A0A3Q0KRR9_SCHMA Loading...

Transmembrane 9 superfamily member

AlphaFold DB , UniProt , Accession A0A3Q0KRR9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 651 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	50.4	Low	64.7	Low	211 Å²	211	124.8 Å²	124.8	100%	1.039	65%	0.647	S	S	*	*				0	-45	0	-122.7	169.5	-166.1	0	0	112.5	V3 K4 N5	M1-V3 PolarHBondContact O-N 2.85Å; M1-K4 PolarHBondContact O-N 3.15Å; M1-N5 PolarHBondContact O-N 3.18Å
2	M	52	Low	64.9	Low	164 Å²	164	123.3 Å²	123.3	81%	0.808	64%	0.64	S	S	*	*	H	α-helix	trans	-51.4	-43.6	178.6	-93	169.8	132	0	0	115.3	K4 N5 C6	M2-K4 PolarHBondContact O-N 3.2Å; M2-N5 PolarHBondContact O-N 2.69Å; M2-C6 PolarHBondContact O-N 2.97Å; M2-C6 VanDerWaalsContact O-N 3.08Å
3	V	63.3	Low	65.2	Low	118 Å²	118	122.2 Å²	122.2	72%	0.715	63%	0.633	S	S	*	*	H	α-helix	trans	-63.8	-37.7	-177.7	-178.3	0	0	0	0	112.7	M1 N5 C6 V7	M1-V3 PolarHBondContact O-N 2.85Å; V3-N5 PolarHBondContact O-N 3.4Å; V3-C6 PolarHBondContact O-N 3.04Å; V3-V7 WeakPolarHBondContact O-CG2 3.3Å; V3-V7 PolarHBondContact O-N 3.47Å; V3-V7 VanDerWaalsContact O-N 3.16Å
4	K	58.7	Low	65.6	Low	175 Å²	175	118 Å²	118	76%	0.761	62%	0.616	S	S	*	*	H	α-helix	trans	-66.7	-36.6	177.5	-105.2	-177.1	174.6	-179.2	0	112.3	M1 M2 L8	M1-K4 PolarHBondContact O-N 3.15Å; M2-K4 PolarHBondContact O-N 3.2Å; K4-L8 PolarHBondContact O-N 3.38Å
5	N	63.9	Low	65.5	Low	115 Å²	115	118.3 Å²	118.3	62%	0.615	61%	0.613	S	S	*	*	H	α-helix	trans	-72.7	-35.7	178.6	-69.9	1.6	0	0	0	111.7	M1 M2 V3 L8 G9	M1-N5 PolarHBondContact O-N 3.18Å; M2-N5 PolarHBondContact O-N 2.69Å; V3-N5 PolarHBondContact O-N 3.4Å; N5-L8 PolarHBondContact O-N 3.1Å; N5-G9 PolarHBondContact O-N 3.14Å
6	C	70.7	Confident	65.1	Low	83 Å²	83	118 Å²	118	56%	0.561	61%	0.611	S	S	*	*	H	α-helix	trans	-64.7	-41.8	174.1	-79.9	0	0	0	0	112.6	M2 V3 G9 W10	M2-C6 PolarHBondContact O-N 2.97Å; M2-C6 VanDerWaalsContact O-N 3.08Å; V3-C6 PolarHBondContact O-N 3.04Å; C6-G9 PolarHBondContact O-N 3.24Å; C6-W10 WeakPolarHBondContact O-CB 3.38Å; C6-W10 PolarHBondContact O-N 2.66Å
7	V	73.7	Confident	65	Low	85 Å²	85	116.5 Å²	116.5	52%	0.515	61%	0.614	S	S	.	*	H	α-helix	trans	-65.2	-40.5	178.3	174.9	0	0	0	0	111.2	V3 W10 L11	V3-V7 WeakPolarHBondContact O-CG2 3.3Å; V3-V7 PolarHBondContact O-N 3.47Å; V3-V7 VanDerWaalsContact O-N 3.16Å; V7-W10 PolarHBondContact O-N 3.18Å; V7-L11 HydrophobicContact CG1-CD1 4.06Å; V7-L11 WeakPolarHBondContact O-CB 3.4Å; V7-L11 PolarHBondContact O-N 3.07Å
8	L	68.8	Low	64.7	Low	115 Å²	115	117.2 Å²	117.2	60%	0.602	62%	0.617	S	S	*	*	H	α-helix	trans	-66.3	-40	176	-158.6	77.4	0	0	0	111.6	K4 N5 L11 L12	K4-L8 PolarHBondContact O-N 3.38Å; N5-L8 PolarHBondContact O-N 3.1Å; L8-L11 PolarHBondContact O-N 2.99Å; L8-L12 PolarHBondContact O-N 2.98Å
9	G	70	Confident	64.2	Low	32 Å²	32	116.1 Å²	116.1	33%	0.33	62%	0.615	S	S	.	*	H	α-helix	trans	-62	-43.9	174.3	0	0	0	0	0	112.6	N5 C6 L12 I13	N5-G9 PolarHBondContact O-N 3.14Å; C6-G9 PolarHBondContact O-N 3.24Å; G9-L12 PolarHBondContact O-N 3.34Å; G9-I13 VanDerWaalsContact O-CG1 3.28Å; G9-I13 WeakPolarHBondContact O-CG1 3.14Å; G9-I13 PolarHBondContact O-N 3.46Å
10	W	72.1	Confident	63.5	Low	186 Å²	186	121.7 Å²	121.7	71%	0.705	63%	0.627	S	S	*	*	H	α-helix	trans	-65.1	-43	176	-95.4	80.3	0	0	0	112.7	C6 V7 L12 I13 V14	C6-W10 WeakPolarHBondContact O-CB 3.38Å; C6-W10 PolarHBondContact O-N 2.66Å; V7-W10 PolarHBondContact O-N 3.18Å; W10-L12 VanDerWaalsContact C-N 3.3Å; W10-L12 PolarHBondContact O-N 3.08Å; W10-I13 PolarHBondContact O-N 3.14Å; W10-V14 HydrophobicContact CE3-CG2 4.43Å; W10-V14 WeakPolarHBondContact O-CB 3.39Å; W10-V14 VanDerWaalsContact O-CG2 3.28Å; W10-V14 WeakPolarHBondContact O-CG2 3.35Å; W10-V14 PolarHBondContact O-N 2.95Å
11	L	68.7	Low	62.7	Low	89 Å²	89	120.6 Å²	120.6	47%	0.466	64%	0.636	S	S	.	*	H	α-helix	trans	-60.5	-40.1	174.2	-85.2	160.3	0	0	0	111.7	V7 L8 V14 H15	V7-L11 HydrophobicContact CG1-CD1 4.06Å; V7-L11 WeakPolarHBondContact O-CB 3.4Å; V7-L11 PolarHBondContact O-N 3.07Å; L8-L11 PolarHBondContact O-N 2.99Å; L11-V14 PolarHBondContact O-N 3.49Å; L11-H15 WeakPolarHBondContact O-CB 2.92Å; L11-H15 PolarHBondContact O-CD2 3.29Å; L11-H15 PolarHBondContact O-N 3.32Å
12	L	67	Low	62.3	Low	107 Å²	107	121.5 Å²	121.5	56%	0.56	63%	0.628	S	S	*	*	H	α-helix	trans	-66.2	-41.4	177.5	-135.4	109.2	0	0	0	111.7	L8 G9 W10 H15 L16	L8-L12 PolarHBondContact O-N 2.98Å; G9-L12 PolarHBondContact O-N 3.34Å; W10-L12 VanDerWaalsContact C-N 3.3Å; W10-L12 PolarHBondContact O-N 3.08Å; L12-H15 PolarHBondContact O-N 3.21Å; L12-L16 HydrophobicContact CD2-CD1 4.12Å; L12-L16 WeakPolarHBondContact O-CB 3.3Å; L12-L16 WeakPolarHBondContact O-CD1 3.38Å; L12-L16 VanDerWaalsContact O-CG 3.3Å; L12-L16 WeakPolarHBondContact O-CG 3.22Å; L12-L16 PolarHBondContact O-N 3.42Å
13	I	68.5	Low	61.8	Low	108 Å²	108	120.1 Å²	120.1	55%	0.554	62%	0.615	S	S	*	*	H	α-helix	trans	-67.6	-41.3	177.8	-66.4	164.2	0	0	0	111.1	G9 W10 L16 S17	G9-I13 VanDerWaalsContact O-CG1 3.28Å; G9-I13 WeakPolarHBondContact O-CG1 3.14Å; G9-I13 PolarHBondContact O-N 3.46Å; W10-I13 PolarHBondContact O-N 3.14Å; I13-L16 PolarHBondContact O-N 3.42Å; I13-S17 PolarHBondContact O-N 3Å; I13-S17 PolarHBondContact O-OG 3.03Å
14	V	70.1	Confident	60.9	Low	64 Å²	64	118.2 Å²	118.2	39%	0.388	60%	0.6	S	S	.	*	H	α-helix	trans	-65.8	-39.6	175.5	172.1	0	0	0	0	111	W10 L11 S17 L18	W10-V14 HydrophobicContact CE3-CG2 4.43Å; W10-V14 WeakPolarHBondContact O-CB 3.39Å; W10-V14 VanDerWaalsContact O-CG2 3.28Å; W10-V14 WeakPolarHBondContact O-CG2 3.35Å; W10-V14 PolarHBondContact O-N 2.95Å; L11-V14 PolarHBondContact O-N 3.49Å; V14-S17 WeakPolarHBondContact CA-OG 3.33Å; V14-S17 PolarHBondContact O-N 3.21Å; V14-S17 PolarHBondContact O-OG 3.44Å; V14-S17 VanDerWaalsContact O-OG 3.05Å; V14-L18 HydrophobicContact CG1-CD1 4.01Å; V14-L18 WeakPolarHBondContact O-CB 3.3Å; V14-L18 WeakPolarHBondContact O-CD1 3.31Å; V14-L18 VanDerWaalsContact O-CG 3.32Å; V14-L18 WeakPolarHBondContact O-CG 3.39Å; V14-L18 PolarHBondContact O-N 3.46Å
15	H	64	Low	60.3	Low	123 Å²	123	113.2 Å²	113.2	57%	0.569	59%	0.585	S	S	*	*	H	α-helix	trans	-65.6	-40	173	-83.7	-60.8	0	0	0	111.9	L11 L12 L18 V19	L11-H15 WeakPolarHBondContact O-CB 2.92Å; L11-H15 PolarHBondContact O-CD2 3.29Å; L11-H15 PolarHBondContact O-N 3.32Å; L12-H15 PolarHBondContact O-N 3.21Å; H15-L18 PolarHBondContact O-N 2.89Å; H15-V19 WeakPolarHBondContact O-CG2 3.31Å; H15-V19 PolarHBondContact O-N 3.11Å
16	L	60.4	Low	59.8	Low	113 Å²	113	108.2 Å²	108.2	59%	0.592	56%	0.562	S	S	*	*	H	α-helix	trans	-65.5	-36.2	175.7	-79.3	159.4	0	0	0	112.4	L12 I13 V19	L12-L16 HydrophobicContact CD2-CD1 4.12Å; L12-L16 WeakPolarHBondContact O-CB 3.3Å; L12-L16 WeakPolarHBondContact O-CD1 3.38Å; L12-L16 VanDerWaalsContact O-CG 3.3Å; L12-L16 WeakPolarHBondContact O-CG 3.22Å; L12-L16 PolarHBondContact O-N 3.42Å; I13-L16 PolarHBondContact O-N 3.42Å; L16-V19 PolarHBondContact O-N 3.36Å
17	S	63.4	Low	59.3	Low	93 Å²	93	108.7 Å²	108.7	65%	0.65	56%	0.557	S	S	*	*	H	α-helix	trans	-76.3	-23.7	177.1	64.2	0	0	0	0	113.4	I13 V14 V19	I13-S17 PolarHBondContact O-N 3Å; I13-S17 PolarHBondContact O-OG 3.03Å; V14-S17 WeakPolarHBondContact CA-OG 3.33Å; V14-S17 PolarHBondContact O-N 3.21Å; V14-S17 PolarHBondContact O-OG 3.44Å; V14-S17 VanDerWaalsContact O-OG 3.05Å; S17-V19 VanDerWaalsContact C-N 3.3Å
18	L	58.4	Low	59.2	Low	128 Å²	128	107.2 Å²	107.2	67%	0.67	55%	0.551	S	S	*	*	H	α-helix	trans	-77.6	-14.4	170.6	-74.2	165.7	0	0	0	113.1	V14 H15 R20	V14-L18 HydrophobicContact CG1-CD1 4.01Å; V14-L18 WeakPolarHBondContact O-CB 3.3Å; V14-L18 WeakPolarHBondContact O-CD1 3.31Å; V14-L18 VanDerWaalsContact O-CG 3.32Å; V14-L18 WeakPolarHBondContact O-CG 3.39Å; V14-L18 PolarHBondContact O-N 3.46Å; H15-L18 PolarHBondContact O-N 2.89Å; L18-R20 PolarHBondContact O-N 3.49Å
19	V	55.6	Low	59.6	Low	96 Å²	96	104 Å²	104	58%	0.582	54%	0.537	S	S	*	.			trans	-77.9	93.3	171.8	179	0	0	0	0	108	H15 L16 S17 A21	H15-V19 WeakPolarHBondContact O-CG2 3.31Å; H15-V19 PolarHBondContact O-N 3.11Å; L16-V19 PolarHBondContact O-N 3.36Å; S17-V19 VanDerWaalsContact C-N 3.3Å; V19-A21 PolarHBondContact O-N 2.89Å; V19-A21 VanDerWaalsContact O-N 3.12Å
20	R	50.2	Low	60.4	Low	229 Å²	229	104.6 Å²	104.6	86%	0.864	53%	0.532	S	S	*	.			trans	-52.5	121.1	156.4	-80	-177.7	172.5	-179.1	-2.5	106.8	L18 W22	L18-R20 PolarHBondContact O-N 3.49Å; R20-W22 PolarHBondContact O-N 2.9Å
21	A	46.8	Very low	61.1	Low	98 Å²	98	96.9 Å²	96.9	81%	0.81	51%	0.505	S	S	*	.			trans	-43.7	114.5	175.8	0	0	0	0	0	108.6	V19 Y23	V19-A21 PolarHBondContact O-N 2.89Å; V19-A21 VanDerWaalsContact O-N 3.12Å; A21-Y23 PolarHBondContact O-N 3.4Å; A21-Y23 VanDerWaalsContact O-N 3.1Å
