	0	0	0	111.3	S113 R119 R120 N121	S113-L117 WeakPolarHBondContact O-CB 3.35Å; S113-L117 PolarHBondContact O-N 3.32Å; L117-R119 PolarHBondContact O-N 3.46Å; L117-R120 PolarHBondContact O-N 3.33Å; L117-N121 VanDerWaalsContact O-CG 3.23Å; L117-N121 PolarHBondContact O-N 3.44Å; L117-N121 PolarHBondContact O-OD1 3.5Å
118	L	42.4	Very low	48.3	Very low	107 Å²	107	100 Å²	100	56%	0.56	49%	0.493	S	S	*	.	H	α-helix	trans	-65.1	-40.1	177.7	-155.6	76	0	0	0	112.3	N114 L116 R120 T122	N114-L118 WeakPolarHBondContact O-CB 3.37Å; N114-L118 PolarHBondContact O-N 3.24Å; L116-L118 VanDerWaalsContact C-N 3.34Å; L116-L118 PolarHBondContact O-N 3.43Å; L118-R120 VanDerWaalsContact C-N 3.34Å; L118-T122 WeakPolarHBondContact O-CG2 3.5Å; L118-T122 PolarHBondContact O-N 3.25Å; L118-T122 PolarHBondContact O-OG1 3.5Å
119	R	35.3	Very low	50.7	Low	133 Å²	133	95.3 Å²	95.3	50%	0.502	47%	0.467	S	S	.	.	H	α-helix	trans	-70.2	-30.2	176.8	-166.4	-178.9	-173.6	176.1	9.6	112.6	N63 K115 L116 L117 T122 L123	N63-R119 PolarHBondContact O-NH2 3.13Å; N63-R119 VanDerWaalsContact O-NH2 3.11Å; K115-R119 PolarHBondContact O-N 2.95Å; K115-R119 VanDerWaalsContact O-N 3.13Å; L116-R119 PolarHBondContact O-N 3.13Å; L117-R119 PolarHBondContact O-N 3.46Å; R119-T122 WeakPolarHBondContact CA-OG1 3.36Å; R119-T122 PolarHBondContact O-OG1 3.27Å; R119-L123 PolarHBondContact O-N 3.5Å
120	R	45	Very low	53	Low	153 Å²	153	92.2 Å²	92.2	58%	0.577	45%	0.451	S	S	*	.	H	α-helix	trans	-75.2	-37	178.1	-154.7	173.1	-169.2	120.5	4.6	111.9	L116 L117 L118 L123 S124	L116-R120 WeakPolarHBondContact O-CB 3.27Å; L116-R120 PolarHBondContact O-N 2.83Å; L117-R120 PolarHBondContact O-N 3.33Å; L118-R120 VanDerWaalsContact C-N 3.34Å; R120-L123 PolarHBondContact O-N 3.16Å; R120-S124 PolarHBondContact O-N 3.31Å
121	N	51.5	Low	55.3	Low	33 Å²	33	89 Å²	89	18%	0.176	43%	0.428	C	S	.	.	H	α-helix	trans	-70	-30.9	175.3	-66	5.8	0	0	0	112.6	L117 L123 S124 Q125	L117-N121 VanDerWaalsContact O-CG 3.23Å; L117-N121 PolarHBondContact O-N 3.44Å; L117-N121 PolarHBondContact O-OD1 3.5Å; N121-L123 VanDerWaalsContact C-N 3.28Å; N121-L123 PolarHBondContact O-N 3.04Å; N121-S124 PolarHBondContact O-OG 3.31Å; N121-Q125 PolarHBondContact O-N 3Å
122	T	52.8	Low	57.6	Low	67 Å²	67	80.9 Å²	80.9	41%	0.411	40%	0.4	S	S	.	.	H	α-helix	trans	-69.9	-29.1	173	51	0	0	0	0	112.2	L118 R119 Q126	L118-T122 WeakPolarHBondContact O-CG2 3.5Å; L118-T122 PolarHBondContact O-N 3.25Å; L118-T122 PolarHBondContact O-OG1 3.5Å; R119-T122 WeakPolarHBondContact CA-OG1 3.36Å; R119-T122 PolarHBondContact O-OG1 3.27Å; T122-Q126 WeakPolarHBondContact O-CB 3.47Å; T122-Q126 WeakPolarHBondContact O-CG 3.45Å; T122-Q126 PolarHBondContact O-N 3.36Å; T122-Q126 VanDerWaalsContact O-N 3.13Å
123	L	53.2	Low	59.9	Low	91 Å²	91	74.9 Å²	74.9	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-75.3	-37.6	-179.8	-167.8	68.2	0	0	0	111.8	R119 R120 N121 Q126 N127	R119-L123 PolarHBondContact O-N 3.5Å; R120-L123 PolarHBondContact O-N 3.16Å; N121-L123 VanDerWaalsContact C-N 3.28Å; N121-L123 PolarHBondContact O-N 3.04Å; L123-Q126 PolarHBondContact O-N 2.84Å; L123-N127 WeakPolarHBondContact O-CB 3.14Å; L123-N127 PolarHBondContact O-N 3.48Å; L123-N127 PolarHBondContact O-OD1 2.84Å
124	S	62.3	Low	61.9	Low	19 Å²	19	76.5 Å²	76.5	13%	0.133	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-45.8	172.2	39.3	0	0	0	0	112.3	R120 N121 Q126 N127 L128 E220 N317	R120-S124 PolarHBondContact O-N 3.31Å; N121-S124 PolarHBondContact O-OG 3.31Å; S124-Q126 VanDerWaalsContact C-N 3.28Å; S124-Q126 PolarHBondContact O-N 3.32Å; S124-N127 PolarHBondContact O-N 3.36Å; S124-N127 VanDerWaalsContact O-N 3.17Å; S124-L128 WeakPolarHBondContact O-CB 3.25Å; S124-L128 PolarHBondContact O-N 2.8Å; S124-E220 VanDerWaalsContact CB-OE1 3.27Å; S124-E220 WeakPolarHBondContact CB-OE1 3.35Å; S124-E220 PolarHBondContact OG-OE1 3.21Å; S124-N317 WeakPolarHBondContact CB-ND2 3.24Å; S124-N317 PolarHBondContact OG-ND2 2.83Å; S124-N317 VanDerWaalsContact OG-ND2 3.15Å; S124-N317 PolarHBondContact OG-OD1 2.99Å
125	Q	66.2	Low	64.2	Low	40 Å²	40	71 Å²	71	19%	0.187	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-35.5	-178.8	-162.9	-148.5	-62.8	0	0	112.2	N121 I129 E220 R221	N121-Q125 PolarHBondContact O-N 3Å; Q125-I129 HydrophobicContact CG-CD1 4.41Å; Q125-I129 WeakPolarHBondContact O-CD1 3.38Å; Q125-I129 VanDerWaalsContact O-CG1 3.24Å; Q125-I129 WeakPolarHBondContact O-CG1 3.28Å; Q125-I129 PolarHBondContact O-N 3.47Å; Q125-E220 WeakPolarHBondContact CA-OE2 3.07Å; Q125-E220 PolarHBondContact N-OE1 3.26Å; Q125-R221 VanDerWaalsContact CD-NH1 3.26Å; Q125-R221 VanDerWaalsContact OE1-CZ 3.27Å
126	Q	69.9	Low	66.6	Low	64 Å²	64	64.6 Å²	64.6	30%	0.299	32%	0.317	S	S	.	.	H	α-helix	trans	-68.7	-41.8	174.5	-74.7	179.2	-37.9	0	0	111.8	Y56 T122 L123 S124 L128 I129 L130	Y56-Q126 HydrophobicContact CD1-CB 4.4Å; Y56-Q126 HydrophobicContact CD1-CG 4.24Å; Y56-Q126 HydrophobicContact CE1-CB 4.37Å; Y56-Q126 HydrophobicContact CE1-CG 3.88Å; T122-Q126 WeakPolarHBondContact O-CB 3.47Å; T122-Q126 WeakPolarHBondContact O-CG 3.45Å; T122-Q126 PolarHBondContact O-N 3.36Å; T122-Q126 VanDerWaalsContact O-N 3.13Å; L123-Q126 PolarHBondContact O-N 2.84Å; S124-Q126 VanDerWaalsContact C-N 3.28Å; S124-Q126 PolarHBondContact O-N 3.32Å; Q126-L128 VanDerWaalsContact C-N 3.3Å; Q126-L128 PolarHBondContact O-N 2.84Å; Q126-I129 PolarHBondContact O-N 3.26Å; Q126-L130 WeakPolarHBondContact O-CB 3.3Å; Q126-L130 PolarHBondContact O-N 3.09Å
127	N	76.1	Confident	69.1	Low	95 Å²	95	61.2 Å²	61.2	51%	0.508	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-35.7	178.1	-68.8	-0.2	0	0	0	112	L123 S124 L130 L131	L123-N127 WeakPolarHBondContact O-CB 3.14Å; L123-N127 PolarHBondContact O-N 3.48Å; L123-N127 PolarHBondContact O-OD1 2.84Å; S124-N127 PolarHBondContact O-N 3.36Å; S124-N127 VanDerWaalsContact O-N 3.17Å; N127-L130 PolarHBondContact O-N 3.05Å; N127-L131 WeakPolarHBondContact O-CB 3.5Å; N127-L131 PolarHBondContact O-N 3.07Å
128	L	77.8	Confident	71.3	Confident	15 Å²	15	59.6 Å²	59.6	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-71.9	-37.4	178.9	-164.6	65.2	0	0	0	112.1	S124 Q126 L131 L132 V213 A216 I217 L324	S124-L128 WeakPolarHBondContact O-CB 3.25Å; S124-L128 PolarHBondContact O-N 2.8Å; Q126-L128 VanDerWaalsContact C-N 3.3Å; Q126-L128 PolarHBondContact O-N 2.84Å; L128-L131 PolarHBondContact O-N 3.42Å; L128-L132 PolarHBondContact O-N 2.89Å; L128-V213 HydrophobicContact CD1-CG1 3.94Å; L128-V213 HydrophobicContact CG-CG1 4.15Å; L128-A216 HydrophobicContact CD1-CB 4.28Å; L128-A216 HydrophobicContact CD2-CB 4.12Å; L128-I217 HydrophobicContact CB-CG1 4.34Å; L128-I217 HydrophobicContact CD2-CB 3.98Å; L128-I217 HydrophobicContact CD2-CD1 4.48Å; L128-I217 HydrophobicContact CD2-CG1 3.24Å; L128-I217 HydrophobicContact CG-CD1 4.28Å; L128-I217 HydrophobicContact CG-CG1 3.49Å; L128-I217 VanDerWaalsContact CG-CG1 3.49Å; L128-L324 HydrophobicContact CD1-CD1 3.73Å
129	I	82.1	Confident	73.5	Confident	40 Å²	40	55.8 Å²	55.8	21%	0.205	27%	0.272	C	S	.	.	H	α-helix	trans	-67.5	-39.8	172.4	-67.1	164.3	0	0	0	110.9	V52 Y56 Q125 Q126 L131 L132 A133	V52-I129 HydrophobicContact CG1-CG2 4.44Å; Y56-I129 HydrophobicContact CE2-CG2 3.85Å; Q125-I129 HydrophobicContact CG-CD1 4.41Å; Q125-I129 WeakPolarHBondContact O-CD1 3.38Å; Q125-I129 VanDerWaalsContact O-CG1 3.24Å; Q125-I129 WeakPolarHBondContact O-CG1 3.28Å; Q125-I129 PolarHBondContact O-N 3.47Å; Q126-I129 PolarHBondContact O-N 3.26Å; I129-L131 VanDerWaalsContact C-N 3.32Å; I129-L132 PolarHBondContact O-N 2.9Å; I129-A133 PolarHBondContact O-N 3.39Å
130	L	84.2	Confident	76	Confident	56 Å²	56	49.9 Å²	49.9	29%	0.293	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-41.9	174.8	-170.6	100.6	0	0	0	111.1	Q126 N127 A133 F134	Q126-L130 WeakPolarHBondContact O-CB 3.3Å; Q126-L130 PolarHBondContact O-N 3.09Å; N127-L130 PolarHBondContact O-N 3.05Å; L130-A133 PolarHBondContact O-N 3.27Å; L130-F134 WeakPolarHBondContact O-CB 3.47Å; L130-F134 PolarHBondContact O-N 3.49Å
131	L	84.1	Confident	78	Confident	69 Å²	69	45.9 Å²	45.9	36%	0.361	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-43.4	176.6	-176.6	65.9	0	0	0	111.4	N127 L128 I129 F134 I135 V213	N127-L131 WeakPolarHBondContact O-CB 3.5Å; N127-L131 PolarHBondContact O-N 3.07Å; L128-L131 PolarHBondContact O-N 3.42Å; I129-L131 VanDerWaalsContact C-N 3.32Å; L131-F134 PolarHBondContact O-N 2.83Å; L131-I135 HydrophobicContact CD1-CD1 4.26Å; L131-I135 HydrophobicContact CG-CD1 3.88Å; L131-I135 WeakPolarHBondContact O-CD1 3.17Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.27Å; L131-I135 PolarHBondContact O-N 2.85Å; L131-V213 HydrophobicContact CD2-CG2 3.82Å; L131-V213 HydrophobicContact CG-CG2 4.23Å
132	L	87.4	Confident	79.6	Confident	28 Å²	28	49.3 Å²	49.3	15%	0.147	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-51.2	175	-173.3	63.9	0	0	0	111.1	L128 I129 F134 I135 D136 E210 V213 L214 I217	L128-L132 PolarHBondContact O-N 2.89Å; I129-L132 PolarHBondContact O-N 2.9Å; L132-F134 PolarHBondContact O-N 2.9Å; L132-I135 PolarHBondContact O-N 3.39Å; L132-I135 VanDerWaalsContact O-N 3.09Å; L132-D136 VanDerWaalsContact O-CG 3.25Å; L132-D136 PolarHBondContact O-N 2.86Å; L132-E210 HydrophobicContact CD1-CG 4.05Å; L132-V213 HydrophobicContact CB-CG1 3.79Å; L132-V213 HydrophobicContact CD1-CB 4.29Å; L132-V213 HydrophobicContact CD1-CG1 3.98Å; L132-V213 HydrophobicContact CG-CG1 4.41Å; L132-L214 HydrophobicContact CD1-CD2 4.43Å; L132-L214 HydrophobicContact CD1-CG 4.24Å; L132-L214 HydrophobicContact CD2-CD2 3.88Å; L132-I217 HydrophobicContact CD2-CD1 3.98Å
133	A	87.3	Confident	81.1	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.033	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-33.6	178.3	0	0	0	0	0	112.9	N49 V52 I53 I129 L130 L137	N49-A133 WeakPolarHBondContact CB-O 3.49Å; V52-A133 HydrophobicContact CB-CB 4.06Å; V52-A133 HydrophobicContact CG1-CB 3.64Å; I53-A133 HydrophobicContact CG1-CB 4.02Å; I129-A133 PolarHBondContact O-N 3.39Å; L130-A133 PolarHBondContact O-N 3.27Å; A133-L137 WeakPolarHBondContact O-CB 3.4Å; A133-L137 PolarHBondContact O-N 3.01Å
134	F	88.3	Confident	82.6	Confident	106 Å²	106	43.6 Å²	43.6	47%	0.465	22%	0.224	S	C	.	.	H	α-helix	trans	-69.7	-42	175.1	-179.7	-100.6	0	0	0	112.4	L130 L131 L132 L137 L138	L130-F134 WeakPolarHBondContact O-CB 3.47Å; L130-F134 PolarHBondContact O-N 3.49Å; L131-F134 PolarHBondContact O-N 2.83Å; L132-F134 PolarHBondContact O-N 2.9Å; F134-L137 WeakPolarHBondContact O-CB 3.16Å; F134-L137 PolarHBondContact O-N 2.9Å; F134-L138 HydrophobicContact CD1-CD1 4.1Å; F134-L138 HydrophobicContact CE1-CD1 3.63Å; F134-L138 HydrophobicContact CE1-CG 4.19Å; F134-L138 HydrophobicContact CZ-CD1 4.19Å; F134-L138 HydrophobicContact CZ-CD2 4.41Å; F134-L138 HydrophobicContact CZ-CG 4.38Å; F134-L138 WeakPolarHBondContact O-CG 3.47Å; F134-L138 PolarHBondContact O-N 3.31Å
135	I	87.4	Confident	83.7	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-45.5	176.4	-66.3	158.1	0	0	0	110.2	L131 L132 L137 L138 T139 I206 C209 E210 V213	L131-I135 HydrophobicContact CD1-CD1 4.26Å; L131-I135 HydrophobicContact CG-CD1 3.88Å; L131-I135 WeakPolarHBondContact O-CD1 3.17Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.27Å; L131-I135 PolarHBondContact O-N 2.85Å; L132-I135 PolarHBondContact O-N 3.39Å; L132-I135 VanDerWaalsContact O-N 3.09Å; I135-L137 PolarHBondContact O-N 3.02Å; I135-L138 WeakPolarHBondContact O-CA 3.42Å; I135-L138 WeakPolarHBondContact O-CB 3.3Å; I135-L138 PolarHBondContact O-N 3.49Å; I135-T139 PolarHBondContact O-N 2.92Å; I135-T139 PolarHBondContact O-OG1 2.95Å; I135-I206 HydrophobicContact CG2-CG2 3.98Å; I135-C209 HydrophobicContact CD1-CB 4.27Å; I135-C209 WeakPolarHBondContact CD1-SG 3.42Å; I135-C209 HydrophobicContact CG2-CB 4.32Å; I135-E210 HydrophobicContact CG2-CB 4.32Å; I135-V213 HydrophobicContact CD1-CB 4.46Å; I135-V213 HydrophobicContact CD1-CG2 3.63Å
136	D	88	Confident	84.4	Confident	37 Å²	37	45.2 Å²	45.2	20%	0.198	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-35.1	177.5	-62.2	-8	0	0	0	111.1	N49 L132 T139 C140	N49-D136 WeakPolarHBondContact ND2-CB 3.49Å; L132-D136 VanDerWaalsContact O-CG 3.25Å; L132-D136 PolarHBondContact O-N 2.86Å; D136-T139 WeakPolarHBondContact O-CB 3.24Å; D136-T139 PolarHBondContact O-N 3.28Å; D136-C140 PolarHBondContact O-N 3.44Å; D136-C140 PolarHBondContact O-SG 2.91Å
137	L	89.6	Confident	84.9	Confident	35 Å²	35	43.2 Å²	43.2	18%	0.183	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-42.4	172.2	-175.3	69.2	0	0	0	111.5	I46 N49 I53 A133 F134 I135 T139 C140 V141	I46-L137 HydrophobicContact CB-CD1 4.48Å; I46-L137 HydrophobicContact CG1-CD1 4.43Å; I46-L137 HydrophobicContact CG2-CD1 4.3Å; N49-L137 HydrophobicContact CB-CB 4.15Å; N49-L137 HydrophobicContact CB-CD1 4.45Å; I53-L137 HydrophobicContact CD1-CD2 3.9Å; A133-L137 WeakPolarHBondContact O-CB 3.4Å; A133-L137 PolarHBondContact O-N 3.01Å; F134-L137 WeakPolarHBondContact O-CB 3.16Å; F134-L137 PolarHBondContact O-N 2.9Å; I135-L137 PolarHBondContact O-N 3.02Å; L137-T139 VanDerWaalsContact C-N 3.31Å; L137-T139 PolarHBondContact O-N 2.96Å; L137-C140 PolarHBondContact O-N 3.31Å; L137-C140 VanDerWaalsContact O-N 3.16Å; L137-V141 HydrophobicContact CD1-CG2 4.23Å; L137-V141 HydrophobicContact CG-CG2 4.27Å; L137-V141 WeakPolarHBondContact O-CB 3.43Å; L137-V141 VanDerWaalsContact O-CG2 3.24Å; L137-V141 WeakPolarHBondContact O-CG2 3.42Å; L137-V141 PolarHBondContact O-N 3.45Å
138	L	87.1	Confident	85.2	Confident	51 Å²	51	40.1 Å²	40.1	27%	0.267	21%	0.208	S	C	.	.	H	α-helix	trans	-61.5	-40.2	174.8	-68.8	173.1	0	0	0	111.6	F134 I135 C140 V141 F142 I206	F134-L138 HydrophobicContact CD1-CD1 4.1Å; F134-L138 HydrophobicContact CE1-CD1 3.63Å; F134-L138 HydrophobicContact CE1-CG 4.19Å; F134-L138 HydrophobicContact CZ-CD1 4.19Å; F134-L138 HydrophobicContact CZ-CD2 4.41Å; F134-L138 HydrophobicContact CZ-CG 4.38Å; F134-L138 WeakPolarHBondContact O-CG 3.47Å; F134-L138 PolarHBondContact O-N 3.31Å; I135-L138 WeakPolarHBondContact O-CA 3.42Å; I135-L138 WeakPolarHBondContact O-CB 3.3Å; I135-L138 PolarHBondContact O-N 3.49Å; L138-C140 VanDerWaalsContact C-N 3.31Å; L138-C140 PolarHBondContact O-N 2.82Å; L138-V141 PolarHBondContact O-N 3.06Å; L138-F142 HydrophobicContact CB-CD2 4.5Å; L138-F142 HydrophobicContact CD2-CD2 3.95Å; L138-F142 HydrophobicContact CD2-CE2 3.66Å; L138-F142 PolarHBondContact O-N 2.65Å; L138-I206 HydrophobicContact CB-CD1 4.03Å
139	T	86.9	Confident	85.4	Confident	27 Å²	27	42.8 Å²	42.8	17%	0.166	22%	0.217	C	C	.	.	I	π-helix	trans	-56.8	-47.7	172.2	-52.3	0	0	0	0	110.9	I135 D136 L137 V141 I143 L144 I206	I135-T139 PolarHBondContact O-N 2.92Å; I135-T139 PolarHBondContact O-OG1 2.95Å; D136-T139 WeakPolarHBondContact O-CB 3.24Å; D136-T139 PolarHBondContact O-N 3.28Å; L137-T139 VanDerWaalsContact C-N 3.31Å; L137-T139 PolarHBondContact O-N 2.96Å; T139-V141 VanDerWaalsContact C-N 3.32Å; T139-V141 PolarHBondContact O-N 3.17Å; T139-I143 HydrophobicContact CG2-CB 4.25Å; T139-I143 HydrophobicContact CG2-CD1 3.97Å; T139-I143 WeakPolarHBondContact O-CA 3.45Å; T139-I143 WeakPolarHBondContact O-CB 3.3Å; T139-I143 PolarHBondContact O-N 3.38Å; T139-L144 PolarHBondContact O-N 3.44Å; T139-I206 WeakPolarHBondContact OG1-CG2 3.49Å
140	C	88	Confident	85	Confident	10 Å²	10	44 Å²	44	7%	0.068	22%	0.219	C	C	.	.	I	π-helix	trans	-71	-26.5	-177.8	-59.4	0	0	0	0	113.5	C42 I46 D136 L137 L138 L144 P145	C42-C140 PolarHBondContact SG-O 3.21Å; I46-C140 HydrophobicContact CG1-CB 3.76Å; D136-C140 PolarHBondContact O-N 3.44Å; D136-C140 PolarHBondContact O-SG 2.91Å; L137-C140 PolarHBondContact O-N 3.31Å; L137-C140 VanDerWaalsContact O-N 3.16Å; L138-C140 VanDerWaalsContact C-N 3.31Å; L138-C140 PolarHBondContact O-N 2.82Å; C140-L144 HydrophobicContact CB-CD1 4.19Å; C140-P145 VanDerWaalsContact O-CD 3.28Å; C140-P145 WeakPolarHBondContact O-CD 3.4Å
141	V	88.7	Confident	84.4	Confident	69 Å²	69	42.6 Å²	42.6	42%	0.418	21%	0.213	S	C	.	.	I	π-helix	trans	-89.6	-35.6	-177.4	171.8	0	0	0	0	112.6	L137 L138 T139 P145	L137-V141 HydrophobicContact CD1-CG2 4.23Å; L137-V141 HydrophobicContact CG-CG2 4.27Å; L137-V141 WeakPolarHBondContact O-CB 3.43Å; L137-V141 VanDerWaalsContact O-CG2 3.24Å; L137-V141 WeakPolarHBondContact O-CG2 3.42Å; L137-V141 PolarHBondContact O-N 3.45Å; L138-V141 PolarHBondContact O-N 3.06Å; T139-V141 VanDerWaalsContact C-N 3.32Å; T139-V141 PolarHBondContact O-N 3.17Å; V141-P145 WeakPolarHBondContact O-CG 3.27Å
142	F	85.1	Confident	84	Confident	105 Å²	105	41.1 Å²	41.1	46%	0.461	21%	0.211	S	C	.	.	I	π-helix	trans	-108.1	-43.7	-174.8	-67.4	-70.8	0	0	0	113.5	L138 L202	L138-F142 HydrophobicContact CB-CD2 4.5Å; L138-F142 HydrophobicContact CD2-CD2 3.95Å; L138-F142 HydrophobicContact CD2-CE2 3.66Å; L138-F142 PolarHBondContact O-N 2.65Å; F142-L202 HydrophobicContact CB-CD2 3.89Å; F142-L202 HydrophobicContact CG-CD2 4.29Å
143	I	83.9	Confident	83.2	Confident	13 Å²	13	42 Å²	42	7%	0.067	22%	0.216	C	C	.	.	I	π-helix	trans	-82.5	-51.2	-172.3	-58.6	170.2	0	0	0	110.4	T139 W146 D147 R203 I206	T139-I143 HydrophobicContact CG2-CB 4.25Å; T139-I143 HydrophobicContact CG2-CD1 3.97Å; T139-I143 WeakPolarHBondContact O-CA 3.45Å; T139-I143 WeakPolarHBondContact O-CB 3.3Å; T139-I143 PolarHBondContact O-N 3.38Å; I143-W146 WeakPolarHBondContact O-CB 3.4Å; I143-W146 PolarHBondContact O-N 3.48Å; I143-W146 VanDerWaalsContact O-N 3.16Å; I143-D147 PolarHBondContact O-N 3.34Å; I143-R203 HydrophobicContact CD1-CB 4.09Å; I143-R203 HydrophobicContact CD1-CG 4.16Å; I143-R203 HydrophobicContact CG1-CB 4.28Å; I143-R203 HydrophobicContact CG2-CB 4.26Å; I143-R203 HydrophobicContact CG2-CG 3.87Å; I143-I206 HydrophobicContact CD1-CB 3.76Å; I143-I206 HydrophobicContact CD1-CD1 3.72Å; I143-I206 HydrophobicContact CD1-CG1 4.28Å; I143-I206 HydrophobicContact CD1-CG2 3.71Å; I143-I206 HydrophobicContact CG1-CD1 4.21Å
144	L	83.5	Confident	82.2	Confident	24 Å²	24	48.4 Å²	48.4	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-43.1	-176.1	-71.7	-179.8	0	0	0	113.3	I41 C42 T139 C140 W146 D147 I148	I41-L144 HydrophobicContact CG2-CD1 4.33Å; C42-L144 HydrophobicContact CB-CB 4.07Å; C42-L144 HydrophobicContact CB-CD1 3.76Å; T139-L144 PolarHBondContact O-N 3.44Å; C140-L144 HydrophobicContact CB-CD1 4.19Å; L144-W146 VanDerWaalsContact C-N 3.26Å; L144-W146 PolarHBondContact O-N 3.2Å; L144-D147 PolarHBondContact O-N 3.35Å; L144-I148 WeakPolarHBondContact O-CB 3.35Å; L144-I148 WeakPolarHBondContact O-CD1 3.24Å; L144-I148 WeakPolarHBondContact O-CG1 3.16Å; L144-I148 PolarHBondContact O-N 2.98Å
145	P	85.1	Confident	81	Confident	57 Å²	57	43.9 Å²	43.9	37%	0.37	22%	0.222	S	C	.	.	H	α-helix	trans	-63.8	-34.5	176.7	-26.9	40	0	0	0	112.3	C140 V141 Y149	C140-P145 VanDerWaalsContact O-CD 3.28Å; C140-P145 WeakPolarHBondContact O-CD 3.4Å; V141-P145 WeakPolarHBondContact O-CG 3.27Å; P145-Y149 VanDerWaalsContact O-CB 3.27Å; P145-Y149 WeakPolarHBondContact O-CB 3.43Å; P145-Y149 PolarHBondContact O-N 3.36Å
146	W	82.6	Confident	79.9	Confident	36 Å²	36	50.7 Å²	50.7	14%	0.136	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-45	173.8	179.2	-109.2	0	0	0	112.3	I143 L144 Y149 R150 L195 N196 L199	I143-W146 WeakPolarHBondContact O-CB 3.4Å; I143-W146 PolarHBondContact O-N 3.48Å; I143-W146 VanDerWaalsContact O-N 3.16Å; L144-W146 VanDerWaalsContact C-N 3.26Å; L144-W146 PolarHBondContact O-N 3.2Å; W146-Y149 HydrophobicContact CE3-CD1 4.15Å; W146-Y149 AromaticContact CZ3-CD1 3.93Å; W146-Y149 HydrophobicContact CZ3-CD1 3.93Å; W146-Y149 HydrophobicContact CZ3-CE1 4.2Å; W146-Y149 WeakPolarHBondContact O-CB 3.45Å; W146-Y149 PolarHBondContact O-N 2.62Å; W146-R150 PolarHBondContact O-N 2.84Å; W146-L195 HydrophobicContact CE3-CD2 4.05Å; W146-L195 HydrophobicContact CH2-CD2 3.41Å; W146-L195 VanDerWaalsContact CH2-CD2 3.41Å; W146-L195 HydrophobicContact CZ2-CD2 4.14Å; W146-L195 HydrophobicContact CZ3-CD2 3.34Å; W146-N196 HydrophobicContact CZ2-CB 4Å; W146-N196 WeakPolarHBondContact CZ2-OD1 3.39Å; W146-N196 PolarHBondContact NE1-OD1 3.36Å; W146-L199 HydrophobicContact CB-CD1 4.04Å; W146-L199 HydrophobicContact CD2-CB 4.46Å; W146-L199 HydrophobicContact CD2-CD1 3.18Å; W146-L199 HydrophobicContact CD2-CG 4.42Å; W146-L199 HydrophobicContact CE3-CD1 3.34Å; W146-L199 HydrophobicContact CG-CB 4.28Å; W146-L199 HydrophobicContact CG-CD1 3.5Å; W146-L199 VanDerWaalsContact CG-CD1 3.5Å; W146-L199 HydrophobicContact CG-CG 4.46Å; W146-L199 HydrophobicContact CH2-CD1 4.29Å; W146-L199 HydrophobicContact CZ2-CD1 4.16Å; W146-L199 HydrophobicContact CZ3-CD1 3.91Å
147	D	80.5	Confident	78.4	Confident	23 Å²	23	54 Å²	54	12%	0.123	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-39.7	177.6	-76.3	-23.4	0	0	0	111.4	L38 I143 L144 R150 V151 R203	L38-D147 HydrophobicContact CD2-CB 4.05Å; I143-D147 PolarHBondContact O-N 3.34Å; L144-D147 PolarHBondContact O-N 3.35Å; D147-R150 PolarHBondContact O-N 3.13Å; D147-R150 IonicContact OD1-CZ 3.27Å; D147-R150 VanDerWaalsContact OD1-CZ 3.27Å; D147-R150 IonicContact OD1-NH1 3.22Å; D147-R150 PolarHBondContact OD1-NH1 2.94Å; D147-R150 IonicContact OD1-NH2 2.69Å; D147-R150 PolarHBondContact OD1-NH2 3.21Å; D147-V151 VanDerWaalsContact O-CG2 3.29Å; D147-V151 WeakPolarHBondContact O-CG2 3.42Å; D147-V151 PolarHBondContact O-N 3.26Å; D147-R203 IonicContact OD1-NH1 3.86Å
148	I	82.6	Confident	76.7	Confident	30 Å²	30	58.1 Å²	58.1	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-47.2	172.5	-69.1	162	0	0	0	110.2	V35 L38 C42 L144 R150 V151 A152	V35-I148 HydrophobicContact CG1-CG2 4.17Å; L38-I148 HydrophobicContact CB-CD1 4.23Å; L38-I148 HydrophobicContact CB-CG1 3.65Å; L38-I148 HydrophobicContact CD2-CG1 4.22Å; C42-I148 HydrophobicContact CB-CD1 4.29Å; L144-I148 WeakPolarHBondContact O-CB 3.35Å; L144-I148 WeakPolarHBondContact O-CD1 3.24Å; L144-I148 WeakPolarHBondContact O-CG1 3.16Å; L144-I148 PolarHBondContact O-N 2.98Å; I148-R150 VanDerWaalsContact C-N 3.34Å; I148-R150 PolarHBondContact O-N 3.28Å; I148-V151 PolarHBondContact O-N 3.01Å; I148-A152 WeakPolarHBondContact O-CB 3.33Å; I148-A152 PolarHBondContact O-N 3.34Å
149	Y	80.3	Confident	75.1	Confident	71 Å²	71	59.3 Å²	59.3	28%	0.278	29%	0.294	S	S	.	.	H	α-helix	trans	-59.1	-46.3	177	179.3	-100.2	0	0	0	111	P145 W146 V151 A152 N153 F189 Y190	P145-Y149 VanDerWaalsContact O-CB 3.27Å; P145-Y149 WeakPolarHBondContact O-CB 3.43Å; P145-Y149 PolarHBondContact O-N 3.36Å; W146-Y149 HydrophobicContact CE3-CD1 4.15Å; W146-Y149 AromaticContact CZ3-CD1 3.93Å; W146-Y149 HydrophobicContact CZ3-CD1 3.93Å; W146-Y149 HydrophobicContact CZ3-CE1 4.2Å; W146-Y149 WeakPolarHBondContact O-CB 3.45Å; W146-Y149 PolarHBondContact O-N 2.62Å; Y149-V151 PolarHBondContact O-N 3.16Å; Y149-A152 PolarHBondContact O-N 2.82Å; Y149-N153 WeakPolarHBondContact CD2-ND2 3.48Å; Y149-N153 WeakPolarHBondContact CE2-ND2 3.42Å; Y149-N153 VanDerWaalsContact CZ-ND2 3.34Å; Y149-N153 PolarHBondContact O-N 3.22Å; Y149-N153 VanDerWaalsContact O-N 3.12Å; Y149-N153 PolarHBondContact O-ND2 3.15Å; Y149-F189 WeakPolarHBondContact OH-CB 3.2Å; Y149-Y190 HydrophobicContact CD1-CE2 4.08Å; Y149-Y190 WeakPolarHBondContact CD1-OH 3.33Å; Y149-Y190 HydrophobicContact CE1-CD2 4.02Å; Y149-Y190 AromaticContact CE1-CE2 3.21Å; Y149-Y190 HydrophobicContact CE1-CE2 3.21Å; Y149-Y190 AromaticContact CE1-CZ 3.63Å; Y149-Y190 WeakPolarHBondContact CE1-OH 3.32Å; Y149-Y190 AromaticContact CZ-CE2 3.48Å; Y149-Y190 VanDerWaalsContact CZ-CE2 3.48Å; Y149-Y190 PolarHBondContact O-OH 3.16Å; Y149-Y190 VanDerWaalsContact O-OH 3.06Å; Y149-Y190 WeakPolarHBondContact OH-CE2 3.19Å
150	R	74.3	Confident	72.9	Confident	64 Å²	64	62 Å²	62	24%	0.242	31%	0.306	C	S	.	.	H	α-helix	trans	-54.9	-54.7	176.7	-171.3	175.2	62.9	-125.6	-16	111.8	W146 D147 I148 A152 N153 Y154 Y190	W146-R150 PolarHBondContact O-N 2.84Å; D147-R150 PolarHBondContact O-N 3.13Å; D147-R150 IonicContact OD1-CZ 3.27Å; D147-R150 VanDerWaalsContact OD1-CZ 3.27Å; D147-R150 IonicContact OD1-NH1 3.22Å; D147-R150 PolarHBondContact OD1-NH1 2.94Å; D147-R150 IonicContact OD1-NH2 2.69Å; D147-R150 PolarHBondContact OD1-NH2 3.21Å; I148-R150 VanDerWaalsContact C-N 3.34Å; I148-R150 PolarHBondContact O-N 3.28Å; R150-A152 PolarHBondContact O-N 3.37Å; R150-N153 PolarHBondContact O-N 2.96Å; R150-Y154 HydrophobicContact CG-CD2 3.93Å; R150-Y154 HydrophobicContact CG-CE2 3.55Å; R150-Y154 WeakPolarHBondContact O-CD2 3.43Å; R150-Y154 PolarHBondContact O-N 3.48Å; R150-Y190 WeakPolarHBondContact CA-OH 3.31Å