22	W	42.4	Very low	62.1	Low	231 Å²	231	93.2 Å²	93.2	88%	0.875	49%	0.485	S	S	*	.			trans	-66.5	114.3	-178.1	-116.5	37.3	0	0	0	107.5	R20 L24	R20-W22 PolarHBondContact O-N 2.9Å; W22-L24 PolarHBondContact O-N 3.13Å; W22-L24 VanDerWaalsContact O-N 3.15Å
23	Y	42	Very low	63.1	Low	134 Å²	134	88.7 Å²	88.7	53%	0.525	46%	0.462	S	S	.	.			trans	-59.4	114.8	162.2	170.9	-114	0	0	0	107.2	A21 P25 S28	A21-Y23 PolarHBondContact O-N 3.4Å; A21-Y23 VanDerWaalsContact O-N 3.1Å; Y23-P25 HydrophobicContact CD1-CB 4.28Å; Y23-P25 HydrophobicContact CD1-CG 3.92Å; Y23-P25 VanDerWaalsContact CE1-CA 3.43Å; Y23-P25 HydrophobicContact CE1-CB 3.71Å; Y23-P25 HydrophobicContact CE1-CG 3.84Å; Y23-P25 WeakPolarHBondContact O-CD 3.3Å; Y23-S28 WeakPolarHBondContact CE2-OG 3.25Å
24	L	43.5	Very low	63.8	Low	79 Å²	79	85.8 Å²	85.8	41%	0.414	45%	0.45	S	S	.	.			trans	-81	106.1	164.5	-89.2	129.3	0	0	0	107.3	W22 G26 I27	W22-L24 PolarHBondContact O-N 3.13Å; W22-L24 VanDerWaalsContact O-N 3.15Å; L24-G26 PolarHBondContact O-N 2.92Å; L24-I27 HydrophobicContact CB-CD1 3.55Å; L24-I27 HydrophobicContact CB-CG1 4.06Å; L24-I27 HydrophobicContact CD1-CD1 4.32Å; L24-I27 HydrophobicContact CD2-CD1 3.99Å; L24-I27 HydrophobicContact CG-CD1 4.16Å; L24-I27 PolarHBondContact O-N 3.18Å
25	P	46	Very low	64.4	Low	69 Å²	69	86.3 Å²	86.3	45%	0.448	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	133.4	-179.4	-19.8	33.5	0	0	0	110.8	Y23	Y23-P25 HydrophobicContact CD1-CB 4.28Å; Y23-P25 HydrophobicContact CD1-CG 3.92Å; Y23-P25 VanDerWaalsContact CE1-CA 3.43Å; Y23-P25 HydrophobicContact CE1-CB 3.71Å; Y23-P25 HydrophobicContact CE1-CG 3.84Å; Y23-P25 WeakPolarHBondContact O-CD 3.3Å
26	G	53.1	Low	64.8	Low	11 Å²	11	86.9 Å²	86.9	11%	0.113	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-4.2	174.6	0	0	0	0	0	116.4	L24 N142	L24-G26 PolarHBondContact O-N 2.92Å; G26-N142 WeakPolarHBondContact CA-ND2 3.37Å
27	I	61.2	Low	65	Low	92 Å²	92	83.7 Å²	83.7	47%	0.472	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-36.5	-179.5	-54.6	-174.4	0	0	0	112.6	L24 W271	L24-I27 HydrophobicContact CB-CD1 3.55Å; L24-I27 HydrophobicContact CB-CG1 4.06Å; L24-I27 HydrophobicContact CD1-CD1 4.32Å; L24-I27 HydrophobicContact CD2-CD1 3.99Å; L24-I27 HydrophobicContact CG-CD1 4.16Å; L24-I27 PolarHBondContact O-N 3.18Å; I27-W271 WeakPolarHBondContact O-CH2 3.4Å
28	S	71.1	Confident	64.7	Low	54 Å²	54	81.5 Å²	81.5	38%	0.378	45%	0.447	S	S	.	.	S	Bend	trans	-85.4	138.2	-179.4	68	0	0	0	0	111.8	Y23	Y23-S28 WeakPolarHBondContact CE2-OG 3.25Å
29	P	77.9	Confident	64.6	Low	49 Å²	49	81.8 Å²	81.8	32%	0.318	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-68.4	140.3	175.7	28.4	-33.8	0	0	0	111.5	R217 W271	P29-R217 HydrophobicContact CB-CG 4.4Å; P29-W271 HydrophobicContact CB-CD2 3.9Å; P29-W271 HydrophobicContact CB-CE3 4Å; P29-W271 HydrophobicContact CB-CH2 4.07Å; P29-W271 HydrophobicContact CB-CZ2 3.96Å; P29-W271 HydrophobicContact CB-CZ3 4.09Å
30	I	85.6	Confident	64.5	Low	44 Å²	44	86.4 Å²	86.4	23%	0.226	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-97.7	127.9	168	-60.3	176.2	0	0	0	107.5	Y32 K44	I30-Y32 HydrophobicContact CB-CE2 3.93Å; I30-Y32 HydrophobicContact CG2-CD2 4.19Å; I30-Y32 HydrophobicContact CG2-CE1 4.13Å; I30-Y32 HydrophobicContact CG2-CE2 3.66Å; I30-K44 HydrophobicContact CG2-CD 4.21Å
31	N	87.5	Confident	64.9	Low	24 Å²	24	78.1 Å²	78.1	13%	0.128	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131	172.7	-69.6	-13.7	0	0	0	108.9	C43 K44 R217	N31-C43 VanDerWaalsContact C-SG 3.51Å; N31-C43 WeakPolarHBondContact O-CA 3.32Å; N31-C43 PolarHBondContact O-SG 3.09Å; N31-C43 VanDerWaalsContact O-SG 3.35Å; N31-K44 PolarHBondContact O-N 3.09Å; N31-R217 PolarHBondContact OD1-NE 3.08Å; N31-R217 PolarHBondContact OD1-NH2 3.31Å
32	Y	89.7	Confident	66.2	Low	12 Å²	12	81.2 Å²	81.2	5%	0.047	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.5	175.1	-66.5	-85.4	0	0	0	111.5	I30 K44 I47 F101 D141 A215 G216 I218	I30-Y32 HydrophobicContact CB-CE2 3.93Å; I30-Y32 HydrophobicContact CG2-CD2 4.19Å; I30-Y32 HydrophobicContact CG2-CE1 4.13Å; I30-Y32 HydrophobicContact CG2-CE2 3.66Å; Y32-K44 CarbonylContact C-O 3.52Å; Y32-K44 WeakPolarHBondContact CA-O 3.44Å; Y32-K44 HydrophobicContact CD1-CB 3.98Å; Y32-K44 WeakPolarHBondContact CD1-O 3.5Å; Y32-K44 HydrophobicContact CE1-CB 4.06Å; Y32-I47 HydrophobicContact CD1-CG1 3.61Å; Y32-I47 HydrophobicContact CE1-CB 4.28Å; Y32-I47 HydrophobicContact CE1-CG1 3.64Å; Y32-I47 HydrophobicContact CE1-CG2 4.46Å; Y32-I47 HydrophobicContact CG-CG1 4.25Å; Y32-F101 HydrophobicContact CG-CD2 4.48Å; Y32-F101 WeakPolarHBondContact O-CE1 3.38Å; Y32-D141 HydrophobicContact CE2-CB 4.36Å; Y32-A215 CarbonylContact O-C 3.58Å; Y32-A215 VanDerWaalsContact O-CA 3.22Å; Y32-A215 WeakPolarHBondContact O-CA 3.33Å; Y32-G216 PolarHBondContact N-O 3.24Å; Y32-G216 PolarHBondContact O-N 3.01Å; Y32-I218 HydrophobicContact CD2-CD1 4.01Å; Y32-I218 HydrophobicContact CD2-CG1 4.04Å; Y32-I218 HydrophobicContact CE2-CD1 3.72Å; Y32-I218 HydrophobicContact CE2-CG1 4.09Å
33	C	87.4	Confident	67.9	Low	12 Å²	12	70.9 Å²	70.9	8%	0.081	42%	0.418	C	S	.	.			trans	-136.1	143.5	-176.2	-64.4	0	0	0	0	110.4	V37 C43 K44 S45 V213	C33-V37 HydrophobicContact CB-CG2 4.18Å; C33-C43 VanDerWaalsContact CA-SG 3.59Å; C33-C43 HydrophobicContact CB-CB 3.81Å; C33-C43 WeakPolarHBondContact CB-SG 3.18Å; C33-C43 PolarHBondContact N-SG 3.38Å; C33-C43 WeakPolarHBondContact SG-CB 3.36Å; C33-C43 CovalentContact SG-SG 2.02Å; C33-C43 PolarHBondContact SG-SG 3.37Å; C33-K44 PolarHBondContact N-O 2.92Å; C33-S45 VanDerWaalsContact O-CA 3.23Å; C33-S45 WeakPolarHBondContact O-CA 3.47Å; C33-S45 WeakPolarHBondContact O-CB 3.45Å; C33-V213 HydrophobicContact CB-CG1 3.86Å
34	P	84.1	Confident	70	Confident	47 Å²	47	70.5 Å²	70.5	31%	0.305	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-65.3	147	173.7	27.9	-33	0	0	0	109.9	K214	P34-K214 WeakPolarHBondContact CD-O 3.45Å
35	P	82.1	Confident	72.1	Confident	75 Å²	75	68.6 Å²	68.6	49%	0.487	41%	0.412	S	S	.	.	S	Bend	trans	-62.9	152.5	173.1	26.8	-33.6	0	0	0	111.6	I100	P35-I100 HydrophobicContact CG-CG2 3.88Å
36	P	72.9	Confident	74.2	Confident	134 Å²	134	69.6 Å²	69.6	87%	0.87	41%	0.41	S	S	*	.	P	Polyproline II helix	cis	-81.7	128.7	4.9	31.6	-32.9	0	0	0	112.5
37	V	63	Low	76.1	Confident	46 Å²	46	69 Å²	69	28%	0.279	41%	0.405	S	S	.	.			trans	-97.7	115.8	175.6	177.2	0	0	0	0	107.5	C33 S41 C43	C33-V37 HydrophobicContact CB-CG2 4.18Å; V37-S41 WeakPolarHBondContact CG1-OG 3.25Å; V37-C43 VanDerWaalsContact CG1-O 3.27Å; V37-C43 WeakPolarHBondContact CG1-O 3.3Å
38	G	57.8	Low	77.5	Confident	48 Å²	48	67.2 Å²	67.2	50%	0.495	40%	0.398	S	S	.	.			trans	-64.8	141.1	171	0	0	0	0	0	110	E40 S41	G38-E40 PolarHBondContact O-N 3.37Å; G38-S41 PolarHBondContact O-N 3.17Å; G38-S41 PolarHBondContact O-OG 3.32Å
39	S	56.3	Low	78.5	Confident	133 Å²	133	64.7 Å²	64.7	93%	0.93	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-21	178.6	19.3	0	0	0	0	114.1
40	E	53.9	Low	79.2	Confident	194 Å²	194	63.6 Å²	63.6	91%	0.907	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-5.9	177.6	-71	-178.9	166.5	0	0	114.7	G38	G38-E40 PolarHBondContact O-N 3.37Å
41	S	59.4	Low	79.6	Confident	54 Å²	54	61.5 Å²	61.5	38%	0.378	36%	0.361	S	S	.	.	S	Bend	trans	-83.8	135.7	-179.5	64.6	0	0	0	0	111.4	V37 G38 C43	V37-S41 WeakPolarHBondContact CG1-OG 3.25Å; G38-S41 PolarHBondContact O-N 3.17Å; G38-S41 PolarHBondContact O-OG 3.32Å; S41-C43 PolarHBondContact O-N 3.03Å
42	N	72.5	Confident	79.7	Confident	163 Å²	163	61 Å²	61	87%	0.872	36%	0.359	S	S	*	.	S	Bend	trans	-69	28.5	170.8	-81.5	-25.9	0	0	0	112.6
43	C	79.9	Confident	79.8	Confident	15 Å²	15	61.7 Å²	61.7	10%	0.101	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.2	-171.8	-145.7	0	0	0	0	110.4	N31 C33 V37 S41	N31-C43 VanDerWaalsContact C-SG 3.51Å; N31-C43 WeakPolarHBondContact O-CA 3.32Å; N31-C43 PolarHBondContact O-SG 3.09Å; N31-C43 VanDerWaalsContact O-SG 3.35Å; C33-C43 VanDerWaalsContact CA-SG 3.59Å; C33-C43 HydrophobicContact CB-CB 3.81Å; C33-C43 WeakPolarHBondContact CB-SG 3.18Å; C33-C43 PolarHBondContact N-SG 3.38Å; C33-C43 WeakPolarHBondContact SG-CB 3.36Å; C33-C43 CovalentContact SG-SG 2.02Å; C33-C43 PolarHBondContact SG-SG 3.37Å; V37-C43 VanDerWaalsContact CG1-O 3.27Å; V37-C43 WeakPolarHBondContact CG1-O 3.3Å; S41-C43 PolarHBondContact O-N 3.03Å
44	K	85.9	Confident	80.1	Confident	126 Å²	126	61.1 Å²	61.1	55%	0.548	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.5	175.5	-67	-172.4	176	-172.1	0	110.2	I30 N31 Y32 C33	I30-K44 HydrophobicContact CG2-CD 4.21Å; N31-K44 PolarHBondContact O-N 3.09Å; Y32-K44 CarbonylContact C-O 3.52Å; Y32-K44 WeakPolarHBondContact CA-O 3.44Å; Y32-K44 HydrophobicContact CD1-CB 3.98Å; Y32-K44 WeakPolarHBondContact CD1-O 3.5Å; Y32-K44 HydrophobicContact CE1-CB 4.06Å; C33-K44 PolarHBondContact N-O 2.92Å
45	S	87.6	Confident	80.5	Confident	38 Å²	38	60.6 Å²	60.6	27%	0.266	35%	0.354	S	S	.	.	S	Bend	trans	-88.6	-39.1	173.5	43.8	0	0	0	0	112.9	C33 F101	C33-S45 VanDerWaalsContact O-CA 3.23Å; C33-S45 WeakPolarHBondContact O-CA 3.47Å; C33-S45 WeakPolarHBondContact O-CB 3.45Å; S45-F101 WeakPolarHBondContact O-CB 3.46Å; S45-F101 PolarHBondContact O-N 2.99Å
46	E	89.9	Confident	80.9	Confident	90 Å²	90	57.7 Å²	57.7	42%	0.421	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-88.2	135.7	-177.6	-173.3	168.5	-164.5	0	0	111.6
47	I	91.5	Very high	81.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.313	C	S	.	.			trans	-109.5	99.9	178	-55.2	163.5	0	0	0	108.1	Y32 L49 I99 F101 M140 I198 I218 F263	Y32-I47 HydrophobicContact CD1-CG1 3.61Å; Y32-I47 HydrophobicContact CE1-CB 4.28Å; Y32-I47 HydrophobicContact CE1-CG1 3.64Å; Y32-I47 HydrophobicContact CE1-CG2 4.46Å; Y32-I47 HydrophobicContact CG-CG1 4.25Å; I47-L49 PolarHBondContact O-N 3.45Å; I47-I99 HydrophobicContact CB-CB 4.32Å; I47-I99 HydrophobicContact CB-CG2 4.12Å; I47-I99 HydrophobicContact CD1-CG2 4.11Å; I47-I99 PolarHBondContact N-O 2.76Å; I47-F101 HydrophobicContact CD1-CB 4.01Å; I47-F101 HydrophobicContact CD1-CD2 4.11Å; I47-F101 HydrophobicContact CG1-CB 4.42Å; I47-M140 HydrophobicContact CG2-CE 3.98Å; I47-M140 HydrophobicContact CG2-CG 3.4Å; I47-M140 VanDerWaalsContact CG2-CG 3.4Å; I47-M140 HydrophobicContact CG2-SD 3.48Å; I47-M140 WeakPolarHBondContact CG2-SD 3.26Å; I47-I198 HydrophobicContact CD1-CD1 4.36Å; I47-I218 HydrophobicContact CD1-CD1 3.99Å; I47-I218 HydrophobicContact CG1-CD1 4.26Å; I47-I218 HydrophobicContact CG2-CD1 3.83Å; I47-F263 HydrophobicContact CD1-CE1 3.88Å; I47-F263 HydrophobicContact CD1-CZ 4.04Å
48	T	91.3	Very high	82.7	Confident	54 Å²	54	54.9 Å²	54.9	33%	0.331	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-67.7	119.9	177.8	-43.4	0	0	0	0	110.8	L50 P94	T48-L50 HydrophobicContact CG2-CD2 3.98Å; T48-P94 HydrophobicContact CG2-CB 3.93Å
49	L	92.9	Very high	84.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.5	168	178.6	67	0	0	0	109.3	I47 S95 Y97 I99 W138 M140 V145 L196	I47-L49 PolarHBondContact O-N 3.45Å; L49-S95 WeakPolarHBondContact CB-OG 3.28Å; L49-S95 WeakPolarHBondContact O-CB 3.27Å; L49-S95 PolarHBondContact O-N 2.97Å; L49-S95 PolarHBondContact O-OG 3.2Å; L49-Y97 HydrophobicContact CD2-CD1 4.4Å; L49-Y97 HydrophobicContact CD2-CD2 3.74Å; L49-Y97 HydrophobicContact CD2-CE2 4.19Å; L49-Y97 HydrophobicContact CD2-CG 3.83Å; L49-I99 HydrophobicContact CB-CD1 4.19Å; L49-W138 HydrophobicContact CD1-CB 4.06Å; L49-W138 HydrophobicContact CD1-CE3 4.38Å; L49-W138 HydrophobicContact CD2-CD2 4.44Å; L49-W138 HydrophobicContact CD2-CE3 3.92Å; L49-W138 HydrophobicContact CD2-CZ3 4.23Å; L49-M140 HydrophobicContact CB-CE 4.22Å; L49-M140 HydrophobicContact CD1-CB 4.25Å; L49-M140 HydrophobicContact CD1-CE 4Å; L49-V145 HydrophobicContact CD1-CG2 3.89Å; L49-L196 HydrophobicContact CD2-CD1 4.31Å
50	L	93	Very high	85.8	Confident	26 Å²	26	48.6 Å²	48.6	14%	0.136	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.8	177.2	-58.4	173.6	0	0	0	109.8	T48 P79 L92 S93 P94 W138 V139	T48-L50 HydrophobicContact CG2-CD2 3.98Å; L50-P79 HydrophobicContact CD1-CG 4.04Å; L50-P79 HydrophobicContact CD2-CG 4.1Å; L50-L92 HydrophobicContact CB-CD2 4.33Å; L50-S93 WeakPolarHBondContact CA-O 3.44Å; L50-P94 HydrophobicContact CD2-CB 4.24Å; L50-W138 CarbonylContact O-C 3.44Å; L50-W138 WeakPolarHBondContact O-CA 3.39Å; L50-V139 HydrophobicContact CB-CB 4.41Å; L50-V139 WeakPolarHBondContact CB-O 3.28Å; L50-V139 PolarHBondContact N-O 2.96Å; L50-V139 PolarHBondContact O-N 3.23Å
51	V	92.2	Very high	87.5	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140	173	-63.7	0	0	0	0	109.5	Y65 L73 L92 S93 W138	V51-Y65 HydrophobicContact CB-CD2 3.77Å; V51-Y65 HydrophobicContact CB-CE2 4.14Å; V51-Y65 HydrophobicContact CB-CG 4.02Å; V51-Y65 HydrophobicContact CG1-CD2 4.11Å; V51-Y65 HydrophobicContact CG1-CE2 3.96Å; V51-Y65 HydrophobicContact CG2-CD1 3.88Å; V51-Y65 HydrophobicContact CG2-CD2 3.92Å; V51-Y65 HydrophobicContact CG2-CE1 4.33Å; V51-Y65 HydrophobicContact CG2-CE2 4.38Å; V51-Y65 HydrophobicContact CG2-CG 3.64Å; V51-L73 HydrophobicContact CG2-CD2 3.48Å; V51-L73 VanDerWaalsContact CG2-CD2 3.48Å; V51-L92 WeakPolarHBondContact O-CA 3.29Å; V51-S93 WeakPolarHBondContact CG2-O 3.18Å; V51-S93 PolarHBondContact N-O 3.47Å; V51-S93 PolarHBondContact O-N 2.9Å; V51-W138 HydrophobicContact CG1-CD2 4.48Å; V51-W138 HydrophobicContact CG1-CG 4.19Å
52	N	91.4	Very high	89.1	Confident	14 Å²	14	37.9 Å²	37.9	8%	0.075	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-176.3	175.5	-160.4	-2.5	0	0	0	110.1	R91 L92 H137	N52-R91 WeakPolarHBondContact CA-O 3.23Å; N52-R91 PolarHBondContact OD1-N 2.78Å; N52-R91 PolarHBondContact OD1-O 3.16Å; N52-L92 HydrophobicContact CB-CD2 4Å; N52-H137 HydrophobicContact CB-CB 4.11Å; N52-H137 WeakPolarHBondContact CB-O 3.41Å; N52-H137 PolarHBondContact N-O 2.97Å
53	K	91.4	Very high	90	Very high	25 Å²	25	31.9 Å²	31.9	11%	0.109	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	152.7	170.5	66.5	-177.5	173.6	-168.7	0	112.8	T55 F63 F88 G89 A450 T451	K53-T55 HydrophobicContact CD-CG2 4.48Å; K53-T55 HydrophobicContact CG-CG2 4.26Å; K53-F63 CarbonylContact C-O 3.53Å; K53-F63 VanDerWaalsContact CA-O 3.31Å; K53-F63 WeakPolarHBondContact CA-O 3.47Å; K53-F63 WeakPolarHBondContact CB-O 3.32Å; K53-F88 PolarHBondContact NZ-O 3.45Å; K53-G89 VanDerWaalsContact CD-O 3.23Å; K53-G89 WeakPolarHBondContact CD-O 3.37Å; K53-G89 VanDerWaalsContact CE-O 3.24Å; K53-G89 WeakPolarHBondContact CE-O 3.46Å; K53-G89 PolarHBondContact NZ-O 3.2Å; K53-A450 HydrophobicContact CB-CB 3.74Å; K53-A450 HydrophobicContact CD-CB 4.22Å; K53-T451 PolarHBondContact NZ-OG1 3.26Å
54	L	93.3	Very high	90.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	138	168.4	-72.5	74.4	0	0	0	109.7	S62 F63 Y65 F68 F70 Y134 E135 L164	L54-S62 VanDerWaalsContact O-CA 3.27Å; L54-S62 WeakPolarHBondContact O-CA 3.32Å; L54-S62 WeakPolarHBondContact O-CB 3.41Å; L54-F63 PolarHBondContact N-O 3.46Å; L54-F63 PolarHBondContact O-N 3.19Å; L54-F63 VanDerWaalsContact O-N 3.09Å; L54-Y65 HydrophobicContact CD1-CD2 4.15Å; L54-F68 HydrophobicContact CB-CE2 4.04Å; L54-F68 HydrophobicContact CB-CZ 4.42Å; L54-F68 HydrophobicContact CD1-CD2 4.08Å; L54-F68 HydrophobicContact CD1-CE2 3.93Å; L54-F68 HydrophobicContact CD2-CD2 4.13Å; L54-F68 HydrophobicContact CD2-CE1 4.43Å; L54-F68 HydrophobicContact CD2-CE2 3.67Å; L54-F68 HydrophobicContact CD2-CZ 3.85Å; L54-F68 HydrophobicContact CG-CE2 4.09Å; L54-F70 HydrophobicContact CD1-CE2 4.35Å; L54-F70 HydrophobicContact CD2-CE2 4.08Å; L54-F70 HydrophobicContact CD2-CZ 4.26Å; L54-Y134 HydrophobicContact CB-CD1 4.05Å; L54-E135 WeakPolarHBondContact CA-O 3.32Å; L54-E135 WeakPolarHBondContact CB-O 3.44Å; L54-L164 HydrophobicContact CD2-CD2 4.29Å
55	T	92.4	Very high	90.7	Very high	36 Å²	36	30.9 Å²	30.9	22%	0.221	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	159.8	179.4	66.1	0	0	0	0	110.9	K53 Y134 E135 H137	K53-T55 HydrophobicContact CD-CG2 4.48Å; K53-T55 HydrophobicContact CG-CG2 4.26Å; T55-Y134 CarbonylContact O-C 3.57Å; T55-Y134 WeakPolarHBondContact O-CA 3.41Å; T55-E135 PolarHBondContact N-O 3.02Å; T55-E135 VanDerWaalsContact N-O 3.15Å; T55-E135 PolarHBondContact O-N 3.41Å; T55-H137 PolarHBondContact OG1-NE2 3.32Å
56	S	90.7	Very high	90.7	Very high	14 Å²	14	32.7 Å²	32.7	10%	0.098	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	152.4	174.3	167.5	0	0	0	0	110	K58 M132	S56-K58 VanDerWaalsContact C-N 3.33Å; S56-K58 PolarHBondContact OG-N 3.3Å; S56-M132 PolarHBondContact OG-O 3.18Å
57	K	86.6	Confident	90.6	Very high	94 Å²	94	31.2 Å²	31.2	41%	0.409	16%	0.157	S	C	.	.	S	Bend	trans	-75.5	-24.2	168.1	-65.2	-179.7	-176.4	177.1	0	112.6	D172	K57-D172 IonicContact NZ-OD2 3.08Å; K57-D172 PolarHBondContact NZ-OD2 3.23Å
58	K	88	Confident	90.4	Very high	28 Å²	28	31.6 Å²	31.6	12%	0.122	16%	0.159	C	C	.	.	S	Bend	trans	-85.7	-13.2	-176.6	-62	-178.2	-178.1	174.9	0	113.6	S56 M131 M132 G169 N170 E604 F605 Q606	S56-K58 VanDerWaalsContact C-N 3.33Å; S56-K58 PolarHBondContact OG-N 3.3Å; K58-M131 PolarHBondContact NZ-O 3.42Å; K58-M132 HydrophobicContact CB-CE 3.85Å; K58-G169 PolarHBondContact NZ-O 3.34Å; K58-N170 WeakPolarHBondContact CE-OD1 3.47Å; K58-N170 PolarHBondContact NZ-OD1 3.01Å; K58-E604 WeakPolarHBondContact CA-O 3.21Å; K58-F605 WeakPolarHBondContact O-CA 3.47Å; K58-Q606 HydrophobicContact CB-CG 4.46Å; K58-Q606 PolarHBondContact O-N 2.92Å
59	S	89.2	Confident	90.2	Very high	8 Å²	8	30.1 Å²	30.1	6%	0.056	15%	0.149	C	C	.	.			trans	-149.6	140.4	177.6	-168.8	0	0	0	0	111.1	I61 D607 S610	S59-I61 PolarHBondContact O-N 2.88Å; S59-I61 PolarHBondContact OG-N 3.49Å; S59-D607 PolarHBondContact OG-OD1 3.37Å; S59-S610 PolarHBondContact OG-OG 2.85Å; S59-S610 VanDerWaalsContact OG-OG 3.14Å