151	V	72.6	Confident	70.4	Confident	27 Å²	27	66.9 Å²	66.9	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-40	-177.8	179.6	0	0	0	0	111.6	S31 V35 D147 I148 Y149 N153 Y154 A155	S31-V151 VanDerWaalsContact OG-CG1 3.23Å; S31-V151 WeakPolarHBondContact OG-CG1 3.48Å; S31-V151 PolarHBondContact OG-O 3.15Å; S31-V151 VanDerWaalsContact OG-O 3.07Å; V35-V151 HydrophobicContact CG2-CB 4.06Å; V35-V151 HydrophobicContact CG2-CG1 3.69Å; D147-V151 VanDerWaalsContact O-CG2 3.29Å; D147-V151 WeakPolarHBondContact O-CG2 3.42Å; D147-V151 PolarHBondContact O-N 3.26Å; I148-V151 PolarHBondContact O-N 3.01Å; Y149-V151 PolarHBondContact O-N 3.16Å; V151-N153 VanDerWaalsContact C-N 3.35Å; V151-N153 PolarHBondContact O-N 3Å; V151-Y154 PolarHBondContact O-N 2.85Å; V151-A155 PolarHBondContact O-N 3.46Å; V151-A155 VanDerWaalsContact O-N 3.15Å
152	A	75.2	Confident	68	Low	39 Å²	39	70.8 Å²	70.8	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-63.7	-37.1	-179.9	0	0	0	0	0	113	V35 I148 Y149 R150 A155 Y156	V35-A152 HydrophobicContact CG2-CB 4.1Å; I148-A152 WeakPolarHBondContact O-CB 3.33Å; I148-A152 PolarHBondContact O-N 3.34Å; Y149-A152 PolarHBondContact O-N 2.82Å; R150-A152 PolarHBondContact O-N 3.37Å; A152-A155 WeakPolarHBondContact O-CB 3.35Å; A152-A155 PolarHBondContact O-N 3.26Å; A152-Y156 PolarHBondContact O-N 3.46Å
153	N	70.5	Confident	65.6	Low	46 Å²	46	71.3 Å²	71.3	25%	0.246	37%	0.369	C	S	.	.	H	α-helix	trans	-79.2	-30.1	178	-67.8	-82.7	0	0	0	112.8	Y149 R150 V151 A155 Y156 D157 Y190	Y149-N153 WeakPolarHBondContact CD2-ND2 3.48Å; Y149-N153 WeakPolarHBondContact CE2-ND2 3.42Å; Y149-N153 VanDerWaalsContact CZ-ND2 3.34Å; Y149-N153 PolarHBondContact O-N 3.22Å; Y149-N153 VanDerWaalsContact O-N 3.12Å; Y149-N153 PolarHBondContact O-ND2 3.15Å; R150-N153 PolarHBondContact O-N 2.96Å; V151-N153 VanDerWaalsContact C-N 3.35Å; V151-N153 PolarHBondContact O-N 3Å; N153-A155 PolarHBondContact O-N 2.81Å; N153-Y156 PolarHBondContact O-N 3.42Å; N153-D157 PolarHBondContact O-N 2.91Å; N153-Y190 HydrophobicContact CB-CD2 4.38Å; N153-Y190 HydrophobicContact CB-CE1 4.29Å; N153-Y190 HydrophobicContact CB-CE2 3.38Å; N153-Y190 WeakPolarHBondContact CB-OH 3.45Å; N153-Y190 WeakPolarHBondContact ND2-CE2 3.29Å; N153-Y190 PolarHBondContact ND2-OH 2.87Å
154	Y	66.6	Low	63.2	Low	138 Å²	138	77.5 Å²	77.5	54%	0.541	40%	0.401	S	S	.	.	H	α-helix	trans	-57.4	-38.3	167.3	-82.4	-67.1	0	0	0	111.3	R150 V151 Y156	R150-Y154 HydrophobicContact CG-CD2 3.93Å; R150-Y154 HydrophobicContact CG-CE2 3.55Å; R150-Y154 WeakPolarHBondContact O-CD2 3.43Å; R150-Y154 PolarHBondContact O-N 3.48Å; V151-Y154 PolarHBondContact O-N 2.85Å; Y154-Y156 VanDerWaalsContact C-N 3.33Å
155	A	63	Low	60.9	Low	11 Å²	11	81.9 Å²	81.9	9%	0.091	43%	0.43	C	S	.	.	H	α-helix	trans	-67.2	-32.8	173.4	0	0	0	0	0	113	F28 V151 A152 N153	F28-A155 HydrophobicContact CD2-CB 4.15Å; F28-A155 HydrophobicContact CE2-CB 4.11Å; F28-A155 WeakPolarHBondContact CE2-O 3.4Å; V151-A155 PolarHBondContact O-N 3.46Å; V151-A155 VanDerWaalsContact O-N 3.15Å; A152-A155 WeakPolarHBondContact O-CB 3.35Å; A152-A155 PolarHBondContact O-N 3.26Å; N153-A155 PolarHBondContact O-N 2.81Å
156	Y	63	Low	58.6	Low	152 Å²	152	86.2 Å²	86.2	60%	0.596	45%	0.449	S	S	*	.	H	α-helix	trans	-74.7	-37.5	-179.7	-167.1	-93.1	0	0	0	112.3	A152 N153 Y154 E158 T159	A152-Y156 PolarHBondContact O-N 3.46Å; N153-Y156 PolarHBondContact O-N 3.42Å; Y154-Y156 VanDerWaalsContact C-N 3.33Å; Y156-E158 VanDerWaalsContact C-N 3.31Å; Y156-E158 PolarHBondContact O-N 3.12Å; Y156-T159 PolarHBondContact O-N 2.84Å; Y156-T159 PolarHBondContact O-OG1 2.73Å
157	D	58.3	Low	56.4	Low	107 Å²	107	89.9 Å²	89.9	57%	0.572	48%	0.477	S	S	*	.	H	α-helix	trans	-67.5	-31	-177.6	-128.9	10.3	0	0	0	112.4	N153 T159 I160	N153-D157 PolarHBondContact O-N 2.91Å; D157-T159 PolarHBondContact O-N 3.47Å; D157-I160 PolarHBondContact O-N 2.92Å
158	E	53.7	Low	54.3	Low	121 Å²	121	96.9 Å²	96.9	57%	0.565	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-13.9	172	-75	-160.7	157.1	0	0	113.8	Y156 I160	Y156-E158 VanDerWaalsContact C-N 3.31Å; Y156-E158 PolarHBondContact O-N 3.12Å; E158-I160 VanDerWaalsContact C-N 3.34Å
159	T	52.1	Low	52.2	Low	76 Å²	76	103.8 Å²	103.8	47%	0.466	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-4.3	179.5	65.4	0	0	0	0	114	F28 Y156 D157	F28-T159 HydrophobicContact CE2-CG2 3.79Å; F28-T159 HydrophobicContact CZ-CG2 4.35Å; Y156-T159 PolarHBondContact O-N 2.84Å; Y156-T159 PolarHBondContact O-OG1 2.73Å; D157-T159 PolarHBondContact O-N 3.47Å
160	I	41.9	Very low	50.1	Low	82 Å²	82	109.2 Å²	109.2	42%	0.421	57%	0.572	S	S	.	*	S	Bend	trans	-94.7	117.1	174	-55.1	176.9	0	0	0	108.3	D157 E158 I162	D157-I160 PolarHBondContact O-N 2.92Å; E158-I160 VanDerWaalsContact C-N 3.34Å; I160-I162 PolarHBondContact O-N 3.45Å; I160-I162 VanDerWaalsContact O-N 3.11Å
161	P	35.5	Very low	48.2	Very low	114 Å²	114	113.4 Å²	113.4	74%	0.74	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-61.4	120.2	176.1	23.9	-30.6	0	0	0	109.4	P163	P161-P163 WeakPolarHBondContact O-CD 3.45Å
162	I	37.8	Very low	46.5	Very low	150 Å²	150	124.4 Å²	124.4	77%	0.769	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-53.9	121.6	170.4	-59.1	167.3	0	0	0	107.3	I160 I164	I160-I162 PolarHBondContact O-N 3.45Å; I160-I162 VanDerWaalsContact O-N 3.11Å; I162-I164 PolarHBondContact O-N 2.92Å
163	P	34.3	Very low	44.7	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-63.6	122.6	170.3	25.3	-28.9	0	0	0	107.7	P161	P161-P163 WeakPolarHBondContact O-CD 3.45Å
164	I	34.5	Very low	42.8	Very low	144 Å²	144	130 Å²	130	74%	0.738	67%	0.671	S	S	*	*			trans	-43.5	131	177.9	-59.4	159.5	0	0	0	109.1	I162 I166	I162-I164 PolarHBondContact O-N 2.92Å; I164-I166 PolarHBondContact O-N 3.39Å
165	P	35.1	Very low	41.6	Very low	115 Å²	115	129.9 Å²	129.9	75%	0.747	68%	0.678	S	S	*	*			trans	-66.6	104.7	177.1	26.7	-30.6	0	0	0	108.5
166	I	36.1	Very low	40.4	Very low	148 Å²	148	134 Å²	134	76%	0.759	71%	0.707	S	S	*	*			trans	-65.3	124.8	169	-57.2	170.7	0	0	0	106.4	I164 I168	I164-I166 PolarHBondContact O-N 3.39Å; I166-I168 PolarHBondContact O-N 2.91Å
167	P	36.6	Very low	39	Very low	113 Å²	113	134.8 Å²	134.8	73%	0.734	72%	0.719	S	S	*	*			trans	-61.5	133.5	179.8	23.2	-30.5	0	0	0	110.3	H169	P167-H169 PolarHBondContact O-N 3.2Å
168	I	36.2	Very low	38	Very low	171 Å²	171	137.4 Å²	137.4	88%	0.877	73%	0.728	S	S	*	*	S	Bend	trans	-72.6	89.5	-172.9	-44.6	159.1	0	0	0	108.2	I166	I166-I168 PolarHBondContact O-N 2.91Å
169	H	38.1	Very low	36.8	Very low	174 Å²	174	138 Å²	138	81%	0.806	74%	0.735	S	S	*	*			trans	-148	122.9	159.3	-117.4	-89.8	0	0	0	107	P167	P167-H169 PolarHBondContact O-N 3.2Å
170	E	36.4	Very low	35.9	Very low	185 Å²	185	142 Å²	142	86%	0.864	75%	0.748	S	S	*	*	S	Bend	trans	75.5	75.4	174.3	-55.6	-178.1	154.1	0	0	117.7
171	M	35.3	Very low	35.4	Very low	153 Å²	153	144.3 Å²	144.3	75%	0.754	77%	0.766	S	S	*	*			trans	-154.1	57.5	146.6	-130.9	177.7	-174.3	0	0	113	G173 I175	M171-G173 VanDerWaalsContact C-N 3.29Å; M171-G173 PolarHBondContact O-N 3.34Å; M171-I175 HydrophobicContact CE-CD1 4.18Å; M171-I175 HydrophobicContact SD-CD1 4.39Å
172	Y	37.3	Very low	35.1	Very low	257 Å²	257	141.3 Å²	141.3	100%	1.008	76%	0.756	S	S	*	*			trans	-82.6	83.6	150.1	-110.5	-91.4	0	0	0	106.5
173	G	35.8	Very low	35	Very low	40 Å²	40	142.9 Å²	142.9	41%	0.412	76%	0.762	S	S	.	*	S	Bend	trans	177.6	96.6	-177.4	0	0	0	0	0	113	M171	M171-G173 VanDerWaalsContact C-N 3.29Å; M171-G173 PolarHBondContact O-N 3.34Å
174	N	32.5	Very low	35.1	Very low	164 Å²	164	142.5 Å²	142.5	88%	0.877	75%	0.754	S	S	*	*			trans	53.3	85	152.5	-63.6	-14.3	0	0	0	117.7
175	I	40.9	Very low	35.3	Very low	135 Å²	135	143.3 Å²	143.3	69%	0.692	76%	0.76	S	S	*	*			trans	-130.1	97.7	146.5	-56.1	-180	0	0	0	109	M171 I177	M171-I175 HydrophobicContact CE-CD1 4.18Å; M171-I175 HydrophobicContact SD-CD1 4.39Å; I175-I177 PolarHBondContact O-N 2.89Å
176	S	36.6	Very low	35.8	Very low	98 Å²	98	144 Å²	144	69%	0.685	76%	0.761	S	S	*	*			trans	-48.6	125.3	163	47.9	0	0	0	0	111.7	Q178	S176-Q178 PolarHBondContact O-N 3.4Å
177	I	35.1	Very low	36	Very low	168 Å²	168	142.5 Å²	142.5	86%	0.862	75%	0.749	S	S	*	*			trans	6	86	140.9	-50.3	172.6	0	0	0	112.7	I175	I175-I177 PolarHBondContact O-N 2.89Å
178	Q	35.6	Very low	36.2	Very low	162 Å²	162	138.5 Å²	138.5	76%	0.757	73%	0.729	S	S	*	*			trans	-107.4	112.3	169.4	-152.2	171	14.1	0	0	108	S176 H180	S176-Q178 PolarHBondContact O-N 3.4Å; Q178-H180 PolarHBondContact O-N 3.49Å
179	N	29.4	Very low	36.6	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	72%	0.715	S	S	*	*			trans	-51.8	101.1	174.3	-79	-28.9	0	0	0	111.3	T181	N179-T181 VanDerWaalsContact C-N 3.32Å
180	H	32.5	Very low	37	Very low	159 Å²	159	133.1 Å²	133.1	74%	0.736	70%	0.695	S	S	*	*			trans	-96.1	65.1	155.9	-88.5	-65.3	0	0	0	109.6	Q178 G182	Q178-H180 PolarHBondContact O-N 3.49Å; H180-G182 PolarHBondContact O-N 3.46Å
181	T	31.7	Very low	37.6	Very low	131 Å²	131	129.5 Å²	129.5	80%	0.804	69%	0.685	S	S	*	*			trans	-84.8	92.3	159.4	45.6	0	0	0	0	107.8	N179	N179-T181 VanDerWaalsContact C-N 3.32Å
182	G	30	Very low	38.6	Very low	51 Å²	51	127.8 Å²	127.8	53%	0.526	68%	0.676	S	S	.	*	S	Bend	trans	159.1	118.7	173.7	0	0	0	0	0	111.6	H180	H180-G182 PolarHBondContact O-N 3.46Å
183	M	34.1	Very low	39.8	Very low	184 Å²	184	120.9 Å²	120.9	91%	0.906	65%	0.648	S	S	*	*	S	Bend	trans	96.3	-1.4	178.3	-59.7	175.4	75.1	0	0	118.9
184	N	38.1	Very low	41.3	Very low	107 Å²	107	126.3 Å²	126.3	57%	0.572	66%	0.661	S	S	*	*			trans	-93	-7.8	-179.8	-74	-21.9	0	0	0	116.3	V186 K187	N184-V186 VanDerWaalsContact C-N 3.31Å; N184-V186 PolarHBondContact O-N 3.36Å; N184-K187 PolarHBondContact O-N 2.99Å
185	D	38.1	Very low	43.1	Very low	162 Å²	162	121.4 Å²	121.4	87%	0.866	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-19.4	-177.7	-86.6	-18.2	0	0	0	114.2
186	V	45.1	Very low	44.4	Very low	128 Å²	128	118.2 Å²	118.2	78%	0.776	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-24.1	175.6	-168.9	0	0	0	0	111.5	N184 G188	N184-V186 VanDerWaalsContact C-N 3.31Å; N184-V186 PolarHBondContact O-N 3.36Å; V186-G188 VanDerWaalsContact C-N 3.26Å; V186-G188 PolarHBondContact O-N 3.42Å
187	K	40.9	Very low	45.8	Very low	118 Å²	118	114.9 Å²	114.9	51%	0.513	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-74.4	-14.3	172.9	-84	-173.5	171.3	-170.3	0	113.1	N184 F189 Y190	N184-K187 PolarHBondContact O-N 2.99Å; K187-F189 VanDerWaalsContact C-N 3.27Å; K187-F189 PolarHBondContact O-N 3.26Å; K187-Y190 PolarHBondContact O-N 2.78Å
188	G	41.2	Very low	47.7	Very low	29 Å²	29	112.1 Å²	112.1	30%	0.299	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-68.1	-14.5	-176	0	0	0	0	0	116.1	V186 T191	V186-G188 VanDerWaalsContact C-N 3.26Å; V186-G188 PolarHBondContact O-N 3.42Å; G188-T191 PolarHBondContact O-OG1 2.88Å
189	F	43.4	Very low	49.6	Very low	136 Å²	136	105.9 Å²	105.9	60%	0.596	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-76.2	-24.3	176.2	-106.5	-85.6	0	0	0	113.3	Y149 K187 T191	Y149-F189 WeakPolarHBondContact OH-CB 3.2Å; K187-F189 VanDerWaalsContact C-N 3.27Å; K187-F189 PolarHBondContact O-N 3.26Å; F189-T191 VanDerWaalsContact C-N 3.32Å
190	Y	46.1	Very low	51.5	Low	95 Å²	95	101.5 Å²	101.5	37%	0.373	53%	0.532	S	S	.	.	S	Bend	trans	-75.9	-18.7	175.7	-95.2	-89.2	0	0	0	114	Y149 R150 N153 K187	Y149-Y190 HydrophobicContact CD1-CE2 4.08Å; Y149-Y190 WeakPolarHBondContact CD1-OH 3.33Å; Y149-Y190 HydrophobicContact CE1-CD2 4.02Å; Y149-Y190 AromaticContact CE1-CE2 3.21Å; Y149-Y190 HydrophobicContact CE1-CE2 3.21Å; Y149-Y190 AromaticContact CE1-CZ 3.63Å; Y149-Y190 WeakPolarHBondContact CE1-OH 3.32Å; Y149-Y190 AromaticContact CZ-CE2 3.48Å; Y149-Y190 VanDerWaalsContact CZ-CE2 3.48Å; Y149-Y190 PolarHBondContact O-OH 3.16Å; Y149-Y190 VanDerWaalsContact O-OH 3.06Å; Y149-Y190 WeakPolarHBondContact OH-CE2 3.19Å; R150-Y190 WeakPolarHBondContact CA-OH 3.31Å; N153-Y190 HydrophobicContact CB-CD2 4.38Å; N153-Y190 HydrophobicContact CB-CE1 4.29Å; N153-Y190 HydrophobicContact CB-CE2 3.38Å; N153-Y190 WeakPolarHBondContact CB-OH 3.45Å; N153-Y190 WeakPolarHBondContact ND2-CE2 3.29Å; N153-Y190 PolarHBondContact ND2-OH 2.87Å; K187-Y190 PolarHBondContact O-N 2.78Å
191	T	49.6	Very low	53.4	Low	109 Å²	109	95.6 Å²	95.6	67%	0.669	51%	0.506	S	S	*	.			trans	-95.2	-5.9	-171.9	43.7	0	0	0	0	114.2	G188 F189 Y193	G188-T191 PolarHBondContact O-OG1 2.88Å; F189-T191 VanDerWaalsContact C-N 3.32Å; T191-Y193 PolarHBondContact O-N 2.99Å
192	H	56.9	Low	55.6	Low	118 Å²	118	92 Å²	92	55%	0.546	48%	0.482	S	S	.	.			trans	-79.1	77.3	170.9	-95.7	-74.6	0	0	0	110.3	K194 L195 N196	H192-K194 PolarHBondContact O-N 3.45Å; H192-L195 HydrophobicContact CB-CB 4.12Å; H192-L195 PolarHBondContact O-N 3.36Å; H192-N196 PolarHBondContact O-N 2.85Å
193	Y	62.9	Low	57.8	Low	112 Å²	112	93.4 Å²	93.4	44%	0.439	47%	0.471	S	S	.	.	H	α-helix	trans	-39.9	-38.4	167.4	177.9	-92.3	0	0	0	111.9	T191 L195 A197 D342	T191-Y193 PolarHBondContact O-N 2.99Å; Y193-L195 PolarHBondContact O-N 3.39Å; Y193-A197 WeakPolarHBondContact O-CB 3.41Å; Y193-A197 PolarHBondContact O-N 3.17Å; Y193-D342 PolarHBondContact OH-OD2 2.92Å; Y193-D342 VanDerWaalsContact OH-OD2 3.11Å
194	K	67.2	Low	59.7	Low	153 Å²	153	87.3 Å²	87.3	67%	0.665	44%	0.442	S	S	*	.	H	α-helix	trans	-59.4	-43.3	176.4	-62.4	-175.4	179.7	-180	0	113.6	H192 I198	H192-K194 PolarHBondContact O-N 3.45Å; K194-I198 WeakPolarHBondContact O-CD1 3.41Å; K194-I198 WeakPolarHBondContact O-CG1 3.23Å; K194-I198 PolarHBondContact O-N 2.99Å
195	L	69.3	Low	61.4	Low	62 Å²	62	84.2 Å²	84.2	33%	0.325	43%	0.425	S	S	.	.	H	α-helix	trans	-74.7	-38.1	-177.1	-172.4	142.4	0	0	0	111.3	W146 H192 Y193 A197 I198 L199	W146-L195 HydrophobicContact CE3-CD2 4.05Å; W146-L195 HydrophobicContact CH2-CD2 3.41Å; W146-L195 VanDerWaalsContact CH2-CD2 3.41Å; W146-L195 HydrophobicContact CZ2-CD2 4.14Å; W146-L195 HydrophobicContact CZ3-CD2 3.34Å; H192-L195 HydrophobicContact CB-CB 4.12Å; H192-L195 PolarHBondContact O-N 3.36Å; Y193-L195 PolarHBondContact O-N 3.39Å; L195-A197 VanDerWaalsContact C-N 3.34Å; L195-A197 PolarHBondContact O-N 3.04Å; L195-I198 PolarHBondContact O-N 3.01Å; L195-L199 HydrophobicContact CD2-CD1 3.41Å; L195-L199 VanDerWaalsContact CD2-CD1 3.41Å; L195-L199 HydrophobicContact CD2-CG 4.24Å; L195-L199 HydrophobicContact CG-CD1 4.2Å; L195-L199 WeakPolarHBondContact O-CB 3.31Å; L195-L199 WeakPolarHBondContact O-CG 3.42Å; L195-L199 PolarHBondContact O-N 3.36Å
196	N	68.3	Low	63.5	Low	67 Å²	67	77 Å²	77	36%	0.358	39%	0.387	S	S	.	.	H	α-helix	trans	-63.4	-40.6	173.2	-171	43.9	0	0	0	111.9	W146 H192 L199 T200	W146-N196 HydrophobicContact CZ2-CB 4Å; W146-N196 WeakPolarHBondContact CZ2-OD1 3.39Å; W146-N196 PolarHBondContact NE1-OD1 3.36Å; H192-N196 PolarHBondContact O-N 2.85Å; N196-L199 PolarHBondContact O-N 2.91Å; N196-T200 VanDerWaalsContact O-CB 3.27Å; N196-T200 WeakPolarHBondContact O-CB 3.49Å; N196-T200 PolarHBondContact O-N 2.96Å; N196-T200 PolarHBondContact O-OG1 3.02Å
197	A	66.7	Low	65	Low	29 Å²	29	75.3 Å²	75.3	24%	0.24	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-45.5	174.5	0	0	0	0	0	111.9	Y193 L195 T200 L201	Y193-A197 WeakPolarHBondContact O-CB 3.41Å; Y193-A197 PolarHBondContact O-N 3.17Å; L195-A197 VanDerWaalsContact C-N 3.34Å; L195-A197 PolarHBondContact O-N 3.04Å; A197-T200 PolarHBondContact O-N 3.41Å; A197-L201 WeakPolarHBondContact O-CB 3.19Å; A197-L201 PolarHBondContact O-N 2.88Å
198	I	74.9	Confident	66.5	Low	109 Å²	109	70.9 Å²	70.9	56%	0.559	36%	0.355	S	S	*	.	H	α-helix	trans	-64.5	-40.4	177.8	-68.2	163	0	0	0	111.8	K194 L195 L201 L202	K194-I198 WeakPolarHBondContact O-CD1 3.41Å; K194-I198 WeakPolarHBondContact O-CG1 3.23Å; K194-I198 PolarHBondContact O-N 2.99Å; L195-I198 PolarHBondContact O-N 3.01Å; I198-L201 WeakPolarHBondContact O-CB 3.31Å; I198-L201 PolarHBondContact O-N 3.09Å; I198-L202 WeakPolarHBondContact O-CB 3.44Å; I198-L202 PolarHBondContact O-N 3.38Å
199	L	74.8	Confident	68.1	Low	32 Å²	32	70.5 Å²	70.5	17%	0.168	35%	0.347	C	S	.	.	H	α-helix	trans	-73.6	-33.6	179	-72.6	175.7	0	0	0	112.3	W146 L195 N196 L202 R203	W146-L199 HydrophobicContact CB-CD1 4.04Å; W146-L199 HydrophobicContact CD2-CB 4.46Å; W146-L199 HydrophobicContact CD2-CD1 3.18Å; W146-L199 HydrophobicContact CD2-CG 4.42Å; W146-L199 HydrophobicContact CE3-CD1 3.34Å; W146-L199 HydrophobicContact CG-CB 4.28Å; W146-L199 HydrophobicContact CG-CD1 3.5Å; W146-L199 VanDerWaalsContact CG-CD1 3.5Å; W146-L199 HydrophobicContact CG-CG 4.46Å; W146-L199 HydrophobicContact CH2-CD1 4.29Å; W146-L199 HydrophobicContact CZ2-CD1 4.16Å; W146-L199 HydrophobicContact CZ3-CD1 3.91Å; L195-L199 HydrophobicContact CD2-CD1 3.41Å; L195-L199 VanDerWaalsContact CD2-CD1 3.41Å; L195-L199 HydrophobicContact CD2-CG 4.24Å; L195-L199 HydrophobicContact CG-CD1 4.2Å; L195-L199 WeakPolarHBondContact O-CB 3.31Å; L195-L199 WeakPolarHBondContact O-CG 3.42Å; L195-L199 PolarHBondContact O-N 3.36Å; N196-L199 PolarHBondContact O-N 2.91Å; L199-L202 HydrophobicContact CD2-CD2 4.18Å; L199-L202 PolarHBondContact O-N 3.22Å; L199-R203 WeakPolarHBondContact O-CB 3.26Å; L199-R203 PolarHBondContact O-N 3.26Å
200	T	69.4	Low	69.7	Low	40 Å²	40	66.2 Å²	66.2	25%	0.245	33%	0.329	C	S	.	.	H	α-helix	trans	-64.8	-41.8	171.6	-59.2	0	0	0	0	111	N196 A197 R203 N204	N196-T200 VanDerWaalsContact O-CB 3.27Å; N196-T200 WeakPolarHBondContact O-CB 3.49Å; N196-T200 PolarHBondContact O-N 2.96Å; N196-T200 PolarHBondContact O-OG1 3.02Å; A197-T200 PolarHBondContact O-N 3.41Å; T200-R203 WeakPolarHBondContact O-CB 3.37Å; T200-R203 PolarHBondContact O-N 3Å; T200-N204 PolarHBondContact O-N 2.89Å; T200-N204 PolarHBondContact O-OD1 3.07Å
201	L	72	Confident	71	Confident	36 Å²	36	63.5 Å²	63.5	19%	0.188	33%	0.33	C	S	.	.	H	α-helix	trans	-56.4	-52.7	170.7	176.9	57.5	0	0	0	111.4	A197 I198 R203 N204 I205 E335 I339	A197-L201 WeakPolarHBondContact O-CB 3.19Å; A197-L201 PolarHBondContact O-N 2.88Å; I198-L201 WeakPolarHBondContact O-CB 3.31Å; I198-L201 PolarHBondContact O-N 3.09Å; L201-R203 PolarHBondContact O-N 2.95Å; L201-N204 PolarHBondContact O-N 3.41Å; L201-N204 VanDerWaalsContact O-N 3.13Å; L201-I205 HydrophobicContact CD1-CD1 3.66Å; L201-I205 HydrophobicContact CD1-CG1 4.02Å; L201-I205 HydrophobicContact CD2-CD1 4.29Å; L201-I205 HydrophobicContact CG-CD1 3.76Å; L201-I205 HydrophobicContact CG-CG1 4.43Å; L201-I205 WeakPolarHBondContact O-CG1 3.32Å; L201-I205 PolarHBondContact O-N 3.47Å; L201-E335 HydrophobicContact CD1-CB 3.46Å; L201-E335 VanDerWaalsContact CD1-CB 3.46Å; L201-E335 HydrophobicContact CD1-CG 4.34Å; L201-I339 HydrophobicContact CB-CD1 3.41Å; L201-I339 VanDerWaalsContact CB-CD1 3.41Å; L201-I339 HydrophobicContact CD1-CD1 3.16Å; L201-I339 HydrophobicContact CD1-CG1 4.37Å; L201-I339 HydrophobicContact CD2-CD1 3.38Å; L201-I339 HydrophobicContact CG-CD1 3.39Å
202	L	77.6	Confident	72.3	Confident	56 Å²	56	59.2 Å²	59.2	29%	0.293	31%	0.305	S	S	.	.	H	α-helix	trans	-58.9	-40.6	-177.5	-176.3	64.9	0	0	0	110.4	F142 I198 L199 I205 I206	F142-L202 HydrophobicContact CB-CD2 3.89Å; F142-L202 HydrophobicContact CG-CD2 4.29Å; I198-L202 WeakPolarHBondContact O-CB 3.44Å; I198-L202 PolarHBondContact O-N 3.38Å; L199-L202 HydrophobicContact CD2-CD2 4.18Å; L199-L202 PolarHBondContact O-N 3.22Å; L202-I205 PolarHBondContact O-N 3.07Å; L202-I206 HydrophobicContact CD1-CD1 3.9Å; L202-I206 HydrophobicContact CD1-CG1 4.26Å; L202-I206 HydrophobicContact CD2-CD1 4.42Å; L202-I206 HydrophobicContact CG-CD1 3.79Å; L202-I206 HydrophobicContact CG-CG1 4.43Å; L202-I206 WeakPolarHBondContact O-CB 3.25Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.49Å; L202-I206 PolarHBondContact O-N 2.92Å
203	R	77.4	Confident	73.3	Confident	80 Å²	80	53.6 Å²	53.6	30%	0.302	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-49.1	174.4	-176.6	178.7	68.2	-179.5	1.9	112.4	I143 D147 L199 T200 L201 I206 F207	I143-R203 HydrophobicContact CD1-CB 4.09Å; I143-R203 HydrophobicContact CD1-CG 4.16Å; I143-R203 HydrophobicContact CG1-CB 4.28Å; I143-R203 HydrophobicContact CG2-CB 4.26Å; I143-R203 HydrophobicContact CG2-CG 3.87Å; D147-R203 IonicContact OD1-NH1 3.86Å; L199-R203 WeakPolarHBondContact O-CB 3.26Å; L199-R203 PolarHBondContact O-N 3.26Å; T200-R203 WeakPolarHBondContact O-CB 3.37Å; T200-R203 PolarHBondContact O-N 3Å; L201-R203 PolarHBondContact O-N 2.95Å; R203-I206 PolarHBondContact O-N 2.94Å; R203-F207 WeakPolarHBondContact O-CB 3.4Å; R203-F207 PolarHBondContact O-N 3.09Å
204	N	73.9	Confident	74.1	Confident	56 Å²	56	51.5 Å²	51.5	30%	0.299	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-43.1	179.8	-67.1	-6.1	0	0	0	111.7	T200 L201 F207 A208 E335	T200-N204 PolarHBondContact O-N 2.89Å; T200-N204 PolarHBondContact O-OD1 3.07Å; L201-N204 PolarHBondContact O-N 3.41Å; L201-N204 VanDerWaalsContact O-N 3.13Å; N204-F207 PolarHBondContact O-N 2.81Å; N204-A208 VanDerWaalsContact O-CB 3.3Å; N204-A208 WeakPolarHBondContact O-CB 3.4Å; N204-A208 PolarHBondContact O-N 2.79Å; N204-E335 HydrophobicContact CB-CG 4.22Å; N204-E335 WeakPolarHBondContact CB-OE2 3.08Å; N204-E335 PolarHBondContact ND2-OE2 2.86Å
205	I	74.6	Confident	74.3	Confident	41 Å²	41	46.6 Å²	46.6	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-47.5	177.6	-68.7	172.7	0	0	0	111	L201 L202 A208 C209	L201-I205 HydrophobicContact CD1-CD1 3.66Å; L201-I205 HydrophobicContact CD1-CG1 4.02Å; L201-I205 HydrophobicContact CD2-CD1 4.29Å; L201-I205 HydrophobicContact CG-CD1 3.76Å; L201-I205 HydrophobicContact CG-CG1 4.43Å; L201-I205 WeakPolarHBondContact O-CG1 3.32Å; L201-I205 PolarHBondContact O-N 3.47Å; L202-I205 PolarHBondContact O-N 3.07Å; I205-A208 PolarHBondContact O-N 3.13Å; I205-C209 WeakPolarHBondContact O-CB 3.27Å; I205-C209 PolarHBondContact O-N 3.37Å
206	I	81.2	Confident	74.5	Confident	11 Å²	11	44.1 Å²	44.1	6%	0.056	25%	0.251	C	S	.	.	H	α-helix	trans	-64.5	-44.3	-178.9	-74	177	0	0	0	110.4	I135 L138 T139 I143 L202 R203 A208 C209 E210	I135-I206 HydrophobicContact CG2-CG2 3.98Å; L138-I206 HydrophobicContact CB-CD1 4.03Å; T139-I206 WeakPolarHBondContact OG1-CG2 3.49Å; I143-I206 HydrophobicContact CD1-CB 3.76Å; I143-I206 HydrophobicContact CD1-CD1 3.72Å; I143-I206 HydrophobicContact CD1-CG1 4.28Å; I143-I206 HydrophobicContact CD1-CG2 3.71Å; I143-I206 HydrophobicContact CG1-CD1 4.21Å; L202-I206 HydrophobicContact CD1-CD1 3.9Å; L202-I206 HydrophobicContact CD1-CG1 4.26Å; L202-I206 HydrophobicContact CD2-CD1 4.42Å; L202-I206 HydrophobicContact CG-CD1 3.79Å; L202-I206 HydrophobicContact CG-CG1 4.43Å; L202-I206 WeakPolarHBondContact O-CB 3.25Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.49Å; L202-I206 PolarHBondContact O-N 2.92Å; R203-I206 PolarHBondContact O-N 2.94Å; I206-A208 PolarHBondContact O-N 2.8Å; I206-C209 WeakPolarHBondContact O-CA 3.28Å; I206-C209 WeakPolarHBondContact O-CB 3.48Å; I206-C209 PolarHBondContact O-N 3.06Å; I206-C209 VanDerWaalsContact O-N 3.11Å; I206-E210 PolarHBondContact O-N 2.78Å
207	F	77.7	Confident	74.8	Confident	92 Å²	92	42 Å²	42	40%	0.404	24%	0.239	S	C	.	.	H	α-helix	trans	-63.3	-41.5	177.9	-168.5	-107.2	0	0	0	112.3	R203 N204 C209 E210 G211 Y362	R203-F207 WeakPolarHBondContact O-CB 3.4Å; R203-F207 PolarHBondContact O-N 3.09Å; N204-F207 PolarHBondContact O-N 2.81Å; F207-C209 VanDerWaalsContact C-N 3.3Å; F207-C209 PolarHBondContact O-N 3.19Å; F207-E210 PolarHBondContact O-N 3.11Å; F207-G211 PolarHBondContact O-N 3.44Å; F207-G211 VanDerWaalsContact O-N 3.08Å; F207-Y362 WeakPolarHBondContact CE1-OH 3.46Å
208	A	70.8	Confident	75	Confident	26 Å²	26	41.4 Å²	41.4	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-37.9	173.2	0	0	0	0	0	111.9	N204 I205 I206 S212 T331	N204-A208 VanDerWaalsContact O-CB 3.3Å; N204-A208 WeakPolarHBondContact O-CB 3.4Å; N204-A208 PolarHBondContact O-N 2.79Å; I205-A208 PolarHBondContact O-N 3.13Å; I206-A208 PolarHBondContact O-N 2.8Å; A208-S212 VanDerWaalsContact O-CB 3.27Å; A208-S212 WeakPolarHBondContact O-CB 3.46Å; A208-S212 PolarHBondContact O-N 3.23Å; A208-S212 PolarHBondContact O-OG 3.38Å; A208-T331 HydrophobicContact CB-CG2 3.92Å
209	C	75.4	Confident	74.9	Confident	21 Å²	21	39.7 Å²	39.7	14%	0.142	22%	0.223	C	C	.	.	H	α-helix	trans	-66.1	-45.4	176.8	-160.1	0	0	0	0	111.6	I135 I205 I206 F207 S212 V213	I135-C209 HydrophobicContact CD1-CB 4.27Å; I135-C209 WeakPolarHBondContact CD1-SG 3.42Å; I135-C209 HydrophobicContact CG2-CB 4.32Å; I205-C209 WeakPolarHBondContact O-CB 3.27Å; I205-C209 PolarHBondContact O-N 3.37Å; I206-C209 WeakPolarHBondContact O-CA 3.28Å; I206-C209 WeakPolarHBondContact O-CB 3.48Å; I206-C209 PolarHBondContact O-N 3.06Å; I206-C209 VanDerWaalsContact O-N 3.11Å; F207-C209 VanDerWaalsContact C-N 3.3Å; F207-C209 PolarHBondContact O-N 3.19Å; C209-S212 PolarHBondContact O-N 3.42Å; C209-V213 WeakPolarHBondContact O-CG2 3.4Å; C209-V213 PolarHBondContact O-N 3.07Å
210	E	77.8	Confident	74.7	Confident	45 Å²	45	38.5 Å²	38.5	21%	0.21	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-52.3	176.8	-170.8	-173.6	154.3	0	0	111.1	L132 I135 I206 F207 S212 V213 L214	L132-E210 HydrophobicContact CD1-CG 4.05Å; I135-E210 HydrophobicContact CG2-CB 4.32Å; I206-E210 PolarHBondContact O-N 2.78Å; F207-E210 PolarHBondContact O-N 3.11Å; E210-S212 VanDerWaalsContact C-N 3.31Å; E210-S212 PolarHBondContact O-N 2.82Å; E210-V213 PolarHBondContact O-N 2.8Å; E210-L214 HydrophobicContact CG-CD1 4.36Å; E210-L214 WeakPolarHBondContact O-CG 3.34Å; E210-L214 PolarHBondContact O-N 3.36Å
211	G	72.4	Confident	74.6	Confident	39 Å²	39	39.4 Å²	39.4	40%	0.402	22%	0.216	S	C	.	.	H	α-helix	trans	-59.9	-39.6	176.8	0	0	0	0	0	113.1	F207 L214 A215	F207-G211 PolarHBondContact O-N 3.44Å; F207-G211 VanDerWaalsContact O-N 3.08Å; G211-L214 PolarHBondContact O-N 3.29Å; G211-A215 WeakPolarHBondContact O-CB 3.48Å; G211-A215 PolarHBondContact O-N 2.9Å
212	S	76.4	Confident	74.4	Confident	19 Å²	19	38.3 Å²	38.3	13%	0.133	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-42.4	178.2	-61	0	0	0	0	112.5	A208 C209 E210 A215 A216 L324 V327	A208-S212 VanDerWaalsContact O-CB 3.27Å; A208-S212 WeakPolarHBondContact O-CB 3.46Å; A208-S212 PolarHBondContact O-N 3.23Å; A208-S212 PolarHBondContact O-OG 3.38Å; C209-S212 PolarHBondContact O-N 3.42Å; E210-S212 VanDerWaalsContact C-N 3.31Å; E210-S212 PolarHBondContact O-N 2.82Å; S212-A215 PolarHBondContact O-N 2.86Å; S212-A216 WeakPolarHBondContact O-CB 3.23Å; S212-A216 PolarHBondContact O-N 2.73Å; S212-L324 WeakPolarHBondContact O-CD2 3.39Å; S212-V327 WeakPolarHBondContact OG-CG1 3.47Å
213	V	79.5	Confident	73.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.7	-42.8	176.8	171.9	0	0	0	0	110.7	L128 L131 L132 I135 C209 E210 A215 A216 I217 L324	L128-V213 HydrophobicContact CD1-CG1 3.94Å; L128-V213 HydrophobicContact CG-CG1 4.15Å; L131-V213 HydrophobicContact CD2-CG2 3.82Å; L131-V213 HydrophobicContact CG-CG2 4.23Å; L132-V213 HydrophobicContact CB-CG1 3.79Å; L132-V213 HydrophobicContact CD1-CB 4.29Å; L132-V213 HydrophobicContact CD1-CG1 3.98Å; L132-V213 HydrophobicContact CG-CG1 4.41Å; I135-V213 HydrophobicContact CD1-CB 4.46Å; I135-V213 HydrophobicContact CD1-CG2 3.63Å; C209-V213 WeakPolarHBondContact O-CG2 3.4Å; C209-V213 PolarHBondContact O-N 3.07Å; E210-V213 PolarHBondContact O-N 2.8Å; V213-A215 PolarHBondContact O-N 3.34Å; V213-A216 PolarHBondContact O-N 3.31Å; V213-I217 HydrophobicContact CG1-CD1 4.16Å; V213-I217 VanDerWaalsContact O-CG1 3.31Å; V213-I217 WeakPolarHBondContact O-CG1 3.24Å; V213-I217 PolarHBondContact O-N 3.49Å; V213-L324 HydrophobicContact CG2-CD2 4.35Å
214	L	78.9	Confident	73.2	Confident	67 Å²	67	36.2 Å²	36.2	35%	0.351	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-45.5	173.6	-74	169.9	0	0	0	112.1	L132 E210 G211 A216 I217 A218	L132-L214 HydrophobicContact CD1-CD2 4.43Å; L132-L214 HydrophobicContact CD1-CG 4.24Å; L132-L214 HydrophobicContact CD2-CD2 3.88Å; E210-L214 HydrophobicContact CG-CD1 4.36Å; E210-L214 WeakPolarHBondContact O-CG 3.34Å; E210-L214 PolarHBondContact O-N 3.36Å; G211-L214 PolarHBondContact O-N 3.29Å; L214-A216 VanDerWaalsContact C-N 3.33Å; L214-A216 PolarHBondContact O-N 2.95Å; L214-I217 PolarHBondContact O-N 2.87Å; L214-A218 PolarHBondContact O-N 2.98Å
215	A	71.9	Confident	72.8	Confident	51 Å²	51	37.6 Å²	37.6	42%	0.421	21%	0.211	S	C	.	.	H	α-helix	trans	-61.8	-40.9	176	0	0	0	0	0	111.9	G211 S212 V213 A218 F219	G211-A215 WeakPolarHBondContact O-CB 3.48Å; G211-A215 PolarHBondContact O-N 2.9Å; S212-A215 PolarHBondContact O-N 2.86Å; V213-A215 PolarHBondContact O-N 3.34Å; A215-A218 PolarHBondContact O-N 3.26Å; A215-F219 WeakPolarHBondContact O-CB 3.28Å; A215-F219 PolarHBondContact O-N 2.87Å
216	A	73.4	Confident	72.2	Confident	9 Å²	9	37 Å²	37	7%	0.074	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-37.4	175.9	0	0	0	0	0	112.7	L128 S212 V213 L214 A218 F219 E220 I320 L324	L128-A216 HydrophobicContact CD1-CB 4.28Å; L128-A216 HydrophobicContact CD2-CB 4.12Å; S212-A216 WeakPolarHBondContact O-CB 3.23Å; S212-A216 PolarHBondContact O-N 2.73Å; V213-A216 PolarHBondContact O-N 3.31Å; L214-A216 VanDerWaalsContact C-N 3.33Å; L214-A216 PolarHBondContact O-N 2.95Å; A216-A218 VanDerWaalsContact C-N 3.34Å; A216-F219 PolarHBondContact O-N 3.21Å; A216-E220 WeakPolarHBondContact O-CB 3.39Å; A216-E220 PolarHBondContact O-N 2.96Å; A216-I320 HydrophobicContact CB-CG2 3.96Å; A216-L324 HydrophobicContact CB-CD1 3.61Å; A216-L324 HydrophobicContact CB-CD2 3.53Å; A216-L324 HydrophobicContact CB-CG 3.62Å
217	I	75	Confident	71.1	Confident	22 Å²	22	40.2 Å²	40.2	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-47.3	174.3	-66.6	164.9	0	0	0	109.1	L128 L132 V213 L214 F219 E220 R221	L128-I217 HydrophobicContact CB-CG1 4.34Å; L128-I217 HydrophobicContact CD2-CB 3.98Å; L128-I217 HydrophobicContact CD2-CD1 4.48Å; L128-I217 HydrophobicContact CD2-CG1 3.24Å; L128-I217 HydrophobicContact CG-CD1 4.28Å; L128-I217 HydrophobicContact CG-CG1 3.49Å; L128-I217 VanDerWaalsContact CG-CG1 3.49Å; L132-I217 HydrophobicContact CD2-CD1 3.98Å; V213-I217 HydrophobicContact CG1-CD1 4.16Å; V213-I217 VanDerWaalsContact O-CG1 3.31Å; V213-I217 WeakPolarHBondContact O-CG1 3.24Å; V213-I217 PolarHBondContact O-N 3.49Å; L214-I217 PolarHBondContact O-N 2.87Å; I217-F219 VanDerWaalsContact C-N 3.34Å; I217-F219 PolarHBondContact O-N 3.18Å; I217-E220 PolarHBondContact O-N 3.43Å; I217-R221 VanDerWaalsContact O-CG 3.24Å; I217-R221 WeakPolarHBondContact O-CG 3.46Å; I217-R221 PolarHBondContact O-N 3.02Å
218	A	70.6	Confident	70.1	Confident	18 Å²	18	45.5 Å²	45.5	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-43.6	178.7	0	0	0	0	0	111.7	L214 A215 A216 R221 Y222	L214-A218 PolarHBondContact O-N 2.98Å; A215-A218 PolarHBondContact O-N 3.26Å; A216-A218 VanDerWaalsContact C-N 3.34Å; A218-R221 WeakPolarHBondContact O-CB 3.35Å; A218-R221 PolarHBondContact O-N 3.29Å; A218-Y222 WeakPolarHBondContact O-CB 3.33Å; A218-Y222 PolarHBondContact O-N 3.41Å
219	F	71.3	Confident	69.2	Low	72 Å²	72	46.8 Å²	46.8	32%	0.316	26%	0.256	S	S	.	.	H	α-helix	trans	-66.7	-42.5	177.7	-174.2	-95	0	0	0	112.6	A215 A216 I217 R221 Y222 M223 I320	A215-F219 WeakPolarHBondContact O-CB 3.28Å; A215-F219 PolarHBondContact O-N 2.87Å; A216-F219 PolarHBondContact O-N 3.21Å; I217-F219 VanDerWaalsContact C-N 3.34Å; I217-F219 PolarHBondContact O-N 3.18Å; F219-R221 VanDerWaalsContact C-N 3.29Å; F219-R221 PolarHBondContact O-N 2.71Å; F219-Y222 WeakPolarHBondContact O-CB 3.35Å; F219-Y222 PolarHBondContact O-N 2.82Å; F219-M223 HydrophobicContact CD1-CG 3.97Å; F219-M223 HydrophobicContact CE1-CG 3.55Å; F219-M223 HydrophobicContact CE1-SD 4.28Å; F219-M223 HydrophobicContact CE2-CG 4.44Å; F219-M223 HydrophobicContact CZ-CG 3.82Å; F219-M223 HydrophobicContact CZ-SD 4Å; F219-M223 WeakPolarHBondContact O-CG 3.43Å; F219-M223 PolarHBondContact O-N 3.34Å; F219-I320 HydrophobicContact CD1-CD1 4.14Å; F219-I320 HydrophobicContact CD1-CG1 3.82Å; F219-I320 HydrophobicContact CE1-CG1 4.03Å
220	E	71.4	Confident	68	Low	7 Å²	7	48.2 Å²	48.2	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-58.1	-44.5	174.4	-170.2	-178	-174.6	0	0	110.5	S124 Q125 A216 I217 M223 I224 I320	S124-E220 VanDerWaalsContact CB-OE1 3.27Å; S124-E220 WeakPolarHBondContact CB-OE1 3.35Å; S124-E220 PolarHBondContact OG-OE1 3.21Å; Q125-E220 WeakPolarHBondContact CA-OE2 3.07Å; Q125-E220 PolarHBondContact N-OE1 3.26Å; A216-E220 WeakPolarHBondContact O-CB 3.39Å; A216-E220 PolarHBondContact O-N 2.96Å; I217-E220 PolarHBondContact O-N 3.43Å; E220-M223 PolarHBondContact O-N 3.42Å; E220-I224 HydrophobicContact CG-CD1 3.92Å; E220-I224 VanDerWaalsContact O-CG1 3.25Å; E220-I224 WeakPolarHBondContact O-CG1 3.47Å; E220-I224 PolarHBondContact O-N 3.24Å; E220-I320 HydrophobicContact CB-CD1 3.91Å; E220-I320 HydrophobicContact CG-CD1 4.05Å
221	R	68.5	Low	66.6	Low	59 Å²	59	46.9 Å²	46.9	22%	0.223	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-44.9	175.6	-70.9	-63.8	-167.9	-157.9	-3.4	112.5	Q125 I217 A218 F219 I224 L225	Q125-R221 VanDerWaalsContact CD-NH1 3.26Å; Q125-R221 VanDerWaalsContact OE1-CZ 3.27Å; I217-R221 VanDerWaalsContact O-CG 3.24Å; I217-R221 WeakPolarHBondContact O-CG 3.46Å; I217-R221 PolarHBondContact O-N 3.02Å; A218-R221 WeakPolarHBondContact O-CB 3.35Å; A218-R221 PolarHBondContact O-N 3.29Å; F219-R221 VanDerWaalsContact C-N 3.29Å; F219-R221 PolarHBondContact O-N 2.71Å; R221-I224 PolarHBondContact O-N 2.92Å; R221-L225 WeakPolarHBondContact O-CB 3.3Å; R221-L225 WeakPolarHBondContact O-CG 3.47Å; R221-L225 PolarHBondContact O-N 3.19Å
222	Y	66.4	Low	65.4	Low	13 Å²	13	53.3 Å²	53.3	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-46.7	177.2	178.4	-97.5	0	0	0	111.6	A218 F219 I224 L225 V226 I230 L376 R379 I380	A218-Y222 WeakPolarHBondContact O-CB 3.33Å; A218-Y222 PolarHBondContact O-N 3.41Å; F219-Y222 WeakPolarHBondContact O-CB 3.35Å; F219-Y222 PolarHBondContact O-N 2.82Å; Y222-I224 VanDerWaalsContact C-N 3.32Å; Y222-I224 PolarHBondContact O-N 3.35Å; Y222-L225 PolarHBondContact O-N 2.85Å; Y222-V226 HydrophobicContact CD2-CB 4.14Å; Y222-V226 HydrophobicContact CD2-CG2 3.84Å; Y222-V226 HydrophobicContact CE2-CB 3.81Å; Y222-V226 HydrophobicContact CE2-CG1 3.92Å; Y222-V226 HydrophobicContact CE2-CG2 3.78Å; Y222-V226 PolarHBondContact O-N 3.12Å; Y222-I230 HydrophobicContact CE1-CD1 4.09Å; Y222-L376 HydrophobicContact CD1-CD2 4.41Å; Y222-L376 HydrophobicContact CD2-CB 4.45Å; Y222-L376 HydrophobicContact CD2-CD2 3.75Å; Y222-L376 HydrophobicContact CE1-CD2 4.25Å; Y222-L376 HydrophobicContact CE2-CD2 3.56Å; Y222-L376 HydrophobicContact CG-CD2 4.17Å; Y222-R379 PolarHBondContact OH-NH1 3.35Å; Y222-I380 HydrophobicContact CD2-CD1 4.05Å; Y222-I380 HydrophobicContact CD2-CG1 3.89Å
223	M	65.2	Low	64.1	Low	19 Å²	19	56.6 Å²	56.6	9%	0.094	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-36.9	178.8	-75	-60.5	-62.4	0	0	112.9	F219 E220 I230 C231	F219-M223 HydrophobicContact CD1-CG 3.97Å; F219-M223 HydrophobicContact CE1-CG 3.55Å; F219-M223 HydrophobicContact CE1-SD 4.28Å; F219-M223 HydrophobicContact CE2-CG 4.44Å; F219-M223 HydrophobicContact CZ-CG 3.82Å; F219-M223 HydrophobicContact CZ-SD 4Å; F219-M223 WeakPolarHBondContact O-CG 3.43Å; F219-M223 PolarHBondContact O-N 3.34Å; E220-M223 PolarHBondContact O-N 3.42Å; M223-I230 HydrophobicContact SD-CB 4.41Å; M223-C231 HydrophobicContact CE-CB 3.75Å
224	I	65	Low	62.8	Low	73 Å²	73	61.5 Å²	61.5	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-71.3	-38.6	177.5	-68.5	167.6	0	0	0	111.5	E220 R221 Y222	E220-I224 HydrophobicContact CG-CD1 3.92Å; E220-I224 VanDerWaalsContact O-CG1 3.25Å; E220-I224 WeakPolarHBondContact O-CG1 3.47Å; E220-I224 PolarHBondContact O-N 3.24Å; R221-I224 PolarHBondContact O-N 2.92Å; Y222-I224 VanDerWaalsContact C-N 3.32Å; Y222-I224 PolarHBondContact O-N 3.35Å
225	L	65.1	Low	61.3	Low	86 Å²	86	59.7 Å²	59.7	45%	0.45	32%	0.315	S	S	.	.	H	α-helix	trans	-91.3	-39.2	-170.2	-69.9	172.8	0	0	0	114.6	R221 Y222 I380	R221-L225 WeakPolarHBondContact O-CB 3.3Å; R221-L225 WeakPolarHBondContact O-CG 3.47Å; R221-L225 PolarHBondContact O-N 3.19Å; Y222-L225 PolarHBondContact O-N 2.85Å; L225-I380 HydrophobicContact CD1-CG2 3.83Å
226	V	62.4	Low	59.7	Low	28 Å²	28	60 Å²	60	17%	0.17	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-49.6	-165.7	-178.4	0	0	0	0	112.6	Y222 I380	Y222-V226 HydrophobicContact CD2-CB 4.14Å; Y222-V226 HydrophobicContact CD2-CG2 3.84Å; Y222-V226 HydrophobicContact CE2-CB 3.81Å; Y222-V226 HydrophobicContact CE2-CG1 3.92Å; Y222-V226 HydrophobicContact CE2-CG2 3.78Å; Y222-V226 PolarHBondContact O-N 3.12Å; V226-I380 HydrophobicContact CG2-CB 4.41Å; V226-I380 HydrophobicContact CG2-CG1 3.67Å
227	Q	58.8	Low	58.1	Low	79 Å²	79	66.3 Å²	66.3	37%	0.369	35%	0.345	S	S	.	.			trans	-151.5	103.6	-169.2	-116	164.5	-17.8	0	0	113.6	G229 I230	Q227-G229 PolarHBondContact O-N 3.47Å; Q227-I230 HydrophobicContact CB-CD1 3.78Å; Q227-I230 HydrophobicContact CB-CG1 4.1Å; Q227-I230 HydrophobicContact CG-CD1 4.45Å
228	R	56.9	Low	56.2	Low	202 Å²	202	69.7 Å²	69.7	76%	0.762	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.5	169.1	-75.9	-178.4	177.1	-179.7	-1.8	113.8
229	G	50.3	Low	54.5	Low	53 Å²	53	76.9 Å²	76.9	55%	0.546	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-21.1	-169	0	0	0	0	0	116.4	Q227 C231 K232	Q227-G229 PolarHBondContact O-N 3.47Å; G229-C231 VanDerWaalsContact C-N 3.33Å; G229-C231 PolarHBondContact O-N 2.96Å; G229-K232 PolarHBondContact O-N 3.37Å
230	I	51.7	Low	52.8	Low	52 Å²	52	80.1 Å²	80.1	27%	0.267	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-27.4	-173.2	-60.2	165.5	0	0	0	111.7	Y222 M223 Q227 K232 S233 I234	Y222-I230 HydrophobicContact CE1-CD1 4.09Å; M223-I230 HydrophobicContact SD-CB 4.41Å; Q227-I230 HydrophobicContact CB-CD1 3.78Å; Q227-I230 HydrophobicContact CB-CG1 4.1Å; Q227-I230 HydrophobicContact CG-CD1 4.45Å; I230-K232 PolarHBondContact O-N 3.22Å; I230-S233 PolarHBondContact O-N 3.47Å; I230-I234 HydrophobicContact CG2-CD1 3.82Å; I230-I234 PolarHBondContact O-N 2.97Å
231	C	47.9	Very low	51.1	Low	17 Å²	17	86.1 Å²	86.1	12%	0.115	46%	0.462	C	S	.	.	H	α-helix	trans	-60	-23.1	176.8	-160.9	0	0	0	0	112.6	M223 G229 C235	M223-C231 HydrophobicContact CE-CB 3.75Å; G229-C231 VanDerWaalsContact C-N 3.33Å; G229-C231 PolarHBondContact O-N 2.96Å; C231-C235 WeakPolarHBondContact O-CB 3.47Å; C231-C235 PolarHBondContact O-N 2.91Å; C231-C235 VanDerWaalsContact SG-SG 3.6Å
232	K	47	Very low	49.6	Very low	174 Å²	174	91 Å²	91	76%	0.757	49%	0.491	S	S	*	.	H	α-helix	trans	-77.3	-21.9	-177.4	-120.5	-174.3	-177.7	-170.5	0	114	G229 I230 C236	G229-K232 PolarHBondContact O-N 3.37Å; I230-K232 PolarHBondContact O-N 3.22Å; K232-C236 WeakPolarHBondContact O-CB 3.13Å
233	S	48.7	Very low	48	Very low	88 Å²	88	98.9 Å²	98.9	62%	0.615	53%	0.528	S	S	*	.	H	α-helix	trans	-103.5	-29.5	179.5	82.4	0	0	0	0	113.6	I230	I230-S233 PolarHBondContact O-N 3.47Å
234	I	52	Low	46.4	Very low	103 Å²	103	105.6 Å²	105.6	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-95	-37.6	-176.8	-63.2	173	0	0	0	111.7	I230 M323	I230-I234 HydrophobicContact CG2-CD1 3.82Å; I230-I234 PolarHBondContact O-N 2.97Å; I234-M323 HydrophobicContact CG2-CE 4.29Å
235	C	47.3	Very low	44.9	Very low	29 Å²	29	109.7 Å²	109.7	20%	0.196	59%	0.587	C	S	.	*	S	Bend	trans	-96.7	-5.9	-176.3	-47.1	0	0	0	0	113.4	C231 C314 C319	C231-C235 WeakPolarHBondContact O-CB 3.47Å; C231-C235 PolarHBondContact O-N 2.91Å; C231-C235 VanDerWaalsContact SG-SG 3.6Å; C235-C314 WeakPolarHBondContact CB-SG 3.33Å; C235-C314 PolarHBondContact O-SG 3Å; C235-C319 HydrophobicContact CB-CB 3.71Å; C235-C319 WeakPolarHBondContact CB-SG 3.4Å; C235-C319 WeakPolarHBondContact SG-CB 2.92Å; C235-C319 CovalentContact SG-SG 2.04Å; C235-C319 PolarHBondContact SG-SG 2.91Å
236	C	39.2	Very low	43.6	Very low	56 Å²	56	115 Å²	115	38%	0.378	61%	0.606	S	S	.	*			trans	-112.5	40.6	176.7	-59.7	0	0	0	0	111.3	K232 P238 C314	K232-C236 WeakPolarHBondContact O-CB 3.13Å; C236-P238 WeakPolarHBondContact O-CD 3.35Å; C236-P238 VanDerWaalsContact O-N 3.16Å; C236-C314 WeakPolarHBondContact SG-CB 3.46Å
237	L	40.4	Very low	42.2	Very low	142 Å²	142	121 Å²	121	74%	0.743	64%	0.638	S	S	*	*			trans	-65.9	112.9	163.4	-146.7	79.1	0	0	0	106.2	L239	L237-L239 PolarHBondContact O-N 3.02Å
238	P	33.7	Very low	41.3	Very low	93 Å²	93	125.9 Å²	125.9	60%	0.604	66%	0.662	S	S	*	*			trans	-69.9	107	179.6	29	-29.5	0	0	0	106.8	C236 N240	C236-P238 WeakPolarHBondContact O-CD 3.35Å; C236-P238 VanDerWaalsContact O-N 3.16Å; P238-N240 HydrophobicContact CB-CB 4.36Å; P238-N240 PolarHBondContact O-N 3.3Å
239	L	36.1	Very low	40.2	Very low	170 Å²	170	124.3 Å²	124.3	89%	0.89	67%	0.669	S	S	*	*			trans	-69.6	68.2	166.6	-153.8	87.4	0	0	0	107.9	L237	L237-L239 PolarHBondContact O-N 3.02Å
240	N	35.5	Very low	39.4	Very low	139 Å²	139	125.1 Å²	125.1	74%	0.743	68%	0.677	S	S	*	*			trans	-131.5	19	-175.3	-104.5	8	0	0	0	112.6	P238	P238-N240 HydrophobicContact CB-CB 4.36Å; P238-N240 PolarHBondContact O-N 3.3Å
241	T	34.8	Very low	38.5	Very low	133 Å²	133	132.2 Å²	132.2	82%	0.816	71%	0.706	S	S	*	*	S	Bend	trans	-115.7	20.7	-175.2	-11.5	0	0	0	0	114.7
242	I	36.7	Very low	37.9	Very low	163 Å²	163	137.4 Å²	137.4	84%	0.836	74%	0.738	S	S	*	*	S	Bend	trans	-127.3	-14.3	-178.8	-59.3	-178.2	0	0	0	114.5
243	E	34.2	Very low	37.1	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	74%	0.742	S	S	*	*	S	Bend	trans	-121.4	93.3	174.1	-81.1	-175	141.4	0	0	110.6
244	N	31.7	Very low	36.4	Very low	160 Å²	160	140.4 Å²	140.4	86%	0.856	75%	0.751	S	S	*	*			trans	162.4	78.5	147.2	-82.6	-27.2	0	0	0	109.6
245	N	32.7	Very low	35.3	Very low	159 Å²	159	140.8 Å²	140.8	85%	0.85	76%	0.763	S	S	*	*			trans	-144.2	65.4	160.1	-118.8	-8.2	0	0	0	109.7
246	K	38.3	Very low	34.8	Very low	198 Å²	198	146.2 Å²	146.2	86%	0.861	80%	0.795	S	S	*	*	S	Bend	trans	-118.5	121.7	153.5	-75.3	-176.4	178	179.1	0	105.2
247	N	33.1	Very low	34.3	Very low	154 Å²	154	152 Å²	152	82%	0.824	81%	0.814	S	S	*	*			trans	85.7	86.3	-175	-55.8	-13.5	0	0	0	115.2
248	M	38.8	Very low	33.8	Very low	180 Å²	180	152.4 Å²	152.4	89%	0.887	82%	0.822	S	S	*	*				-164.4	117	121.8	-98.3	-61	175.1	0	0	108.3
249	N	34	Very low	33.5	Very low	170 Å²	170	152.3 Å²	152.3	91%	0.909	82%	0.823	S	S	*	*			trans	-58.2	140.6	169.4	-78.5	-28.3	0	0	0	110.3
250	G	32.6	Very low	33.3	Very low	69 Å²	69	149.2 Å²	149.2	71%	0.711	82%	0.816	S	S	*	*			trans	105.3	110	151.8	0	0	0	0	0	116.3
251	K	34.6	Very low	33.1	Very low	201 Å²	201	150.8 Å²	150.8	87%	0.874	82%	0.824	S	S	*	*			trans	80.1	100.4	144	-73.1	-179.2	176.2	177.8	0	119.1
252	T	33.6	Very low	32.9	Very low	127 Å²	127	154.9 Å²	154.9	78%	0.779	83%	0.831	S	S	*	*				71.6	103.3	129.3	32.1	0	0	0	0	120.1
253	M	31	Very low	32.5	Very low	171 Å²	171	155.7 Å²	155.7	84%	0.842	83%	0.831	S	S	*	*			trans	20.4	120.6	130.7	-78.1	170.3	125.4	0	0	117.8
254	N	34.2	Very low	32.3	Very low	153 Å²	153	157.6 Å²	157.6	82%	0.818	84%	0.836	S	S	*	*				-165	132.1	108.2	-89.8	-24.9	0	0	0	112.1
255	S	29.9	Very low	32.2	Very low	111 Å²	111	153.5 Å²	153.5	78%	0.776	83%	0.832	S	S	*	*			trans	-62.5	125.4	179.1	55.6	0	0	0	0	112.4
256	V	35.2	Very low	32	Very low	143 Å²	143	152.9 Å²	152.9	87%	0.867	83%	0.834	S	S	*	*			trans	-106.8	103	164.2	-179.3	0	0	0	0	108.9
257	K	29	Very low	31.5	Very low	177 Å²	177	148.9 Å²	148.9	77%	0.77	83%	0.831	S	S	*	*			trans	-48.1	130.8	170.9	-94	172.3	169.4	173	0	111.9	S259	K257-S259 PolarHBondContact O-N 3.24Å
258	V	29.8	Very low	31.4	Very low	151 Å²	151	145.8 Å²	145.8	92%	0.915	83%	0.827	S	S	*	*	S	Bend	trans	-69.3	82.7	160.4	179.7	0	0	0	0	107.8
259	S	28.5	Very low	30.8	Very low	91 Å²	91	148.7 Å²	148.7	64%	0.636	83%	0.828	S	S	*	*			trans	-153.8	69	179	-57.1	0	0	0	0	110.7	K257	K257-S259 PolarHBondContact O-N 3.24Å
260	S	31.2	Very low	30.6	Very low	106 Å²	106	148 Å²	148	74%	0.741	82%	0.824	S	S	*	*			trans	-159.4	4.6	167.6	61.1	0	0	0	0	116.6	F262	S260-F262 PolarHBondContact O-N 3.37Å
261	L	30.8	Very low	30.4	Very low	172 Å²	172	151.9 Å²	151.9	90%	0.901	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	2	-173.9	-101.6	153.4	0	0	0	115.7
262	F	31.6	Very low	30.1	Very low	219 Å²	219	151.6 Å²	151.6	96%	0.961	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	9.9	179.5	-94.2	-77.8	0	0	0	115.6	S260	S260-F262 PolarHBondContact O-N 3.37Å
263	Q	28.5	Very low	30	Very low	179 Å²	179	150.1 Å²	150.1	84%	0.836	83%	0.825	S	S	*	*			trans	-136.1	78.5	-173.4	-121.6	-179.3	0.4	0	0	112.8
264	K	29.1	Very low	30.2	Very low	219 Å²	219	146.8 Å²	146.8	95%	0.952	81%	0.814	S	S	*	*			trans	-169	97.2	153	-119.8	165.8	179.7	169.5	0	111.6
265	G	29.3	Very low	30.1	Very low	74 Å²	74	149.1 Å²	149.1	76%	0.763	81%	0.812	S	S	*	*	S	Bend	trans	-167.3	8.3	175.5	0	0	0	0	0	116.6
266	T	28.5	Very low	30.2	Very low	145 Å²	145	149.6 Å²	149.6	89%	0.89	81%	0.807	S	S	*	*			trans	-161.6	104.8	177.3	17.9	0	0	0	0	110.1
267	S	29.5	Very low	30.1	Very low	115 Å²	115	147.6 Å²	147.6	80%	0.804	80%	0.795	S	S	*	*			trans	-173.8	97.1	147	-153.9	0	0	0	0	105.5
268	A	29.2	Very low	30.5	Very low	88 Å²	88	144.2 Å²	144.2	73%	0.727	79%	0.789	S	S	*	*				57	114.9	89.9	0	0	0	0	0	111.7
269	R	26.2	Very low	30.8	Very low	241 Å²	241	143.4 Å²	143.4	91%	0.909	78%	0.778	S	S	*	*			trans	-37.5	143.7	166.1	-72.1	169.6	163	179.9	-7.6	111.8
270	L	29.7	Very low	31.1	Very low	157 Å²	157	146.7 Å²	146.7	82%	0.822	78%	0.783	S	S	*	*			trans	146.9	117.4	164.2	-81.9	155.7	0	0	0	104
271	N	28.8	Very low	31.2	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	78%	0.776	S	S	*	*			cis	-160.8	144.6	32.5	-75.9	-34.2	0	0	0	110
272	E	29.5	Very low	31.5	Very low	195 Å²	195	142.9 Å²	142.9	91%	0.911	77%	0.766	S	S	*	*			trans	-152.7	122.7	154.3	-166.8	169.4	-158.1	0	0	102.1
273	S	30.4	Very low	31.4	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	76%	0.757	S	S	*	*			cis	-151.3	174.5	35.4	48.2	0	0	0	0	108.1
274	T	34.4	Very low	31.8	Very low	100 Å²	100	137.3 Å²	137.3	61%	0.613	76%	0.757	S	S	*	*				168.7	141.6	102.9	-26.3	0	0	0	0	112.1
275	Y	32.3	Very low	32	Very low	202 Å²	202	134.6 Å²	134.6	79%	0.792	75%	0.752	S	S	*	*			trans	67.5	139.8	152.1	-69.5	-54	0	0	0	118.7
276	D	33.5	Very low	32.3	Very low	122 Å²	122	135.5 Å²	135.5	65%	0.652	75%	0.752	S	S	*	*			cis	-169.8	156.8	-4.7	-139.4	-23.5	0	0	0	108.8
277	T	33.1	Very low	32.3	Very low	101 Å²	101	136.3 Å²	136.3	62%	0.62	75%	0.751	S	S	*	*			trans	38.3	131.6	146	7.4	0	0	0	0	120.7
278	T	35.9	Very low	32.5	Very low	106 Å²	106	136.3 Å²	136.3	65%	0.65	75%	0.751	S	S	*	*				171.3	142.6	66	16.6	0	0	0	0	110.2
279	I	36	Very low	32.5	Very low	134 Å²	134	137.8 Å²	137.8	69%	0.687	76%	0.756	S	S	*	*			trans	74.5	138.4	131.3	-65.7	175.6	0	0	0	119
280	H	35	Very low	32.7	Very low	159 Å²	159	131.4 Å²	131.4	74%	0.736	75%	0.749	S	S	*	*			cis	-159.4	144.3	10.1	-123.9	-39.2	0	0	0	109.8
281	S	34	Very low	32.8	Very low	84 Å²	84	129 Å²	129	59%	0.587	74%	0.74	S	S	*	*			trans	33.4	142.2	135.3	55.2	0	0	0	0	121.8
282	T	36.2	Very low	32.6	Very low	115 Å²	115	133.7 Å²	133.7	71%	0.706	75%	0.746	S	S	*	*				-172.2	139.7	57.9	10.1	0	0	0	0	111.8
283	N	31	Very low	32.8	Very low	143 Å²	143	129.7 Å²	129.7	77%	0.765	74%	0.735	S	S	*	*			trans	39.5	134.7	135.9	-53	-13.4	0	0	0	119.7
284	V	37.2	Very low	32.7	Very low	138 Å²	138	129.6 Å²	129.6	84%	0.836	74%	0.735	S	S	*	*				-165.4	140.4	65.5	163.9	0	0	0	0	111.1
285	L	31.5	Very low	32.6	Very low	162 Å²	162	131.1 Å²	131.1	85%	0.848	75%	0.746	S	S	*	*			trans	-50.4	149.3	170.2	-93	65.2	0	0	0	115.7
286	A	35.9	Very low	32.5	Very low	93 Å²	93	130.2 Å²	130.2	77%	0.769	75%	0.747	S	S	*	*				167.2	126	103.5	0	0	0	0	0	113.1
287	D	29.6	Very low	32.3	Very low	161 Å²	161	132.6 Å²	132.6	86%	0.861	76%	0.759	S	S	*	*			trans	10.3	121.8	155.1	-75.3	-38.7	0	0	0	121.5
288	S	33.7	Very low	32.2	Very low	115 Å²	115	136.7 Å²	136.7	80%	0.804	77%	0.773	S	S	*	*				-169.2	119.6	118.8	30.6	0	0	0	0	110.9	S290	S288-S290 PolarHBondContact O-N 3.45Å
289	S	29.2	Very low	31.7	Very low	120 Å²	120	137.9 Å²	137.9	84%	0.839	78%	0.775	S	S	*	*			trans	-48.9	115.5	173	52	0	0	0	0	113
290	S	29.2	Very low	31.7	Very low	107 Å²	107	137.5 Å²	137.5	75%	0.748	78%	0.782	S	S	*	*			trans	-171	149.1	146.7	60.6	0	0	0	0	112.9	S288	S288-S290 PolarHBondContact O-N 3.45Å
291	V	31.9	Very low	31.5	Very low	106 Å²	106	140 Å²	140	64%	0.642	78%	0.784	S	S	*	*			trans	84.5	84.9	155.9	-151.8	0	0	0	0	118.3	T293	V291-T293 HydrophobicContact CG1-CG2 3.65Å; V291-T293 PolarHBondContact O-N 2.91Å; V291-T293 VanDerWaalsContact O-N 3.13Å
292	R	26.1	Very low	31.2	Very low	248 Å²	248	143.1 Å²	143.1	94%	0.936	80%	0.795	S	S	*	*			trans	-37.1	111.2	135.6	-88.7	176.3	169.7	160.8	-2.3	110.5
293	T	32.5	Very low	31.1	Very low	111 Å²	111	142.7 Å²	142.7	68%	0.681	80%	0.797	S	S	*	*			trans	-116.3	95.4	161.1	40.6	0	0	0	0	110	V291	V291-T293 HydrophobicContact CG1-CG2 3.65Å; V291-T293 PolarHBondContact O-N 2.91Å; V291-T293 VanDerWaalsContact O-N 3.13Å
294	S	28.2	Very low	31	Very low	95 Å²	95	142.9 Å²	142.9	66%	0.664	80%	0.798	S	S	*	*			trans	-54	152.7	158	-66.9	0	0	0	0	110	K296	S294-K296 PolarHBondContact O-N 2.9Å
295	P	32.7	Very low	30.7	Very low	131 Å²	131	140.4 Å²	140.4	85%	0.851	80%	0.8	S	S	*	*			trans	-62.1	104.7	175.8	26.5	-31.4	0	0	0	108.2	L297	P295-L297 PolarHBondContact O-N 3.33Å; P295-L297 VanDerWaalsContact O-N 3.16Å
296	K	30.9	Very low	30.7	Very low	184 Å²	184	140.4 Å²	140.4	80%	0.8	80%	0.8	S	S	*	*			trans	-58.9	117.3	179.1	-91.7	177.8	174.9	173.7	0	108.8	S294 M298	S294-K296 PolarHBondContact O-N 2.9Å; K296-M298 PolarHBondContact O-N 3.45Å