60	F	89.1	Confident	89.8	Confident	41 Å²	41	30.5 Å²	30.5	18%	0.18	15%	0.15	C	C	.	.	S	Bend	trans	-70.3	-21.1	172	-174.3	-90.5	0	0	0	112	S62 L444 T451 W535 F605 S610 L613 Y617	F60-S62 PolarHBondContact O-N 3.02Å; F60-L444 HydrophobicContact CE1-CD2 4.38Å; F60-T451 HydrophobicContact CE1-CG2 4.43Å; F60-W535 HydrophobicContact CD2-CE3 4.23Å; F60-W535 AromaticContact CD2-CZ3 3.83Å; F60-W535 HydrophobicContact CD2-CZ3 3.83Å; F60-W535 HydrophobicContact CE2-CE3 4.01Å; F60-W535 HydrophobicContact CE2-CH2 4.45Å; F60-W535 AromaticContact CE2-CZ3 3.41Å; F60-W535 HydrophobicContact CE2-CZ3 3.41Å; F60-W535 VanDerWaalsContact CE2-CZ3 3.41Å; F60-W535 HydrophobicContact CZ-CZ3 4.37Å; F60-F605 HydrophobicContact CB-CE1 4.4Å; F60-F605 HydrophobicContact CB-CE2 4.44Å; F60-F605 HydrophobicContact CB-CZ 4.16Å; F60-F605 HydrophobicContact CD2-CZ 4.28Å; F60-S610 WeakPolarHBondContact CB-OG 3.17Å; F60-S610 PolarHBondContact N-OG 2.68Å; F60-L613 HydrophobicContact CD1-CB 3.8Å; F60-L613 HydrophobicContact CD1-CD1 3.56Å; F60-L613 HydrophobicContact CD1-CG 4.28Å; F60-L613 HydrophobicContact CE1-CB 4.05Å; F60-L613 HydrophobicContact CE1-CD1 4.1Å; F60-L613 HydrophobicContact CG-CB 4.32Å; F60-L613 HydrophobicContact CG-CD1 4.49Å; F60-Y617 AromaticContact CE1-CE2 3.98Å; F60-Y617 HydrophobicContact CE1-CE2 3.98Å; F60-Y617 HydrophobicContact CZ-CD2 4.04Å; F60-Y617 AromaticContact CZ-CE2 3.77Å; F60-Y617 HydrophobicContact CZ-CE2 3.77Å
61	I	90.5	Very high	89.4	Confident	20 Å²	20	29.6 Å²	29.6	10%	0.103	15%	0.146	C	C	.	.			trans	-70.3	120.7	-178.7	-56.9	172.5	0	0	0	109.6	S59 F63 Y134 L447	S59-I61 PolarHBondContact O-N 2.88Å; S59-I61 PolarHBondContact OG-N 3.49Å; I61-F63 HydrophobicContact CG2-CE1 4.04Å; I61-F63 HydrophobicContact CG2-CE2 4.28Å; I61-F63 HydrophobicContact CG2-CZ 3.81Å; I61-Y134 WeakPolarHBondContact O-CE1 3.17Å; I61-Y134 PolarHBondContact O-OH 2.93Å; I61-L447 HydrophobicContact CD1-CD1 3.99Å; I61-L447 HydrophobicContact CD1-CD2 4.36Å; I61-L447 HydrophobicContact CG1-CD1 4.45Å
62	S	92.3	Very high	88.7	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.014	18%	0.176	C	C	.	.			trans	-106.1	145.5	176.5	61.8	0	0	0	0	110.8	L54 F60 S449 A450 T451	L54-S62 VanDerWaalsContact O-CA 3.27Å; L54-S62 WeakPolarHBondContact O-CA 3.32Å; L54-S62 WeakPolarHBondContact O-CB 3.41Å; F60-S62 PolarHBondContact O-N 3.02Å; S62-S449 CarbonylContact O-C 3.6Å; S62-S449 WeakPolarHBondContact O-CA 3.29Å; S62-S449 PolarHBondContact O-OG 2.88Å; S62-S449 PolarHBondContact OG-OG 2.97Å; S62-A450 PolarHBondContact O-N 3.48Å; S62-T451 WeakPolarHBondContact OG-CB 3.36Å; S62-T451 PolarHBondContact OG-N 2.97Å; S62-T451 VanDerWaalsContact OG-N 3.15Å; S62-T451 PolarHBondContact OG-OG1 2.9Å
63	F	91.7	Very high	88.1	Confident	37 Å²	37	35.4 Å²	35.4	16%	0.162	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-113.3	149.3	178.3	-65.8	-68.4	0	0	0	111.2	K53 L54 I61 F68 F125 Y134	K53-F63 CarbonylContact C-O 3.53Å; K53-F63 VanDerWaalsContact CA-O 3.31Å; K53-F63 WeakPolarHBondContact CA-O 3.47Å; K53-F63 WeakPolarHBondContact CB-O 3.32Å; L54-F63 PolarHBondContact N-O 3.46Å; L54-F63 PolarHBondContact O-N 3.19Å; L54-F63 VanDerWaalsContact O-N 3.09Å; I61-F63 HydrophobicContact CG2-CE1 4.04Å; I61-F63 HydrophobicContact CG2-CE2 4.28Å; I61-F63 HydrophobicContact CG2-CZ 3.81Å; F63-F68 HydrophobicContact CB-CE2 3.54Å; F63-F68 HydrophobicContact CB-CZ 3.97Å; F63-F68 HydrophobicContact CD2-CZ 4.3Å; F63-F68 HydrophobicContact CG-CE2 4.48Å; F63-F68 HydrophobicContact CG-CZ 4.48Å; F63-F125 HydrophobicContact CB-CZ 4.49Å; F63-F125 HydrophobicContact CD1-CZ 4.02Å; F63-F125 HydrophobicContact CD2-CE2 4.5Å; F63-F125 AromaticContact CD2-CZ 3.87Å; F63-F125 HydrophobicContact CD2-CZ 3.87Å; F63-F125 HydrophobicContact CE1-CE2 4.43Å; F63-F125 HydrophobicContact CE1-CZ 4.2Å; F63-F125 HydrophobicContact CE2-CE2 4.21Å; F63-F125 HydrophobicContact CE2-CZ 4.03Å; F63-F125 AromaticContact CG-CZ 3.86Å; F63-F125 HydrophobicContact CG-CZ 3.86Å; F63-F125 HydrophobicContact CZ-CE2 4.19Å; F63-F125 HydrophobicContact CZ-CZ 4.2Å; F63-Y134 HydrophobicContact CD2-CD1 4.43Å; F63-Y134 AromaticContact CD2-CE1 3.68Å; F63-Y134 HydrophobicContact CD2-CE1 3.68Å; F63-Y134 HydrophobicContact CD2-CE2 4.34Å; F63-Y134 AromaticContact CD2-CZ 3.63Å; F63-Y134 HydrophobicContact CE2-CE1 4.13Å; F63-Y134 HydrophobicContact CE2-CE2 4.19Å; F63-Y134 AromaticContact CE2-CZ 3.59Å; F63-Y134 VanDerWaalsContact CE2-OH 3.22Å; F63-Y134 WeakPolarHBondContact CE2-OH 3.18Å
64	R	90	Very high	87.3	Confident	101 Å²	101	35.7 Å²	35.7	38%	0.381	19%	0.189	S	C	.	.			trans	-73.7	155.9	177.4	-62	177.6	56.7	-147.9	-13.8	108.8	D66 S67 F68 A450	R64-D66 VanDerWaalsContact C-N 3.26Å; R64-D66 WeakPolarHBondContact CB-OD1 3.35Å; R64-D66 IonicContact CZ-OD1 2.74Å; R64-D66 IonicContact CZ-OD2 3.55Å; R64-D66 IonicContact NE-OD1 3.77Å; R64-D66 PolarHBondContact NE-OD1 3.06Å; R64-D66 IonicContact NE-OD2 3.4Å; R64-D66 IonicContact NH1-OD1 3.93Å; R64-D66 IonicContact NH1-OD2 2.76Å; R64-D66 PolarHBondContact NH1-OD2 3.28Å; R64-D66 IonicContact NH2-OD1 3.26Å; R64-D66 PolarHBondContact NH2-OD1 2.78Å; R64-D66 VanDerWaalsContact NH2-OD1 3.12Å; R64-D66 IonicContact NH2-OD2 3.45Å; R64-D66 PolarHBondContact NH2-OD2 3.09Å; R64-D66 PolarHBondContact O-N 2.75Å; R64-S67 WeakPolarHBondContact O-CB 3.41Å; R64-S67 PolarHBondContact O-N 3.22Å; R64-S67 VanDerWaalsContact O-N 3.14Å; R64-F68 WeakPolarHBondContact O-CD2 3.5Å; R64-A450 HydrophobicContact CB-CB 4.29Å; R64-A450 HydrophobicContact CG-CB 3.44Å; R64-A450 VanDerWaalsContact CG-CB 3.44Å
65	Y	90.1	Very high	86.4	Confident	19 Å²	19	42.1 Å²	42.1	8%	0.075	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-59.1	-39.4	179.1	-175.1	-86.5	0	0	0	112.2	V51 L54 S67 F68 F70 L73 H136	V51-Y65 HydrophobicContact CB-CD2 3.77Å; V51-Y65 HydrophobicContact CB-CE2 4.14Å; V51-Y65 HydrophobicContact CB-CG 4.02Å; V51-Y65 HydrophobicContact CG1-CD2 4.11Å; V51-Y65 HydrophobicContact CG1-CE2 3.96Å; V51-Y65 HydrophobicContact CG2-CD1 3.88Å; V51-Y65 HydrophobicContact CG2-CD2 3.92Å; V51-Y65 HydrophobicContact CG2-CE1 4.33Å; V51-Y65 HydrophobicContact CG2-CE2 4.38Å; V51-Y65 HydrophobicContact CG2-CG 3.64Å; L54-Y65 HydrophobicContact CD1-CD2 4.15Å; Y65-S67 VanDerWaalsContact C-N 3.3Å; Y65-S67 PolarHBondContact O-N 2.86Å; Y65-F68 PolarHBondContact O-N 3.23Å; Y65-F70 HydrophobicContact CD1-CD2 4.39Å; Y65-F70 HydrophobicContact CD2-CD2 4.07Å; Y65-F70 HydrophobicContact CD2-CE2 4.48Å; Y65-F70 HydrophobicContact CE1-CB 3.97Å; Y65-F70 HydrophobicContact CE1-CD2 4.12Å; Y65-F70 AromaticContact CE2-CD2 3.76Å; Y65-F70 HydrophobicContact CE2-CD2 3.76Å; Y65-F70 HydrophobicContact CE2-CE2 4.38Å; Y65-F70 HydrophobicContact CG-CD2 4.38Å; Y65-F70 AromaticContact CZ-CD2 3.79Å; Y65-L73 HydrophobicContact CD1-CD2 3.6Å; Y65-L73 HydrophobicContact CD1-CG 4.25Å; Y65-L73 HydrophobicContact CE1-CD2 3.93Å; Y65-L73 HydrophobicContact CG-CD2 4.47Å; Y65-H136 AromaticContact CE2-ND1 3.97Å
66	D	87.3	Confident	85.6	Confident	77 Å²	77	44.5 Å²	44.5	41%	0.412	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-74	-14.6	178.8	60	-38.3	0	0	0	114.4	R64 F68 L73	R64-D66 VanDerWaalsContact C-N 3.26Å; R64-D66 WeakPolarHBondContact CB-OD1 3.35Å; R64-D66 IonicContact CZ-OD1 2.74Å; R64-D66 IonicContact CZ-OD2 3.55Å; R64-D66 IonicContact NE-OD1 3.77Å; R64-D66 PolarHBondContact NE-OD1 3.06Å; R64-D66 IonicContact NE-OD2 3.4Å; R64-D66 IonicContact NH1-OD1 3.93Å; R64-D66 IonicContact NH1-OD2 2.76Å; R64-D66 PolarHBondContact NH1-OD2 3.28Å; R64-D66 IonicContact NH2-OD1 3.26Å; R64-D66 PolarHBondContact NH2-OD1 2.78Å; R64-D66 VanDerWaalsContact NH2-OD1 3.12Å; R64-D66 IonicContact NH2-OD2 3.45Å; R64-D66 PolarHBondContact NH2-OD2 3.09Å; R64-D66 PolarHBondContact O-N 2.75Å; D66-F68 PolarHBondContact O-N 2.89Å; D66-L73 HydrophobicContact CB-CD1 4.09Å
67	S	87.2	Confident	84.9	Confident	58 Å²	58	49.4 Å²	49.4	41%	0.406	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-66.5	-22.6	171.1	-55.8	0	0	0	0	112.1	R64 Y65	R64-S67 WeakPolarHBondContact O-CB 3.41Å; R64-S67 PolarHBondContact O-N 3.22Å; R64-S67 VanDerWaalsContact O-N 3.14Å; Y65-S67 VanDerWaalsContact C-N 3.3Å; Y65-S67 PolarHBondContact O-N 2.86Å