297	L	28.3	Very low	30.3	Very low	172 Å²	172	145.4 Å²	145.4	90%	0.901	80%	0.804	S	S	*	*			trans	-47.7	102.9	155.7	-132.9	84.5	0	0	0	107.9	P295 N299	P295-L297 PolarHBondContact O-N 3.33Å; P295-L297 VanDerWaalsContact O-N 3.16Å; L297-N299 PolarHBondContact O-N 3.3Å; L297-N299 VanDerWaalsContact O-N 3.16Å
298	M	30.6	Very low	30.4	Very low	186 Å²	186	148.6 Å²	148.6	92%	0.916	81%	0.806	S	S	*	*			trans	-70.8	108.4	168.3	-100	168.8	80	0	0	107.9	K296 P300	K296-M298 PolarHBondContact O-N 3.45Å; M298-P300 WeakPolarHBondContact O-CD 3.41Å
299	N	27.3	Very low	30.3	Very low	132 Å²	132	152 Å²	152	71%	0.706	81%	0.806	S	S	*	*			trans	-79.8	117.3	169.4	-165.3	14.6	0	0	0	108	L297	L297-N299 PolarHBondContact O-N 3.3Å; L297-N299 VanDerWaalsContact O-N 3.16Å
300	P	34	Very low	30.4	Very low	126 Å²	126	151.1 Å²	151.1	82%	0.818	80%	0.8	S	S	*	*			trans	-97.3	90.2	165	32.4	-20	0	0	0	107.8	M298	M298-P300 WeakPolarHBondContact O-CD 3.41Å
301	R	31.3	Very low	30.7	Very low	210 Å²	210	153.3 Å²	153.3	79%	0.792	80%	0.803	S	S	*	*			trans	-101.9	129.2	161.5	-125.6	178.8	-172.9	174	1.6	107.3
302	N	28.9	Very low	31	Very low	151 Å²	151	156.7 Å²	156.7	81%	0.807	81%	0.812	S	S	*	*			trans	79.6	97	173	-60.4	-5	0	0	0	117.2
303	S	33.1	Very low	31.7	Very low	106 Å²	106	150.6 Å²	150.6	74%	0.741	80%	0.802	S	S	*	*				179	114	120.8	39.9	0	0	0	0	110.9
304	N	30	Very low	32.3	Very low	147 Å²	147	147.2 Å²	147.2	79%	0.786	78%	0.783	S	S	*	*			trans	52.3	105.2	140.1	-55.5	-9.3	0	0	0	119.3	L306	N304-L306 PolarHBondContact O-N 2.9Å; N304-L306 VanDerWaalsContact O-N 3.11Å
305	G	30.1	Very low	33.8	Very low	86 Å²	86	147.7 Å²	147.7	89%	0.887	77%	0.773	S	S	*	*				77.4	9.2	121.8	0	0	0	0	0	119.7	K307	G305-K307 PolarHBondContact O-N 3.42Å
306	L	30.9	Very low	35	Very low	161 Å²	161	143.6 Å²	143.6	84%	0.843	75%	0.746	S	S	*	*			trans	-85.5	94.7	173.8	-86.1	134	0	0	0	111	N304 Y308	N304-L306 PolarHBondContact O-N 2.9Å; N304-L306 VanDerWaalsContact O-N 3.11Å; L306-Y308 PolarHBondContact O-N 3.45Å
307	K	28.6	Very low	36.6	Very low	198 Å²	198	136.6 Å²	136.6	86%	0.861	72%	0.717	S	S	*	*			trans	-43.3	111.4	163.1	-80.1	178.8	176.4	175	0	108.7	G305 K309	G305-K307 PolarHBondContact O-N 3.42Å; K307-K309 VanDerWaalsContact C-N 3.31Å; K307-K309 PolarHBondContact O-N 3Å
308	Y	31	Very low	38.3	Very low	229 Å²	229	132.1 Å²	132.1	90%	0.898	70%	0.697	S	S	*	*			trans	-56.9	96.7	167.5	-113	-97.5	0	0	0	107.8	L306 S310	L306-Y308 PolarHBondContact O-N 3.45Å; Y308-S310 PolarHBondContact O-N 3.16Å; Y308-S310 VanDerWaalsContact O-N 3.15Å
309	K	31.7	Very low	39.9	Very low	187 Å²	187	124.1 Å²	124.1	81%	0.813	66%	0.659	S	S	*	*			trans	-65	114.5	172.9	-143.6	174.6	-174.6	-179.7	0	105.5	K307 N311	K307-K309 VanDerWaalsContact C-N 3.31Å; K307-K309 PolarHBondContact O-N 3Å; K309-N311 PolarHBondContact O-N 3.46Å; K309-N311 VanDerWaalsContact O-N 3.09Å
310	S	32.4	Very low	41.8	Very low	100 Å²	100	118.4 Å²	118.4	70%	0.699	63%	0.628	S	S	*	*			trans	-52.8	121.1	-176.4	63.6	0	0	0	0	109.1	Y308 E312	Y308-S310 PolarHBondContact O-N 3.16Å; Y308-S310 VanDerWaalsContact O-N 3.15Å; S310-E312 VanDerWaalsContact C-N 3.31Å; S310-E312 PolarHBondContact O-N 3.36Å
311	N	34.2	Very low	43.4	Very low	153 Å²	153	115.8 Å²	115.8	82%	0.818	61%	0.61	S	S	*	*			trans	-56.2	100.7	168.1	-79	-27.9	0	0	0	107.6	K309 V313	K309-N311 PolarHBondContact O-N 3.46Å; K309-N311 VanDerWaalsContact O-N 3.09Å; N311-V313 PolarHBondContact O-N 2.96Å
312	E	38.3	Very low	45.2	Very low	177 Å²	177	108.8 Å²	108.8	83%	0.827	59%	0.594	S	S	*	*			trans	-69.5	100.4	-177.7	-145.6	174.8	-175.7	0	0	106.9	S310 C314	S310-E312 VanDerWaalsContact C-N 3.31Å; S310-E312 PolarHBondContact O-N 3.36Å; E312-C314 PolarHBondContact O-N 2.93Å
313	V	41.2	Very low	47.2	Very low	121 Å²	121	105.9 Å²	105.9	73%	0.733	58%	0.576	S	S	*	*			trans	-63.8	104.1	177.2	-178.2	0	0	0	0	106.4	N311 K315	N311-V313 PolarHBondContact O-N 2.96Å; V313-K315 PolarHBondContact O-N 3.04Å
314	C	45.8	Very low	48.9	Very low	40 Å²	40	101.6 Å²	101.6	27%	0.27	55%	0.545	S	S	.	.			trans	-55.3	119.3	177.7	-170.9	0	0	0	0	108.9	C235 C236 E312 P316	C235-C314 WeakPolarHBondContact CB-SG 3.33Å; C235-C314 PolarHBondContact O-SG 3Å; C236-C314 WeakPolarHBondContact SG-CB 3.46Å; E312-C314 PolarHBondContact O-N 2.93Å; C314-P316 WeakPolarHBondContact O-CD 3.21Å
315	K	59.5	Low	51.1	Low	105 Å²	105	99.1 Å²	99.1	46%	0.457	53%	0.531	S	S	.	.			trans	-76.9	119.6	-176	-68.7	167.5	-173	153.4	0	106.3	V313 N317 T318 C319	V313-K315 PolarHBondContact O-N 3.04Å; K315-N317 PolarHBondContact O-N 3.31Å; K315-T318 WeakPolarHBondContact O-CB 3.5Å; K315-T318 PolarHBondContact O-N 3.44Å; K315-C319 PolarHBondContact O-N 3.31Å
316	P	57.9	Low	53.2	Low	45 Å²	45	99.2 Å²	99.2	29%	0.292	51%	0.514	S	S	.	.	H	α-helix	trans	-54.7	-32.8	178.4	21.4	-32.5	0	0	0	111.4	C314 T318 C319 I320	C314-P316 WeakPolarHBondContact O-CD 3.21Å; P316-T318 VanDerWaalsContact C-N 3.31Å; P316-T318 PolarHBondContact O-N 3.35Å; P316-C319 WeakPolarHBondContact O-CB 3.32Å; P316-C319 PolarHBondContact O-N 3.24Å; P316-I320 VanDerWaalsContact O-CG1 3.3Å; P316-I320 WeakPolarHBondContact O-CG1 3.12Å; P316-I320 PolarHBondContact O-N 3.05Å
317	N	62.8	Low	55.1	Low	36 Å²	36	94.7 Å²	94.7	19%	0.193	49%	0.493	C	S	.	.	H	α-helix	trans	-59.6	-38.3	175.1	-60.7	5.1	0	0	0	112.8	S124 K315 C319 I320 T321	S124-N317 WeakPolarHBondContact CB-ND2 3.24Å; S124-N317 PolarHBondContact OG-ND2 2.83Å; S124-N317 VanDerWaalsContact OG-ND2 3.15Å; S124-N317 PolarHBondContact OG-OD1 2.99Å; K315-N317 PolarHBondContact O-N 3.31Å; N317-C319 VanDerWaalsContact C-N 3.34Å; N317-I320 PolarHBondContact O-N 3.41Å; N317-T321 WeakPolarHBondContact O-CB 3.5Å; N317-T321 WeakPolarHBondContact O-CG2 3.21Å; N317-T321 PolarHBondContact O-N 3.07Å; N317-T321 PolarHBondContact O-OG1 3.26Å
318	T	65.4	Low	57.2	Low	79 Å²	79	88 Å²	88	49%	0.485	47%	0.466	S	S	.	.	H	α-helix	trans	-67.9	-37.1	179.6	-57.9	0	0	0	0	111.4	K315 P316 T321 S322	K315-T318 WeakPolarHBondContact O-CB 3.5Å; K315-T318 PolarHBondContact O-N 3.44Å; P316-T318 VanDerWaalsContact C-N 3.31Å; P316-T318 PolarHBondContact O-N 3.35Å; T318-T321 WeakPolarHBondContact CA-OG1 3.37Å; T318-T321 PolarHBondContact O-OG1 3.46Å; T318-S322 WeakPolarHBondContact O-CB 3.48Å; T318-S322 PolarHBondContact O-N 3.23Å
319	C	64.1	Low	59.3	Low	17 Å²	17	81.5 Å²	81.5	12%	0.115	45%	0.446	C	S	.	.	H	α-helix	trans	-67.7	-42.5	176.7	-159.7	0	0	0	0	111.1	C235 K315 P316 N317 S322 M323	C235-C319 HydrophobicContact CB-CB 3.71Å; C235-C319 WeakPolarHBondContact CB-SG 3.4Å; C235-C319 WeakPolarHBondContact SG-CB 2.92Å; C235-C319 CovalentContact SG-SG 2.04Å; C235-C319 PolarHBondContact SG-SG 2.91Å; K315-C319 PolarHBondContact O-N 3.31Å; P316-C319 WeakPolarHBondContact O-CB 3.32Å; P316-C319 PolarHBondContact O-N 3.24Å; N317-C319 VanDerWaalsContact C-N 3.34Å; C319-S322 PolarHBondContact O-N 2.85Å; C319-M323 WeakPolarHBondContact O-CG 3.23Å; C319-M323 PolarHBondContact O-N 2.98Å
320	I	66.9	Low	61.3	Low	12 Å²	12	74.4 Å²	74.4	6%	0.062	43%	0.426	C	S	.	.	H	α-helix	trans	-65.6	-46.7	176.5	-63.6	168.3	0	0	0	110.9	A216 F219 E220 P316 N317 S322 M323 L324	A216-I320 HydrophobicContact CB-CG2 3.96Å; F219-I320 HydrophobicContact CD1-CD1 4.14Å; F219-I320 HydrophobicContact CD1-CG1 3.82Å; F219-I320 HydrophobicContact CE1-CG1 4.03Å; E220-I320 HydrophobicContact CB-CD1 3.91Å; E220-I320 HydrophobicContact CG-CD1 4.05Å; P316-I320 VanDerWaalsContact O-CG1 3.3Å; P316-I320 WeakPolarHBondContact O-CG1 3.12Å; P316-I320 PolarHBondContact O-N 3.05Å; N317-I320 PolarHBondContact O-N 3.41Å; I320-S322 VanDerWaalsContact C-N 3.3Å; I320-S322 PolarHBondContact O-N 3.37Å; I320-M323 PolarHBondContact O-N 3.24Å; I320-L324 HydrophobicContact CG2-CD1 4.22Å; I320-L324 WeakPolarHBondContact O-CB 3.44Å; I320-L324 WeakPolarHBondContact O-CG 3.26Å; I320-L324 PolarHBondContact O-N 2.04Å
321	T	66.9	Low	63.1	Low	71 Å²	71	71.2 Å²	71.2	44%	0.436	40%	0.402	S	S	.	.	H	α-helix	trans	-64.7	-36.5	176.6	52.9	0	0	0	0	111.7	N317 T318 L324 I325	N317-T321 WeakPolarHBondContact O-CB 3.5Å; N317-T321 WeakPolarHBondContact O-CG2 3.21Å; N317-T321 PolarHBondContact O-N 3.07Å; N317-T321 PolarHBondContact O-OG1 3.26Å; T318-T321 WeakPolarHBondContact CA-OG1 3.37Å; T318-T321 PolarHBondContact O-OG1 3.46Å; T321-L324 PolarHBondContact O-N 3.46Å; T321-I325 WeakPolarHBondContact O-CB 3.39Å; T321-I325 WeakPolarHBondContact O-CD1 3.29Å; T321-I325 WeakPolarHBondContact O-CG1 3.18Å; T321-I325 PolarHBondContact O-N 2.77Å
322	S	68.9	Low	64.9	Low	64 Å²	64	66.2 Å²	66.2	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-46.8	174.9	-173.8	0	0	0	0	110.9	T318 C319 I320 L324 I325 T326	T318-S322 WeakPolarHBondContact O-CB 3.48Å; T318-S322 PolarHBondContact O-N 3.23Å; C319-S322 PolarHBondContact O-N 2.85Å; I320-S322 VanDerWaalsContact C-N 3.3Å; I320-S322 PolarHBondContact O-N 3.37Å; S322-L324 VanDerWaalsContact C-N 3.34Å; S322-L324 PolarHBondContact O-N 3.4Å; S322-I325 PolarHBondContact O-N 2.95Å; S322-T326 WeakPolarHBondContact O-CB 3.25Å; S322-T326 PolarHBondContact O-N 3.36Å; S322-T326 PolarHBondContact O-OG1 2.98Å
323	M	70.8	Confident	66.7	Low	90 Å²	90	62.7 Å²	62.7	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-60.4	-44.3	176.2	-74.6	-179.1	171.5	0	0	111.4	I234 C319 I320 T326 V327	I234-M323 HydrophobicContact CG2-CE 4.29Å; C319-M323 WeakPolarHBondContact O-CG 3.23Å; C319-M323 PolarHBondContact O-N 2.98Å; I320-M323 PolarHBondContact O-N 3.24Å; M323-T326 PolarHBondContact O-N 2.89Å; M323-V327 VanDerWaalsContact O-CG2 3.29Å; M323-V327 WeakPolarHBondContact O-CG2 3.49Å; M323-V327 PolarHBondContact O-N 3.07Å
324	L	70.4	Confident	68.2	Low	16 Å²	16	61.1 Å²	61.1	8%	0.084	35%	0.349	C	S	.	.	H	α-helix	trans	-58.6	-50.1	175.4	-82	169.8	0	0	0	112.3	L128 S212 V213 A216 I320 T321 S322 T326 V327 I328	L128-L324 HydrophobicContact CD1-CD1 3.73Å; S212-L324 WeakPolarHBondContact O-CD2 3.39Å; V213-L324 HydrophobicContact CG2-CD2 4.35Å; A216-L324 HydrophobicContact CB-CD1 3.61Å; A216-L324 HydrophobicContact CB-CD2 3.53Å; A216-L324 HydrophobicContact CB-CG 3.62Å; I320-L324 HydrophobicContact CG2-CD1 4.22Å; I320-L324 WeakPolarHBondContact O-CB 3.44Å; I320-L324 WeakPolarHBondContact O-CG 3.26Å; I320-L324 PolarHBondContact O-N 2.04Å; T321-L324 PolarHBondContact O-N 3.46Å; S322-L324 VanDerWaalsContact C-N 3.34Å; S322-L324 PolarHBondContact O-N 3.4Å; L324-T326 VanDerWaalsContact C-N 3.32Å; L324-T326 PolarHBondContact O-N 3.4Å; L324-V327 PolarHBondContact O-N 2.95Å; L324-I328 WeakPolarHBondContact O-CD1 3.16Å; L324-I328 VanDerWaalsContact O-CG1 3.23Å; L324-I328 WeakPolarHBondContact O-CG1 3.37Å; L324-I328 PolarHBondContact O-N 3.22Å
325	I	74.6	Confident	69.4	Low	94 Å²	94	60.7 Å²	60.7	48%	0.482	34%	0.343	S	S	.	.	H	α-helix	trans	-61.3	-43.8	179.1	-69.8	164	0	0	0	110.2	T321 S322 V327 I328 I329	T321-I325 WeakPolarHBondContact O-CB 3.39Å; T321-I325 WeakPolarHBondContact O-CD1 3.29Å; T321-I325 WeakPolarHBondContact O-CG1 3.18Å; T321-I325 PolarHBondContact O-N 2.77Å; S322-I325 PolarHBondContact O-N 2.95Å; I325-V327 VanDerWaalsContact C-N 3.35Å; I325-V327 PolarHBondContact O-N 3.48Å; I325-I328 PolarHBondContact O-N 3.44Å; I325-I329 HydrophobicContact CG2-CD1 3.52Å; I325-I329 HydrophobicContact CG2-CG1 4.23Å; I325-I329 WeakPolarHBondContact O-CB 3.05Å; I325-I329 VanDerWaalsContact O-CG1 3.24Å; I325-I329 WeakPolarHBondContact O-CG1 3.41Å; I325-I329 PolarHBondContact O-N 3.24Å
326	T	74.6	Confident	69.9	Low	89 Å²	89	58.3 Å²	58.3	55%	0.546	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-42.1	177.6	-60.1	0	0	0	0	111.8	S322 M323 L324 G330	S322-T326 WeakPolarHBondContact O-CB 3.25Å; S322-T326 PolarHBondContact O-N 3.36Å; S322-T326 PolarHBondContact O-OG1 2.98Å; M323-T326 PolarHBondContact O-N 2.89Å; L324-T326 VanDerWaalsContact C-N 3.32Å; L324-T326 PolarHBondContact O-N 3.4Å; T326-G330 PolarHBondContact O-N 3.36Å
327	V	71.8	Confident	70.6	Confident	65 Å²	65	60.9 Å²	60.9	39%	0.394	35%	0.349	S	S	.	.	H	α-helix	trans	-66.3	-45.8	177.3	176	0	0	0	0	110.6	S212 M323 L324 I325 I329 G330 T331	S212-V327 WeakPolarHBondContact OG-CG1 3.47Å; M323-V327 VanDerWaalsContact O-CG2 3.29Å; M323-V327 WeakPolarHBondContact O-CG2 3.49Å; M323-V327 PolarHBondContact O-N 3.07Å; L324-V327 PolarHBondContact O-N 2.95Å; I325-V327 VanDerWaalsContact C-N 3.35Å; I325-V327 PolarHBondContact O-N 3.48Å; V327-I329 PolarHBondContact O-N 3.38Å; V327-G330 PolarHBondContact O-N 2.94Å; V327-T331 HydrophobicContact CG1-CG2 4.19Å; V327-T331 WeakPolarHBondContact O-CG2 3.19Å; V327-T331 PolarHBondContact O-N 3.33Å; V327-T331 PolarHBondContact O-OG1 2.85Å; V327-T331 VanDerWaalsContact O-OG1 3.04Å
328	I	71.2	Confident	70.8	Confident	57 Å²	57	60.9 Å²	60.9	29%	0.292	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-45.1	178.3	-67.3	163.5	0	0	0	111.4	L324 I325 T331 C332	L324-I328 WeakPolarHBondContact O-CD1 3.16Å; L324-I328 VanDerWaalsContact O-CG1 3.23Å; L324-I328 WeakPolarHBondContact O-CG1 3.37Å; L324-I328 PolarHBondContact O-N 3.22Å; I325-I328 PolarHBondContact O-N 3.44Å; I328-T331 WeakPolarHBondContact CA-OG1 3.43Å; I328-T331 PolarHBondContact O-OG1 3.47Å; I328-C332 WeakPolarHBondContact O-CB 3.42Å; I328-C332 PolarHBondContact O-N 2.91Å
329	I	75.9	Confident	70.8	Confident	93 Å²	93	59.1 Å²	59.1	48%	0.477	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-44.1	176.6	-67.9	170.8	0	0	0	109.8	I325 V327 T331 C332 L333	I325-I329 HydrophobicContact CG2-CD1 3.52Å; I325-I329 HydrophobicContact CG2-CG1 4.23Å; I325-I329 WeakPolarHBondContact O-CB 3.05Å; I325-I329 VanDerWaalsContact O-CG1 3.24Å; I325-I329 WeakPolarHBondContact O-CG1 3.41Å; I325-I329 PolarHBondContact O-N 3.24Å; V327-I329 PolarHBondContact O-N 3.38Å; I329-T331 PolarHBondContact O-N 2.73Å; I329-C332 PolarHBondContact O-N 2.86Å; I329-L333 HydrophobicContact CG2-CD1 3.81Å; I329-L333 HydrophobicContact CG2-CG 4.19Å; I329-L333 WeakPolarHBondContact O-CB 3.45Å; I329-L333 VanDerWaalsContact O-CG 3.25Å; I329-L333 WeakPolarHBondContact O-CG 3.42Å; I329-L333 PolarHBondContact O-N 2.79Å
330	G	74.9	Confident	71	Confident	38 Å²	38	62.7 Å²	62.7	39%	0.392	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-45.4	178.6	0	0	0	0	0	112.6	T326 V327 L333 F334	T326-G330 PolarHBondContact O-N 3.36Å; V327-G330 PolarHBondContact O-N 2.94Å; G330-L333 PolarHBondContact O-N 3.01Å; G330-F334 VanDerWaalsContact O-CB 3.23Å; G330-F334 WeakPolarHBondContact O-CB 3.27Å; G330-F334 PolarHBondContact O-N 3.21Å
331	T	69.5	Low	71	Confident	33 Å²	33	64.6 Å²	64.6	20%	0.202	37%	0.367	C	S	.	.	H	α-helix	trans	-68.3	-40.7	177.3	54.4	0	0	0	0	111.3	A208 V327 I328 I329 F334 E335	A208-T331 HydrophobicContact CB-CG2 3.92Å; V327-T331 HydrophobicContact CG1-CG2 4.19Å; V327-T331 WeakPolarHBondContact O-CG2 3.19Å; V327-T331 PolarHBondContact O-N 3.33Å; V327-T331 PolarHBondContact O-OG1 2.85Å; V327-T331 VanDerWaalsContact O-OG1 3.04Å; I328-T331 WeakPolarHBondContact CA-OG1 3.43Å; I328-T331 PolarHBondContact O-OG1 3.47Å; I329-T331 PolarHBondContact O-N 2.73Å; T331-F334 PolarHBondContact O-N 3.06Å; T331-E335 WeakPolarHBondContact O-CB 3.36Å; T331-E335 VanDerWaalsContact O-CG 3.32Å; T331-E335 WeakPolarHBondContact O-CG 3.49Å; T331-E335 PolarHBondContact O-N 3.35Å
332	C	70.9	Confident	70.8	Confident	49 Å²	49	63.5 Å²	63.5	33%	0.331	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-44.9	176.1	-175.7	0	0	0	0	111.6	I328 I329 C336	I328-C332 WeakPolarHBondContact O-CB 3.42Å; I328-C332 PolarHBondContact O-N 2.91Å; I329-C332 PolarHBondContact O-N 2.86Å; C332-C336 VanDerWaalsContact O-CB 3.23Å; C332-C336 WeakPolarHBondContact O-CB 3.33Å; C332-C336 PolarHBondContact O-N 3.34Å; C332-C336 PolarHBondContact O-SG 2.88Å
333	L	77	Confident	70.5	Confident	103 Å²	103	66 Å²	66	54%	0.539	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-43.2	176.2	-73	175.1	0	0	0	111.4	I329 G330 C336 I337	I329-L333 HydrophobicContact CG2-CD1 3.81Å; I329-L333 HydrophobicContact CG2-CG 4.19Å; I329-L333 WeakPolarHBondContact O-CB 3.45Å; I329-L333 VanDerWaalsContact O-CG 3.25Å; I329-L333 WeakPolarHBondContact O-CG 3.42Å; I329-L333 PolarHBondContact O-N 2.79Å; G330-L333 PolarHBondContact O-N 3.01Å; L333-C336 PolarHBondContact O-N 2.91Å; L333-I337 WeakPolarHBondContact O-CD1 3.33Å; L333-I337 WeakPolarHBondContact O-CG1 3.34Å; L333-I337 PolarHBondContact O-N 3.37Å
334	F	73.1	Confident	70.1	Confident	87 Å²	87	63.9 Å²	63.9	38%	0.382	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-47.8	179.6	-177.8	-100.8	0	0	0	112.5	G330 T331 C336 I337 L338 V358	G330-F334 VanDerWaalsContact O-CB 3.23Å; G330-F334 WeakPolarHBondContact O-CB 3.27Å; G330-F334 PolarHBondContact O-N 3.21Å; T331-F334 PolarHBondContact O-N 3.06Å; F334-C336 VanDerWaalsContact C-N 3.34Å; F334-C336 PolarHBondContact O-N 2.85Å; F334-I337 WeakPolarHBondContact O-CB 3.41Å; F334-I337 PolarHBondContact O-N 3.08Å; F334-I337 VanDerWaalsContact O-N 3.16Å; F334-L338 HydrophobicContact CD1-CD1 3.98Å; F334-L338 HydrophobicContact CD1-CG 4.47Å; F334-L338 HydrophobicContact CE1-CD1 3.55Å; F334-L338 HydrophobicContact CE1-CG 4.18Å; F334-L338 HydrophobicContact CZ-CD1 4.17Å; F334-L338 HydrophobicContact CZ-CG 4.45Å; F334-L338 WeakPolarHBondContact O-CG 3.32Å; F334-L338 PolarHBondContact O-N 3.44Å; F334-V358 HydrophobicContact CE1-CG1 3.56Å; F334-V358 HydrophobicContact CE1-CG2 4.39Å; F334-V358 HydrophobicContact CE2-CG2 4.32Å; F334-V358 HydrophobicContact CZ-CB 4.14Å; F334-V358 HydrophobicContact CZ-CG1 3.48Å; F334-V358 VanDerWaalsContact CZ-CG1 3.48Å; F334-V358 HydrophobicContact CZ-CG2 3.51Å
335	E	70.4	Confident	69.4	Low	32 Å²	32	70.9 Å²	70.9	15%	0.15	39%	0.39	C	S	.	.	H	α-helix	trans	-65.8	-36.9	175.6	-68.6	-68	148.7	0	0	111.8	L201 N204 T331 I337 L338 I339	L201-E335 HydrophobicContact CD1-CB 3.46Å; L201-E335 VanDerWaalsContact CD1-CB 3.46Å; L201-E335 HydrophobicContact CD1-CG 4.34Å; N204-E335 HydrophobicContact CB-CG 4.22Å; N204-E335 WeakPolarHBondContact CB-OE2 3.08Å; N204-E335 PolarHBondContact ND2-OE2 2.86Å; T331-E335 WeakPolarHBondContact O-CB 3.36Å; T331-E335 VanDerWaalsContact O-CG 3.32Å; T331-E335 WeakPolarHBondContact O-CG 3.49Å; T331-E335 PolarHBondContact O-N 3.35Å; E335-I337 VanDerWaalsContact C-N 3.32Å; E335-I337 PolarHBondContact O-N 3.4Å; E335-L338 PolarHBondContact O-N 3.36Å; E335-I339 WeakPolarHBondContact O-CG1 3.27Å; E335-I339 PolarHBondContact O-N 3.25Å
336	C	69.4	Low	68.6	Low	55 Å²	55	74.3 Å²	74.3	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-59.9	-42.7	170.9	-74.9	0	0	0	0	111.5	C332 L333 F334 I339 V340	C332-C336 VanDerWaalsContact O-CB 3.23Å; C332-C336 WeakPolarHBondContact O-CB 3.33Å; C332-C336 PolarHBondContact O-N 3.34Å; C332-C336 PolarHBondContact O-SG 2.88Å; L333-C336 PolarHBondContact O-N 2.91Å; F334-C336 VanDerWaalsContact C-N 3.34Å; F334-C336 PolarHBondContact O-N 2.85Å; C336-I339 PolarHBondContact O-N 3Å; C336-V340 WeakPolarHBondContact O-CB 3Å; C336-V340 VanDerWaalsContact O-CG2 3.28Å; C336-V340 WeakPolarHBondContact O-CG2 3.27Å; C336-V340 PolarHBondContact O-N 3.26Å
337	I	72.8	Confident	67.9	Low	99 Å²	99	76.1 Å²	76.1	51%	0.508	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-45	175.9	-71	161.2	0	0	0	110	L333 F334 E335 I339 V340 L341	L333-I337 WeakPolarHBondContact O-CD1 3.33Å; L333-I337 WeakPolarHBondContact O-CG1 3.34Å; L333-I337 PolarHBondContact O-N 3.37Å; F334-I337 WeakPolarHBondContact O-CB 3.41Å; F334-I337 PolarHBondContact O-N 3.08Å; F334-I337 VanDerWaalsContact O-N 3.16Å; E335-I337 VanDerWaalsContact C-N 3.32Å; E335-I337 PolarHBondContact O-N 3.4Å; I337-I339 VanDerWaalsContact C-N 3.28Å; I337-I339 PolarHBondContact O-N 3.28Å; I337-V340 PolarHBondContact O-N 3.16Å; I337-L341 HydrophobicContact CG2-CD1 3.76Å; I337-L341 HydrophobicContact CG2-CG 4.34Å; I337-L341 WeakPolarHBondContact O-CB 3.47Å; I337-L341 WeakPolarHBondContact O-CG 3.23Å; I337-L341 PolarHBondContact O-N 2.95Å
338	L	67.1	Low	67.3	Low	36 Å²	36	75.3 Å²	75.3	19%	0.188	40%	0.4	C	S	.	.	H	α-helix	trans	-59.4	-39.3	176.6	-70.2	178	0	0	0	112.3	F334 E335 L341 D342 L354 V358	F334-L338 HydrophobicContact CD1-CD1 3.98Å; F334-L338 HydrophobicContact CD1-CG 4.47Å; F334-L338 HydrophobicContact CE1-CD1 3.55Å; F334-L338 HydrophobicContact CE1-CG 4.18Å; F334-L338 HydrophobicContact CZ-CD1 4.17Å; F334-L338 HydrophobicContact CZ-CG 4.45Å; F334-L338 WeakPolarHBondContact O-CG 3.32Å; F334-L338 PolarHBondContact O-N 3.44Å; E335-L338 PolarHBondContact O-N 3.36Å; L338-L341 PolarHBondContact O-N 3.47Å; L338-D342 WeakPolarHBondContact O-CB 3.38Å; L338-D342 PolarHBondContact O-N 3.46Å; L338-L354 HydrophobicContact CD2-CD2 3.52Å; L338-V358 HydrophobicContact CD1-CG1 4.49Å; L338-V358 HydrophobicContact CD2-CG2 4.49Å
339	I	66.2	Low	66.9	Low	41 Å²	41	78.3 Å²	78.3	21%	0.21	41%	0.413	C	S	.	.	H	α-helix	trans	-73.5	-38.9	178.4	-72.8	171.1	0	0	0	112.4	L201 E335 C336 I337 L341 D342 L343	L201-I339 HydrophobicContact CB-CD1 3.41Å; L201-I339 VanDerWaalsContact CB-CD1 3.41Å; L201-I339 HydrophobicContact CD1-CD1 3.16Å; L201-I339 HydrophobicContact CD1-CG1 4.37Å; L201-I339 HydrophobicContact CD2-CD1 3.38Å; L201-I339 HydrophobicContact CG-CD1 3.39Å; E335-I339 WeakPolarHBondContact O-CG1 3.27Å; E335-I339 PolarHBondContact O-N 3.25Å; C336-I339 PolarHBondContact O-N 3Å; I337-I339 VanDerWaalsContact C-N 3.28Å; I337-I339 PolarHBondContact O-N 3.28Å; I339-L341 PolarHBondContact O-N 2.86Å; I339-D342 PolarHBondContact O-N 2.89Å; I339-L343 HydrophobicContact CG2-CD1 3.64Å; I339-L343 HydrophobicContact CG2-CG 4.24Å; I339-L343 VanDerWaalsContact O-CB 3.29Å; I339-L343 WeakPolarHBondContact O-CB 3.49Å; I339-L343 VanDerWaalsContact O-CG 3.3Å; I339-L343 WeakPolarHBondContact O-CG 3.13Å; I339-L343 PolarHBondContact O-N 3.35Å
340	V	68.8	Low	66.4	Low	92 Å²	92	78.6 Å²	78.6	56%	0.558	42%	0.415	S	S	*	.	H	α-helix	trans	-62.5	-39.1	173	170.8	0	0	0	0	109.6	C336 I337 L343 S344	C336-V340 WeakPolarHBondContact O-CB 3Å; C336-V340 VanDerWaalsContact O-CG2 3.28Å; C336-V340 WeakPolarHBondContact O-CG2 3.27Å; C336-V340 PolarHBondContact O-N 3.26Å; I337-V340 PolarHBondContact O-N 3.16Å; V340-L343 PolarHBondContact O-N 2.87Å; V340-S344 WeakPolarHBondContact O-CB 3.29Å; V340-S344 PolarHBondContact O-N 3.01Å; V340-S344 PolarHBondContact O-OG 3.03Å
341	L	65.9	Low	65.8	Low	52 Å²	52	77.9 Å²	77.9	27%	0.272	40%	0.403	S	S	.	.	H	α-helix	trans	-64.7	-42.7	174.1	-70.5	168.5	0	0	0	112	I337 L338 I339 S344 L354	I337-L341 HydrophobicContact CG2-CD1 3.76Å; I337-L341 HydrophobicContact CG2-CG 4.34Å; I337-L341 WeakPolarHBondContact O-CB 3.47Å; I337-L341 WeakPolarHBondContact O-CG 3.23Å; I337-L341 PolarHBondContact O-N 2.95Å; L338-L341 PolarHBondContact O-N 3.47Å; I339-L341 PolarHBondContact O-N 2.86Å; L341-S344 WeakPolarHBondContact CA-OG 3.39Å; L341-S344 PolarHBondContact O-N 3.11Å; L341-S344 PolarHBondContact O-OG 2.9Å; L341-L354 HydrophobicContact CD1-CD2 3.69Å
342	D	63.5	Low	65.6	Low	48 Å²	48	81.4 Å²	81.4	26%	0.257	42%	0.417	S	S	.	.	H	α-helix	trans	-64.8	-40.2	176.2	-158.6	63.5	0	0	0	112.2	Y193 L338 I339 R355	Y193-D342 PolarHBondContact OH-OD2 2.92Å; Y193-D342 VanDerWaalsContact OH-OD2 3.11Å; L338-D342 WeakPolarHBondContact O-CB 3.38Å; L338-D342 PolarHBondContact O-N 3.46Å; I339-D342 PolarHBondContact O-N 2.89Å; D342-R355 IonicContact OD1-NH2 3.37Å; D342-R355 PolarHBondContact OD1-NH2 2.66Å
343	L	61.8	Low	65.4	Low	116 Å²	116	86.6 Å²	86.6	61%	0.607	43%	0.43	S	S	*	.	H	α-helix	trans	-75.7	-27.6	178.5	-75.1	168	0	0	0	113.5	I339 V340 K345	I339-L343 HydrophobicContact CG2-CD1 3.64Å; I339-L343 HydrophobicContact CG2-CG 4.24Å; I339-L343 VanDerWaalsContact O-CB 3.29Å; I339-L343 WeakPolarHBondContact O-CB 3.49Å; I339-L343 VanDerWaalsContact O-CG 3.3Å; I339-L343 WeakPolarHBondContact O-CG 3.13Å; I339-L343 PolarHBondContact O-N 3.35Å; V340-L343 PolarHBondContact O-N 2.87Å; L343-K345 PolarHBondContact O-N 3.34Å
344	S	62	Low	64.9	Low	47 Å²	47	84.7 Å²	84.7	33%	0.329	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	6.4	-172.7	55.3	0	0	0	0	114.2	V340 L341 W346	V340-S344 WeakPolarHBondContact O-CB 3.29Å; V340-S344 PolarHBondContact O-N 3.01Å; V340-S344 PolarHBondContact O-OG 3.03Å; L341-S344 WeakPolarHBondContact CA-OG 3.39Å; L341-S344 PolarHBondContact O-N 3.11Å; L341-S344 PolarHBondContact O-OG 2.9Å; S344-W346 VanDerWaalsContact CB-CD1 3.48Å; S344-W346 PolarHBondContact O-N 3.26Å
345	K	57	Low	64.6	Low	163 Å²	163	87.1 Å²	87.1	71%	0.709	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	32.1	175	-66.2	-173.5	176.3	-175.3	0	113.7	L343	L343-K345 PolarHBondContact O-N 3.34Å
346	W	56.6	Low	64.3	Low	165 Å²	165	90.7 Å²	90.7	63%	0.625	44%	0.443	S	S	*	.			trans	-69.8	153.2	168.3	-71.3	68.3	0	0	0	108.8	S344 C348	S344-W346 VanDerWaalsContact CB-CD1 3.48Å; S344-W346 PolarHBondContact O-N 3.26Å; W346-C348 PolarHBondContact O-N 3.44Å
347	D	59.5	Low	64.4	Low	127 Å²	127	92.7 Å²	92.7	68%	0.679	45%	0.45	S	S	*	.			trans	-33.1	114.6	-175.3	-72.2	-40.9	0	0	0	111.2	Q349 L350 T351	D347-Q349 PolarHBondContact O-N 3.47Å; D347-L350 HydrophobicContact CB-CB 4.46Å; D347-L350 WeakPolarHBondContact O-CA 3.22Å; D347-L350 WeakPolarHBondContact O-CB 3.4Å; D347-L350 PolarHBondContact O-N 2.91Å; D347-T351 PolarHBondContact O-N 2.93Å
348	C	60.2	Low	64.1	Low	48 Å²	48	89.1 Å²	89.1	32%	0.324	43%	0.433	S	S	.	.	H	α-helix	trans	-47.5	-34.5	-176.9	174.1	0	0	0	0	111.7	C17 W346 L350 T351 E352	C17-C348 HydrophobicContact CB-CB 4.33Å; C17-C348 WeakPolarHBondContact CB-SG 3.42Å; C17-C348 WeakPolarHBondContact SG-CB 3.17Å; C17-C348 CovalentContact SG-SG 2.04Å; C17-C348 PolarHBondContact SG-SG 3.41Å; W346-C348 PolarHBondContact O-N 3.44Å; C348-L350 PolarHBondContact O-N 2.91Å; C348-T351 PolarHBondContact O-N 2.87Å; C348-E352 WeakPolarHBondContact O-CB 3.47Å; C348-E352 WeakPolarHBondContact O-CG 3.24Å; C348-E352 PolarHBondContact O-N 3.31Å
349	Q	63.1	Low	64.1	Low	121 Å²	121	91 Å²	91	57%	0.565	44%	0.443	S	S	*	.	H	α-helix	trans	-62.5	-36.1	175.1	-165.2	177.8	17.3	0	0	114.5	D347 R353	D347-Q349 PolarHBondContact O-N 3.47Å; Q349-R353 WeakPolarHBondContact O-CB 3.4Å; Q349-R353 VanDerWaalsContact O-CG 3.23Å; Q349-R353 WeakPolarHBondContact O-CG 3.15Å; Q349-R353 PolarHBondContact O-N 3.42Å
350	L	65	Low	64.1	Low	98 Å²	98	93 Å²	93	51%	0.513	45%	0.451	S	S	.	.	H	α-helix	trans	-72.7	-42.2	176.9	-171.9	72.1	0	0	0	110.7	D347 C348 R353 L354	D347-L350 HydrophobicContact CB-CB 4.46Å; D347-L350 WeakPolarHBondContact O-CA 3.22Å; D347-L350 WeakPolarHBondContact O-CB 3.4Å; D347-L350 PolarHBondContact O-N 2.91Å; C348-L350 PolarHBondContact O-N 2.91Å; L350-R353 PolarHBondContact O-N 2.79Å; L350-L354 VanDerWaalsContact O-CB 3.24Å; L350-L354 WeakPolarHBondContact O-CB 3.46Å; L350-L354 PolarHBondContact O-N 3.38Å
351	T	63	Low	64.2	Low	23 Å²	23	92.3 Å²	92.3	14%	0.141	45%	0.447	C	S	.	.	H	α-helix	trans	-64.5	-41.6	177.5	-56.6	0	0	0	0	111.2	D347 C348 L354 R355	D347-T351 PolarHBondContact O-N 2.93Å; C348-T351 PolarHBondContact O-N 2.87Å; T351-L354 PolarHBondContact O-N 2.98Å; T351-R355 VanDerWaalsContact O-CB 3.26Å; T351-R355 WeakPolarHBondContact O-CB 3.22Å; T351-R355 PolarHBondContact O-N 3.02Å
352	E	64.6	Low	64.2	Low	108 Å²	108	95.6 Å²	95.6	51%	0.505	46%	0.457	S	S	.	.	H	α-helix	trans	-62.8	-48.1	172.9	-76.9	-176.2	162.7	0	0	112.1	C348 L354 R355 E356	C348-E352 WeakPolarHBondContact O-CB 3.47Å; C348-E352 WeakPolarHBondContact O-CG 3.24Å; C348-E352 PolarHBondContact O-N 3.31Å; E352-L354 VanDerWaalsContact C-N 3.31Å; E352-L354 PolarHBondContact O-N 3.04Å; E352-R355 PolarHBondContact O-N 3.29Å; E352-E356 WeakPolarHBondContact O-CB 3.45Å; E352-E356 PolarHBondContact O-N 3.07Å
353	R	66.5	Low	64.4	Low	157 Å²	157	95 Å²	95	59%	0.592	45%	0.453	S	S	*	.	H	α-helix	trans	-62.1	-38.8	177.1	-78.6	-179.9	176.7	-174.1	1.5	112.7	Q349 L350 E356 L357	Q349-R353 WeakPolarHBondContact O-CB 3.4Å; Q349-R353 VanDerWaalsContact O-CG 3.23Å; Q349-R353 WeakPolarHBondContact O-CG 3.15Å; Q349-R353 PolarHBondContact O-N 3.42Å; L350-R353 PolarHBondContact O-N 2.79Å; R353-E356 PolarHBondContact O-N 2.99Å; R353-L357 WeakPolarHBondContact O-CB 3.34Å; R353-L357 PolarHBondContact O-N 2.87Å
354	L	66.6	Low	64.8	Low	64 Å²	64	95.5 Å²	95.5	34%	0.335	46%	0.456	S	S	.	.	H	α-helix	trans	-67.8	-45.7	176.3	-168	105	0	0	0	110	L338 L341 L350 T351 E352 E356 L357 V358	L338-L354 HydrophobicContact CD2-CD2 3.52Å; L341-L354 HydrophobicContact CD1-CD2 3.69Å; L350-L354 VanDerWaalsContact O-CB 3.24Å; L350-L354 WeakPolarHBondContact O-CB 3.46Å; L350-L354 PolarHBondContact O-N 3.38Å; T351-L354 PolarHBondContact O-N 2.98Å; E352-L354 VanDerWaalsContact C-N 3.31Å; E352-L354 PolarHBondContact O-N 3.04Å; L354-E356 VanDerWaalsContact C-N 3.28Å; L354-E356 PolarHBondContact O-N 3.2Å; L354-L357 PolarHBondContact O-N 3.1Å; L354-V358 HydrophobicContact CG-CG2 4.42Å; L354-V358 WeakPolarHBondContact O-CB 3.42Å; L354-V358 WeakPolarHBondContact O-CG2 3.46Å; L354-V358 PolarHBondContact O-N 2.88Å
355	R	65.7	Low	65.2	Low	138 Å²	138	98.4 Å²	98.4	52%	0.521	47%	0.467	S	S	.	.	H	α-helix	trans	-59.1	-41.4	175.4	-173.4	178.5	-70.1	-176.9	2.9	111.1	D342 T351 E352 V358 N359	D342-R355 IonicContact OD1-NH2 3.37Å; D342-R355 PolarHBondContact OD1-NH2 2.66Å; T351-R355 VanDerWaalsContact O-CB 3.26Å; T351-R355 WeakPolarHBondContact O-CB 3.22Å; T351-R355 PolarHBondContact O-N 3.02Å; E352-R355 PolarHBondContact O-N 3.29Å; R355-V358 PolarHBondContact O-N 2.68Å; R355-N359 WeakPolarHBondContact O-CB 3.4Å; R355-N359 PolarHBondContact O-N 3.31Å; R355-N359 PolarHBondContact O-ND2 3.46Å
356	E	65.8	Low	65.6	Low	106 Å²	106	91.7 Å²	91.7	50%	0.495	44%	0.44	S	S	.	.	H	α-helix	trans	-63.4	-48.5	175.1	-168	-177.7	176.2	0	0	111.6	E352 R353 L354 V358 N359 Q360	E352-E356 WeakPolarHBondContact O-CB 3.45Å; E352-E356 PolarHBondContact O-N 3.07Å; R353-E356 PolarHBondContact O-N 2.99Å; L354-E356 VanDerWaalsContact C-N 3.28Å; L354-E356 PolarHBondContact O-N 3.2Å; E356-V358 VanDerWaalsContact C-N 3.32Å; E356-V358 PolarHBondContact O-N 2.99Å; E356-N359 PolarHBondContact O-N 3.49Å; E356-Q360 WeakPolarHBondContact O-CB 3.44Å; E356-Q360 VanDerWaalsContact O-CG 3.25Å; E356-Q360 WeakPolarHBondContact O-CG 3.43Å; E356-Q360 PolarHBondContact O-N 3.33Å; E356-Q360 PolarHBondContact OE1-NE2 3.19Å
357	L	70.1	Confident	66.2	Low	97 Å²	97	87.1 Å²	87.1	51%	0.508	42%	0.424	S	S	.	.	H	α-helix	trans	-60.9	-41.5	177.2	-177.7	144.2	0	0	0	111.7	R353 L354 Q360 V361	R353-L357 WeakPolarHBondContact O-CB 3.34Å; R353-L357 PolarHBondContact O-N 2.87Å; L354-L357 PolarHBondContact O-N 3.1Å; L357-Q360 WeakPolarHBondContact O-CB 3.42Å; L357-Q360 PolarHBondContact O-N 3.05Å; L357-V361 HydrophobicContact CD2-CG2 4.11Å; L357-V361 WeakPolarHBondContact O-CB 3.19Å; L357-V361 VanDerWaalsContact O-CG2 3.28Å; L357-V361 WeakPolarHBondContact O-CG2 3.26Å; L357-V361 PolarHBondContact O-N 3.29Å
358	V	67.7	Low	66.7	Low	25 Å²	25	85.5 Å²	85.5	15%	0.152	42%	0.416	C	S	.	.	H	α-helix	trans	-64.5	-44.7	176.9	168.1	0	0	0	0	110.8	F334 L338 L354 R355 E356 Q360 V361 Y362	F334-V358 HydrophobicContact CE1-CG1 3.56Å; F334-V358 HydrophobicContact CE1-CG2 4.39Å; F334-V358 HydrophobicContact CE2-CG2 4.32Å; F334-V358 HydrophobicContact CZ-CB 4.14Å; F334-V358 HydrophobicContact CZ-CG1 3.48Å; F334-V358 VanDerWaalsContact CZ-CG1 3.48Å; F334-V358 HydrophobicContact CZ-CG2 3.51Å; L338-V358 HydrophobicContact CD1-CG1 4.49Å; L338-V358 HydrophobicContact CD2-CG2 4.49Å; L354-V358 HydrophobicContact CG-CG2 4.42Å; L354-V358 WeakPolarHBondContact O-CB 3.42Å; L354-V358 WeakPolarHBondContact O-CG2 3.46Å; L354-V358 PolarHBondContact O-N 2.88Å; R355-V358 PolarHBondContact O-N 2.68Å; E356-V358 VanDerWaalsContact C-N 3.32Å; E356-V358 PolarHBondContact O-N 2.99Å; V358-Q360 VanDerWaalsContact C-N 3.3Å; V358-Q360 PolarHBondContact O-N 3.49Å; V358-V361 PolarHBondContact O-N 2.98Å; V358-Y362 WeakPolarHBondContact O-CB 3.37Å; V358-Y362 PolarHBondContact O-N 3.4Å
359	N	66	Low	67.2	Low	76 Å²	76	85 Å²	85	41%	0.406	41%	0.413	S	S	.	.	H	α-helix	trans	-61.4	-40.3	174.4	-73.6	-17.1	0	0	0	111.3	R355 E356 Y362 I363	R355-N359 WeakPolarHBondContact O-CB 3.4Å; R355-N359 PolarHBondContact O-N 3.31Å; R355-N359 PolarHBondContact O-ND2 3.46Å; E356-N359 PolarHBondContact O-N 3.49Å; N359-Y362 PolarHBondContact O-N 2.9Å; N359-I363 VanDerWaalsContact O-CG1 3.24Å; N359-I363 WeakPolarHBondContact O-CG1 3.29Å; N359-I363 PolarHBondContact O-N 3.33Å
360	Q	65.8	Low	67.5	Low	81 Å²	81	82.5 Å²	82.5	38%	0.379	40%	0.4	S	S	.	.	H	α-helix	trans	-64.1	-47.3	175.9	-73.1	175.8	9.3	0	0	112	E356 L357 V358 Y362 I363 L364	E356-Q360 WeakPolarHBondContact O-CB 3.44Å; E356-Q360 VanDerWaalsContact O-CG 3.25Å; E356-Q360 WeakPolarHBondContact O-CG 3.43Å; E356-Q360 PolarHBondContact O-N 3.33Å; E356-Q360 PolarHBondContact OE1-NE2 3.19Å; L357-Q360 WeakPolarHBondContact O-CB 3.42Å; L357-Q360 PolarHBondContact O-N 3.05Å; V358-Q360 VanDerWaalsContact C-N 3.3Å; V358-Q360 PolarHBondContact O-N 3.49Å; Q360-Y362 VanDerWaalsContact C-N 3.3Å; Q360-Y362 PolarHBondContact O-N 3.07Å; Q360-I363 PolarHBondContact O-N 3.41Å; Q360-L364 WeakPolarHBondContact O-CB 3.28Å; Q360-L364 PolarHBondContact O-N 3.12Å
361	V	70.8	Confident	67.8	Low	79 Å²	79	82.9 Å²	82.9	48%	0.479	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-40.4	176.3	171.2	0	0	0	0	110.5	L357 V358 L364 L365	L357-V361 HydrophobicContact CD2-CG2 4.11Å; L357-V361 WeakPolarHBondContact O-CB 3.19Å; L357-V361 VanDerWaalsContact O-CG2 3.28Å; L357-V361 WeakPolarHBondContact O-CG2 3.26Å; L357-V361 PolarHBondContact O-N 3.29Å; V358-V361 PolarHBondContact O-N 2.98Å; V361-L364 PolarHBondContact O-N 3.17Å; V361-L365 VanDerWaalsContact O-CB 3.23Å; V361-L365 WeakPolarHBondContact O-CB 3.2Å; V361-L365 PolarHBondContact O-N 3.37Å
362	Y	66.6	Low	68.3	Low	121 Å²	121	86 Å²	86	48%	0.475	42%	0.416	S	S	.	.	H	α-helix	trans	-61.8	-46.3	176.8	-176.6	-93.6	0	0	0	111.7	F207 V358 N359 Q360 L365 T366	F207-Y362 WeakPolarHBondContact CE1-OH 3.46Å; V358-Y362 WeakPolarHBondContact O-CB 3.37Å; V358-Y362 PolarHBondContact O-N 3.4Å; N359-Y362 PolarHBondContact O-N 2.9Å; Q360-Y362 VanDerWaalsContact C-N 3.3Å; Q360-Y362 PolarHBondContact O-N 3.07Å; Y362-L365 PolarHBondContact O-N 3.15Å; Y362-T366 WeakPolarHBondContact O-CB 3.2Å; Y362-T366 PolarHBondContact O-N 2.86Å; Y362-T366 PolarHBondContact O-OG1 3.47Å
363	I	67	Low	68.5	Low	35 Å²	35	82.4 Å²	82.4	18%	0.179	40%	0.4	C	S	.	.	H	α-helix	trans	-60.8	-49.6	175.7	-70.1	165	0	0	0	110.2	N359 Q360 L365 T366 F367 L588 H591 F592	N359-I363 VanDerWaalsContact O-CG1 3.24Å; N359-I363 WeakPolarHBondContact O-CG1 3.29Å; N359-I363 PolarHBondContact O-N 3.33Å; Q360-I363 PolarHBondContact O-N 3.41Å; I363-L365 PolarHBondContact O-N 2.78Å; I363-T366 WeakPolarHBondContact O-CB 3.23Å; I363-T366 PolarHBondContact O-N 3.41Å; I363-T366 VanDerWaalsContact O-N 3.14Å; I363-F367 HydrophobicContact CG2-CD2 3.9Å; I363-F367 HydrophobicContact CG2-CE2 3.76Å; I363-F367 VanDerWaalsContact O-CD2 3.26Å; I363-F367 WeakPolarHBondContact O-CD2 3.33Å; I363-F367 PolarHBondContact O-N 3.32Å; I363-L588 HydrophobicContact CG1-CD2 4.46Å; I363-L588 HydrophobicContact CG2-CD2 4.03Å; I363-H591 HydrophobicContact CD1-CB 4.24Å; I363-F592 HydrophobicContact CG2-CE2 4.49Å; I363-F592 HydrophobicContact CG2-CZ 4.25Å
364	L	71	Confident	68.7	Low	126 Å²	126	77.7 Å²	77.7	66%	0.66	39%	0.389	S	S	*	.	H	α-helix	trans	-59.1	-45.5	179.3	-178.4	68.9	0	0	0	111.9	Q360 V361 T366 F367 L368	Q360-L364 WeakPolarHBondContact O-CB 3.28Å; Q360-L364 PolarHBondContact O-N 3.12Å; V361-L364 PolarHBondContact O-N 3.17Å; L364-T366 VanDerWaalsContact C-N 3.3Å; L364-T366 PolarHBondContact O-N 3.46Å; L364-F367 PolarHBondContact O-N 2.83Å; L364-L368 PolarHBondContact O-N 2.72Å
365	L	70.9	Confident	69	Low	108 Å²	108	81.4 Å²	81.4	57%	0.565	40%	0.399	S	S	*	.	H	α-helix	trans	-65.3	-36.1	177.7	-172.7	65.7	0	0	0	111.2	V361 Y362 I363 L368 S369	V361-L365 VanDerWaalsContact O-CB 3.23Å; V361-L365 WeakPolarHBondContact O-CB 3.2Å; V361-L365 PolarHBondContact O-N 3.37Å; Y362-L365 PolarHBondContact O-N 3.15Å; I363-L365 PolarHBondContact O-N 2.78Å; L365-L368 PolarHBondContact O-N 3.25Å; L365-S369 VanDerWaalsContact O-CB 3.28Å; L365-S369 WeakPolarHBondContact O-CB 3.24Å; L365-S369 PolarHBondContact O-N 2.69Å
366	T	65.5	Low	69.1	Low	23 Å²	23	76.9 Å²	76.9	14%	0.141	39%	0.385	C	S	.	.	H	α-helix	trans	-62.4	-44.6	174.4	-59	0	0	0	0	110.7	Y362 I363 L364 S369 F370	Y362-T366 WeakPolarHBondContact O-CB 3.2Å; Y362-T366 PolarHBondContact O-N 2.86Å; Y362-T366 PolarHBondContact O-OG1 3.47Å; I363-T366 WeakPolarHBondContact O-CB 3.23Å; I363-T366 PolarHBondContact O-N 3.41Å; I363-T366 VanDerWaalsContact O-N 3.14Å; L364-T366 VanDerWaalsContact C-N 3.3Å; L364-T366 PolarHBondContact O-N 3.46Å; T366-S369 PolarHBondContact O-N 3.48Å; T366-S369 PolarHBondContact O-OG 3.4Å; T366-F370 PolarHBondContact O-N 3.01Å
367	F	67.7	Low	69.1	Low	68 Å²	68	72.9 Å²	72.9	30%	0.298	37%	0.366	S	S	.	.	H	α-helix	trans	-61.1	-46.6	173.1	-85.7	-73.3	0	0	0	113	I363 L364 S369 F370 I371 L588 F592	I363-F367 HydrophobicContact CG2-CD2 3.9Å; I363-F367 HydrophobicContact CG2-CE2 3.76Å; I363-F367 VanDerWaalsContact O-CD2 3.26Å; I363-F367 WeakPolarHBondContact O-CD2 3.33Å; I363-F367 PolarHBondContact O-N 3.32Å; L364-F367 PolarHBondContact O-N 2.83Å; F367-S369 VanDerWaalsContact C-N 3.28Å; F367-S369 PolarHBondContact O-N 3.06Å; F367-F370 WeakPolarHBondContact O-CB 3.39Å; F367-F370 PolarHBondContact O-N 2.89Å; F367-I371 WeakPolarHBondContact O-CG1 3.48Å; F367-I371 PolarHBondContact O-N 3.34Å; F367-L588 HydrophobicContact CE1-CD1 4.48Å; F367-L588 HydrophobicContact CE2-CD1 4.19Å; F367-L588 HydrophobicContact CE2-CD2 3.85Å; F367-L588 HydrophobicContact CE2-CG 4.45Å; F367-L588 HydrophobicContact CZ-CB 4.31Å; F367-L588 HydrophobicContact CZ-CD1 3.83Å; F367-L588 HydrophobicContact CZ-CD2 4.26Å; F367-L588 HydrophobicContact CZ-CG 4.37Å; F367-F592 HydrophobicContact CD2-CE2 4.41Å; F367-F592 HydrophobicContact CD2-CZ 4.16Å; F367-F592 AromaticContact CE2-CE2 3.25Å; F367-F592 HydrophobicContact CE2-CE2 3.25Å; F367-F592 AromaticContact CE2-CZ 3.37Å; F367-F592 HydrophobicContact CE2-CZ 3.37Å; F367-F592 AromaticContact CZ-CE2 3.37Å; F367-F592 HydrophobicContact CZ-CE2 3.37Å; F367-F592 AromaticContact CZ-CZ 3.81Å; F367-F592 HydrophobicContact CZ-CZ 3.81Å
368	L	72.1	Confident	69.1	Low	94 Å²	94	70.3 Å²	70.3	49%	0.492	36%	0.359	S	S	.	.	H	α-helix	trans	-61.9	-40.8	178	-171.9	66.6	0	0	0	110.9	L364 L365 F370 I371 I372	L364-L368 PolarHBondContact O-N 2.72Å; L365-L368 PolarHBondContact O-N 3.25Å; L368-F370 VanDerWaalsContact C-N 3.34Å; L368-F370 PolarHBondContact O-N 2.96Å; L368-I371 PolarHBondContact O-N 2.88Å; L368-I372 HydrophobicContact CG-CD1 3.98Å; L368-I372 VanDerWaalsContact O-CG1 3.26Å; L368-I372 WeakPolarHBondContact O-CG1 3.33Å; L368-I372 PolarHBondContact O-N 2.91Å
369	S	69.6	Low	69.4	Low	38 Å²	38	73.4 Å²	73.4	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-41.9	175.7	82.4	0	0	0	0	111.4	L365 T366 F367 I371 I372 I373	L365-S369 VanDerWaalsContact O-CB 3.28Å; L365-S369 WeakPolarHBondContact O-CB 3.24Å; L365-S369 PolarHBondContact O-N 2.69Å; T366-S369 PolarHBondContact O-N 3.48Å; T366-S369 PolarHBondContact O-OG 3.4Å; F367-S369 VanDerWaalsContact C-N 3.28Å; F367-S369 PolarHBondContact O-N 3.06Å; S369-I371 PolarHBondContact O-N 3.42Å; S369-I372 PolarHBondContact O-N 3.22Å; S369-I373 VanDerWaalsContact O-CB 3.25Å; S369-I373 WeakPolarHBondContact O-CB 3.47Å; S369-I373 WeakPolarHBondContact O-CD1 3.18Å; S369-I373 WeakPolarHBondContact O-CG1 3.38Å; S369-I373 PolarHBondContact O-N 2.92Å
370	F	69.1	Low	69.6	Low	67 Å²	67	70.7 Å²	70.7	29%	0.294	35%	0.353	S	S	.	.	H	α-helix	trans	-60.6	-45.3	176.9	173.7	-106.9	0	0	0	111.5	T366 F367 L368 I373 T374 Y581	T366-F370 PolarHBondContact O-N 3.01Å; F367-F370 WeakPolarHBondContact O-CB 3.39Å; F367-F370 PolarHBondContact O-N 2.89Å; L368-F370 VanDerWaalsContact C-N 3.34Å; L368-F370 PolarHBondContact O-N 2.96Å; F370-I373 PolarHBondContact O-N 3.46Å; F370-T374 WeakPolarHBondContact CE2-OG1 3.36Å; F370-T374 WeakPolarHBondContact O-CB 3.37Å; F370-T374 PolarHBondContact O-N 3.05Å; F370-T374 PolarHBondContact O-OG1 3.32Å; F370-Y581 HydrophobicContact CB-CD1 4.29Å; F370-Y581 HydrophobicContact CB-CE1 3.98Å; F370-Y581 AromaticContact CD2-CD1 3.59Å; F370-Y581 HydrophobicContact CD2-CD1 3.59Å; F370-Y581 AromaticContact CD2-CD2 3.44Å; F370-Y581 HydrophobicContact CD2-CD2 3.44Å; F370-Y581 VanDerWaalsContact CD2-CD2 3.44Å; F370-Y581 AromaticContact CD2-CE1 3.91Å; F370-Y581 HydrophobicContact CD2-CE1 3.91Å; F370-Y581 AromaticContact CD2-CE2 3.79Å; F370-Y581 HydrophobicContact CD2-CE2 3.79Å; F370-Y581 AromaticContact CD2-CG 3.34Å; F370-Y581 HydrophobicContact CD2-CG 3.34Å; F370-Y581 HydrophobicContact CE2-CD1 4.33Å; F370-Y581 AromaticContact CE2-CD2 3.77Å; F370-Y581 HydrophobicContact CE2-CD2 3.77Å; F370-Y581 HydrophobicContact CE2-CE2 4.48Å; F370-Y581 AromaticContact CE2-CG 3.69Å; F370-Y581 HydrophobicContact CE2-CG 3.69Å; F370-Y581 HydrophobicContact CG-CD1 4.28Å; F370-Y581 HydrophobicContact CG-CE1 4.41Å; F370-Y581 HydrophobicContact CG-CG 4.42Å
371	I	72.7	Confident	69.7	Low	107 Å²	107	70 Å²	70	55%	0.549	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-47.5	177.1	-65.6	169.6	0	0	0	110.3	F367 L368 S369 Y375	F367-I371 WeakPolarHBondContact O-CG1 3.48Å; F367-I371 PolarHBondContact O-N 3.34Å; L368-I371 PolarHBondContact O-N 2.88Å; S369-I371 PolarHBondContact O-N 3.42Å; I371-Y375 VanDerWaalsContact O-CB 3.23Å; I371-Y375 WeakPolarHBondContact O-CB 3.47Å; I371-Y375 PolarHBondContact O-N 3.41Å
372	I	72.8	Confident	69.8	Low	87 Å²	87	75 Å²	75	45%	0.446	36%	0.359	S	S	.	.	H	α-helix	trans	-62.6	-46.8	180	-68.1	167.4	0	0	0	110.7	L368 S369 Y375 L376	L368-I372 HydrophobicContact CG-CD1 3.98Å; L368-I372 VanDerWaalsContact O-CG1 3.26Å; L368-I372 WeakPolarHBondContact O-CG1 3.33Å; L368-I372 PolarHBondContact O-N 2.91Å; S369-I372 PolarHBondContact O-N 3.22Å; I372-Y375 WeakPolarHBondContact O-CB 3.3Å; I372-Y375 PolarHBondContact O-N 2.93Å; I372-L376 HydrophobicContact CG2-CD1 4.02Å; I372-L376 HydrophobicContact CG2-CG 4.44Å; I372-L376 WeakPolarHBondContact O-CB 3.34Å; I372-L376 VanDerWaalsContact O-CG 3.26Å; I372-L376 WeakPolarHBondContact O-CG 3.46Å; I372-L376 PolarHBondContact O-N 2.97Å
373	I	69.3	Low	69.9	Low	34 Å²	34	70.8 Å²	70.8	17%	0.174	35%	0.346	C	S	.	.	H	α-helix	trans	-65.8	-45.5	-178.7	-71.9	164.6	0	0	0	110.4	S369 F370 Y375 L376 Y377 Y581	S369-I373 VanDerWaalsContact O-CB 3.25Å; S369-I373 WeakPolarHBondContact O-CB 3.47Å; S369-I373 WeakPolarHBondContact O-CD1 3.18Å; S369-I373 WeakPolarHBondContact O-CG1 3.38Å; S369-I373 PolarHBondContact O-N 2.92Å; F370-I373 PolarHBondContact O-N 3.46Å; I373-Y375 VanDerWaalsContact C-N 3.32Å; I373-Y375 PolarHBondContact O-N 3.43Å; I373-L376 WeakPolarHBondContact O-CB 3.42Å; I373-L376 PolarHBondContact O-N 2.94Å; I373-Y377 HydrophobicContact CG2-CD2 3.58Å; I373-Y377 HydrophobicContact CG2-CE2 3.45Å; I373-Y377 VanDerWaalsContact CG2-CE2 3.45Å; I373-Y377 VanDerWaalsContact O-CD2 3.25Å; I373-Y377 WeakPolarHBondContact O-CD2 3.41Å; I373-Y377 PolarHBondContact O-N 3.04Å; I373-Y581 WeakPolarHBondContact CD1-OH 3.33Å; I373-Y581 HydrophobicContact CG2-CE2 4.49Å
374	T	69.4	Low	70	Confident	57 Å²	57	71.7 Å²	71.7	35%	0.35	35%	0.353	S	S	.	.	H	α-helix	trans	-60.4	-43.3	175.6	-60.4	0	0	0	0	111	F370 L376 Y377 A378	F370-T374 WeakPolarHBondContact CE2-OG1 3.36Å; F370-T374 WeakPolarHBondContact O-CB 3.37Å; F370-T374 PolarHBondContact O-N 3.05Å; F370-T374 PolarHBondContact O-OG1 3.32Å; T374-L376 PolarHBondContact O-N 3.13Å; T374-Y377 PolarHBondContact O-N 3.34Å; T374-A378 VanDerWaalsContact O-CB 3.31Å; T374-A378 WeakPolarHBondContact O-CB 3.17Å; T374-A378 PolarHBondContact O-N 2.84Å
375	Y	74.5	Confident	70	Confident	142 Å²	142	74.5 Å²	74.5	56%	0.557	36%	0.355	S	S	*	.	H	α-helix	trans	-61.2	-43.7	174.2	173.9	-102.4	0	0	0	112.3	I371 I372 I373 A378 R379	I371-Y375 VanDerWaalsContact O-CB 3.23Å; I371-Y375 WeakPolarHBondContact O-CB 3.47Å; I371-Y375 PolarHBondContact O-N 3.41Å; I372-Y375 WeakPolarHBondContact O-CB 3.3Å; I372-Y375 PolarHBondContact O-N 2.93Å; I373-Y375 VanDerWaalsContact C-N 3.32Å; I373-Y375 PolarHBondContact O-N 3.43Å; Y375-A378 PolarHBondContact O-N 3.43Å; Y375-R379 WeakPolarHBondContact O-CB 3.47Å; Y375-R379 PolarHBondContact O-N 2.87Å
376	L	66.4	Low	70.1	Confident	44 Å²	44	74.1 Å²	74.1	23%	0.23	35%	0.35	C	S	.	.	H	α-helix	trans	-61.9	-46.1	176.3	-72.8	170.5	0	0	0	111.3	Y222 I372 I373 T374 R379 I380	Y222-L376 HydrophobicContact CD1-CD2 4.41Å; Y222-L376 HydrophobicContact CD2-CB 4.45Å; Y222-L376 HydrophobicContact CD2-CD2 3.75Å; Y222-L376 HydrophobicContact CE1-CD2 4.25Å; Y222-L376 HydrophobicContact CE2-CD2 3.56Å; Y222-L376 HydrophobicContact CG-CD2 4.17Å; I372-L376 HydrophobicContact CG2-CD1 4.02Å; I372-L376 HydrophobicContact CG2-CG 4.44Å; I372-L376 WeakPolarHBondContact O-CB 3.34Å; I372-L376 VanDerWaalsContact O-CG 3.26Å; I372-L376 WeakPolarHBondContact O-CG 3.46Å; I372-L376 PolarHBondContact O-N 2.97Å; I373-L376 WeakPolarHBondContact O-CB 3.42Å; I373-L376 PolarHBondContact O-N 2.94Å; T374-L376 PolarHBondContact O-N 3.13Å; L376-R379 PolarHBondContact O-N 2.92Å; L376-I380 VanDerWaalsContact O-CG1 3.3Å; L376-I380 WeakPolarHBondContact O-CG1 3.24Å; L376-I380 PolarHBondContact O-N 2.82Å
377	Y	66.2	Low	70.1	Confident	22 Å²	22	76.7 Å²	76.7	9%	0.086	36%	0.363	C	S	.	.	H	α-helix	trans	-62.8	-45.5	175.3	-81.4	-65.3	0	0	0	111.8	I373 T374 R379 I380 F381 I573 F574 T577	I373-Y377 HydrophobicContact CG2-CD2 3.58Å; I373-Y377 HydrophobicContact CG2-CE2 3.45Å; I373-Y377 VanDerWaalsContact CG2-CE2 3.45Å; I373-Y377 VanDerWaalsContact O-CD2 3.25Å; I373-Y377 WeakPolarHBondContact O-CD2 3.41Å; I373-Y377 PolarHBondContact O-N 3.04Å; T374-Y377 PolarHBondContact O-N 3.34Å; Y377-R379 VanDerWaalsContact C-N 3.26Å; Y377-R379 PolarHBondContact O-N 2.92Å; Y377-I380 HydrophobicContact CD1-CD1 4.28Å; Y377-I380 CarbonylContact O-C 3.59Å; Y377-I380 WeakPolarHBondContact O-CA 3.39Å; Y377-I380 WeakPolarHBondContact O-CB 3.44Å; Y377-I380 PolarHBondContact O-N 3.18Å; Y377-I380 VanDerWaalsContact O-N 3.07Å; Y377-F381 WeakPolarHBondContact O-CD2 3.4Å; Y377-F381 PolarHBondContact O-N 3.46Å; Y377-I573 HydrophobicContact CE1-CG2 4.16Å; Y377-I573 WeakPolarHBondContact OH-CG2 3.36Å; Y377-F574 HydrophobicContact CD1-CD2 4.33Å; Y377-F574 HydrophobicContact CG-CD2 4.02Å; Y377-T577 HydrophobicContact CE2-CG2 3.92Å
378	A	70.8	Confident	70.1	Confident	43 Å²	43	77.5 Å²	77.5	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-57.7	-40.3	175.9	0	0	0	0	0	111.6	T374 Y375 F381 R382	T374-A378 VanDerWaalsContact O-CB 3.31Å; T374-A378 WeakPolarHBondContact O-CB 3.17Å; T374-A378 PolarHBondContact O-N 2.84Å; Y375-A378 PolarHBondContact O-N 3.43Å; A378-F381 PolarHBondContact O-N 2.8Å; A378-R382 WeakPolarHBondContact O-CG 3.49Å; A378-R382 PolarHBondContact O-N 3.45Å
379	R	74.3	Confident	69.9	Low	90 Å²	90	76.8 Å²	76.8	34%	0.34	37%	0.367	S	S	.	.	H	α-helix	trans	-66.8	-39.7	174.9	-166.9	176.9	-176.4	-179.2	4.3	112.3	Y222 Y375 L376 Y377 T383	Y222-R379 PolarHBondContact OH-NH1 3.35Å; Y375-R379 WeakPolarHBondContact O-CB 3.47Å; Y375-R379 PolarHBondContact O-N 2.87Å; L376-R379 PolarHBondContact O-N 2.92Å; Y377-R379 VanDerWaalsContact C-N 3.26Å; Y377-R379 PolarHBondContact O-N 2.92Å; R379-T383 WeakPolarHBondContact O-CB 3.19Å; R379-T383 PolarHBondContact O-N 2.9Å; R379-T383 PolarHBondContact O-OG1 3.39Å
380	I	68.7	Low	69.7	Low	18 Å²	18	81.5 Å²	81.5	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-60.3	-48.9	172.3	-67.5	163.1	0	0	0	109.7	Y222 L225 V226 L376 Y377 R382 T383 V384	Y222-I380 HydrophobicContact CD2-CD1 4.05Å; Y222-I380 HydrophobicContact CD2-CG1 3.89Å; L225-I380 HydrophobicContact CD1-CG2 3.83Å; V226-I380 HydrophobicContact CG2-CB 4.41Å; V226-I380 HydrophobicContact CG2-CG1 3.67Å; L376-I380 VanDerWaalsContact O-CG1 3.3Å; L376-I380 WeakPolarHBondContact O-CG1 3.24Å; L376-I380 PolarHBondContact O-N 2.82Å; Y377-I380 HydrophobicContact CD1-CD1 4.28Å; Y377-I380 CarbonylContact O-C 3.59Å; Y377-I380 WeakPolarHBondContact O-CA 3.39Å; Y377-I380 WeakPolarHBondContact O-CB 3.44Å; Y377-I380 PolarHBondContact O-N 3.18Å; Y377-I380 VanDerWaalsContact O-N 3.07Å; I380-R382 PolarHBondContact O-N 3.3Å; I380-T383 PolarHBondContact O-N 2.96Å; I380-V384 HydrophobicContact CG2-CG2 4.22Å; I380-V384 WeakPolarHBondContact O-CB 3.24Å; I380-V384 VanDerWaalsContact O-CG2 3.29Å; I380-V384 WeakPolarHBondContact O-CG2 3.45Å; I380-V384 PolarHBondContact O-N 3.47Å
381	F	69	Low	69.5	Low	68 Å²	68	83.4 Å²	83.4	30%	0.298	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-44.6	178.8	-82.8	-70.9	0	0	0	112.5	Y377 A378 T383 V384 R385 F574	Y377-F381 WeakPolarHBondContact O-CD2 3.4Å; Y377-F381 PolarHBondContact O-N 3.46Å; A378-F381 PolarHBondContact O-N 2.8Å; F381-T383 VanDerWaalsContact C-N 3.35Å; F381-T383 PolarHBondContact O-N 2.9Å; F381-V384 PolarHBondContact O-N 2.9Å; F381-R385 VanDerWaalsContact O-CB 3.25Å; F381-R385 WeakPolarHBondContact O-CB 3.35Å; F381-R385 PolarHBondContact O-N 3.49Å; F381-F574 HydrophobicContact CD2-CD2 4.41Å; F381-F574 HydrophobicContact CE2-CB 3.72Å; F381-F574 AromaticContact CE2-CD1 3.89Å; F381-F574 HydrophobicContact CE2-CD1 3.89Å; F381-F574 AromaticContact CE2-CD2 3.51Å; F381-F574 HydrophobicContact CE2-CD2 3.51Å; F381-F574 HydrophobicContact CE2-CE1 4.37Å; F381-F574 HydrophobicContact CE2-CE2 4.01Å; F381-F574 AromaticContact CE2-CG 3.41Å; F381-F574 HydrophobicContact CE2-CG 3.41Å; F381-F574 VanDerWaalsContact CE2-CG 3.41Å; F381-F574 HydrophobicContact CE2-CZ 4.41Å; F381-F574 HydrophobicContact CZ-CB 3.71Å; F381-F574 AromaticContact CZ-CD1 3.91Å; F381-F574 HydrophobicContact CZ-CD1 3.91Å; F381-F574 HydrophobicContact CZ-CD2 4.28Å; F381-F574 AromaticContact CZ-CG 3.7Å; F381-F574 HydrophobicContact CZ-CG 3.7Å