68	F	88.2	Confident	84.5	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.035	28%	0.277	C	S	.	.	S	Bend	trans	-93.6	148.7	175.1	-64.7	-91.3	0	0	0	110.9	L54 F63 R64 Y65 D66 F70 F125 I126 A129 L164	L54-F68 HydrophobicContact CB-CE2 4.04Å; L54-F68 HydrophobicContact CB-CZ 4.42Å; L54-F68 HydrophobicContact CD1-CD2 4.08Å; L54-F68 HydrophobicContact CD1-CE2 3.93Å; L54-F68 HydrophobicContact CD2-CD2 4.13Å; L54-F68 HydrophobicContact CD2-CE1 4.43Å; L54-F68 HydrophobicContact CD2-CE2 3.67Å; L54-F68 HydrophobicContact CD2-CZ 3.85Å; L54-F68 HydrophobicContact CG-CE2 4.09Å; F63-F68 HydrophobicContact CB-CE2 3.54Å; F63-F68 HydrophobicContact CB-CZ 3.97Å; F63-F68 HydrophobicContact CD2-CZ 4.3Å; F63-F68 HydrophobicContact CG-CE2 4.48Å; F63-F68 HydrophobicContact CG-CZ 4.48Å; R64-F68 WeakPolarHBondContact O-CD2 3.5Å; Y65-F68 PolarHBondContact O-N 3.23Å; D66-F68 PolarHBondContact O-N 2.89Å; F68-F70 HydrophobicContact CB-CD1 4.17Å; F68-F70 HydrophobicContact CB-CD2 3.35Å; F68-F70 HydrophobicContact CB-CE1 3.96Å; F68-F70 HydrophobicContact CB-CE2 3.1Å; F68-F70 HydrophobicContact CB-CG 3.88Å; F68-F70 HydrophobicContact CB-CZ 3.42Å; F68-F70 VanDerWaalsContact CB-CZ 3.42Å; F68-F70 HydrophobicContact CD1-CE1 4.47Å; F68-F70 HydrophobicContact CD1-CE2 4.01Å; F68-F70 AromaticContact CD1-CZ 3.68Å; F68-F70 HydrophobicContact CD1-CZ 3.68Å; F68-F70 HydrophobicContact CD2-CD2 4.48Å; F68-F70 AromaticContact CD2-CE2 3.69Å; F68-F70 HydrophobicContact CD2-CE2 3.69Å; F68-F70 HydrophobicContact CD2-CZ 4.21Å; F68-F70 HydrophobicContact CG-CD2 4.1Å; F68-F70 HydrophobicContact CG-CE1 4.42Å; F68-F70 AromaticContact CG-CE2 3.33Å; F68-F70 HydrophobicContact CG-CE2 3.33Å; F68-F70 AromaticContact CG-CZ 3.51Å; F68-F70 HydrophobicContact CG-CZ 3.51Å; F68-F70 PolarHBondContact O-N 3.4Å; F68-F125 AromaticContact CD1-CD1 3.72Å; F68-F125 HydrophobicContact CD1-CD1 3.72Å; F68-F125 AromaticContact CD1-CE1 3.53Å; F68-F125 HydrophobicContact CD1-CE1 3.53Å; F68-F125 HydrophobicContact CD2-CE1 4.3Å; F68-F125 AromaticContact CE1-CD1 3.8Å; F68-F125 HydrophobicContact CE1-CD1 3.8Å; F68-F125 AromaticContact CE1-CE1 3.34Å; F68-F125 HydrophobicContact CE1-CE1 3.34Å; F68-F125 HydrophobicContact CE1-CZ 4.1Å; F68-F125 HydrophobicContact CE2-CE1 4.16Å; F68-F125 HydrophobicContact CG-CD1 4.42Å; F68-F125 HydrophobicContact CG-CE1 4.01Å; F68-F125 AromaticContact CZ-CE1 3.68Å; F68-F125 HydrophobicContact CZ-CE1 3.68Å; F68-F125 HydrophobicContact CZ-CZ 4.12Å; F68-I126 HydrophobicContact CD1-CG1 4.22Å; F68-A129 HydrophobicContact CE1-CB 3.54Å; F68-A129 HydrophobicContact CZ-CB 4.12Å; F68-L164 HydrophobicContact CE1-CD2 4.33Å
69	D	87.1	Confident	84.1	Confident	23 Å²	23	49.2 Å²	49.2	12%	0.123	29%	0.287	C	S	.	.	S	Bend	trans	-80.5	45.8	177.3	-160.5	13.9	0	0	0	112.7	K113 Y115 K122 I126	D69-K113 IonicContact OD1-NZ 2.68Å; D69-K113 PolarHBondContact OD1-NZ 3.34Å; D69-Y115 HydrophobicContact CB-CE1 4.32Å; D69-Y115 PolarHBondContact O-OH 3.42Å; D69-Y115 VanDerWaalsContact O-OH 3.14Å; D69-K122 HydrophobicContact CB-CB 4.08Å; D69-K122 HydrophobicContact CB-CD 3.94Å; D69-K122 HydrophobicContact CB-CG 4.48Å; D69-K122 VanDerWaalsContact OD2-CD 3.23Å; D69-K122 WeakPolarHBondContact OD2-CD 3.33Å; D69-K122 IonicContact OD2-NZ 2.77Å; D69-I126 HydrophobicContact CB-CD1 4.43Å
70	F	84.7	Confident	83.6	Confident	9 Å²	9	55.9 Å²	55.9	4%	0.039	33%	0.327	C	S	.	.	S	Bend	trans	-74.2	-179.1	169.5	-55.7	-41.6	0	0	0	110.8	L54 Y65 F68 S72 K113 H136 L164 Y257	L54-F70 HydrophobicContact CD1-CE2 4.35Å; L54-F70 HydrophobicContact CD2-CE2 4.08Å; L54-F70 HydrophobicContact CD2-CZ 4.26Å; Y65-F70 HydrophobicContact CD1-CD2 4.39Å; Y65-F70 HydrophobicContact CD2-CD2 4.07Å; Y65-F70 HydrophobicContact CD2-CE2 4.48Å; Y65-F70 HydrophobicContact CE1-CB 3.97Å; Y65-F70 HydrophobicContact CE1-CD2 4.12Å; Y65-F70 AromaticContact CE2-CD2 3.76Å; Y65-F70 HydrophobicContact CE2-CD2 3.76Å; Y65-F70 HydrophobicContact CE2-CE2 4.38Å; Y65-F70 HydrophobicContact CG-CD2 4.38Å; Y65-F70 AromaticContact CZ-CD2 3.79Å; F68-F70 HydrophobicContact CB-CD1 4.17Å; F68-F70 HydrophobicContact CB-CD2 3.35Å; F68-F70 HydrophobicContact CB-CE1 3.96Å; F68-F70 HydrophobicContact CB-CE2 3.1Å; F68-F70 HydrophobicContact CB-CG 3.88Å; F68-F70 HydrophobicContact CB-CZ 3.42Å; F68-F70 VanDerWaalsContact CB-CZ 3.42Å; F68-F70 HydrophobicContact CD1-CE1 4.47Å; F68-F70 HydrophobicContact CD1-CE2 4.01Å; F68-F70 AromaticContact CD1-CZ 3.68Å; F68-F70 HydrophobicContact CD1-CZ 3.68Å; F68-F70 HydrophobicContact CD2-CD2 4.48Å; F68-F70 AromaticContact CD2-CE2 3.69Å; F68-F70 HydrophobicContact CD2-CE2 3.69Å; F68-F70 HydrophobicContact CD2-CZ 4.21Å; F68-F70 HydrophobicContact CG-CD2 4.1Å; F68-F70 HydrophobicContact CG-CE1 4.42Å; F68-F70 AromaticContact CG-CE2 3.33Å; F68-F70 HydrophobicContact CG-CE2 3.33Å; F68-F70 AromaticContact CG-CZ 3.51Å; F68-F70 HydrophobicContact CG-CZ 3.51Å; F68-F70 PolarHBondContact O-N 3.4Å; F70-S72 PolarHBondContact O-N 3.13Å; F70-K113 WeakPolarHBondContact O-CE 3.16Å; F70-K113 PolarHBondContact O-NZ 3.45Å; F70-H136 AromaticContact CE2-CE1 3.47Å; F70-H136 VanDerWaalsContact CE2-CE1 3.47Å; F70-H136 WeakPolarHBondContact CE2-CE1 3.47Å; F70-H136 AromaticContact CZ-CE1 3.73Å; F70-L164 HydrophobicContact CE1-CD1 3.62Å; F70-L164 HydrophobicContact CE2-CD1 4.49Å; F70-L164 HydrophobicContact CZ-CD1 3.39Å; F70-L164 HydrophobicContact CZ-CD2 4.28Å; F70-L164 HydrophobicContact CZ-CG 4.5Å; F70-Y257 HydrophobicContact CD1-CE1 4.41Å
71	C	85.3	Confident	83.3	Confident	7 Å²	7	56 Å²	56	5%	0.047	33%	0.328	C	S	.	.	S	Bend	trans	-57.3	136.4	171.2	-55.9	0	0	0	0	110.7	L110 C111	C71-L110 HydrophobicContact CB-CD2 3.72Å; C71-L110 HydrophobicContact CB-CG 3.87Å; C71-L110 VanDerWaalsContact SG-CD2 3.55Å; C71-C111 WeakPolarHBondContact CA-SG 3.49Å; C71-C111 HydrophobicContact CB-CB 3.79Å; C71-C111 WeakPolarHBondContact CB-SG 3.17Å; C71-C111 WeakPolarHBondContact SG-CB 3.32Å; C71-C111 CovalentContact SG-SG 2.02Å; C71-C111 PolarHBondContact SG-SG 2.98Å
72	S	76.1	Confident	83.1	Confident	89 Å²	89	57 Å²	57	62%	0.622	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-53.9	145.8	-179.7	-57.3	0	0	0	0	110.7	F70 S96	F70-S72 PolarHBondContact O-N 3.13Å; S72-S96 WeakPolarHBondContact O-CB 3.32Å; S72-S96 PolarHBondContact O-OG 3.33Å
73	L	78.2	Confident	82.9	Confident	48 Å²	48	59.5 Å²	59.5	25%	0.251	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-66.5	156.1	172.4	-64.5	170.1	0	0	0	110.1	V51 Y65 D66 P94	V51-L73 HydrophobicContact CG2-CD2 3.48Å; V51-L73 VanDerWaalsContact CG2-CD2 3.48Å; Y65-L73 HydrophobicContact CD1-CD2 3.6Å; Y65-L73 HydrophobicContact CD1-CG 4.25Å; Y65-L73 HydrophobicContact CE1-CD2 3.93Å; Y65-L73 HydrophobicContact CG-CD2 4.47Å; D66-L73 HydrophobicContact CB-CD1 4.09Å; L73-P94 WeakPolarHBondContact CD2-O 3.34Å
74	S	76.3	Confident	82.8	Confident	30 Å²	30	57.8 Å²	57.8	21%	0.21	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-66.2	154.8	175.4	64.7	0	0	0	0	110.5	E76 P94 S96	S74-E76 PolarHBondContact O-N 3.08Å; S74-E76 VanDerWaalsContact O-N 3.15Å; S74-P94 PolarHBondContact N-O 3.43Å; S74-P94 WeakPolarHBondContact OG-CB 3.49Å; S74-P94 VanDerWaalsContact OG-CG 3.23Å; S74-P94 WeakPolarHBondContact OG-CG 3.23Å; S74-P94 PolarHBondContact OG-O 3.23Å; S74-S96 PolarHBondContact N-OG 3.43Å
75	S	74.2	Confident	82.9	Confident	136 Å²	136	53.6 Å²	53.6	95%	0.951	32%	0.324	S	S	*	.	S	Bend	trans	-70.9	-1.1	174.8	-51.7	0	0	0	0	114.1
76	E	75.1	Confident	82.9	Confident	85 Å²	85	53.5 Å²	53.5	40%	0.397	33%	0.325	S	S	.	.	S	Bend	trans	-66.4	147.5	-179.6	-65.7	-164.3	152.2	0	0	112.7	S74 S78 P94	S74-E76 PolarHBondContact O-N 3.08Å; S74-E76 VanDerWaalsContact O-N 3.15Å; E76-S78 PolarHBondContact O-N 2.81Å; E76-P94 HydrophobicContact CB-CB 4.16Å; E76-P94 HydrophobicContact CB-CG 3.75Å; E76-P94 WeakPolarHBondContact O-CG 3.27Å
77	P	75.4	Confident	83	Confident	118 Å²	118	50.8 Å²	50.8	77%	0.766	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-63.9	134.3	175.2	27	-33.3	0	0	0	110.6
78	S	78.7	Confident	83	Confident	67 Å²	67	52.9 Å²	52.9	47%	0.469	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-63	144.1	174.4	-65.1	0	0	0	0	111	E76	E76-S78 PolarHBondContact O-N 2.81Å
79	P	79.7	Confident	82.9	Confident	51 Å²	51	52.5 Å²	52.5	33%	0.331	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-61.8	148	178.1	27.4	-35	0	0	0	110.8	L50 E81 L92	L50-P79 HydrophobicContact CD1-CG 4.04Å; L50-P79 HydrophobicContact CD2-CG 4.1Å; P79-E81 PolarHBondContact O-N 3.01Å; P79-L92 HydrophobicContact CG-CB 3.87Å; P79-L92 HydrophobicContact CG-CD1 4.44Å
80	V	78.4	Confident	82.9	Confident	147 Å²	147	53.3 Å²	53.3	89%	0.891	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-70.3	117.5	177.2	-175.5	0	0	0	0	109.3
81	E	81.9	Confident	83	Confident	43 Å²	43	54.6 Å²	54.6	20%	0.201	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-82.5	141.6	175.3	-64.3	173.7	166.5	0	0	110.5	P79 Q85 V86 E90 R91 L92	P79-E81 PolarHBondContact O-N 3.01Å; E81-Q85 HydrophobicContact CB-CB 4.26Å; E81-V86 HydrophobicContact CB-CG2 3.69Å; E81-E90 VanDerWaalsContact CD-O 3.32Å; E81-E90 VanDerWaalsContact OE2-O 3.08Å; E81-R91 WeakPolarHBondContact OE1-CA 3.36Å; E81-R91 IonicContact OE2-NH1 3.94Å; E81-R91 PolarHBondContact OE2-NH1 2.89Å; E81-L92 PolarHBondContact OE1-N 2.92Å
82	N	87.6	Confident	83.2	Confident	41 Å²	41	54.6 Å²	54.6	22%	0.219	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-78.4	164.5	170.4	68.7	51.2	0	0	0	111.6	G84 Q85 V86 R384 T389	N82-G84 VanDerWaalsContact C-N 3.28Å; N82-G84 PolarHBondContact O-N 3.38Å; N82-G84 PolarHBondContact OD1-N 3.17Å; N82-G84 VanDerWaalsContact OD1-N 3.17Å; N82-Q85 PolarHBondContact ND2-OE1 2.73Å; N82-Q85 WeakPolarHBondContact O-CB 3.22Å; N82-Q85 PolarHBondContact O-N 2.91Å; N82-Q85 VanDerWaalsContact O-N 3.16Å; N82-Q85 WeakPolarHBondContact OD1-CG 3.21Å; N82-Q85 PolarHBondContact OD1-N 3Å; N82-V86 WeakPolarHBondContact O-CG2 3.36Å; N82-V86 PolarHBondContact O-N 3.48Å; N82-V86 VanDerWaalsContact O-N 3.07Å; N82-R384 PolarHBondContact ND2-O 3.31Å; N82-T389 PolarHBondContact OD1-OG1 3.27Å
83	L	88.5	Confident	83.8	Confident	56 Å²	56	51.2 Å²	51.2	29%	0.293	30%	0.295	S	S	.	.	H	α-helix	trans	-54	-43.4	-176.4	-179.9	61.6	0	0	0	112.7	V86 V87 T389 L392 T457 L461	L83-V86 PolarHBondContact O-N 3.18Å; L83-V87 HydrophobicContact CD1-CG2 4.25Å; L83-V87 VanDerWaalsContact O-CG2 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.47Å; L83-V87 PolarHBondContact O-N 2.96Å; L83-T389 HydrophobicContact CB-CG2 4.42Å; L83-L392 HydrophobicContact CD2-CD1 4.01Å; L83-L392 HydrophobicContact CG-CD1 4.23Å; L83-T457 HydrophobicContact CD1-CG2 3.65Å; L83-L461 HydrophobicContact CD1-CD2 4.16Å; L83-L461 HydrophobicContact CD2-CD2 4.13Å
84	G	89.7	Confident	84.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-38.7	-178.8	0	0	0	0	0	113.2	N82 V86 V87 F88 G385 T389	N82-G84 VanDerWaalsContact C-N 3.28Å; N82-G84 PolarHBondContact O-N 3.38Å; N82-G84 PolarHBondContact OD1-N 3.17Å; N82-G84 VanDerWaalsContact OD1-N 3.17Å; G84-V86 VanDerWaalsContact C-N 3.3Å; G84-V86 PolarHBondContact O-N 3.28Å; G84-V87 PolarHBondContact O-N 2.78Å; G84-F88 WeakPolarHBondContact O-CD2 3.48Å; G84-F88 PolarHBondContact O-N 2.96Å; G84-G385 WeakPolarHBondContact CA-O 3.19Å; G84-T389 WeakPolarHBondContact CA-OG1 3.42Å; G84-T389 PolarHBondContact N-OG1 3.43Å
85	Q	90.2	Very high	85.2	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-44.8	171.9	-71.9	-179.2	-68.7	0	0	110.5	E81 N82 V87 F88 G89 E90 R384	E81-Q85 HydrophobicContact CB-CB 4.26Å; N82-Q85 PolarHBondContact ND2-OE1 2.73Å; N82-Q85 WeakPolarHBondContact O-CB 3.22Å; N82-Q85 PolarHBondContact O-N 2.91Å; N82-Q85 VanDerWaalsContact O-N 3.16Å; N82-Q85 WeakPolarHBondContact OD1-CG 3.21Å; N82-Q85 PolarHBondContact OD1-N 3Å; Q85-V87 PolarHBondContact O-N 3.34Å; Q85-F88 CarbonylContact O-C 3.55Å; Q85-F88 PolarHBondContact O-N 3.37Å; Q85-G89 PolarHBondContact O-N 3.35Å; Q85-E90 HydrophobicContact CB-CB 4.13Å; Q85-E90 WeakPolarHBondContact CG-OE2 3.41Å; Q85-E90 PolarHBondContact NE2-OE2 2.76Å; Q85-E90 PolarHBondContact O-N 2.88Å; Q85-R384 HydrophobicContact CG-CB 4.16Å; Q85-R384 WeakPolarHBondContact CG-O 3.39Å
86	V	90.5	Very high	85.9	Confident	17 Å²	17	43.8 Å²	43.8	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-64.3	-41.6	-179	178.1	0	0	0	0	112	E81 N82 L83 G84 G89 R91 P454 T457	E81-V86 HydrophobicContact CB-CG2 3.69Å; N82-V86 WeakPolarHBondContact O-CG2 3.36Å; N82-V86 PolarHBondContact O-N 3.48Å; N82-V86 VanDerWaalsContact O-N 3.07Å; L83-V86 PolarHBondContact O-N 3.18Å; G84-V86 VanDerWaalsContact C-N 3.3Å; G84-V86 PolarHBondContact O-N 3.28Å; V86-G89 WeakPolarHBondContact O-CA 3.27Å; V86-G89 PolarHBondContact O-N 2.96Å; V86-R91 PolarHBondContact O-NH2 3.44Å; V86-P454 HydrophobicContact CG1-CG 4.15Å; V86-T457 HydrophobicContact CB-CG2 4.49Å; V86-T457 HydrophobicContact CG1-CG2 3.82Å; V86-T457 WeakPolarHBondContact CG1-OG1 3.13Å
87	V	89.6	Confident	86.7	Confident	20 Å²	20	40.5 Å²	40.5	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-70	-34.5	179	170.4	0	0	0	0	112.4	L83 G84 Q85 G89 M388 L392 F437 T457 L461	L83-V87 HydrophobicContact CD1-CG2 4.25Å; L83-V87 VanDerWaalsContact O-CG2 3.31Å; L83-V87 WeakPolarHBondContact O-CG2 3.47Å; L83-V87 PolarHBondContact O-N 2.96Å; G84-V87 PolarHBondContact O-N 2.78Å; Q85-V87 PolarHBondContact O-N 3.34Å; V87-G89 PolarHBondContact O-N 3.19Å; V87-M388 HydrophobicContact CB-CG 4.48Å; V87-M388 HydrophobicContact CG1-CG 4.29Å; V87-L392 HydrophobicContact CG2-CD1 4.42Å; V87-F437 HydrophobicContact CG1-CE2 4.46Å; V87-F437 HydrophobicContact CG1-CZ 4.42Å; V87-T457 HydrophobicContact CG2-CG2 4.48Å; V87-L461 HydrophobicContact CG2-CD1 4.13Å
88	F	87.1	Confident	87.4	Confident	102 Å²	102	40.2 Å²	40.2	45%	0.447	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-2.7	168.9	-71.9	-51.9	0	0	0	113.2	K53 G84 Q85 M388	K53-F88 PolarHBondContact NZ-O 3.45Å; G84-F88 WeakPolarHBondContact O-CD2 3.48Å; G84-F88 PolarHBondContact O-N 2.96Å; Q85-F88 CarbonylContact O-C 3.55Å; Q85-F88 PolarHBondContact O-N 3.37Å; F88-M388 HydrophobicContact CD2-CB 4.04Å; F88-M388 HydrophobicContact CE1-CE 3.64Å; F88-M388 HydrophobicContact CE2-CB 3.31Å; F88-M388 HydrophobicContact CE2-CE 4.24Å; F88-M388 HydrophobicContact CE2-CG 4.08Å; F88-M388 HydrophobicContact CZ-CB 3.73Å; F88-M388 HydrophobicContact CZ-CE 3.44Å; F88-M388 VanDerWaalsContact CZ-CE 3.44Å; F88-M388 HydrophobicContact CZ-CG 4.23Å
89	G	87.1	Confident	88.1	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	31.4	177.9	0	0	0	0	0	113.7	K53 Q85 V86 V87	K53-G89 VanDerWaalsContact CD-O 3.23Å; K53-G89 WeakPolarHBondContact CD-O 3.37Å; K53-G89 VanDerWaalsContact CE-O 3.24Å; K53-G89 WeakPolarHBondContact CE-O 3.46Å; K53-G89 PolarHBondContact NZ-O 3.2Å; Q85-G89 PolarHBondContact O-N 3.35Å; V86-G89 WeakPolarHBondContact O-CA 3.27Å; V86-G89 PolarHBondContact O-N 2.96Å; V87-G89 PolarHBondContact O-N 3.19Å
90	E	87.6	Confident	88.8	Confident	40 Å²	40	37.3 Å²	37.3	19%	0.187	20%	0.195	C	C	.	.			trans	-66.9	136.4	163	-68.9	-169.3	176.5	0	0	109	E81 Q85	E81-E90 VanDerWaalsContact CD-O 3.32Å; E81-E90 VanDerWaalsContact OE2-O 3.08Å; Q85-E90 HydrophobicContact CB-CB 4.13Å; Q85-E90 WeakPolarHBondContact CG-OE2 3.41Å; Q85-E90 PolarHBondContact NE2-OE2 2.76Å; Q85-E90 PolarHBondContact O-N 2.88Å
91	R	86.5	Confident	89.4	Confident	37 Å²	37	30.4 Å²	30.4	14%	0.14	15%	0.154	C	C	.	.			trans	-137.2	84.4	-179.9	-65.2	-65.8	175.1	-99.1	-17.1	108.6	N52 E81 V86 A452	N52-R91 WeakPolarHBondContact CA-O 3.23Å; N52-R91 PolarHBondContact OD1-N 2.78Å; N52-R91 PolarHBondContact OD1-O 3.16Å; E81-R91 WeakPolarHBondContact OE1-CA 3.36Å; E81-R91 IonicContact OE2-NH1 3.94Å; E81-R91 PolarHBondContact OE2-NH1 2.89Å; V86-R91 PolarHBondContact O-NH2 3.44Å; R91-A452 PolarHBondContact NH2-O 3.31Å
92	L	88.6	Confident	89.6	Confident	6 Å²	6	30.5 Å²	30.5	3%	0.031	17%	0.166	C	C	.	.			trans	-84.5	128	-177.8	-62.7	167.4	0	0	0	110.2	L50 V51 N52 P79 E81 V139	L50-L92 HydrophobicContact CB-CD2 4.33Å; V51-L92 WeakPolarHBondContact O-CA 3.29Å; N52-L92 HydrophobicContact CB-CD2 4Å; P79-L92 HydrophobicContact CG-CB 3.87Å; P79-L92 HydrophobicContact CG-CD1 4.44Å; E81-L92 PolarHBondContact OE1-N 2.92Å; L92-V139 HydrophobicContact CD2-CG2 4.29Å
93	S	89.7	Confident	89.8	Confident	19 Å²	19	33.2 Å²	33.2	13%	0.133	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.6	173	-59.6	0	0	0	0	110.6	L50 V51	L50-S93 WeakPolarHBondContact CA-O 3.44Å; V51-S93 WeakPolarHBondContact CG2-O 3.18Å; V51-S93 PolarHBondContact N-O 3.47Å; V51-S93 PolarHBondContact O-N 2.9Å
94	P	91.3	Very high	90.1	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.019	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	134.7	176.7	29.6	-33.7	0	0	0	110	T48 L50 L73 S74 E76	T48-P94 HydrophobicContact CG2-CB 3.93Å; L50-P94 HydrophobicContact CD2-CB 4.24Å; L73-P94 WeakPolarHBondContact CD2-O 3.34Å; S74-P94 PolarHBondContact N-O 3.43Å; S74-P94 WeakPolarHBondContact OG-CB 3.49Å; S74-P94 VanDerWaalsContact OG-CG 3.23Å; S74-P94 WeakPolarHBondContact OG-CG 3.23Å; S74-P94 PolarHBondContact OG-O 3.23Å; E76-P94 HydrophobicContact CB-CB 4.16Å; E76-P94 HydrophobicContact CB-CG 3.75Å; E76-P94 WeakPolarHBondContact O-CG 3.27Å
95	S	91.3	Very high	90.3	Very high	9 Å²	9	38 Å²	38	6%	0.063	20%	0.197	C	C	.	.			trans	-94.3	163.2	-179.6	66.5	0	0	0	0	111.4	L49 Y97	L49-S95 WeakPolarHBondContact CB-OG 3.28Å; L49-S95 WeakPolarHBondContact O-CB 3.27Å; L49-S95 PolarHBondContact O-N 2.97Å; L49-S95 PolarHBondContact O-OG 3.2Å; S95-Y97 PolarHBondContact O-N 2.82Å; S95-Y97 WeakPolarHBondContact OG-CD2 3.32Å
96	S	89.9	Confident	90.3	Very high	45 Å²	45	42.9 Å²	42.9	32%	0.315	23%	0.227	S	C	.	.	S	Bend	trans	-79.8	13.8	179.6	-62.4	0	0	0	0	114.1	S72 S74 E98 L110	S72-S96 WeakPolarHBondContact O-CB 3.32Å; S72-S96 PolarHBondContact O-OG 3.33Å; S74-S96 PolarHBondContact N-OG 3.43Å; S96-E98 PolarHBondContact O-N 3.03Å; S96-L110 WeakPolarHBondContact O-CD1 3.24Å