382	R	71.7	Confident	69	Low	182 Å²	182	83.1 Å²	83.1	69%	0.687	38%	0.383	S	S	*	.	H	α-helix	trans	-59	-46.1	174.3	-76	-176.1	-175.3	175.3	3.1	111.3	A378 I380 V384 R385 E386	A378-R382 WeakPolarHBondContact O-CG 3.49Å; A378-R382 PolarHBondContact O-N 3.45Å; I380-R382 PolarHBondContact O-N 3.3Å; R382-V384 PolarHBondContact O-N 2.96Å; R382-R385 PolarHBondContact O-N 2.86Å; R382-E386 WeakPolarHBondContact O-CB 3.26Å; R382-E386 WeakPolarHBondContact O-CG 3.33Å; R382-E386 PolarHBondContact O-N 3.48Å
383	T	69.1	Low	68.5	Low	33 Å²	33	87.7 Å²	87.7	20%	0.202	40%	0.395	C	S	.	.	H	α-helix	trans	-64.5	-41.1	179.6	-52.6	0	0	0	0	112	R379 I380 F381 N387	R379-T383 WeakPolarHBondContact O-CB 3.19Å; R379-T383 PolarHBondContact O-N 2.9Å; R379-T383 PolarHBondContact O-OG1 3.39Å; I380-T383 PolarHBondContact O-N 2.96Å; F381-T383 VanDerWaalsContact C-N 3.35Å; F381-T383 PolarHBondContact O-N 2.9Å; T383-N387 WeakPolarHBondContact O-CB 3.42Å; T383-N387 PolarHBondContact O-N 3.28Å; T383-N387 PolarHBondContact O-ND2 2.95Å; T383-N387 VanDerWaalsContact O-ND2 3.09Å
384	V	69	Low	67.8	Low	55 Å²	55	94.9 Å²	94.9	33%	0.333	42%	0.42	S	S	.	.	H	α-helix	trans	-66.2	-44.4	176.2	171.9	0	0	0	0	110.6	I380 F381 R382 N387 D388	I380-V384 HydrophobicContact CG2-CG2 4.22Å; I380-V384 WeakPolarHBondContact O-CB 3.24Å; I380-V384 VanDerWaalsContact O-CG2 3.29Å; I380-V384 WeakPolarHBondContact O-CG2 3.45Å; I380-V384 PolarHBondContact O-N 3.47Å; F381-V384 PolarHBondContact O-N 2.9Å; R382-V384 PolarHBondContact O-N 2.96Å; V384-N387 PolarHBondContact O-N 3.45Å; V384-D388 PolarHBondContact O-N 2.83Å
385	R	72.2	Confident	67.3	Low	185 Å²	185	98.1 Å²	98.1	70%	0.698	44%	0.435	S	S	*	.	H	α-helix	trans	-63.3	-43.7	177.5	-173	177.7	-177.4	-176.8	0.7	112	F381 R382 N387 D388 L389	F381-R385 VanDerWaalsContact O-CB 3.25Å; F381-R385 WeakPolarHBondContact O-CB 3.35Å; F381-R385 PolarHBondContact O-N 3.49Å; R382-R385 PolarHBondContact O-N 2.86Å; R385-N387 VanDerWaalsContact C-N 3.33Å; R385-N387 PolarHBondContact O-N 3.28Å; R385-D388 PolarHBondContact O-N 3.34Å; R385-L389 HydrophobicContact CG-CD1 4.21Å; R385-L389 WeakPolarHBondContact O-CB 3.06Å; R385-L389 WeakPolarHBondContact O-CG 3.24Å; R385-L389 PolarHBondContact O-N 3.27Å
386	E	72.7	Confident	66.4	Low	100 Å²	100	95.7 Å²	95.7	47%	0.467	43%	0.434	S	S	.	.	H	α-helix	trans	-60.5	-43	174.1	-79.5	-176.4	-151.4	0	0	111.9	R382 D388 R390	R382-E386 WeakPolarHBondContact O-CB 3.26Å; R382-E386 WeakPolarHBondContact O-CG 3.33Å; R382-E386 PolarHBondContact O-N 3.48Å; E386-D388 VanDerWaalsContact C-N 3.32Å; E386-D388 PolarHBondContact O-N 3.22Å; E386-R390 WeakPolarHBondContact O-CB 3.22Å; E386-R390 VanDerWaalsContact O-CG 3.25Å; E386-R390 WeakPolarHBondContact O-CG 3.23Å; E386-R390 PolarHBondContact O-N 3.14Å; E386-R390 IonicContact OE2-NH2 3.07Å; E386-R390 PolarHBondContact OE2-NH2 3.41Å; E386-R390 VanDerWaalsContact OE2-NH2 3.07Å
387	N	65.5	Low	65.9	Low	77 Å²	77	97.6 Å²	97.6	41%	0.412	45%	0.448	S	S	.	.	H	α-helix	trans	-65.8	-35.8	177.4	-79.4	-37	0	0	0	112.2	T383 V384 R385 K391	T383-N387 WeakPolarHBondContact O-CB 3.42Å; T383-N387 PolarHBondContact O-N 3.28Å; T383-N387 PolarHBondContact O-ND2 2.95Å; T383-N387 VanDerWaalsContact O-ND2 3.09Å; V384-N387 PolarHBondContact O-N 3.45Å; R385-N387 VanDerWaalsContact C-N 3.33Å; R385-N387 PolarHBondContact O-N 3.28Å; N387-K391 WeakPolarHBondContact O-CG 3.18Å; N387-K391 PolarHBondContact O-N 2.95Å
388	D	66.8	Low	65.2	Low	84 Å²	84	101.2 Å²	101.2	45%	0.449	46%	0.464	S	S	.	.	H	α-helix	trans	-71.5	-44.1	177	-158.4	40.2	0	0	0	111.8	V384 R385 E386 R390 K391 Q392	V384-D388 PolarHBondContact O-N 2.83Å; R385-D388 PolarHBondContact O-N 3.34Å; E386-D388 VanDerWaalsContact C-N 3.32Å; E386-D388 PolarHBondContact O-N 3.22Å; D388-R390 VanDerWaalsContact C-N 3.32Å; D388-R390 PolarHBondContact O-N 3Å; D388-K391 WeakPolarHBondContact O-CB 3.38Å; D388-K391 PolarHBondContact O-N 2.97Å; D388-K391 VanDerWaalsContact O-N 3.08Å; D388-Q392 WeakPolarHBondContact O-CG 3.13Å; D388-Q392 PolarHBondContact O-N 3.46Å
389	L	68.3	Low	64.1	Low	80 Å²	80	104.7 Å²	104.7	42%	0.419	48%	0.477	S	S	.	.	H	α-helix	trans	-60.6	-40.1	173	-72.1	172.8	0	0	0	112	R385 Q392 R393	R385-L389 HydrophobicContact CG-CD1 4.21Å; R385-L389 WeakPolarHBondContact O-CB 3.06Å; R385-L389 WeakPolarHBondContact O-CG 3.24Å; R385-L389 PolarHBondContact O-N 3.27Å; L389-Q392 PolarHBondContact O-N 3.43Å; L389-R393 WeakPolarHBondContact O-CG 3.34Å; L389-R393 PolarHBondContact O-N 3.03Å
390	R	65.6	Low	63	Low	136 Å²	136	104.8 Å²	104.8	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-48.6	172.2	-74.6	178.1	-150.3	-172.9	9.5	110.1	E386 D388 Q392 R393 W394	E386-R390 WeakPolarHBondContact O-CB 3.22Å; E386-R390 VanDerWaalsContact O-CG 3.25Å; E386-R390 WeakPolarHBondContact O-CG 3.23Å; E386-R390 PolarHBondContact O-N 3.14Å; E386-R390 IonicContact OE2-NH2 3.07Å; E386-R390 PolarHBondContact OE2-NH2 3.41Å; E386-R390 VanDerWaalsContact OE2-NH2 3.07Å; D388-R390 VanDerWaalsContact C-N 3.32Å; D388-R390 PolarHBondContact O-N 3Å; R390-Q392 VanDerWaalsContact C-N 3.34Å; R390-Q392 PolarHBondContact O-N 2.63Å; R390-R393 WeakPolarHBondContact O-CB 3.47Å; R390-R393 PolarHBondContact O-N 3.39Å; R390-W394 PolarHBondContact O-N 3.36Å
391	K	65.3	Low	62	Low	107 Å²	107	108.9 Å²	108.9	47%	0.465	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-40.4	178.4	-77.7	178.5	-179.3	178.1	0	112.9	N387 D388 W394 L395	N387-K391 WeakPolarHBondContact O-CG 3.18Å; N387-K391 PolarHBondContact O-N 2.95Å; D388-K391 WeakPolarHBondContact O-CB 3.38Å; D388-K391 PolarHBondContact O-N 2.97Å; D388-K391 VanDerWaalsContact O-N 3.08Å; K391-W394 PolarHBondContact O-N 3.33Å; K391-L395 WeakPolarHBondContact O-CG 3.27Å; K391-L395 PolarHBondContact O-N 3.38Å
392	Q	61.7	Low	60.9	Low	101 Å²	101	111.3 Å²	111.3	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-41.9	174.6	-70.9	-179.2	-3.6	0	0	111.7	D388 L389 R390 W394 L395 T396	D388-Q392 WeakPolarHBondContact O-CG 3.13Å; D388-Q392 PolarHBondContact O-N 3.46Å; L389-Q392 PolarHBondContact O-N 3.43Å; R390-Q392 VanDerWaalsContact C-N 3.34Å; R390-Q392 PolarHBondContact O-N 2.63Å; Q392-W394 PolarHBondContact O-N 3.27Å; Q392-L395 PolarHBondContact O-N 2.72Å; Q392-T396 PolarHBondContact O-N 3.43Å; Q392-T396 PolarHBondContact O-OG1 3.2Å
393	R	61.9	Low	59.6	Low	184 Å²	184	106.1 Å²	106.1	69%	0.694	51%	0.509	S	S	*	.	H	α-helix	trans	-61	-42.2	173	-71.3	-178	-169.7	-172.9	3	112	L389 R390 L395 T396 V397	L389-R393 WeakPolarHBondContact O-CG 3.34Å; L389-R393 PolarHBondContact O-N 3.03Å; R390-R393 WeakPolarHBondContact O-CB 3.47Å; R390-R393 PolarHBondContact O-N 3.39Å; R393-L395 VanDerWaalsContact C-N 3.33Å; R393-L395 PolarHBondContact O-N 2.86Å; R393-T396 PolarHBondContact O-N 2.83Å; R393-V397 WeakPolarHBondContact O-CB 3.45Å; R393-V397 VanDerWaalsContact O-CG2 3.27Å; R393-V397 WeakPolarHBondContact O-CG2 3.32Å; R393-V397 PolarHBondContact O-N 3.44Å
394	W	54.9	Low	58.4	Low	184 Å²	184	107.2 Å²	107.2	70%	0.697	52%	0.518	S	S	*	.	H	α-helix	trans	-63.2	-35.8	176	-74.3	105.3	0	0	0	113.2	R390 K391 Q392 K398	R390-W394 PolarHBondContact O-N 3.36Å; K391-W394 PolarHBondContact O-N 3.33Å; Q392-W394 PolarHBondContact O-N 3.27Å; W394-K398 PolarHBondContact O-N 2.75Å
395	L	58.2	Low	57.1	Low	126 Å²	126	111.3 Å²	111.3	66%	0.66	54%	0.535	S	S	*	.	H	α-helix	trans	-70.2	-40.5	174.8	-71.9	167.8	0	0	0	111.5	K391 Q392 R393 K398 N399	K391-L395 WeakPolarHBondContact O-CG 3.27Å; K391-L395 PolarHBondContact O-N 3.38Å; Q392-L395 PolarHBondContact O-N 2.72Å; R393-L395 VanDerWaalsContact C-N 3.33Å; R393-L395 PolarHBondContact O-N 2.86Å; L395-K398 PolarHBondContact O-N 3.34Å; L395-N399 PolarHBondContact O-N 2.92Å; L395-N399 VanDerWaalsContact O-N 3.14Å
396	T	56.5	Low	55.7	Low	90 Å²	90	109.1 Å²	109.1	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-44.8	178.9	-44.8	0	0	0	0	111.3	Q392 R393 K398 N399 V400	Q392-T396 PolarHBondContact O-N 3.43Å; Q392-T396 PolarHBondContact O-OG1 3.2Å; R393-T396 PolarHBondContact O-N 2.83Å; T396-K398 VanDerWaalsContact C-N 3.33Å; T396-K398 PolarHBondContact O-N 2.94Å; T396-N399 PolarHBondContact O-N 3.02Å; T396-N399 VanDerWaalsContact O-N 3.16Å; T396-V400 WeakPolarHBondContact O-CG2 3.23Å; T396-V400 PolarHBondContact O-N 2.9Å; T396-V400 VanDerWaalsContact O-N 3.12Å
397	V	55.1	Low	54.4	Low	84 Å²	84	110 Å²	110	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-35.6	178.1	172.9	0	0	0	0	112	R393 N401	R393-V397 WeakPolarHBondContact O-CB 3.45Å; R393-V397 VanDerWaalsContact O-CG2 3.27Å; R393-V397 WeakPolarHBondContact O-CG2 3.32Å; R393-V397 PolarHBondContact O-N 3.44Å; V397-N401 PolarHBondContact O-N 3.47Å
398	K	51.3	Low	53.4	Low	99 Å²	99	111.9 Å²	111.9	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-65.5	-41	173.3	-83.7	-176	175.7	-179.7	0	111.8	W394 L395 T396 V400 N401 Y402	W394-K398 PolarHBondContact O-N 2.75Å; L395-K398 PolarHBondContact O-N 3.34Å; T396-K398 VanDerWaalsContact C-N 3.33Å; T396-K398 PolarHBondContact O-N 2.94Å; K398-V400 VanDerWaalsContact C-N 3.34Å; K398-V400 PolarHBondContact O-N 3.4Å; K398-N401 PolarHBondContact O-N 3.45Å; K398-Y402 VanDerWaalsContact O-CD2 3.29Å; K398-Y402 WeakPolarHBondContact O-CD2 3.36Å; K398-Y402 PolarHBondContact O-N 2.88Å
399	N	48.4	Very low	52.3	Low	116 Å²	116	114 Å²	114	62%	0.62	56%	0.558	S	S	*	*	H	α-helix	trans	-67.9	-34.7	-178.7	-125.9	-2.8	0	0	0	112.5	L395 T396 S403	L395-N399 PolarHBondContact O-N 2.92Å; L395-N399 VanDerWaalsContact O-N 3.14Å; T396-N399 PolarHBondContact O-N 3.02Å; T396-N399 VanDerWaalsContact O-N 3.16Å; N399-S403 WeakPolarHBondContact O-CB 3.19Å; N399-S403 PolarHBondContact O-N 3.43Å
400	V	51.5	Low	51.1	Low	92 Å²	92	118.3 Å²	118.3	56%	0.558	57%	0.573	S	S	*	*	H	α-helix	trans	-66.7	-42.8	174.6	-179.4	0	0	0	0	111.2	T396 K398 S403 S404	T396-V400 WeakPolarHBondContact O-CG2 3.23Å; T396-V400 PolarHBondContact O-N 2.9Å; T396-V400 VanDerWaalsContact O-N 3.12Å; K398-V400 VanDerWaalsContact C-N 3.34Å; K398-V400 PolarHBondContact O-N 3.4Å; V400-S403 PolarHBondContact O-N 3.36Å; V400-S404 PolarHBondContact O-N 3.32Å; V400-S404 PolarHBondContact O-OG 2.98Å
401	N	48.1	Very low	50.1	Low	103 Å²	103	115.5 Å²	115.5	55%	0.551	57%	0.574	S	S	*	*	H	α-helix	trans	-72.5	-29.2	-179.7	-85	-2.7	0	0	0	114.5	V397 K398 S404 M405	V397-N401 PolarHBondContact O-N 3.47Å; K398-N401 PolarHBondContact O-N 3.45Å; N401-S404 PolarHBondContact O-OG 3.49Å; N401-M405 VanDerWaalsContact O-CB 3.27Å; N401-M405 WeakPolarHBondContact O-CB 3.34Å; N401-M405 PolarHBondContact O-N 3.03Å
402	Y	46.3	Very low	48.9	Very low	119 Å²	119	116.7 Å²	116.7	47%	0.467	59%	0.586	S	S	.	*	H	α-helix	trans	-76.1	-30.9	172.9	-84.2	-80.8	0	0	0	112.2	K398 K406	K398-Y402 VanDerWaalsContact O-CD2 3.29Å; K398-Y402 WeakPolarHBondContact O-CD2 3.36Å; K398-Y402 PolarHBondContact O-N 2.88Å; Y402-K406 WeakPolarHBondContact O-CB 3.46Å; Y402-K406 PolarHBondContact O-N 3.3Å
403	S	42.7	Very low	47.8	Very low	73 Å²	73	116.1 Å²	116.1	51%	0.51	59%	0.593	S	S	.	*	H	α-helix	trans	-75.1	-41.5	178.3	-149.1	0	0	0	0	112.3	N399 V400 M405 K406 I407	N399-S403 WeakPolarHBondContact O-CB 3.19Å; N399-S403 PolarHBondContact O-N 3.43Å; V400-S403 PolarHBondContact O-N 3.36Å; S403-M405 PolarHBondContact O-N 3.33Å; S403-K406 PolarHBondContact O-N 2.88Å; S403-I407 WeakPolarHBondContact O-CG1 3.41Å; S403-I407 PolarHBondContact O-N 3.33Å
404	S	44	Very low	46.5	Very low	56 Å²	56	116.5 Å²	116.5	39%	0.392	60%	0.6	S	S	.	*	H	α-helix	trans	-67.8	-33.2	176.2	52.1	0	0	0	0	113.1	V400 N401 L408	V400-S404 PolarHBondContact O-N 3.32Å; V400-S404 PolarHBondContact O-OG 2.98Å; N401-S404 PolarHBondContact O-OG 3.49Å; S404-L408 PolarHBondContact O-N 3.23Å
405	M	42.8	Very low	45.5	Very low	141 Å²	141	115.8 Å²	115.8	70%	0.695	61%	0.609	S	S	*	*	H	α-helix	trans	-78.2	-26.1	178.2	-154.3	169.8	170.8	0	0	112.8	N401 S403 N409	N401-M405 VanDerWaalsContact O-CB 3.27Å; N401-M405 WeakPolarHBondContact O-CB 3.34Å; N401-M405 PolarHBondContact O-N 3.03Å; S403-M405 PolarHBondContact O-N 3.33Å; M405-N409 WeakPolarHBondContact O-CB 3.23Å; M405-N409 PolarHBondContact O-N 2.92Å
406	K	42.6	Very low	44.2	Very low	139 Å²	139	119 Å²	119	60%	0.604	62%	0.621	S	S	*	*	H	α-helix	trans	-75.5	-24.9	173.6	-137.6	174.6	-172.1	177.8	0	112.7	Y402 S403	Y402-K406 WeakPolarHBondContact O-CB 3.46Å; Y402-K406 PolarHBondContact O-N 3.3Å; S403-K406 PolarHBondContact O-N 2.88Å
407	I	45.6	Very low	42.8	Very low	118 Å²	118	120.6 Å²	120.6	61%	0.605	64%	0.636	S	S	*	*	H	α-helix	trans	-77.9	-42.2	174.1	-64.4	165.8	0	0	0	110.3	S403 N409 K410 S411	S403-I407 WeakPolarHBondContact O-CG1 3.41Å; S403-I407 PolarHBondContact O-N 3.33Å; I407-N409 PolarHBondContact O-N 3.48Å; I407-K410 PolarHBondContact O-N 2.81Å; I407-S411 PolarHBondContact O-N 3.04Å; I407-S411 PolarHBondContact O-OG 3.44Å
408	L	44.3	Very low	41.8	Very low	118 Å²	118	121.8 Å²	121.8	62%	0.618	65%	0.648	S	S	*	*	H	α-helix	trans	-70.4	-28.8	178.1	-110.9	103.6	0	0	0	114.4	S404 K410 S411	S404-L408 PolarHBondContact O-N 3.23Å; L408-K410 VanDerWaalsContact C-N 3.34Å; L408-S411 PolarHBondContact O-OG 2.88Å
409	N	42.8	Very low	41	Very low	127 Å²	127	123.1 Å²	123.1	68%	0.679	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-6.9	179.3	-131.8	18	0	0	0	113.4	M405 I407	M405-N409 WeakPolarHBondContact O-CB 3.23Å; M405-N409 PolarHBondContact O-N 2.92Å; I407-N409 PolarHBondContact O-N 3.48Å
410	K	43.9	Very low	40.3	Very low	171 Å²	171	127.2 Å²	127.2	74%	0.743	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-18.6	174.5	-155.4	174	-175.3	-176.5	0	112.3	I407 L408	I407-K410 PolarHBondContact O-N 2.81Å; L408-K410 VanDerWaalsContact C-N 3.34Å
411	S	44.4	Very low	39.3	Very low	77 Å²	77	129 Å²	129	54%	0.538	68%	0.679	S	S	.	*	S	Bend	trans	-84.7	-12.2	175.4	51.7	0	0	0	0	114.3	I407 L408	I407-S411 PolarHBondContact O-N 3.04Å; I407-S411 PolarHBondContact O-OG 3.44Å; L408-S411 PolarHBondContact O-OG 2.88Å
412	N	40.6	Very low	38.6	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	69%	0.694	S	S	*	*	S	Bend	trans	-104.7	7.8	-178	-74.3	-2.9	0	0	0	114.5
413	S	37.7	Very low	37.9	Very low	90 Å²	90	133 Å²	133	63%	0.629	71%	0.712	S	S	*	*	S	Bend	trans	-111.8	22.3	179.2	67.9	0	0	0	0	113.7
414	F	34.1	Very low	37.5	Very low	192 Å²	192	135.1 Å²	135.1	84%	0.842	72%	0.721	S	S	*	*	S	Bend	trans	-118.3	10.8	-178.2	-137.7	-93.4	0	0	0	114
415	L	34.3	Very low	37.2	Very low	168 Å²	168	138.5 Å²	138.5	88%	0.88	74%	0.74	S	S	*	*	S	Bend	trans	-132.3	62.2	177.1	-78.3	169.8	0	0	0	110.7
416	Q	31.3	Very low	36.8	Very low	193 Å²	193	139 Å²	139	90%	0.902	75%	0.745	S	S	*	*	S	Bend	trans	-165.1	123.7	157	-123.6	158.8	-2.7	0	0	108.7
417	S	27.6	Very low	36.6	Very low	125 Å²	125	138.1 Å²	138.1	87%	0.874	75%	0.753	S	S	*	*			trans	104.3	75.7	175.6	-162.6	0	0	0	0	116.4
418	S	33.7	Very low	36	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	76%	0.756	S	S	*	*			trans	-136.6	102.9	139.2	58.7	0	0	0	0	107.2
419	V	35.2	Very low	35.4	Very low	127 Å²	127	137 Å²	137	77%	0.77	77%	0.769	S	S	*	*				78.6	94.8	101.6	174.1	0	0	0	0	110
420	Y	32.5	Very low	34.9	Very low	202 Å²	202	138.3 Å²	138.3	79%	0.792	77%	0.774	S	S	*	*				76.1	117.8	92.9	-112.6	-90	0	0	0	113.9
421	D	30.4	Very low	34.3	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	77%	0.773	S	S	*	*			trans	48	119.2	152.8	-60.1	-9.3	0	0	0	121.2
422	S	34.6	Very low	33.9	Very low	125 Å²	125	140.6 Å²	140.6	87%	0.874	78%	0.779	S	S	*	*				173.8	145.6	97.9	-95.2	0	0	0	0	111.9
423	E	31.1	Very low	33.7	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	78%	0.784	S	S	*	*			trans	-83.8	170.9	-170.7	-164.1	175.2	-152	0	0	112.1
424	V	35	Very low	33.6	Very low	117 Å²	117	139.5 Å²	139.5	71%	0.709	79%	0.787	S	S	*	*			trans	103	101.4	153.4	-170.1	0	0	0	0	119.2
425	V	36.1	Very low	33.6	Very low	128 Å²	128	139.2 Å²	139.2	78%	0.776	79%	0.788	S	S	*	*			trans	81.6	100.8	131.8	-178.4	0	0	0	0	121.5
426	D	34.7	Very low	33.7	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	78%	0.775	S	S	*	*				51.8	159.2	112.5	-108.5	4.1	0	0	0	122.8
427	P	38	Very low	33.9	Very low	119 Å²	119	134.8 Å²	134.8	77%	0.773	77%	0.773	S	S	*	*				-124.4	171.2	-115.7	34.6	-14.6	0	0	0	114.5
428	G	33	Very low	34.2	Very low	65 Å²	65	133 Å²	133	67%	0.67	76%	0.76	S	S	*	*			trans	165.5	134.4	161.8	0	0	0	0	0	117.3
429	V	33.6	Very low	34.1	Very low	147 Å²	147	134.2 Å²	134.2	89%	0.891	76%	0.763	S	S	*	*			trans	76.9	134.6	146.5	-172.6	0	0	0	0	116
430	M	30.6	Very low	33.8	Very low	156 Å²	156	133 Å²	133	77%	0.768	76%	0.76	S	S	*	*			cis	179.9	159.4	-17.2	-153.3	-175.5	-171.4	0	0	105.3
431	K	32.7	Very low	33.9	Very low	166 Å²	166	128.7 Å²	128.7	72%	0.722	76%	0.76	S	S	*	*			trans	75.2	139.9	154.2	-80.6	-173.8	160.9	175.8	0	117.8
432	L	35.8	Very low	34.1	Very low	130 Å²	130	130.1 Å²	130.1	68%	0.681	77%	0.766	S	S	*	*			cis	-168	134.5	20.7	-111.2	157.4	0	0	0	111.4
433	T	35.1	Very low	34.2	Very low	132 Å²	132	129.2 Å²	129.2	81%	0.81	76%	0.757	S	S	*	*			trans	61.2	136.8	134.9	46.3	0	0	0	0	126.4
434	G	35.3	Very low	34.4	Very low	66 Å²	66	129 Å²	129	68%	0.68	76%	0.761	S	S	*	*			trans	133.9	78.8	149.3	0	0	0	0	0	113
435	E	35.4	Very low	34.2	Very low	186 Å²	186	130.3 Å²	130.3	87%	0.869	76%	0.763	S	S	*	*				53.5	133.2	91.5	-71.3	-175.4	173.1	0	0	113.5
436	S	35.6	Very low	34.2	Very low	86 Å²	86	132.5 Å²	132.5	60%	0.601	77%	0.765	S	S	*	*			cis	-178.3	155.9	1.1	33.7	0	0	0	0	108
437	E	35.4	Very low	34.2	Very low	183 Å²	183	132.6 Å²	132.6	86%	0.855	76%	0.76	S	S	*	*			trans	64.4	150.1	144.7	-72.4	167.7	-169	0	0	121.3
438	S	34.8	Very low	33.9	Very low	86 Å²	86	136 Å²	136	60%	0.601	76%	0.763	S	S	*	*			cis	173.9	138	-26.6	46.2	0	0	0	0	106.4
439	T	31.2	Very low	33.8	Very low	134 Å²	134	138 Å²	138	82%	0.822	76%	0.764	S	S	*	*			trans	59.4	154.3	149.9	54.4	0	0	0	0	119.4
440	S	28.8	Very low	33.7	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	76%	0.759	S	S	*	*			cis	174.1	134.7	-18.7	57.9	0	0	0	0	104.4
441	S	35.4	Very low	33.5	Very low	112 Å²	112	139.6 Å²	139.6	78%	0.783	76%	0.759	S	S	*	*			trans	152.4	107.7	139.3	64	0	0	0	0	115.1
442	I	33.2	Very low	33.4	Very low	161 Å²	161	140.5 Å²	140.5	83%	0.826	77%	0.766	S	S	*	*				30.6	162.2	129	-12.6	-177.8	0	0	0	121.6
443	P	37.9	Very low	33	Very low	105 Å²	105	140.2 Å²	140.2	68%	0.682	77%	0.765	S	S	*	*				-126.3	174.9	-86.9	41.2	-24.8	0	0	0	113.7
444	L	34.1	Very low	32.7	Very low	177 Å²	177	140.3 Å²	140.3	93%	0.927	77%	0.77	S	S	*	*			trans	-165.7	148.6	140.5	-131.1	80.4	0	0	0	114.2
445	N	30.7	Very low	32.4	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	77%	0.77	S	S	*	*			trans	-62.1	147.1	-169.6	-102.7	-34.3	0	0	0	119
446	H	36.8	Very low	32	Very low	174 Å²	174	141 Å²	141	81%	0.806	76%	0.763	S	S	*	*				-169.2	99.5	128.5	-96.6	-14.6	0	0	0	109.9
447	Q	34	Very low	31.7	Very low	153 Å²	153	145.3 Å²	145.3	72%	0.715	78%	0.778	S	S	*	*				84.1	92.6	84.9	-156.6	179.3	15.9	0	0	115.6
448	K	32.4	Very low	31.3	Very low	192 Å²	192	145.4 Å²	145.4	84%	0.835	78%	0.779	S	S	*	*				165.4	149.5	120.4	-92.6	-170.7	178	170	0	112.7
449	P	30.6	Very low	31.1	Very low	105 Å²	105	146.9 Å²	146.9	68%	0.682	79%	0.789	S	S	*	*			trans	-127.1	179.4	-137	28.5	-5.7	0	0	0	115.4
450	H	31.2	Very low	30.9	Very low	173 Å²	173	151.5 Å²	151.5	80%	0.801	79%	0.791	S	S	*	*			trans	99.5	97.9	157.8	-75.9	-70.2	0	0	0	119.8
451	E	27.8	Very low	31	Very low	164 Å²	164	158.3 Å²	158.3	77%	0.766	80%	0.802	S	S	*	*			trans	-33.7	137.4	143	-65.4	169.8	123.4	0	0	114
452	H	30.5	Very low	30.7	Very low	185 Å²	185	158.7 Å²	158.7	86%	0.856	80%	0.804	S	S	*	*			trans	-133.9	99.7	146.4	-113.2	-51.4	0	0	0	110.1	C454	H452-C454 PolarHBondContact O-N 2.88Å
453	N	27.3	Very low	30.5	Very low	124 Å²	124	153.9 Å²	153.9	66%	0.663	79%	0.794	S	S	*	*			trans	-55.3	115.8	154.4	-90.1	-35.6	0	0	0	109.3	H455	N453-H455 VanDerWaalsContact C-N 3.3Å; N453-H455 PolarHBondContact O-N 3.08Å
454	C	27.7	Very low	30.1	Very low	134 Å²	134	156.3 Å²	156.3	91%	0.905	80%	0.801	S	S	*	*			trans	-89.1	72.6	162.8	-97	0	0	0	0	109.8	H452	H452-C454 PolarHBondContact O-N 2.88Å
455	H	29.1	Very low	29.9	Very low	150 Å²	150	153.1 Å²	153.1	69%	0.694	79%	0.793	S	S	*	*			trans	-77.5	122.5	156.6	-94.1	-84.2	0	0	0	109.4	N453	N453-H455 VanDerWaalsContact C-N 3.3Å; N453-H455 PolarHBondContact O-N 3.08Å
456	T	26.5	Very low	29.7	Very low	118 Å²	118	156.6 Å²	156.6	72%	0.724	80%	0.797	S	S	*	*			trans	22	105.6	141.1	39.3	0	0	0	0	118.1
457	L	29.8	Very low	29.4	Very low	175 Å²	175	159.6 Å²	159.6	92%	0.916	80%	0.801	S	S	*	*			trans	-124.5	91.9	149.1	-99.2	164.1	0	0	0	110.5	S459	L457-S459 PolarHBondContact O-N 3.35Å
458	Q	27.3	Very low	29.2	Very low	186 Å²	186	159 Å²	159	87%	0.869	80%	0.802	S	S	*	*			trans	-66.1	98.4	166.8	-172.1	175.6	18.3	0	0	109
459	S	30.1	Very low	29.2	Very low	117 Å²	117	157.5 Å²	157.5	82%	0.818	80%	0.802	S	S	*	*			trans	-101.2	106.8	168.1	-176.9	0	0	0	0	110.8	L457 R461	L457-S459 PolarHBondContact O-N 3.35Å; S459-R461 PolarHBondContact O-N 2.93Å
460	R	26.7	Very low	29.2	Very low	230 Å²	230	161.5 Å²	161.5	87%	0.868	81%	0.808	S	S	*	*			trans	-54	119.2	169.6	-76.7	170.6	162.6	169.3	-4.9	111
461	R	31.1	Very low	29.1	Very low	246 Å²	246	159 Å²	159	93%	0.928	80%	0.797	S	S	*	*			trans	-144.7	95.5	134.7	-125.5	173.9	-176.3	178.4	1.8	111.2	S459	S459-R461 PolarHBondContact O-N 2.93Å
462	S	29.8	Very low	29.2	Very low	120 Å²	120	156.9 Å²	156.9	84%	0.839	79%	0.79	S	S	*	*			trans	-46.1	139.8	166.8	45.8	0	0	0	0	114.2
463	G	29.1	Very low	29	Very low	59 Å²	59	151.3 Å²	151.3	61%	0.608	77%	0.772	S	S	*	*			trans	161.2	74.9	158.7	0	0	0	0	0	117.4
464	L	29	Very low	29.2	Very low	157 Å²	157	150.3 Å²	150.3	82%	0.822	77%	0.774	S	S	*	*			trans	87.5	108.8	150.9	-84.1	81.5	0	0	0	122.1
465	S	29.7	Very low	29.3	Very low	110 Å²	110	151.2 Å²	151.2	77%	0.769	77%	0.769	S	S	*	*			trans	71.6	70.3	133.8	-69.5	0	0	0	0	120.4
466	Y	26.5	Very low	29.4	Very low	216 Å²	216	151.2 Å²	151.2	85%	0.847	77%	0.77	S	S	*	*			trans	-84.9	97.4	153.3	-24	-85.9	0	0	0	108.9
467	R	30.4	Very low	29.5	Very low	238 Å²	238	151.1 Å²	151.1	90%	0.898	77%	0.769	S	S	*	*			trans	-149.9	122.8	163.3	-109.7	179.8	177	-178.3	-1.3	109.3
468	L	31	Very low	29.6	Very low	139 Å²	139	149.7 Å²	149.7	73%	0.728	76%	0.761	S	S	*	*			trans	90.1	70.3	176.5	-67.2	133.9	0	0	0	117.8	R111	R111-L468 VanDerWaalsContact NH2-CD1 3.34Å
469	I	31.9	Very low	29.8	Very low	162 Å²	162	147.6 Å²	147.6	83%	0.831	76%	0.761	S	S	*	*			trans	-134.7	82.7	138.8	-57.3	179.7	0	0	0	107.7
470	K	31.6	Very low	29.9	Very low	188 Å²	188	148.4 Å²	148.4	82%	0.817	76%	0.756	S	S	*	*			trans	-85.3	109.5	151.6	-111.4	-173.4	171.8	-177.2	0	104.9
471	Q	28.9	Very low	30	Very low	120 Å²	120	145 Å²	145	56%	0.561	75%	0.75	S	S	*	*				76.4	98.3	88.7	-163.3	179.1	11.5	0	0	110.2
472	L	29.1	Very low	30	Very low	121 Å²	121	143.7 Å²	143.7	63%	0.634	75%	0.746	S	S	*	*			trans	-177.8	100.9	141.8	-96	143.9	0	0	0	107.8
473	S	26.9	Very low	29.9	Very low	67 Å²	67	145.2 Å²	145.2	47%	0.469	75%	0.745	S	S	.	*			trans	-103.7	111.3	162.1	179.4	0	0	0	0	104.3
474	C	30.7	Very low	30	Very low	104 Å²	104	149.1 Å²	149.1	70%	0.703	76%	0.757	S	S	*	*			trans	-135	88.9	170.5	-69.9	0	0	0	0	107
475	D	29.5	Very low	30	Very low	152 Å²	152	150.4 Å²	150.4	81%	0.813	76%	0.759	S	S	*	*			trans	-80.1	106.3	142.2	-80.8	-30.1	0	0	0	105.5
476	Q	31.9	Very low	29.9	Very low	150 Å²	150	150.1 Å²	150.1	70%	0.701	76%	0.756	S	S	*	*			trans	176.9	125.7	148.9	-103.5	-177.8	-44.3	0	0	109.8
477	V	29	Very low	30.1	Very low	116 Å²	116	146.5 Å²	146.5	70%	0.703	75%	0.75	S	S	*	*			trans	76	100.2	140.4	-178.5	0	0	0	0	115.9
478	I	31.2	Very low	30	Very low	146 Å²	146	143.5 Å²	143.5	75%	0.749	75%	0.746	S	S	*	*				171.2	96	120.5	-76.3	147.6	0	0	0	106.3
479	T	32.3	Very low	29.9	Very low	142 Å²	142	146.1 Å²	146.1	87%	0.871	75%	0.746	S	S	*	*			trans	-108.8	102.5	151.7	46.7	0	0	0	0	105.4
480	N	30.8	Very low	29.8	Very low	133 Å²	133	145.4 Å²	145.4	71%	0.711	74%	0.744	S	S	*	*			trans	-89.4	134.7	159.4	-88.7	-3.3	0	0	0	107.8
481	Q	29.7	Very low	29.9	Very low	160 Å²	160	142.1 Å²	142.1	75%	0.748	74%	0.74	S	S	*	*			trans	63.9	96.5	159.2	-72.3	164.8	-59.9	0	0	116.1
482	Y	31.5	Very low	30.1	Very low	217 Å²	217	143.3 Å²	143.3	85%	0.851	75%	0.749	S	S	*	*				-169.9	138.8	91.2	-100.3	-81.8	0	0	0	108.5	T484	Y482-T484 PolarHBondContact O-N 3.49Å