97	Y	91.8	Very high	90.3	Very high	17 Å²	17	43.2 Å²	43.2	7%	0.067	23%	0.23	C	C	.	.			trans	-78.8	113.7	176.8	-69	-101.3	0	0	0	109.4	L49 S95 I99 L110 W138 V194 Y259	L49-Y97 HydrophobicContact CD2-CD1 4.4Å; L49-Y97 HydrophobicContact CD2-CD2 3.74Å; L49-Y97 HydrophobicContact CD2-CE2 4.19Å; L49-Y97 HydrophobicContact CD2-CG 3.83Å; S95-Y97 PolarHBondContact O-N 2.82Å; S95-Y97 WeakPolarHBondContact OG-CD2 3.32Å; Y97-I99 PolarHBondContact O-N 3.19Å; Y97-L110 HydrophobicContact CD1-CD1 4.31Å; Y97-L110 HydrophobicContact CD1-CD2 4.41Å; Y97-L110 HydrophobicContact CD2-CD1 4.23Å; Y97-L110 HydrophobicContact CD2-CD2 4.06Å; Y97-L110 HydrophobicContact CE1-CD2 3.9Å; Y97-L110 HydrophobicContact CE2-CD2 3.53Å; Y97-L110 HydrophobicContact CG-CD1 4.15Å; Y97-L110 HydrophobicContact CG-CD2 4.5Å; Y97-L110 VanDerWaalsContact CZ-CD2 3.44Å; Y97-W138 HydrophobicContact CE2-CH2 4.49Å; Y97-W138 WeakPolarHBondContact OH-CH2 3.44Å; Y97-V194 HydrophobicContact CE1-CG1 3.8Å; Y97-Y259 AromaticContact CD1-CD1 3.71Å; Y97-Y259 HydrophobicContact CD1-CD1 3.71Å; Y97-Y259 AromaticContact CD1-CD2 3.89Å; Y97-Y259 HydrophobicContact CD1-CD2 3.89Å; Y97-Y259 HydrophobicContact CD1-CE1 4.1Å; Y97-Y259 HydrophobicContact CD1-CE2 4.27Å; Y97-Y259 AromaticContact CD1-CG 3.58Å; Y97-Y259 HydrophobicContact CD1-CG 3.58Å; Y97-Y259 AromaticContact CE1-CD1 3.93Å; Y97-Y259 HydrophobicContact CE1-CD1 3.93Å; Y97-Y259 HydrophobicContact CE1-CD2 4.5Å; Y97-Y259 AromaticContact CE1-CG 3.81Å; Y97-Y259 HydrophobicContact CE1-CG 3.81Å
98	E	90.5	Very high	90.5	Very high	111 Å²	111	44.5 Å²	44.5	52%	0.519	23%	0.234	S	C	.	.			trans	-87.8	100.7	177.7	-65	172.7	175.4	0	0	109.6	S96 K108 Y259	S96-E98 PolarHBondContact O-N 3.03Å; E98-K108 IonicContact OE2-NZ 2.85Å; E98-K108 PolarHBondContact OE2-NZ 3.24Å; E98-Y259 PolarHBondContact N-OH 2.78Å; E98-Y259 PolarHBondContact O-OH 3.06Å
99	I	93.5	Very high	90.7	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.23	C	C	.	.			trans	-115.4	110.2	-176.2	-54.9	177.3	0	0	0	108.4	I47 L49 Y97 M140 L196 I198 V261 F263	I47-I99 HydrophobicContact CB-CB 4.32Å; I47-I99 HydrophobicContact CB-CG2 4.12Å; I47-I99 HydrophobicContact CD1-CG2 4.11Å; I47-I99 PolarHBondContact N-O 2.76Å; L49-I99 HydrophobicContact CB-CD1 4.19Å; Y97-I99 PolarHBondContact O-N 3.19Å; I99-M140 HydrophobicContact CD1-CE 3.42Å; I99-M140 VanDerWaalsContact CD1-CE 3.42Å; I99-L196 HydrophobicContact CD1-CD1 3.62Å; I99-I198 HydrophobicContact CG2-CD1 3.84Å; I99-V261 HydrophobicContact CG1-CG2 4.22Å; I99-V261 HydrophobicContact CG2-CG1 3.99Å; I99-V261 HydrophobicContact CG2-CG2 4.41Å; I99-F263 HydrophobicContact CG2-CZ 4.24Å
100	I	93.2	Very high	90.8	Very high	56 Å²	56	44 Å²	44	29%	0.287	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-103.1	128	178.6	-58.1	175	0	0	0	108.3	P35 G102 K103 F263	P35-I100 HydrophobicContact CG-CG2 3.88Å; I100-G102 PolarHBondContact O-N 2.8Å; I100-K103 HydrophobicContact CB-CB 4Å; I100-K103 HydrophobicContact CB-CD 4.38Å; I100-K103 HydrophobicContact CD1-CD 4.21Å; I100-K103 HydrophobicContact CG2-CB 4.26Å; I100-K103 PolarHBondContact O-N 3.02Å; I100-K103 VanDerWaalsContact O-N 3.08Å; I100-F263 WeakPolarHBondContact O-CE2 3.4Å; I100-F263 WeakPolarHBondContact O-CZ 3.43Å
101	F	90.7	Very high	91	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.013	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	127.3	-179.5	-178.8	-96.4	0	0	0	111.8	Y32 S45 I47 K103 Y200 K214 F263	Y32-F101 HydrophobicContact CG-CD2 4.48Å; Y32-F101 WeakPolarHBondContact O-CE1 3.38Å; S45-F101 WeakPolarHBondContact O-CB 3.46Å; S45-F101 PolarHBondContact O-N 2.99Å; I47-F101 HydrophobicContact CD1-CB 4.01Å; I47-F101 HydrophobicContact CD1-CD2 4.11Å; I47-F101 HydrophobicContact CG1-CB 4.42Å; F101-K103 PolarHBondContact O-N 2.83Å; F101-Y200 HydrophobicContact CE2-CD1 4.1Å; F101-Y200 AromaticContact CE2-CD2 3.96Å; F101-Y200 HydrophobicContact CE2-CD2 3.96Å; F101-Y200 HydrophobicContact CE2-CE2 4.35Å; F101-Y200 AromaticContact CE2-CG 3.8Å; F101-Y200 HydrophobicContact CE2-CG 3.8Å; F101-Y200 HydrophobicContact CZ-CD1 4.34Å; F101-Y200 AromaticContact CZ-CD2 3.64Å; F101-Y200 HydrophobicContact CZ-CD2 3.64Å; F101-Y200 HydrophobicContact CZ-CE1 4.4Å; F101-Y200 AromaticContact CZ-CE2 3.68Å; F101-Y200 HydrophobicContact CZ-CE2 3.68Å; F101-Y200 AromaticContact CZ-CG 3.97Å; F101-Y200 HydrophobicContact CZ-CG 3.97Å; F101-K214 WeakPolarHBondContact CE1-O 3.36Å; F101-F263 HydrophobicContact CD2-CD1 4.35Å; F101-F263 AromaticContact CD2-CE1 3.92Å; F101-F263 HydrophobicContact CD2-CE1 3.92Å; F101-F263 HydrophobicContact CE2-CD1 4.48Å; F101-F263 HydrophobicContact CE2-CE1 4.46Å
102	G	87	Confident	91.2	Very high	44 Å²	44	44.9 Å²	44.9	45%	0.454	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	-3.3	-180	0	0	0	0	0	115.2	I100	I100-G102 PolarHBondContact O-N 2.8Å
103	K	91.9	Very high	91.2	Very high	98 Å²	98	46.4 Å²	46.4	43%	0.426	26%	0.26	S	S	.	.			trans	-96.5	106.5	175.1	-169	-170.1	-176.2	-156.7	0	109.8	I100 F101 E105 F263	I100-K103 HydrophobicContact CB-CB 4Å; I100-K103 HydrophobicContact CB-CD 4.38Å; I100-K103 HydrophobicContact CD1-CD 4.21Å; I100-K103 HydrophobicContact CG2-CB 4.26Å; I100-K103 PolarHBondContact O-N 3.02Å; I100-K103 VanDerWaalsContact O-N 3.08Å; F101-K103 PolarHBondContact O-N 2.83Å; K103-E105 WeakPolarHBondContact CE-OE1 3.43Å; K103-E105 IonicContact NZ-OE1 2.73Å; K103-E105 PolarHBondContact NZ-OE1 3.45Å; K103-F263 WeakPolarHBondContact O-CE2 3.33Å
104	E	93.8	Very high	91.2	Very high	121 Å²	121	52.1 Å²	52.1	57%	0.565	28%	0.282	S	S	*	.			trans	-71.9	139.2	172.6	-59.6	-166.3	149.9	0	0	110.7	V261	E104-V261 WeakPolarHBondContact CA-O 3.41Å
105	E	94.1	Very high	91.1	Very high	37 Å²	37	52 Å²	52	17%	0.173	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.7	178.7	-69.4	-76.4	-173.7	0	0	107.8	K103 K108 S260 V261	K103-E105 WeakPolarHBondContact CE-OE1 3.43Å; K103-E105 IonicContact NZ-OE1 2.73Å; K103-E105 PolarHBondContact NZ-OE1 3.45Å; E105-K108 HydrophobicContact CB-CB 4.46Å; E105-K108 HydrophobicContact CG-CD 4.31Å; E105-S260 CarbonylContact O-C 3.6Å; E105-S260 WeakPolarHBondContact O-CA 3.35Å; E105-S260 WeakPolarHBondContact O-CB 3.46Å; E105-V261 HydrophobicContact CB-CB 4.32Å; E105-V261 HydrophobicContact CB-CG2 4.43Å; E105-V261 PolarHBondContact N-O 3.48Å; E105-V261 PolarHBondContact O-N 3.45Å
106	T	91.6	Very high	90.9	Very high	115 Å²	115	53.2 Å²	53.2	71%	0.706	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.1	179.4	56.7	0	0	0	0	109.5	K108	T106-K108 VanDerWaalsContact C-N 3.32Å; T106-K108 PolarHBondContact O-N 3.45Å
107	C	90	Very high	90.6	Very high	23 Å²	23	58 Å²	58	16%	0.155	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	58.8	35.1	177.7	-155.8	0	0	0	0	115.2	V109 C237 Y259 S260	C107-V109 PolarHBondContact O-N 3.11Å; C107-C237 VanDerWaalsContact CA-SG 3.51Å; C107-C237 HydrophobicContact CB-CB 3.59Å; C107-C237 WeakPolarHBondContact CB-SG 3.41Å; C107-C237 WeakPolarHBondContact SG-CB 3.47Å; C107-C237 PolarHBondContact SG-N 2.95Å; C107-C237 CovalentContact SG-SG 2.02Å; C107-C237 PolarHBondContact SG-SG 3.29Å; C107-Y259 CarbonylContact C-O 3.56Å; C107-Y259 PolarHBondContact N-O 3.49Å; C107-S260 PolarHBondContact N-OG 3.21Å
108	K	92.4	Very high	90.2	Very high	47 Å²	47	61.4 Å²	61.4	20%	0.204	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	130.8	177	-176	166.1	170	-166.4	0	110	E98 E105 T106 L110 T258 Y259	E98-K108 IonicContact OE2-NZ 2.85Å; E98-K108 PolarHBondContact OE2-NZ 3.24Å; E105-K108 HydrophobicContact CB-CB 4.46Å; E105-K108 HydrophobicContact CG-CD 4.31Å; T106-K108 VanDerWaalsContact C-N 3.32Å; T106-K108 PolarHBondContact O-N 3.45Å; K108-L110 PolarHBondContact O-N 3.14Å; K108-T258 CarbonylContact O-C 3.41Å; K108-T258 WeakPolarHBondContact O-CA 3.41Å; K108-Y259 HydrophobicContact CB-CD1 4.34Å; K108-Y259 HydrophobicContact CB-CE1 4Å; K108-Y259 HydrophobicContact CB-CE2 4.36Å; K108-Y259 HydrophobicContact CD-CE1 4.18Å; K108-Y259 HydrophobicContact CD-CE2 4.29Å; K108-Y259 WeakPolarHBondContact CD-OH 3.46Å; K108-Y259 WeakPolarHBondContact CE-OH 3.31Å; K108-Y259 HydrophobicContact CG-CE1 3.87Å; K108-Y259 PolarHBondContact N-O 3.18Å; K108-Y259 PolarHBondContact NZ-OH 3.18Å; K108-Y259 WeakPolarHBondContact O-CD1 3.41Å; K108-Y259 PolarHBondContact O-N 3.27Å
109	V	91.3	Very high	90	Very high	60 Å²	60	59.2 Å²	59.2	36%	0.364	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.4	176	179.1	0	0	0	0	109.4	C107 P235 T256 T258	C107-V109 PolarHBondContact O-N 3.11Å; V109-P235 HydrophobicContact CG2-CB 3.51Å; V109-P235 HydrophobicContact CG2-CG 3.43Å; V109-P235 VanDerWaalsContact CG2-CG 3.43Å; V109-T256 HydrophobicContact CG1-CG2 3.93Å; V109-T256 HydrophobicContact CG2-CG2 4.25Å; V109-T258 HydrophobicContact CG2-CG2 4.05Å