483	D	26.3	Very low	30.3	Very low	153 Å²	153	146.8 Å²	146.8	82%	0.818	76%	0.759	S	S	*	*			trans	-50.2	129.4	-177.3	-69.7	-59	0	0	0	113.5
484	T	31.7	Very low	30.6	Very low	140 Å²	140	151.6 Å²	151.6	86%	0.859	77%	0.772	S	S	*	*			trans	-170.9	115.5	130.2	15.7	0	0	0	0	109.3	Y482	Y482-T484 PolarHBondContact O-N 3.49Å
485	Q	29.7	Very low	30.5	Very low	184 Å²	184	157.7 Å²	157.7	86%	0.86	78%	0.78	S	S	*	*			trans	-42.8	147.6	156.9	-58.5	167.1	-10.5	0	0	108.7
486	C	27.4	Very low	30.7	Very low	104 Å²	104	154.6 Å²	154.6	70%	0.703	78%	0.776	S	S	*	*			cis	-177.5	165.8	29.8	-142.2	0	0	0	0	108.3
487	I	31.4	Very low	30.6	Very low	140 Å²	140	154.8 Å²	154.8	72%	0.718	78%	0.782	S	S	*	*			trans	87.9	113.1	150.7	-55.8	150.8	0	0	0	118.6
488	Q	27.6	Very low	30.6	Very low	175 Å²	175	156 Å²	156	82%	0.818	78%	0.784	S	S	*	*			trans	-81.8	114	176.8	-174	-178.3	-2.1	0	0	110.6	N490	Q488-N490 PolarHBondContact O-N 2.84Å
489	W	28.7	Very low	30.6	Very low	195 Å²	195	158 Å²	158	74%	0.739	79%	0.787	S	S	*	*			trans	-92.6	95.1	172.1	-88.1	97.6	0	0	0	110.7	L492	W489-L492 HydrophobicContact CH2-CD1 4.02Å; W489-L492 HydrophobicContact CZ3-CB 4.14Å; W489-L492 HydrophobicContact CZ3-CD1 3.6Å; W489-L492 HydrophobicContact CZ3-CG 4.43Å
490	N	29.8	Very low	30.4	Very low	146 Å²	146	157.6 Å²	157.6	78%	0.781	79%	0.785	S	S	*	*			trans	-141.3	50.6	166.5	-115.8	5	0	0	0	111.6	Q488	Q488-N490 PolarHBondContact O-N 2.84Å
491	T	34.3	Very low	30.5	Very low	119 Å²	119	157.2 Å²	157.2	73%	0.73	79%	0.789	S	S	*	*			trans	-163.7	94.1	164.5	28.1	0	0	0	0	107.7
492	L	32.6	Very low	30.4	Very low	145 Å²	145	154.1 Å²	154.1	76%	0.759	79%	0.785	S	S	*	*			trans	-172.5	88.3	145	-102.3	149	0	0	0	110.8	W489	W489-L492 HydrophobicContact CH2-CD1 4.02Å; W489-L492 HydrophobicContact CZ3-CB 4.14Å; W489-L492 HydrophobicContact CZ3-CD1 3.6Å; W489-L492 HydrophobicContact CZ3-CG 4.43Å
493	K	33.9	Very low	30.5	Very low	194 Å²	194	150.8 Å²	150.8	84%	0.843	78%	0.78	S	S	*	*			trans	-80.9	103.4	157	-174.6	-176.4	-171.6	-179.9	0	106.5
494	K	32.8	Very low	30.6	Very low	169 Å²	169	147.9 Å²	147.9	74%	0.735	77%	0.772	S	S	*	*			trans	149.7	121.3	145	-87.3	171.5	176	177.7	0	113.3
495	R	28.9	Very low	30.5	Very low	231 Å²	231	147.2 Å²	147.2	87%	0.872	77%	0.768	S	S	*	*			trans	76.2	153.2	141.8	-65.7	-178.4	178.8	-179.7	-1	119.9
496	A	34.2	Very low	30.5	Very low	88 Å²	88	145 Å²	145	73%	0.727	76%	0.762	S	S	*	*			trans	83.4	100.8	171	0	0	0	0	0	114.6
497	N	28.5	Very low	30.9	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	76%	0.764	S	S	*	*				72.7	137.7	82.1	-81.1	-13.8	0	0	0	113.3
498	L	29.3	Very low	31	Very low	143 Å²	143	149.6 Å²	149.6	75%	0.749	77%	0.767	S	S	*	*			trans	102.3	103.4	161.6	-68.9	117.8	0	0	0	118.9
499	K	30.5	Very low	31.2	Very low	186 Å²	186	149.9 Å²	149.9	81%	0.809	77%	0.768	S	S	*	*				61.1	120.4	122	-66.8	-172	-176.5	177.2	0	119.6
500	T	29.2	Very low	31.6	Very low	135 Å²	135	146.5 Å²	146.5	83%	0.828	77%	0.772	S	S	*	*			trans	-56.8	150.7	156.5	47	0	0	0	0	112.8
501	P	32.5	Very low	31.9	Very low	125 Å²	125	148.5 Å²	148.5	81%	0.812	78%	0.776	S	S	*	*			trans	-117	135.5	149.5	34.2	-22.7	0	0	0	111.9
502	S	27.4	Very low	31.9	Very low	95 Å²	95	150.2 Å²	150.2	66%	0.664	78%	0.78	S	S	*	*			trans	-85.1	172.1	166.6	51.5	0	0	0	0	111.1
503	I	33.2	Very low	32	Very low	146 Å²	146	151.9 Å²	151.9	75%	0.749	78%	0.782	S	S	*	*			trans	87.4	107.5	153.9	-60.6	157.2	0	0	0	116.9
504	S	28	Very low	31.9	Very low	92 Å²	92	150 Å²	150	64%	0.643	78%	0.775	S	S	*	*				35.3	143.4	120.4	-25.1	0	0	0	0	121.6
505	T	30.3	Very low	32	Very low	126 Å²	126	149.5 Å²	149.5	77%	0.773	78%	0.776	S	S	*	*			trans	69	115.8	156.7	67.1	0	0	0	0	116.8
506	L	30.6	Very low	32.1	Very low	138 Å²	138	144.1 Å²	144.1	72%	0.723	77%	0.769	S	S	*	*				179.3	124.1	117.2	-123.4	51	0	0	0	110.3
507	F	35.3	Very low	32.2	Very low	171 Å²	171	148.2 Å²	148.2	75%	0.75	78%	0.775	S	S	*	*			trans	54.3	145.9	130.5	-74.3	-110.1	0	0	0	119.5
508	E	33.2	Very low	32.6	Very low	169 Å²	169	147.7 Å²	147.7	79%	0.79	77%	0.771	S	S	*	*			cis	-176.7	163.8	-8	-167.7	165.6	-148.3	0	0	105.3
509	H	30.9	Very low	32.9	Very low	182 Å²	182	150.2 Å²	150.2	84%	0.843	78%	0.776	S	S	*	*			trans	-61.9	158.3	-177.1	-94	-75.6	0	0	0	115.9
510	P	37.7	Very low	33.3	Very low	124 Å²	124	149.3 Å²	149.3	81%	0.805	77%	0.774	S	S	*	*			trans	-103.3	134	155.2	33.7	-23.1	0	0	0	112.1
511	H	37	Very low	33.7	Very low	187 Å²	187	149 Å²	149	87%	0.866	77%	0.767	S	S	*	*			trans	-112.5	132.7	176.4	-137.1	-73.3	0	0	0	108.6
512	D	34.3	Very low	34	Very low	155 Å²	155	149.1 Å²	149.1	83%	0.829	76%	0.761	S	S	*	*			trans	-75.3	140.1	175.4	-70.8	-46.6	0	0	0	112.5
513	K	33.3	Very low	34.5	Very low	181 Å²	181	150.4 Å²	150.4	79%	0.787	76%	0.761	S	S	*	*			trans	-178.8	134.7	143.4	-107.6	173.6	-177.2	-177	0	113.9
514	Q	32	Very low	34.6	Very low	153 Å²	153	149.4 Å²	149.4	72%	0.715	76%	0.757	S	S	*	*			trans	67	139.1	148.5	-77.3	164.9	-50.6	0	0	117
515	E	35	Very low	34.8	Very low	159 Å²	159	151.8 Å²	151.8	74%	0.743	76%	0.762	S	S	*	*			cis	-168.6	142.2	33.9	-124.7	156.9	-152	0	0	111.8
516	T	31.2	Very low	35.2	Very low	119 Å²	119	155 Å²	155	73%	0.73	77%	0.768	S	S	*	*			trans	3.5	139.2	151.6	56	0	0	0	0	124.4
517	M	35.9	Very low	35.4	Very low	174 Å²	174	153 Å²	153	86%	0.857	77%	0.766	S	S	*	*				179.3	106.9	120.8	-92.9	-152.6	-179.3	0	0	110.8
518	I	37.9	Very low	35.5	Very low	141 Å²	141	151.5 Å²	151.5	72%	0.723	77%	0.765	S	S	*	*				77.5	113.3	92.4	-64.3	167.2	0	0	0	116.8
519	K	36.3	Very low	35.6	Very low	197 Å²	197	150.2 Å²	150.2	86%	0.857	76%	0.758	S	S	*	*			trans	123.9	145	149.9	-81.8	178	-179.3	178.4	0	114.2
520	H	38.2	Very low	35.9	Very low	167 Å²	167	148.4 Å²	148.4	77%	0.773	75%	0.748	S	S	*	*			cis	-170.2	155	-24.6	-158.7	-65.7	0	0	0	104.9
521	N	37.8	Very low	35.8	Very low	127 Å²	127	149.7 Å²	149.7	68%	0.679	74%	0.743	S	S	*	*			trans	95.9	89.1	150.3	-122.1	24.3	0	0	0	121.9
522	N	38.5	Very low	35.7	Very low	129 Å²	129	147.5 Å²	147.5	69%	0.69	74%	0.735	S	S	*	*				50.5	126.5	109.1	-85.3	0.7	0	0	0	123.1
523	N	37.7	Very low	35.8	Very low	122 Å²	122	146.8 Å²	146.8	65%	0.652	73%	0.73	S	S	*	*				122.3	108	121.1	-78.9	-4.9	0	0	0	118.3
524	N	36.4	Very low	36	Very low	124 Å²	124	144.8 Å²	144.8	66%	0.663	73%	0.728	S	S	*	*				71.1	116.8	120.7	-64.2	-13.4	0	0	0	121.5
525	N	32.4	Very low	36.1	Very low	143 Å²	143	144.6 Å²	144.6	77%	0.765	73%	0.73	S	S	*	*				39.6	120.4	124.1	-60.3	-16.4	0	0	0	118.8
526	Q	37.8	Very low	36.1	Very low	192 Å²	192	141.3 Å²	141.3	90%	0.897	73%	0.73	S	S	*	*				172.8	150.1	107.4	-97.9	172.3	-8	0	0	112.6
527	S	33.8	Very low	36.2	Very low	96 Å²	96	141.6 Å²	141.6	67%	0.671	73%	0.732	S	S	*	*			trans	-77.3	177.2	176.3	48.5	0	0	0	0	112.9
528	I	38.2	Very low	35.9	Very low	141 Å²	141	139 Å²	139	72%	0.723	73%	0.726	S	S	*	*			trans	112.4	119.7	148	-60.6	151.4	0	0	0	117.4
529	H	34.8	Very low	35.6	Very low	141 Å²	141	139 Å²	139	65%	0.653	73%	0.732	S	S	*	*			trans	88.3	120.8	136.9	-102.9	-145.6	0	0	0	124.9
530	K	37.1	Very low	35.1	Very low	144 Å²	144	135.7 Å²	135.7	63%	0.626	73%	0.729	S	S	*	*				67.7	133.1	116.2	-76	-165.9	-171	162.6	0	122.8
531	Q	35.4	Very low	34.8	Very low	152 Å²	152	134.3 Å²	134.3	71%	0.71	73%	0.732	S	S	*	*			trans	73.4	142.9	138.8	-81.3	172.1	-25.8	0	0	116.4
532	M	35	Very low	34.2	Very low	141 Å²	141	135 Å²	135	70%	0.695	74%	0.742	S	S	*	*			cis	-162.2	136.2	15.3	-106.1	166.8	-157.1	0	0	106.4
533	I	36.9	Very low	33.9	Very low	139 Å²	139	135.2 Å²	135.2	71%	0.713	75%	0.748	S	S	*	*				58.8	112.7	101.6	-53.8	177.6	0	0	0	116.5
534	N	36.9	Very low	33.4	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	76%	0.756	S	S	*	*			trans	170.5	104.4	130.8	-89.7	-19.9	0	0	0	110.3
535	I	35	Very low	33.2	Very low	150 Å²	150	136.5 Å²	136.5	77%	0.769	77%	0.765	S	S	*	*				67	105.4	94.4	-60.4	169.4	0	0	0	114.3
536	A	35.1	Very low	33.2	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	77%	0.765	S	S	*	*			trans	177.9	99.2	132.6	0	0	0	0	0	110.5
537	T	33.8	Very low	32.9	Very low	124 Å²	124	134.9 Å²	134.9	76%	0.761	77%	0.765	S	S	*	*				79.6	92.7	101.2	-33.5	0	0	0	0	116
538	T	29	Very low	33	Very low	119 Å²	119	139.3 Å²	139.3	73%	0.73	78%	0.775	S	S	*	*			trans	57.5	108.5	131.3	-25.5	0	0	0	0	121.4
539	T	31.4	Very low	32.7	Very low	141 Å²	141	136.8 Å²	136.8	87%	0.865	77%	0.77	S	S	*	*				-167.6	130.2	116.9	6.2	0	0	0	0	112.2
540	T	26.7	Very low	32.9	Very low	128 Å²	128	135.9 Å²	135.9	79%	0.785	78%	0.777	S	S	*	*			trans	-65.3	138.3	178.3	26.5	0	0	0	0	114.2
541	T	30.3	Very low	33.2	Very low	138 Å²	138	134.9 Å²	134.9	85%	0.847	78%	0.777	S	S	*	*			trans	-158.5	117.6	136.3	17.5	0	0	0	0	110.9
542	T	27	Very low	33.5	Very low	142 Å²	142	131.5 Å²	131.5	87%	0.871	77%	0.77	S	S	*	*			trans	-67.5	128.9	171.9	15.9	0	0	0	0	110.8
543	T	31.3	Very low	33.6	Very low	133 Å²	133	131.3 Å²	131.3	82%	0.816	77%	0.771	S	S	*	*			trans	-129.5	115.8	159.5	41.1	0	0	0	0	110.9	T545	T543-T545 PolarHBondContact O-N 3.33Å
544	T	28.2	Very low	33.9	Very low	134 Å²	134	127.7 Å²	127.7	82%	0.822	76%	0.758	S	S	*	*			trans	-73.4	109.2	176.8	7	0	0	0	0	110.2	T546	T544-T546 PolarHBondContact O-N 3.49Å
545	T	32	Very low	34.1	Very low	140 Å²	140	125 Å²	125	86%	0.859	75%	0.747	S	S	*	*			trans	-80.9	103.2	167.9	49.7	0	0	0	0	109.6	T543	T543-T545 PolarHBondContact O-N 3.33Å
546	T	32.2	Very low	34.3	Very low	125 Å²	125	122.7 Å²	122.7	77%	0.767	74%	0.736	S	S	*	*			trans	-84	125	173.2	33.1	0	0	0	0	110.6	T544 Q548	T544-T546 PolarHBondContact O-N 3.49Å; T546-Q548 PolarHBondContact O-N 2.92Å
547	I	31.7	Very low	34.3	Very low	175 Å²	175	127.4 Å²	127.4	90%	0.897	74%	0.735	S	S	*	*			trans	-65.2	111.3	174.6	-62.7	166.3	0	0	0	109.1
548	Q	34	Very low	34.3	Very low	189 Å²	189	125.9 Å²	125.9	88%	0.883	72%	0.721	S	S	*	*			trans	-95.9	129.6	169.6	-92.9	-176.9	-11	0	0	111.3	T546	T546-Q548 PolarHBondContact O-N 2.92Å
549	S	32.5	Very low	35	Very low	89 Å²	89	123.6 Å²	123.6	62%	0.622	71%	0.707	S	S	*	*			trans	-76.4	147	-168.7	50.1	0	0	0	0	114.8	I551	S549-I551 VanDerWaalsContact C-N 3.34Å; S549-I551 PolarHBondContact O-N 3.42Å; S549-I551 VanDerWaalsContact O-N 3.13Å
550	P	39.7	Very low	35.3	Very low	121 Å²	121	121.4 Å²	121.4	79%	0.786	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	19.6	-164.5	32.9	-37.1	0	0	0	116.5
551	I	42.7	Very low	35.8	Very low	124 Å²	124	122.5 Å²	122.5	64%	0.636	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-23.8	-160.6	-61.3	173.4	0	0	0	113.9	S549 S554	S549-I551 VanDerWaalsContact C-N 3.34Å; S549-I551 PolarHBondContact O-N 3.42Å; S549-I551 VanDerWaalsContact O-N 3.13Å; I551-S554 PolarHBondContact O-OG 3.41Å
552	S	41.1	Very low	36.5	Very low	80 Å²	80	123 Å²	123	56%	0.559	67%	0.674	S	S	*	*	S	Bend	trans	-79.1	-26.5	-170.8	60.2	0	0	0	0	115
553	L	37.3	Very low	37.2	Very low	137 Å²	137	119.2 Å²	119.2	72%	0.717	65%	0.65	S	S	*	*	H	α-helix	trans	-76.1	-26.8	-174.2	-122	116.7	0	0	0	114.1
554	S	43.2	Very low	38.1	Very low	64 Å²	64	116.4 Å²	116.4	45%	0.448	63%	0.633	S	S	.	*	H	α-helix	trans	-71.1	-32.1	-175.5	66.2	0	0	0	0	113.5	I551 L558	I551-S554 PolarHBondContact O-OG 3.41Å; S554-L558 WeakPolarHBondContact O-CD1 3.47Å; S554-L558 WeakPolarHBondContact O-CG 3.27Å; S554-L558 PolarHBondContact O-N 3.29Å
555	V	42.2	Very low	39	Very low	83 Å²	83	119.1 Å²	119.1	50%	0.503	63%	0.628	S	S	.	*	H	α-helix	trans	-73.5	-40.7	-171.3	-177.1	0	0	0	0	111.7	L558 V559	V555-L558 PolarHBondContact O-N 3.33Å; V555-V559 WeakPolarHBondContact O-CG2 3.22Å; V555-V559 PolarHBondContact O-N 3.42Å; V555-V559 VanDerWaalsContact O-N 3.15Å
556	N	38.2	Very low	39.9	Very low	101 Å²	101	115.8 Å²	115.8	54%	0.54	61%	0.61	S	S	.	*	H	α-helix	trans	-66.3	-43	178.7	-84.9	-22.6	0	0	0	111.8	L558 V559 T560	N556-L558 VanDerWaalsContact C-N 3.28Å; N556-L558 PolarHBondContact O-N 3.06Å; N556-V559 PolarHBondContact O-N 3.31Å; N556-V559 VanDerWaalsContact O-N 3.15Å; N556-T560 PolarHBondContact O-N 3.04Å; N556-T560 VanDerWaalsContact O-N 3.08Å; N556-T560 PolarHBondContact O-OG1 3.43Å
557	R	35.1	Very low	40.9	Very low	189 Å²	189	114.5 Å²	114.5	71%	0.713	60%	0.596	S	S	*	*	H	α-helix	trans	-60.2	-36.9	175.8	-116.7	178.1	172.1	170.1	-1.8	112.6	K561	R557-K561 WeakPolarHBondContact O-CB 3.41Å; R557-K561 WeakPolarHBondContact O-CG 3.41Å; R557-K561 PolarHBondContact O-N 3.27Å
558	L	35.2	Very low	42.4	Very low	92 Å²	92	115.4 Å²	115.4	48%	0.482	59%	0.588	S	S	.	*	H	α-helix	trans	-73.3	-25.2	178	-81.6	161.2	0	0	0	114	S554 V555 N556 R562	S554-L558 WeakPolarHBondContact O-CD1 3.47Å; S554-L558 WeakPolarHBondContact O-CG 3.27Å; S554-L558 PolarHBondContact O-N 3.29Å; V555-L558 PolarHBondContact O-N 3.33Å; N556-L558 VanDerWaalsContact C-N 3.28Å; N556-L558 PolarHBondContact O-N 3.06Å; L558-R562 WeakPolarHBondContact O-CB 3.38Å; L558-R562 WeakPolarHBondContact O-CG 3.25Å; L558-R562 PolarHBondContact O-N 3.12Å; L558-R562 PolarHBondContact O-NE 3.15Å
559	V	42.6	Very low	43.6	Very low	71 Å²	71	108.8 Å²	108.8	43%	0.43	56%	0.56	S	S	.	*	H	α-helix	trans	-83.5	-43.4	178.3	173.5	0	0	0	0	110.4	V555 N556 K561 R562 V563	V555-V559 WeakPolarHBondContact O-CG2 3.22Å; V555-V559 PolarHBondContact O-N 3.42Å; V555-V559 VanDerWaalsContact O-N 3.15Å; N556-V559 PolarHBondContact O-N 3.31Å; N556-V559 VanDerWaalsContact O-N 3.15Å; V559-K561 PolarHBondContact O-N 2.92Å; V559-R562 PolarHBondContact O-N 3.46Å; V559-R562 VanDerWaalsContact O-N 3.09Å; V559-V563 WeakPolarHBondContact O-CG2 3.29Å; V559-V563 PolarHBondContact O-N 3.3Å; V559-V563 VanDerWaalsContact O-N 3.11Å
560	T	37.9	Very low	44.7	Very low	95 Å²	95	106 Å²	106	58%	0.583	55%	0.546	S	S	*	.	H	α-helix	trans	-64.3	-42.1	177	-36.4	0	0	0	0	111.5	N556 R562 V563 T564	N556-T560 PolarHBondContact O-N 3.04Å; N556-T560 VanDerWaalsContact O-N 3.08Å; N556-T560 PolarHBondContact O-OG1 3.43Å; T560-R562 PolarHBondContact O-N 2.99Å; T560-V563 PolarHBondContact O-N 3.48Å; T560-T564 PolarHBondContact O-N 3.38Å; T560-T564 PolarHBondContact O-OG1 2.94Å
561	K	38.5	Very low	45.8	Very low	150 Å²	150	103.6 Å²	103.6	65%	0.652	53%	0.526	S	S	*	.	H	α-helix	trans	-61.9	-27.1	172.5	-78.8	-173.7	175.6	-174	0	113.7	R557 V559 T564 R565	R557-K561 WeakPolarHBondContact O-CB 3.41Å; R557-K561 WeakPolarHBondContact O-CG 3.41Å; R557-K561 PolarHBondContact O-N 3.27Å; V559-K561 PolarHBondContact O-N 2.92Å; K561-T564 PolarHBondContact O-OG1 3.11Å; K561-R565 PolarHBondContact O-N 3.35Å
562	R	43.1	Very low	46.8	Very low	150 Å²	150	104.1 Å²	104.1	57%	0.566	53%	0.527	S	S	*	.	H	α-helix	trans	-79.9	-36.7	179.1	-91.2	-175.7	-96.2	-177.2	-11.9	112.9	L558 V559 T560 R565 S566	L558-R562 WeakPolarHBondContact O-CB 3.38Å; L558-R562 WeakPolarHBondContact O-CG 3.25Å; L558-R562 PolarHBondContact O-N 3.12Å; L558-R562 PolarHBondContact O-NE 3.15Å; V559-R562 PolarHBondContact O-N 3.46Å; V559-R562 VanDerWaalsContact O-N 3.09Å; T560-R562 PolarHBondContact O-N 2.99Å; R562-R565 PolarHBondContact O-N 2.83Å; R562-S566 PolarHBondContact O-N 3.43Å; R562-S566 VanDerWaalsContact O-N 3.08Å
563	V	43.2	Very low	48	Very low	62 Å²	62	102.3 Å²	102.3	38%	0.376	51%	0.511	S	S	.	.	H	α-helix	trans	-70.3	-37.5	178.3	176.9	0	0	0	0	111.2	V559 T560 R565 S566 H567	V559-V563 WeakPolarHBondContact O-CG2 3.29Å; V559-V563 PolarHBondContact O-N 3.3Å; V559-V563 VanDerWaalsContact O-N 3.11Å; T560-V563 PolarHBondContact O-N 3.48Å; V563-R565 VanDerWaalsContact C-N 3.35Å; V563-S566 PolarHBondContact O-N 3.38Å; V563-S566 PolarHBondContact O-OG 3.45Å; V563-H567 PolarHBondContact O-N 2.8Å
564	T	48.8	Very low	49.2	Very low	74 Å²	74	99 Å²	99	45%	0.454	49%	0.491	S	S	.	.	H	α-helix	trans	-68.4	-34.2	174.3	56.7	0	0	0	0	112.2	T560 K561 H567 R568	T560-T564 PolarHBondContact O-N 3.38Å; T560-T564 PolarHBondContact O-OG1 2.94Å; K561-T564 PolarHBondContact O-OG1 3.11Å; T564-H567 PolarHBondContact O-N 2.84Å; T564-R568 WeakPolarHBondContact O-CG 3.44Å; T564-R568 PolarHBondContact O-N 3.34Å
565	R	49	Very low	50.4	Low	191 Å²	191	99.7 Å²	99.7	72%	0.721	49%	0.489	S	S	*	.	H	α-helix	trans	-67.7	-41.9	175	-167	175.2	-178.9	173.9	2.6	112.3	K561 R562 V563 H567 R568 T569	K561-R565 PolarHBondContact O-N 3.35Å; R562-R565 PolarHBondContact O-N 2.83Å; V563-R565 VanDerWaalsContact C-N 3.35Å; R565-H567 VanDerWaalsContact C-N 3.34Å; R565-R568 PolarHBondContact O-N 2.89Å; R565-T569 PolarHBondContact O-N 2.94Å; R565-T569 PolarHBondContact O-OG1 3.28Å; R565-T569 VanDerWaalsContact O-OG1 3.08Å
566	S	50	Low	51.5	Low	69 Å²	69	99.2 Å²	99.2	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-67.5	-34.6	175.4	61.7	0	0	0	0	112.7	R562 V563 G570	R562-S566 PolarHBondContact O-N 3.43Å; R562-S566 VanDerWaalsContact O-N 3.08Å; V563-S566 PolarHBondContact O-N 3.38Å; V563-S566 PolarHBondContact O-OG 3.45Å; S566-G570 PolarHBondContact O-N 2.96Å
567	H	53.5	Low	52.7	Low	99 Å²	99	95.8 Å²	95.8	46%	0.458	47%	0.472	S	S	.	.	H	α-helix	trans	-65.2	-45.4	174.3	-171.8	-90.9	0	0	0	111.4	V563 T564 R565 G570 L571	V563-H567 PolarHBondContact O-N 2.8Å; T564-H567 PolarHBondContact O-N 2.84Å; R565-H567 VanDerWaalsContact C-N 3.34Å; H567-G570 PolarHBondContact O-N 3.36Å; H567-L571 VanDerWaalsContact O-CB 3.25Å; H567-L571 WeakPolarHBondContact O-CB 3.28Å; H567-L571 PolarHBondContact O-N 3.29Å
568	R	62.5	Low	54.2	Low	193 Å²	193	90.1 Å²	90.1	73%	0.728	46%	0.458	S	S	*	.	H	α-helix	trans	-61.1	-44.8	175.4	-74.8	-178.6	-178.7	-167.9	-0.5	112.2	T564 R565 M572	T564-R568 WeakPolarHBondContact O-CG 3.44Å; T564-R568 PolarHBondContact O-N 3.34Å; R565-R568 PolarHBondContact O-N 2.89Å; R568-M572 WeakPolarHBondContact O-CB 3.47Å; R568-M572 PolarHBondContact O-N 3.25Å
569	T	58.8	Low	55.9	Low	50 Å²	50	90.3 Å²	90.3	31%	0.307	46%	0.458	S	S	.	.	H	α-helix	trans	-68.6	-39.7	177.8	-55.6	0	0	0	0	112.2	R565 M572 I573	R565-T569 PolarHBondContact O-N 2.94Å; R565-T569 PolarHBondContact O-OG1 3.28Å; R565-T569 VanDerWaalsContact O-OG1 3.08Å; T569-M572 PolarHBondContact O-N 2.93Å; T569-I573 HydrophobicContact CG2-CD1 3.86Å; T569-I573 HydrophobicContact CG2-CG1 4.41Å; T569-I573 WeakPolarHBondContact O-CB 3.48Å; T569-I573 WeakPolarHBondContact O-CG1 3.34Å; T569-I573 PolarHBondContact O-N 2.89Å
570	G	56.8	Low	57	Low	31 Å²	31	90.4 Å²	90.4	32%	0.32	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-41.5	176.5	0	0	0	0	0	112.7	S566 H567 I573 F574	S566-G570 PolarHBondContact O-N 2.96Å; H567-G570 PolarHBondContact O-N 3.36Å; G570-I573 PolarHBondContact O-N 3.46Å; G570-F574 WeakPolarHBondContact O-CB 3.42Å; G570-F574 PolarHBondContact O-N 2.86Å
571	L	61.3	Low	58.2	Low	71 Å²	71	87.5 Å²	87.5	37%	0.372	43%	0.432	S	S	.	.	H	α-helix	trans	-68.8	-39.8	175	-174.8	147.2	0	0	0	111.7	H567 F574 I575	H567-L571 VanDerWaalsContact O-CB 3.25Å; H567-L571 WeakPolarHBondContact O-CB 3.28Å; H567-L571 PolarHBondContact O-N 3.29Å; L571-F574 PolarHBondContact O-N 2.93Å; L571-I575 HydrophobicContact CD2-CD1 3.39Å; L571-I575 HydrophobicContact CD2-CG1 4.21Å; L571-I575 HydrophobicContact CG-CD1 4.2Å; L571-I575 WeakPolarHBondContact O-CB 3.38Å; L571-I575 VanDerWaalsContact O-CG1 3.3Å; L571-I575 WeakPolarHBondContact O-CG1 3.49Å; L571-I575 PolarHBondContact O-N 3.49Å
572	M	65.5	Low	59.4	Low	135 Å²	135	83.1 Å²	83.1	67%	0.665	42%	0.424	S	S	*	.	H	α-helix	trans	-60.9	-45.5	173.2	-179.5	-174	173.9	0	0	111.4	R568 T569 I575 S576	R568-M572 WeakPolarHBondContact O-CB 3.47Å; R568-M572 PolarHBondContact O-N 3.25Å; T569-M572 PolarHBondContact O-N 2.93Å; M572-I575 PolarHBondContact O-N 3.4Å; M572-S576 VanDerWaalsContact O-CB 3.24Å; M572-S576 WeakPolarHBondContact O-CB 3.28Å; M572-S576 PolarHBondContact O-N 2.8Å
573	I	64.6	Low	60.4	Low	41 Å²	41	80.2 Å²	80.2	21%	0.21	42%	0.423	C	S	.	.	H	α-helix	trans	-65.1	-42.5	177.3	-68.5	166.7	0	0	0	110.3	Y377 T569 G570 S576 T577	Y377-I573 HydrophobicContact CE1-CG2 4.16Å; Y377-I573 WeakPolarHBondContact OH-CG2 3.36Å; T569-I573 HydrophobicContact CG2-CD1 3.86Å; T569-I573 HydrophobicContact CG2-CG1 4.41Å; T569-I573 WeakPolarHBondContact O-CB 3.48Å; T569-I573 WeakPolarHBondContact O-CG1 3.34Å; T569-I573 PolarHBondContact O-N 2.89Å; G570-I573 PolarHBondContact O-N 3.46Å; I573-S576 WeakPolarHBondContact O-CB 3.43Å; I573-S576 PolarHBondContact O-N 3.09Å; I573-T577 WeakPolarHBondContact O-CG2 3.17Å; I573-T577 PolarHBondContact O-N 3.16Å; I573-T577 PolarHBondContact O-OG1 2.87Å; I573-T577 VanDerWaalsContact O-OG1 3.12Å
574	F	64.2	Low	61.5	Low	67 Å²	67	79.2 Å²	79.2	29%	0.294	42%	0.415	S	S	.	.	H	α-helix	trans	-60.3	-49.6	176.1	175.7	-107.8	0	0	0	112	Y377 F381 G570 L571 S576 T577 V578	Y377-F574 HydrophobicContact CD1-CD2 4.33Å; Y377-F574 HydrophobicContact CG-CD2 4.02Å; F381-F574 HydrophobicContact CD2-CD2 4.41Å; F381-F574 HydrophobicContact CE2-CB 3.72Å; F381-F574 AromaticContact CE2-CD1 3.89Å; F381-F574 HydrophobicContact CE2-CD1 3.89Å; F381-F574 AromaticContact CE2-CD2 3.51Å; F381-F574 HydrophobicContact CE2-CD2 3.51Å; F381-F574 HydrophobicContact CE2-CE1 4.37Å; F381-F574 HydrophobicContact CE2-CE2 4.01Å; F381-F574 AromaticContact CE2-CG 3.41Å; F381-F574 HydrophobicContact CE2-CG 3.41Å; F381-F574 VanDerWaalsContact CE2-CG 3.41Å; F381-F574 HydrophobicContact CE2-CZ 4.41Å; F381-F574 HydrophobicContact CZ-CB 3.71Å; F381-F574 AromaticContact CZ-CD1 3.91Å; F381-F574 HydrophobicContact CZ-CD1 3.91Å; F381-F574 HydrophobicContact CZ-CD2 4.28Å; F381-F574 AromaticContact CZ-CG 3.7Å; F381-F574 HydrophobicContact CZ-CG 3.7Å; G570-F574 WeakPolarHBondContact O-CB 3.42Å; G570-F574 PolarHBondContact O-N 2.86Å; L571-F574 PolarHBondContact O-N 2.93Å; F574-S576 VanDerWaalsContact C-N 3.29Å; F574-S576 PolarHBondContact O-N 3.23Å; F574-T577 WeakPolarHBondContact CA-OG1 3.47Å; F574-T577 PolarHBondContact O-N 3.35Å; F574-T577 PolarHBondContact O-OG1 2.91Å; F574-V578 HydrophobicContact CD1-CG2 4.36Å; F574-V578 HydrophobicContact CD2-CG2 4.27Å; F574-V578 HydrophobicContact CE1-CG2 3.99Å; F574-V578 HydrophobicContact CE2-CG2 3.92Å; F574-V578 HydrophobicContact CZ-CG2 3.77Å; F574-V578 VanDerWaalsContact O-CG2 3.31Å; F574-V578 WeakPolarHBondContact O-CG2 3.46Å; F574-V578 PolarHBondContact O-N 3.32Å
575	I	68	Low	62.1	Low	80 Å²	80	81.3 Å²	81.3	41%	0.41	42%	0.418	S	S	.	.	H	α-helix	trans	-60.3	-43	175.9	-70	177.5	0	0	0	110.1	L571 M572 T577 V578 I579	L571-I575 HydrophobicContact CD2-CD1 3.39Å; L571-I575 HydrophobicContact CD2-CG1 4.21Å; L571-I575 HydrophobicContact CG-CD1 4.2Å; L571-I575 WeakPolarHBondContact O-CB 3.38Å; L571-I575 VanDerWaalsContact O-CG1 3.3Å; L571-I575 WeakPolarHBondContact O-CG1 3.49Å; L571-I575 PolarHBondContact O-N 3.49Å; M572-I575 PolarHBondContact O-N 3.4Å; I575-T577 VanDerWaalsContact C-N 3.34Å; I575-T577 PolarHBondContact O-N 3.45Å; I575-V578 PolarHBondContact O-N 3.48Å; I575-I579 HydrophobicContact CG2-CD1 3.52Å; I575-I579 HydrophobicContact CG2-CG1 4.11Å; I575-I579 WeakPolarHBondContact O-CB 3.25Å; I575-I579 VanDerWaalsContact O-CG1 3.23Å; I575-I579 WeakPolarHBondContact O-CG1 3.38Å; I575-I579 PolarHBondContact O-N 3.41Å
576	S	65.6	Low	62.6	Low	72 Å²	72	75.8 Å²	75.8	50%	0.503	41%	0.407	S	S	.	.	H	α-helix	trans	-60.6	-41.6	176.9	-168.5	0	0	0	0	112.1	M572 I573 F574 F580	M572-S576 VanDerWaalsContact O-CB 3.24Å; M572-S576 WeakPolarHBondContact O-CB 3.28Å; M572-S576 PolarHBondContact O-N 2.8Å; I573-S576 WeakPolarHBondContact O-CB 3.43Å; I573-S576 PolarHBondContact O-N 3.09Å; F574-S576 VanDerWaalsContact C-N 3.29Å; F574-S576 PolarHBondContact O-N 3.23Å; S576-F580 VanDerWaalsContact O-CB 3.26Å; S576-F580 WeakPolarHBondContact O-CB 3.26Å; S576-F580 PolarHBondContact O-N 3.32Å
577	T	62.9	Low	63	Low	30 Å²	30	76.6 Å²	76.6	18%	0.184	41%	0.409	C	S	.	.	H	α-helix	trans	-68.3	-40.9	175.8	49.7	0	0	0	0	111.7	Y377 I573 F574 I575 F580 Y581	Y377-T577 HydrophobicContact CE2-CG2 3.92Å; I573-T577 WeakPolarHBondContact O-CG2 3.17Å; I573-T577 PolarHBondContact O-N 3.16Å; I573-T577 PolarHBondContact O-OG1 2.87Å; I573-T577 VanDerWaalsContact O-OG1 3.12Å; F574-T577 WeakPolarHBondContact CA-OG1 3.47Å; F574-T577 PolarHBondContact O-N 3.35Å; F574-T577 PolarHBondContact O-OG1 2.91Å; I575-T577 VanDerWaalsContact C-N 3.34Å; I575-T577 PolarHBondContact O-N 3.45Å; T577-F580 PolarHBondContact O-N 3.4Å; T577-Y581 WeakPolarHBondContact O-CD2 3.45Å; T577-Y581 PolarHBondContact O-N 3.4Å
578	V	66.1	Low	63.4	Low	69 Å²	69	73 Å²	73	42%	0.418	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-43.6	176.2	171.3	0	0	0	0	110.5	F574 I575 Y581 A582	F574-V578 HydrophobicContact CD1-CG2 4.36Å; F574-V578 HydrophobicContact CD2-CG2 4.27Å; F574-V578 HydrophobicContact CE1-CG2 3.99Å; F574-V578 HydrophobicContact CE2-CG2 3.92Å; F574-V578 HydrophobicContact CZ-CG2 3.77Å; F574-V578 VanDerWaalsContact O-CG2 3.31Å; F574-V578 WeakPolarHBondContact O-CG2 3.46Å; F574-V578 PolarHBondContact O-N 3.32Å; I575-V578 PolarHBondContact O-N 3.48Å; V578-Y581 PolarHBondContact O-N 3.38Å; V578-A582 WeakPolarHBondContact O-CB 3.21Å; V578-A582 PolarHBondContact O-N 3.18Å
579	I	71.2	Confident	63.4	Low	96 Å²	96	71.1 Å²	71.1	49%	0.492	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-47.7	175.5	-69.4	170.8	0	0	0	110	I575 Y581 A582 T583	I575-I579 HydrophobicContact CG2-CD1 3.52Å; I575-I579 HydrophobicContact CG2-CG1 4.11Å; I575-I579 WeakPolarHBondContact O-CB 3.25Å; I575-I579 VanDerWaalsContact O-CG1 3.23Å; I575-I579 WeakPolarHBondContact O-CG1 3.38Å; I575-I579 PolarHBondContact O-N 3.41Å; I579-Y581 VanDerWaalsContact C-N 3.33Å; I579-Y581 PolarHBondContact O-N 2.89Å; I579-A582 CarbonylContact O-C 3.55Å; I579-A582 PolarHBondContact O-N 3.22Å; I579-A582 VanDerWaalsContact O-N 3.13Å; I579-T583 HydrophobicContact CG2-CG2 4.31Å; I579-T583 WeakPolarHBondContact O-CG2 3.47Å; I579-T583 PolarHBondContact O-N 3.41Å; I579-T583 PolarHBondContact O-OG1 3.24Å; I579-T583 VanDerWaalsContact O-OG1 3.06Å
580	F	65.5	Low	63.5	Low	73 Å²	73	73.5 Å²	73.5	32%	0.32	40%	0.4	S	S	.	.	H	α-helix	trans	-55.9	-45.9	177.9	177.3	-97.9	0	0	0	112.3	S576 T577 T583 L584	S576-F580 VanDerWaalsContact O-CB 3.26Å; S576-F580 WeakPolarHBondContact O-CB 3.26Å; S576-F580 PolarHBondContact O-N 3.32Å; T577-F580 PolarHBondContact O-N 3.4Å; F580-T583 WeakPolarHBondContact CA-OG1 3.48Å; F580-T583 PolarHBondContact O-N 2.84Å; F580-T583 PolarHBondContact O-OG1 2.81Å; F580-L584 HydrophobicContact CD1-CD1 3.92Å; F580-L584 HydrophobicContact CE1-CD1 3.4Å; F580-L584 VanDerWaalsContact CE1-CD1 3.4Å; F580-L584 HydrophobicContact CZ-CD1 3.76Å; F580-L584 PolarHBondContact O-N 3.38Å
581	Y	62.7	Low	63.6	Low	34 Å²	34	76.8 Å²	76.8	13%	0.133	41%	0.407	C	S	.	.	H	α-helix	trans	-71.8	-35	176.2	-75	-66.5	0	0	0	112.9	F370 I373 T577 V578 I579 T583 L584 F585	F370-Y581 HydrophobicContact CB-CD1 4.29Å; F370-Y581 HydrophobicContact CB-CE1 3.98Å; F370-Y581 AromaticContact CD2-CD1 3.59Å; F370-Y581 HydrophobicContact CD2-CD1 3.59Å; F370-Y581 AromaticContact CD2-CD2 3.44Å; F370-Y581 HydrophobicContact CD2-CD2 3.44Å; F370-Y581 VanDerWaalsContact CD2-CD2 3.44Å; F370-Y581 AromaticContact CD2-CE1 3.91Å; F370-Y581 HydrophobicContact CD2-CE1 3.91Å; F370-Y581 AromaticContact CD2-CE2 3.79Å; F370-Y581 HydrophobicContact CD2-CE2 3.79Å; F370-Y581 AromaticContact CD2-CG 3.34Å; F370-Y581 HydrophobicContact CD2-CG 3.34Å; F370-Y581 HydrophobicContact CE2-CD1 4.33Å; F370-Y581 AromaticContact CE2-CD2 3.77Å; F370-Y581 HydrophobicContact CE2-CD2 3.77Å; F370-Y581 HydrophobicContact CE2-CE2 4.48Å; F370-Y581 AromaticContact CE2-CG 3.69Å; F370-Y581 HydrophobicContact CE2-CG 3.69Å; F370-Y581 HydrophobicContact CG-CD1 4.28Å; F370-Y581 HydrophobicContact CG-CE1 4.41Å; F370-Y581 HydrophobicContact CG-CG 4.42Å; I373-Y581 WeakPolarHBondContact CD1-OH 3.33Å; I373-Y581 HydrophobicContact CG2-CE2 4.49Å; T577-Y581 WeakPolarHBondContact O-CD2 3.45Å; T577-Y581 PolarHBondContact O-N 3.4Å; V578-Y581 PolarHBondContact O-N 3.38Å; I579-Y581 VanDerWaalsContact C-N 3.33Å; I579-Y581 PolarHBondContact O-N 2.89Å; Y581-T583 VanDerWaalsContact C-N 3.29Å; Y581-T583 PolarHBondContact O-N 3.46Å; Y581-L584 HydrophobicContact CD1-CD1 4.28Å; Y581-L584 PolarHBondContact O-N 2.81Å; Y581-F585 PolarHBondContact O-N 3.25Å
582	A	64.3	Low	63.3	Low	59 Å²	59	77.2 Å²	77.2	49%	0.488	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-33.5	173.5	0	0	0	0	0	111.8	V578 I579 F585 P586	V578-A582 WeakPolarHBondContact O-CB 3.21Å; V578-A582 PolarHBondContact O-N 3.18Å; I579-A582 CarbonylContact O-C 3.55Å; I579-A582 PolarHBondContact O-N 3.22Å; I579-A582 VanDerWaalsContact O-N 3.13Å; A582-F585 WeakPolarHBondContact O-CB 3.24Å; A582-F585 PolarHBondContact O-N 3.47Å; A582-P586 WeakPolarHBondContact O-CD 3.42Å
583	T	63.8	Low	62.9	Low	88 Å²	88	78.1 Å²	78.1	54%	0.54	41%	0.406	S	S	.	.	H	α-helix	trans	-75.1	-27.2	173.6	50.3	0	0	0	0	112.9	I579 F580 Y581 P586	I579-T583 HydrophobicContact CG2-CG2 4.31Å; I579-T583 WeakPolarHBondContact O-CG2 3.47Å; I579-T583 PolarHBondContact O-N 3.41Å; I579-T583 PolarHBondContact O-OG1 3.24Å; I579-T583 VanDerWaalsContact O-OG1 3.06Å; F580-T583 WeakPolarHBondContact CA-OG1 3.48Å; F580-T583 PolarHBondContact O-N 2.84Å; F580-T583 PolarHBondContact O-OG1 2.81Å; Y581-T583 VanDerWaalsContact C-N 3.29Å; Y581-T583 PolarHBondContact O-N 3.46Å; T583-P586 WeakPolarHBondContact O-CD 3.3Å
584	L	65.3	Low	62.2	Low	42 Å²	42	80.5 Å²	80.5	22%	0.22	42%	0.415	C	S	.	.	H	α-helix	trans	-76.6	-23.7	170.8	-80	168.2	0	0	0	112.6	F580 Y581 V587 L588	F580-L584 HydrophobicContact CD1-CD1 3.92Å; F580-L584 HydrophobicContact CE1-CD1 3.4Å; F580-L584 VanDerWaalsContact CE1-CD1 3.4Å; F580-L584 HydrophobicContact CZ-CD1 3.76Å; F580-L584 PolarHBondContact O-N 3.38Å; Y581-L584 HydrophobicContact CD1-CD1 4.28Å; Y581-L584 PolarHBondContact O-N 2.81Å; L584-V587 WeakPolarHBondContact O-CB 3.2Å; L584-V587 PolarHBondContact O-N 3.47Å; L584-L588 HydrophobicContact CB-CD1 4.33Å; L584-L588 WeakPolarHBondContact O-CG 3.43Å; L584-L588 PolarHBondContact O-N 3.49Å
585	F	62.1	Low	61.3	Low	118 Å²	118	83.4 Å²	83.4	52%	0.518	42%	0.424	S	S	.	.	H	α-helix	trans	-58.4	-43.6	-176.3	-171.9	-93.5	0	0	0	113.6	Y581 A582 V587 L588 W589	Y581-F585 PolarHBondContact O-N 3.25Å; A582-F585 WeakPolarHBondContact O-CB 3.24Å; A582-F585 PolarHBondContact O-N 3.47Å; F585-V587 VanDerWaalsContact C-N 3.33Å; F585-V587 PolarHBondContact O-N 3.27Å; F585-L588 PolarHBondContact O-N 3.37Å; F585-W589 HydrophobicContact CE1-CE3 4.16Å; F585-W589 HydrophobicContact CZ-CE3 4.06Å; F585-W589 VanDerWaalsContact O-CB 3.22Å; F585-W589 WeakPolarHBondContact O-CB 3.29Å; F585-W589 PolarHBondContact O-N 3.11Å
586	P	58.8	Low	60.2	Low	75 Å²	75	85.9 Å²	85.9	49%	0.487	43%	0.429	S	S	.	.	H	α-helix	trans	-59	-39.7	171.9	-25.7	33.1	0	0	0	113.8	A582 T583 W589 V590	A582-P586 WeakPolarHBondContact O-CD 3.42Å; T583-P586 WeakPolarHBondContact O-CD 3.3Å; P586-W589 PolarHBondContact O-N 2.81Å; P586-V590 WeakPolarHBondContact O-CG2 3.4Å; P586-V590 PolarHBondContact O-N 3Å
587	V	58.9	Low	59.3	Low	85 Å²	85	90.3 Å²	90.3	52%	0.515	44%	0.439	S	S	.	.	H	α-helix	trans	-67.4	-45.1	179.2	-179.3	0	0	0	0	110.4	L584 F585 W589 V590 H591	L584-V587 WeakPolarHBondContact O-CB 3.2Å; L584-V587 PolarHBondContact O-N 3.47Å; F585-V587 VanDerWaalsContact C-N 3.33Å; F585-V587 PolarHBondContact O-N 3.27Å; V587-W589 VanDerWaalsContact C-N 3.32Å; V587-W589 PolarHBondContact O-N 3.38Å; V587-V590 PolarHBondContact O-N 2.68Å; V587-H591 PolarHBondContact O-N 3.34Å; V587-H591 VanDerWaalsContact O-N 3.12Å
588	L	61.3	Low	58.4	Low	24 Å²	24	95.9 Å²	95.9	13%	0.126	46%	0.457	C	S	.	.	H	α-helix	trans	-61.2	-43.6	173.7	-69.4	166.7	0	0	0	110.6	I363 F367 L584 F585 V590 H591 F592	I363-L588 HydrophobicContact CG1-CD2 4.46Å; I363-L588 HydrophobicContact CG2-CD2 4.03Å; F367-L588 HydrophobicContact CE1-CD1 4.48Å; F367-L588 HydrophobicContact CE2-CD1 4.19Å; F367-L588 HydrophobicContact CE2-CD2 3.85Å; F367-L588 HydrophobicContact CE2-CG 4.45Å; F367-L588 HydrophobicContact CZ-CB 4.31Å; F367-L588 HydrophobicContact CZ-CD1 3.83Å; F367-L588 HydrophobicContact CZ-CD2 4.26Å; F367-L588 HydrophobicContact CZ-CG 4.37Å; L584-L588 HydrophobicContact CB-CD1 4.33Å; L584-L588 WeakPolarHBondContact O-CG 3.43Å; L584-L588 PolarHBondContact O-N 3.49Å; F585-L588 PolarHBondContact O-N 3.37Å; L588-V590 PolarHBondContact O-N 2.89Å; L588-H591 CarbonylContact O-C 3.6Å; L588-H591 PolarHBondContact O-N 2.87Å; L588-F592 HydrophobicContact CB-CD2 4.47Å; L588-F592 HydrophobicContact CB-CE2 4.39Å; L588-F592 WeakPolarHBondContact O-CD2 3.41Å; L588-F592 PolarHBondContact O-N 3.45Å
589	W	64.1	Low	57.6	Low	154 Å²	154	97.5 Å²	97.5	58%	0.583	47%	0.467	S	S	*	.	H	α-helix	trans	-61.3	-44.4	179.7	-176	-93.4	0	0	0	112.5	F585 P586 V587 H591 F592 K593	F585-W589 HydrophobicContact CE1-CE3 4.16Å; F585-W589 HydrophobicContact CZ-CE3 4.06Å; F585-W589 VanDerWaalsContact O-CB 3.22Å; F585-W589 WeakPolarHBondContact O-CB 3.29Å; F585-W589 PolarHBondContact O-N 3.11Å; P586-W589 PolarHBondContact O-N 2.81Å; V587-W589 VanDerWaalsContact C-N 3.32Å; V587-W589 PolarHBondContact O-N 3.38Å; W589-H591 VanDerWaalsContact C-N 3.34Å; W589-F592 PolarHBondContact O-N 2.87Å; W589-K593 WeakPolarHBondContact O-CB 3.49Å; W589-K593 PolarHBondContact O-N 3.3Å
590	V	60.9	Low	56.3	Low	100 Å²	100	96.7 Å²	96.7	61%	0.606	46%	0.464	S	S	*	.	H	α-helix	trans	-61.8	-44.1	175.4	172.8	0	0	0	0	110.4	P586 V587 L588 F592 K593 F594	P586-V590 WeakPolarHBondContact O-CG2 3.4Å; P586-V590 PolarHBondContact O-N 3Å; V587-V590 PolarHBondContact O-N 2.68Å; L588-V590 PolarHBondContact O-N 2.89Å; V590-F592 PolarHBondContact O-N 3.32Å; V590-K593 PolarHBondContact O-N 3.18Å; V590-F594 PolarHBondContact O-N 2.93Å
591	H	57.7	Low	55	Low	100 Å²	100	97.9 Å²	97.9	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-62.5	-39.1	175.1	-102.3	-81.2	0	0	0	113	I363 V587 L588 W589 F594 W595	I363-H591 HydrophobicContact CD1-CB 4.24Å; V587-H591 PolarHBondContact O-N 3.34Å; V587-H591 VanDerWaalsContact O-N 3.12Å; L588-H591 CarbonylContact O-C 3.6Å; L588-H591 PolarHBondContact O-N 2.87Å; W589-H591 VanDerWaalsContact C-N 3.34Å; H591-F594 PolarHBondContact O-N 3.04Å; H591-W595 WeakPolarHBondContact O-CB 3.11Å; H591-W595 PolarHBondContact O-N 2.96Å
592	F	56.4	Low	53.8	Low	79 Å²	79	103 Å²	103	35%	0.346	51%	0.508	S	S	.	.	H	α-helix	trans	-68.4	-37.6	174.2	-83.1	-69.1	0	0	0	113.3	I363 F367 L588 W589 V590 F594 W595 W596	I363-F592 HydrophobicContact CG2-CE2 4.49Å; I363-F592 HydrophobicContact CG2-CZ 4.25Å; F367-F592 HydrophobicContact CD2-CE2 4.41Å; F367-F592 HydrophobicContact CD2-CZ 4.16Å; F367-F592 AromaticContact CE2-CE2 3.25Å; F367-F592 HydrophobicContact CE2-CE2 3.25Å; F367-F592 AromaticContact CE2-CZ 3.37Å; F367-F592 HydrophobicContact CE2-CZ 3.37Å; F367-F592 AromaticContact CZ-CE2 3.37Å; F367-F592 HydrophobicContact CZ-CE2 3.37Å; F367-F592 AromaticContact CZ-CZ 3.81Å; F367-F592 HydrophobicContact CZ-CZ 3.81Å; L588-F592 HydrophobicContact CB-CD2 4.47Å; L588-F592 HydrophobicContact CB-CE2 4.39Å; L588-F592 WeakPolarHBondContact O-CD2 3.41Å; L588-F592 PolarHBondContact O-N 3.45Å; W589-F592 PolarHBondContact O-N 2.87Å; V590-F592 PolarHBondContact O-N 3.32Å; F592-F594 PolarHBondContact O-N 3.37Å; F592-W595 HydrophobicContact CD1-CE3 4.17Å; F592-W595 VanDerWaalsContact O-CB 3.29Å; F592-W595 WeakPolarHBondContact O-CB 3.48Å; F592-W595 PolarHBondContact O-N 3.08Å; F592-W595 VanDerWaalsContact O-N 3.15Å; F592-W596 PolarHBondContact O-N 2.79Å
593	K	55.4	Low	52.5	Low	155 Å²	155	107.9 Å²	107.9	67%	0.674	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-35.5	177.6	-159.4	-175.6	-179	-172.7	0	110.6	W589 V590	W589-K593 WeakPolarHBondContact O-CB 3.49Å; W589-K593 PolarHBondContact O-N 3.3Å; V590-K593 PolarHBondContact O-N 3.18Å
594	F	50.6	Low	51.3	Low	90 Å²	90	109.3 Å²	109.3	40%	0.395	54%	0.535	S	S	.	.	H	α-helix	trans	-68.5	-41.7	171.3	-158.6	-93.7	0	0	0	111.6	H21 V590 H591 F592 W596 K597 Y598	H21-F594 AromaticContact CE1-CE2 3.93Å; H21-F594 AromaticContact CE1-CZ 3.6Å; H21-F594 AromaticContact NE2-CZ 3.46Å; H21-F594 WeakPolarHBondContact NE2-CZ 3.23Å; V590-F594 PolarHBondContact O-N 2.93Å; H591-F594 PolarHBondContact O-N 3.04Å; F592-F594 PolarHBondContact O-N 3.37Å; F594-W596 PolarHBondContact O-N 2.94Å; F594-K597 PolarHBondContact O-N 3.42Å; F594-K597 VanDerWaalsContact O-N 3.09Å; F594-Y598 AromaticContact CD1-CD2 3.8Å; F594-Y598 HydrophobicContact CD1-CD2 3.8Å; F594-Y598 HydrophobicContact CD1-CE2 4.05Å; F594-Y598 HydrophobicContact CD2-CE2 4.33Å; F594-Y598 AromaticContact CE1-CD2 3.44Å; F594-Y598 HydrophobicContact CE1-CD2 3.44Å; F594-Y598 VanDerWaalsContact CE1-CD2 3.44Å; F594-Y598 AromaticContact CE1-CE2 3.34Å; F594-Y598 HydrophobicContact CE1-CE2 3.34Å; F594-Y598 HydrophobicContact CE1-CG 4.31Å; F594-Y598 HydrophobicContact CE2-CD2 4.34Å; F594-Y598 AromaticContact CE2-CE2 3.66Å; F594-Y598 HydrophobicContact CE2-CE2 3.66Å; F594-Y598 HydrophobicContact CG-CD2 4.39Å; F594-Y598 AromaticContact CZ-CD2 3.75Å; F594-Y598 HydrophobicContact CZ-CD2 3.75Å; F594-Y598 AromaticContact CZ-CE2 3.11Å; F594-Y598 HydrophobicContact CZ-CE2 3.11Å; F594-Y598 AromaticContact CZ-CZ 3.75Å; F594-Y598 PolarHBondContact O-N 2.81Å
595	W	45.8	Very low	50.2	Low	128 Å²	128	113.3 Å²	113.3	49%	0.485	56%	0.557	S	S	.	*	H	α-helix	trans	-55.8	-47.7	177.6	-159	62.5	0	0	0	112.4	H591 F592 K597 Y598 T599	H591-W595 WeakPolarHBondContact O-CB 3.11Å; H591-W595 PolarHBondContact O-N 2.96Å; F592-W595 HydrophobicContact CD1-CE3 4.17Å; F592-W595 VanDerWaalsContact O-CB 3.29Å; F592-W595 WeakPolarHBondContact O-CB 3.48Å; F592-W595 PolarHBondContact O-N 3.08Å; F592-W595 VanDerWaalsContact O-N 3.15Å; W595-K597 PolarHBondContact O-N 3.06Å; W595-Y598 PolarHBondContact O-N 3.48Å; W595-T599 PolarHBondContact O-N 3.22Å; W595-T599 PolarHBondContact O-OG1 3.48Å
596	W	44.7	Very low	49.7	Very low	133 Å²	133	115 Å²	115	50%	0.504	57%	0.571	S	S	.	*	H	α-helix	trans	-65.5	-25.4	179.5	-159.5	-89.3	0	0	0	113.6	F592 F594 I600	F592-W596 PolarHBondContact O-N 2.79Å; F594-W596 PolarHBondContact O-N 2.94Å; W596-I600 WeakPolarHBondContact O-CD1 3.34Å
597	K	46.9	Very low	49.2	Very low	164 Å²	164	117 Å²	117	71%	0.713	58%	0.578	S	S	*	*	H	α-helix	trans	-80.9	-27.5	-176.4	-139.6	-179.4	-179.3	-169.2	0	112.6	F594 W595	F594-K597 PolarHBondContact O-N 3.42Å; F594-K597 VanDerWaalsContact O-N 3.09Å; W595-K597 PolarHBondContact O-N 3.06Å
598	Y	43.9	Very low	48.4	Very low	147 Å²	147	121.3 Å²	121.3	58%	0.576	60%	0.598	S	S	*	*	H	α-helix	trans	-98	-23.3	-176.9	-85.1	-92.3	0	0	0	114.6	F594 W595 I600	F594-Y598 AromaticContact CD1-CD2 3.8Å; F594-Y598 HydrophobicContact CD1-CD2 3.8Å; F594-Y598 HydrophobicContact CD1-CE2 4.05Å; F594-Y598 HydrophobicContact CD2-CE2 4.33Å; F594-Y598 AromaticContact CE1-CD2 3.44Å; F594-Y598 HydrophobicContact CE1-CD2 3.44Å; F594-Y598 VanDerWaalsContact CE1-CD2 3.44Å; F594-Y598 AromaticContact CE1-CE2 3.34Å; F594-Y598 HydrophobicContact CE1-CE2 3.34Å; F594-Y598 HydrophobicContact CE1-CG 4.31Å; F594-Y598 HydrophobicContact CE2-CD2 4.34Å; F594-Y598 AromaticContact CE2-CE2 3.66Å; F594-Y598 HydrophobicContact CE2-CE2 3.66Å; F594-Y598 HydrophobicContact CG-CD2 4.39Å; F594-Y598 AromaticContact CZ-CD2 3.75Å; F594-Y598 HydrophobicContact CZ-CD2 3.75Å; F594-Y598 AromaticContact CZ-CE2 3.11Å; F594-Y598 HydrophobicContact CZ-CE2 3.11Å; F594-Y598 AromaticContact CZ-CZ 3.75Å; F594-Y598 PolarHBondContact O-N 2.81Å; W595-Y598 PolarHBondContact O-N 3.48Å; Y598-I600 PolarHBondContact O-N 3.42Å
599	T	49	Very low	47.2	Very low	103 Å²	103	125.1 Å²	125.1	63%	0.632	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-6.2	177.7	-37.2	0	0	0	0	113.6	W595	W595-T599 PolarHBondContact O-N 3.22Å; W595-T599 PolarHBondContact O-OG1 3.48Å
600	I	44.1	Very low	46	Very low	80 Å²	80	125.6 Å²	125.6	41%	0.41	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.4	-14.1	-173.8	-64.3	179.8	0	0	0	114.2	W596 Y598	W596-I600 WeakPolarHBondContact O-CD1 3.34Å; Y598-I600 PolarHBondContact O-N 3.42Å
601	N	37.5	Very low	44.7	Very low	97 Å²	97	126.4 Å²	126.4	52%	0.519	64%	0.64	S	S	.	*			trans	-129.5	100	-172.6	-71.1	-17	0	0	0	112.5
602	T	37.5	Very low	43.6	Very low	142 Å²	142	126.3 Å²	126.3	87%	0.871	65%	0.647	S	S	*	*			trans	173.3	82.5	139.4	30	0	0	0	0	110.5
603	I	38.6	Very low	42.7	Very low	161 Å²	161	128.2 Å²	128.2	83%	0.826	67%	0.665	S	S	*	*			trans	-100.6	117.6	152.9	-62.7	173	0	0	0	105.2	N605	I603-N605 PolarHBondContact O-N 2.04Å; I603-N605 VanDerWaalsContact O-N 3.09Å
604	P	38	Very low	42	Very low	119 Å²	119	126.3 Å²	126.3	77%	0.773	67%	0.666	S	S	*	*			trans	-72.6	106	175.1	29.3	-28.6	0	0	0	107.3
605	N	42.2	Very low	41.4	Very low	125 Å²	125	127.9 Å²	127.9	67%	0.668	68%	0.684	S	S	*	*			trans	-95.3	129.7	167.6	-153.8	1.4	0	0	0	107.9	I603 N607	I603-N605 PolarHBondContact O-N 2.04Å; I603-N605 VanDerWaalsContact O-N 3.09Å; N605-N607 PolarHBondContact O-N 3.36Å
606	N	50.6	Low	41.3	Very low	154 Å²	154	126 Å²	126	82%	0.824	69%	0.688	S	S	*	*	S	Bend	trans	-67.6	12	-171.6	-87.8	-10.4	0	0	0	115.3
607	N	48	Very low	41.4	Very low	116 Å²	116	123.7 Å²	123.7	62%	0.62	69%	0.689	S	S	*	*	S	Bend	trans	-128	130.9	176.9	-69.2	-22.4	0	0	0	107.7	N605 T609	N605-N607 PolarHBondContact O-N 3.36Å; N607-T609 PolarHBondContact O-N 3.36Å
608	N	42.6	Very low	41.4	Very low	176 Å²	176	121.2 Å²	121.2	94%	0.941	69%	0.687	S	S	*	*	S	Bend	trans	-62.2	54.7	-172.4	-66.4	-20.5	0	0	0	115
609	T	37.6	Very low	41.7	Very low	104 Å²	104	119 Å²	119	64%	0.638	69%	0.689	S	S	*	*			trans	-143.8	104.4	-178.7	-3.2	0	0	0	0	109.4	N607 T611	N607-T609 PolarHBondContact O-N 3.36Å; T609-T611 PolarHBondContact O-N 3.45Å
610	I	38.3	Very low	41.8	Very low	165 Å²	165	116.1 Å²	116.1	85%	0.846	67%	0.671	S	S	*	*			trans	-83.5	104.4	176.2	-59.4	172.6	0	0	0	107.9
611	T	34	Very low	42.4	Very low	117 Å²	117	116.3 Å²	116.3	72%	0.718	67%	0.672	S	S	*	*			trans	-104.5	113.7	167.1	22.9	0	0	0	0	109.4	T609	T609-T611 PolarHBondContact O-N 3.45Å
612	T	34.9	Very low	43	Very low	98 Å²	98	115.4 Å²	115.4	60%	0.601	67%	0.67	S	S	*	*			trans	-79.5	114.5	172.6	36.8	0	0	0	0	110.6
613	T	36.3	Very low	43.9	Very low	119 Å²	119	113.9 Å²	113.9	73%	0.73	66%	0.657	S	S	*	*			trans	-116.8	121.2	168.1	41.5	0	0	0	0	109.9
614	T	41	Very low	44.5	Very low	114 Å²	114	111.2 Å²	111.2	70%	0.699	64%	0.643	S	S	*	*			trans	-92.2	109.7	177.9	49.6	0	0	0	0	110.5
615	T	37.5	Very low	45.7	Very low	124 Å²	124	109.8 Å²	109.8	76%	0.761	63%	0.628	S	S	*	*			trans	-116.3	115.8	164.9	41.1	0	0	0	0	109.5	T617	T615-T617 PolarHBondContact O-N 3.05Å
616	P	45	Very low	46.7	Very low	89 Å²	89	108 Å²	108	58%	0.578	62%	0.618	S	S	*	*			trans	-70.3	121.5	174.3	27.1	-30.8	0	0	0	109.4	T618 I621	P616-T618 PolarHBondContact O-N 2.97Å; P616-I621 HydrophobicContact CB-CD1 4.43Å
617	T	45.8	Very low	47.2	Very low	84 Å²	84	104.8 Å²	104.8	52%	0.515	60%	0.6	S	S	.	*			trans	-67.6	122.4	172.8	47.5	0	0	0	0	109.5	T615 T619 T620	T615-T617 PolarHBondContact O-N 3.05Å; T617-T619 PolarHBondContact O-N 3.26Å; T617-T620 PolarHBondContact O-N 3.2Å; T617-T620 VanDerWaalsContact O-N 3.08Å; T617-T620 PolarHBondContact O-OG1 3.43Å
618	T	46.6	Very low	47.7	Very low	112 Å²	112	103.2 Å²	103.2	69%	0.687	60%	0.598	S	S	*	*	H	α-helix	trans	-55.7	-16.6	-178.1	39.1	0	0	0	0	114.6	P616 T622	P616-T618 PolarHBondContact O-N 2.97Å; T618-T622 PolarHBondContact O-N 3.42Å; T618-T622 PolarHBondContact O-OG1 3.39Å
619	T	51.5	Low	48.6	Very low	101 Å²	101	101 Å²	101	62%	0.62	58%	0.584	S	S	*	*	H	α-helix	trans	-72	-31.3	176.9	51.9	0	0	0	0	113.1	T617 L623	T617-T619 PolarHBondContact O-N 3.26Å; T619-L623 PolarHBondContact O-N 2.93Å
620	T	50.4	Low	49.4	Very low	41 Å²	41	102.5 Å²	102.5	25%	0.252	59%	0.587	S	S	.	*	H	α-helix	trans	-78.2	-36.6	-177.5	55.6	0	0	0	0	112.6	T617 T622 L623 L624	T617-T620 PolarHBondContact O-N 3.2Å; T617-T620 VanDerWaalsContact O-N 3.08Å; T617-T620 PolarHBondContact O-OG1 3.43Å; T620-T622 VanDerWaalsContact C-N 3.35Å; T620-L623 PolarHBondContact O-N 3.07Å; T620-L624 PolarHBondContact O-N 2.85Å
621	I	55.7	Low	49.6	Very low	84 Å²	84	103.4 Å²	103.4	43%	0.431	59%	0.593	S	S	.	*	H	α-helix	trans	-64.9	-41.5	175.3	-62.3	173.8	0	0	0	110.3	P616 L623 L624 I625	P616-I621 HydrophobicContact CB-CD1 4.43Å; I621-L623 VanDerWaalsContact C-N 3.32Å; I621-L623 PolarHBondContact O-N 3.1Å; I621-L624 PolarHBondContact O-N 3.02Å; I621-I625 HydrophobicContact CG2-CD1 3.81Å; I621-I625 HydrophobicContact CG2-CG1 4.41Å; I621-I625 VanDerWaalsContact O-CG1 3.27Å; I621-I625 WeakPolarHBondContact O-CG1 3.49Å; I621-I625 PolarHBondContact O-N 2.75Å
622	T	51.6	Low	50.4	Low	78 Å²	78	102.8 Å²	102.8	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-62.9	-38.7	177.3	-41.6	0	0	0	0	111.8	T618 T620 I625 I626	T618-T622 PolarHBondContact O-N 3.42Å; T618-T622 PolarHBondContact O-OG1 3.39Å; T620-T622 VanDerWaalsContact C-N 3.35Å; T622-I625 PolarHBondContact O-N 2.94Å; T622-I626 HydrophobicContact CG2-CD1 4.2Å; T622-I626 WeakPolarHBondContact O-CD1 3.01Å; T622-I626 VanDerWaalsContact O-CG1 3.22Å; T622-I626 WeakPolarHBondContact O-CG1 3.03Å; T622-I626 PolarHBondContact O-N 3.48Å
623	L	55.2	Low	51.2	Low	111 Å²	111	103 Å²	103	58%	0.581	59%	0.586	S	S	*	*	H	α-helix	trans	-69.1	-38.4	177.5	-147.1	115.7	0	0	0	112	T619 T620 I621 I626 I627	T619-L623 PolarHBondContact O-N 2.93Å; T620-L623 PolarHBondContact O-N 3.07Å; I621-L623 VanDerWaalsContact C-N 3.32Å; I621-L623 PolarHBondContact O-N 3.1Å; L623-I626 PolarHBondContact O-N 3.38Å; L623-I627 HydrophobicContact CD2-CD1 3.81Å; L623-I627 WeakPolarHBondContact O-CB 3.31Å; L623-I627 VanDerWaalsContact O-CG1 3.24Å; L623-I627 WeakPolarHBondContact O-CG1 3.44Å; L623-I627 PolarHBondContact O-N 3.01Å
624	L	51.6	Low	52	Low	104 Å²	104	102.1 Å²	102.1	55%	0.545	58%	0.578	S	S	.	*	H	α-helix	trans	-66.9	-35.9	173.9	-81.9	164.7	0	0	0	113.1	T620 I621 S628	T620-L624 PolarHBondContact O-N 2.85Å; I621-L624 PolarHBondContact O-N 3.02Å; L624-S628 WeakPolarHBondContact O-CB 3.47Å; L624-S628 PolarHBondContact O-N 2.95Å; L624-S628 PolarHBondContact O-OG 2.97Å
625	I	63	Low	52.6	Low	90 Å²	90	101.4 Å²	101.4	46%	0.462	57%	0.571	S	S	.	*	H	α-helix	trans	-67.4	-44.5	173.3	-70	168.4	0	0	0	110	I621 T622 I627 S628 I629	I621-I625 HydrophobicContact CG2-CD1 3.81Å; I621-I625 HydrophobicContact CG2-CG1 4.41Å; I621-I625 VanDerWaalsContact O-CG1 3.27Å; I621-I625 WeakPolarHBondContact O-CG1 3.49Å; I621-I625 PolarHBondContact O-N 2.75Å; T622-I625 PolarHBondContact O-N 2.94Å; I625-I627 PolarHBondContact O-N 3.05Å; I625-S628 PolarHBondContact O-N 3.35Å; I625-I629 HydrophobicContact CG2-CD1 3.56Å; I625-I629 HydrophobicContact CG2-CG1 4.34Å; I625-I629 WeakPolarHBondContact O-CB 3.42Å; I625-I629 WeakPolarHBondContact O-CD1 3.41Å; I625-I629 WeakPolarHBondContact O-CG1 3.42Å; I625-I629 PolarHBondContact O-N 3.48Å
626	I	64.1	Low	53.6	Low	87 Å²	87	100 Å²	100	45%	0.446	56%	0.559	S	S	.	*	H	α-helix	trans	-62.5	-43.4	176.9	-69.4	165	0	0	0	110.8	T622 L623 I629 I630	T622-I626 HydrophobicContact CG2-CD1 4.2Å; T622-I626 WeakPolarHBondContact O-CD1 3.01Å; T622-I626 VanDerWaalsContact O-CG1 3.22Å; T622-I626 WeakPolarHBondContact O-CG1 3.03Å; T622-I626 PolarHBondContact O-N 3.48Å; L623-I626 PolarHBondContact O-N 3.38Å; I626-I629 PolarHBondContact O-N 3.38Å; I626-I630 HydrophobicContact CG2-CD1 3.64Å; I626-I630 HydrophobicContact CG2-CG1 4.45Å; I626-I630 WeakPolarHBondContact O-CB 3.28Å; I626-I630 VanDerWaalsContact O-CG1 3.22Å; I626-I630 WeakPolarHBondContact O-CG1 3.29Å; I626-I630 PolarHBondContact O-N 3.09Å
627	I	61	Low	54.2	Low	86 Å²	86	100.7 Å²	100.7	44%	0.441	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-40.5	176.7	-69	167	0	0	0	111.1	L623 I625 I629 I630 L631	L623-I627 HydrophobicContact CD2-CD1 3.81Å; L623-I627 WeakPolarHBondContact O-CB 3.31Å; L623-I627 VanDerWaalsContact O-CG1 3.24Å; L623-I627 WeakPolarHBondContact O-CG1 3.44Å; L623-I627 PolarHBondContact O-N 3.01Å; I625-I627 PolarHBondContact O-N 3.05Å; I627-I629 VanDerWaalsContact C-N 3.31Å; I627-I629 PolarHBondContact O-N 3.39Å; I627-I630 PolarHBondContact O-N 2.68Å; I627-L631 PolarHBondContact O-N 2.87Å
628	S	57.3	Low	54.8	Low	83 Å²	83	101.9 Å²	101.9	58%	0.58	56%	0.561	S	S	*	*	H	α-helix	trans	-70.5	-23.3	176.4	-64.8	0	0	0	0	114.1	L624 I625	L624-S628 WeakPolarHBondContact O-CB 3.47Å; L624-S628 PolarHBondContact O-N 2.95Å; L624-S628 PolarHBondContact O-OG 2.97Å; I625-S628 PolarHBondContact O-N 3.35Å
629	I	62.1	Low	55.4	Low	129 Å²	129	101.2 Å²	101.2	66%	0.662	55%	0.551	S	S	*	*	H	α-helix	trans	-83.1	-27.7	174.5	-69.8	167.8	0	0	0	111.2	I625 I626 I627	I625-I629 HydrophobicContact CG2-CD1 3.56Å; I625-I629 HydrophobicContact CG2-CG1 4.34Å; I625-I629 WeakPolarHBondContact O-CB 3.42Å; I625-I629 WeakPolarHBondContact O-CD1 3.41Å; I625-I629 WeakPolarHBondContact O-CG1 3.42Å; I625-I629 PolarHBondContact O-N 3.48Å; I626-I629 PolarHBondContact O-N 3.38Å; I627-I629 VanDerWaalsContact C-N 3.31Å; I627-I629 PolarHBondContact O-N 3.39Å
630	I	54.7	Low	55.7	Low	136 Å²	136	101.2 Å²	101.2	70%	0.697	55%	0.545	S	S	*	.	H	α-helix	trans	-82.3	-33	179.3	-70.1	169.7	0	0	0	112	I626 I627	I626-I630 HydrophobicContact CG2-CD1 3.64Å; I626-I630 HydrophobicContact CG2-CG1 4.45Å; I626-I630 WeakPolarHBondContact O-CB 3.28Å; I626-I630 VanDerWaalsContact O-CG1 3.22Å; I626-I630 WeakPolarHBondContact O-CG1 3.29Å; I626-I630 PolarHBondContact O-N 3.09Å; I627-I630 PolarHBondContact O-N 2.68Å
631	L	42.1	Very low	56.2	Low	185 Å²	185	106.6 Å²	106.6	97%	0.969	57%	0.572	S	S	*	*			trans	-71.4	0	170.7	-128.8	103.6	0	0	0	110.8	I627	I627-L631 PolarHBondContact O-N 2.87Å

Retrieved 631 of 631 residues in 805.7 ms (Link to these results)

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