110	L	91.2	Very high	89.7	Confident	31 Å²	31	62.5 Å²	62.5	16%	0.162	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-55.8	171.1	-175.9	67.4	0	0	0	110.2	C71 S96 Y97 K108 Y257 Y259	C71-L110 HydrophobicContact CB-CD2 3.72Å; C71-L110 HydrophobicContact CB-CG 3.87Å; C71-L110 VanDerWaalsContact SG-CD2 3.55Å; S96-L110 WeakPolarHBondContact O-CD1 3.24Å; Y97-L110 HydrophobicContact CD1-CD1 4.31Å; Y97-L110 HydrophobicContact CD1-CD2 4.41Å; Y97-L110 HydrophobicContact CD2-CD1 4.23Å; Y97-L110 HydrophobicContact CD2-CD2 4.06Å; Y97-L110 HydrophobicContact CE1-CD2 3.9Å; Y97-L110 HydrophobicContact CE2-CD2 3.53Å; Y97-L110 HydrophobicContact CG-CD1 4.15Å; Y97-L110 HydrophobicContact CG-CD2 4.5Å; Y97-L110 VanDerWaalsContact CZ-CD2 3.44Å; K108-L110 PolarHBondContact O-N 3.14Å; L110-Y257 PolarHBondContact N-O 2.8Å; L110-Y259 HydrophobicContact CB-CD1 4.04Å; L110-Y259 HydrophobicContact CB-CE1 4.17Å; L110-Y259 HydrophobicContact CD1-CD1 4.49Å; L110-Y259 HydrophobicContact CD1-CE1 4.1Å
111	C	91.3	Very high	89.5	Confident	30 Å²	30	68.5 Å²	68.5	20%	0.203	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	169.8	173.1	81.5	0	0	0	0	111.3	C71 Y257	C71-C111 WeakPolarHBondContact CA-SG 3.49Å; C71-C111 HydrophobicContact CB-CB 3.79Å; C71-C111 WeakPolarHBondContact CB-SG 3.17Å; C71-C111 WeakPolarHBondContact SG-CB 3.32Å; C71-C111 CovalentContact SG-SG 2.02Å; C71-C111 PolarHBondContact SG-SG 2.98Å; C111-Y257 PolarHBondContact O-N 3.16Å
112	S	89.7	Confident	89.5	Confident	66 Å²	66	73.1 Å²	73.1	46%	0.462	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.2	169.1	-65.4	0	0	0	0	110.7	I255 T256	S112-I255 CarbonylContact C-O 3.58Å; S112-I255 WeakPolarHBondContact CA-O 3.32Å; S112-T256 WeakPolarHBondContact OG-CG2 3.47Å; S112-T256 PolarHBondContact OG-OG1 3.47Å
113	K	90	Very high	89.6	Confident	38 Å²	38	71.1 Å²	71.1	17%	0.165	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.9	179.1	-69	-72.3	-175.2	152.9	0	109.9	D69 F70 Y115 T254 I255 Y257	D69-K113 IonicContact OD1-NZ 2.68Å; D69-K113 PolarHBondContact OD1-NZ 3.34Å; F70-K113 WeakPolarHBondContact O-CE 3.16Å; F70-K113 PolarHBondContact O-NZ 3.45Å; K113-Y115 HydrophobicContact CB-CE2 3.85Å; K113-T254 CarbonylContact O-C 3.57Å; K113-T254 WeakPolarHBondContact O-CA 3.32Å; K113-I255 PolarHBondContact N-O 2.93Å; K113-I255 PolarHBondContact O-N 3.2Å; K113-Y257 HydrophobicContact CG-CE2 4.15Å
114	K	89.3	Confident	89.5	Confident	139 Å²	139	70.6 Å²	70.6	60%	0.604	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.8	177.7	-63	-170.3	174.9	-173.7	0	110	T254	K114-T254 HydrophobicContact CG-CG2 4.11Å
115	Y	89	Confident	89.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.6	175.1	-62.2	-80.2	0	0	0	109.3	D69 K113 N119 K122 Y123 I126 E252 L253 I255	D69-Y115 HydrophobicContact CB-CE1 4.32Å; D69-Y115 PolarHBondContact O-OH 3.42Å; D69-Y115 VanDerWaalsContact O-OH 3.14Å; K113-Y115 HydrophobicContact CB-CE2 3.85Å; Y115-N119 HydrophobicContact CD1-CB 4.42Å; Y115-K122 HydrophobicContact CE1-CB 4.33Å; Y115-Y123 HydrophobicContact CD1-CD2 4.37Å; Y115-Y123 HydrophobicContact CD2-CD2 4.36Å; Y115-Y123 HydrophobicContact CG-CD2 4.09Å; Y115-I126 HydrophobicContact CE1-CD1 4.47Å; Y115-I126 WeakPolarHBondContact OH-CD1 3.37Å; Y115-E252 WeakPolarHBondContact O-CA 3.45Å; Y115-L253 PolarHBondContact N-O 3.39Å; Y115-L253 PolarHBondContact O-N 3.36Å; Y115-I255 HydrophobicContact CD2-CD1 3.94Å; Y115-I255 HydrophobicContact CD2-CG1 4.06Å; Y115-I255 HydrophobicContact CE2-CB 4.29Å; Y115-I255 HydrophobicContact CE2-CD1 3.63Å; Y115-I255 HydrophobicContact CE2-CG1 3.96Å
116	S	86.9	Confident	89.3	Confident	36 Å²	36	66.1 Å²	66.1	25%	0.252	35%	0.346	S	S	.	.			trans	-132.6	179.9	171.8	67.1	0	0	0	0	108.7	A118 N119 Y120	S116-A118 PolarHBondContact O-N 2.8Å; S116-N119 PolarHBondContact O-N 3.37Å; S116-Y120 PolarHBondContact O-N 3.39Å
117	H	83.3	Confident	89.2	Confident	144 Å²	144	61.1 Å²	61.1	67%	0.667	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-51.7	-31.3	176.3	-82.4	-63.5	0	0	0	113.8	N119 Y120 L249	H117-N119 PolarHBondContact O-N 3.24Å; H117-Y120 WeakPolarHBondContact O-CB 3.49Å; H117-Y120 PolarHBondContact O-N 3.07Å; H117-L249 PolarHBondContact CE1-O 3.41Å
118	A	84.4	Confident	89.3	Confident	89 Å²	89	66.6 Å²	66.6	74%	0.736	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-64.5	-37.2	177.6	0	0	0	0	0	113.2	S116	S116-A118 PolarHBondContact O-N 2.8Å
119	N	85.4	Confident	89.3	Confident	65 Å²	65	64.5 Å²	64.5	35%	0.348	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-102.4	16	-177.8	-71.2	-26.4	0	0	0	113	Y115 S116 H117 K121 K122 Y123	Y115-N119 HydrophobicContact CD1-CB 4.42Å; S116-N119 PolarHBondContact O-N 3.37Å; H117-N119 PolarHBondContact O-N 3.24Å; N119-K121 VanDerWaalsContact C-N 3.25Å; N119-K121 PolarHBondContact O-N 2.68Å; N119-K121 VanDerWaalsContact O-N 3.14Å; N119-K122 PolarHBondContact O-N 3.43Å; N119-Y123 PolarHBondContact O-N 2.79Å
120	Y	87.6	Confident	89.3	Confident	70 Å²	70	61.7 Å²	61.7	28%	0.275	31%	0.311	S	S	.	.	H	α-helix	trans	-56.8	-34.6	-173	-174.9	-110.8	0	0	0	113.8	S116 H117 K122 Y123 L124 L249	S116-Y120 PolarHBondContact O-N 3.39Å; H117-Y120 WeakPolarHBondContact O-CB 3.49Å; H117-Y120 PolarHBondContact O-N 3.07Å; Y120-K122 VanDerWaalsContact C-N 3.34Å; Y120-K122 PolarHBondContact O-N 3.49Å; Y120-Y123 HydrophobicContact CD2-CD1 4.21Å; Y120-Y123 HydrophobicContact CE2-CD1 4.09Å; Y120-Y123 WeakPolarHBondContact O-CB 3.35Å; Y120-Y123 PolarHBondContact O-N 3.39Å; Y120-L124 WeakPolarHBondContact O-CB 3.49Å; Y120-L124 PolarHBondContact O-N 2.96Å; Y120-L249 HydrophobicContact CD2-CB 3.96Å; Y120-L249 HydrophobicContact CD2-CD2 4.29Å; Y120-L249 HydrophobicContact CE2-CB 3.94Å
121	K	89.5	Confident	89.1	Confident	183 Å²	183	63.7 Å²	63.7	80%	0.796	32%	0.321	S	S	*	.	H	α-helix	trans	-61.6	-39.3	177.3	-68.3	-175.8	-179.3	179.1	0	113.1	N119 L124 F125	N119-K121 VanDerWaalsContact C-N 3.25Å; N119-K121 PolarHBondContact O-N 2.68Å; N119-K121 VanDerWaalsContact O-N 3.14Å; K121-L124 PolarHBondContact O-N 3.13Å; K121-F125 WeakPolarHBondContact O-CB 3.2Å; K121-F125 PolarHBondContact O-N 3.31Å
122	K	89	Confident	89	Confident	100 Å²	100	64.1 Å²	64.1	44%	0.435	32%	0.32	S	S	.	.	H	α-helix	trans	-69.7	-41.4	179.1	-64.7	-179.5	173.7	-174.9	0	111	D69 Y115 N119 Y120 F125 I126	D69-K122 HydrophobicContact CB-CB 4.08Å; D69-K122 HydrophobicContact CB-CD 3.94Å; D69-K122 HydrophobicContact CB-CG 4.48Å; D69-K122 VanDerWaalsContact OD2-CD 3.23Å; D69-K122 WeakPolarHBondContact OD2-CD 3.33Å; D69-K122 IonicContact OD2-NZ 2.77Å; Y115-K122 HydrophobicContact CE1-CB 4.33Å; N119-K122 PolarHBondContact O-N 3.43Å; Y120-K122 VanDerWaalsContact C-N 3.34Å; Y120-K122 PolarHBondContact O-N 3.49Å; K122-F125 WeakPolarHBondContact O-CB 3.37Å; K122-F125 PolarHBondContact O-N 2.89Å; K122-I126 PolarHBondContact O-N 3.47Å; K122-I126 VanDerWaalsContact O-N 3.15Å
123	Y	89.8	Confident	89	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-47.3	172.2	176.6	-101.9	0	0	0	112	Y115 N119 Y120 F125 I126 T127 L245 P246 L249 L253	Y115-Y123 HydrophobicContact CD1-CD2 4.37Å; Y115-Y123 HydrophobicContact CD2-CD2 4.36Å; Y115-Y123 HydrophobicContact CG-CD2 4.09Å; N119-Y123 PolarHBondContact O-N 2.79Å; Y120-Y123 HydrophobicContact CD2-CD1 4.21Å; Y120-Y123 HydrophobicContact CE2-CD1 4.09Å; Y120-Y123 WeakPolarHBondContact O-CB 3.35Å; Y120-Y123 PolarHBondContact O-N 3.39Å; Y123-F125 VanDerWaalsContact C-N 3.28Å; Y123-F125 PolarHBondContact O-N 3.5Å; Y123-I126 PolarHBondContact O-N 3.15Å; Y123-T127 HydrophobicContact CD1-CG2 4.45Å; Y123-T127 HydrophobicContact CE1-CG2 3.96Å; Y123-T127 HydrophobicContact CE2-CG2 4.2Å; Y123-T127 PolarHBondContact O-N 3.43Å; Y123-T127 PolarHBondContact O-OG1 3.1Å; Y123-L245 HydrophobicContact CE2-CB 4.46Å; Y123-L245 HydrophobicContact CE2-CD1 4.42Å; Y123-L245 HydrophobicContact CE2-CD2 4.23Å; Y123-L245 WeakPolarHBondContact OH-CB 3.41Å; Y123-P246 WeakPolarHBondContact OH-CD 3.39Å; Y123-P246 PolarHBondContact OH-O 2.96Å; Y123-L249 HydrophobicContact CE1-CB 4.4Å; Y123-L253 HydrophobicContact CD2-CD2 4.49Å; Y123-L253 HydrophobicContact CE2-CD2 3.73Å
124	L	90.1	Very high	89.1	Confident	86 Å²	86	60.1 Å²	60.1	45%	0.45	30%	0.296	S	S	.	.	H	α-helix	trans	-62.5	-35.4	177.5	-170	69.3	0	0	0	112.1	Y120 K121 T127 K128	Y120-L124 WeakPolarHBondContact O-CB 3.49Å; Y120-L124 PolarHBondContact O-N 2.96Å; K121-L124 PolarHBondContact O-N 3.13Å; L124-T127 VanDerWaalsContact CA-OG1 3.28Å; L124-T127 WeakPolarHBondContact CA-OG1 3.22Å; L124-T127 PolarHBondContact O-OG1 3.45Å; L124-K128 VanDerWaalsContact O-CB 3.24Å; L124-K128 WeakPolarHBondContact O-CB 3.49Å; L124-K128 PolarHBondContact O-N 2.91Å
125	F	91.9	Very high	89.3	Confident	62 Å²	62	54.1 Å²	54.1	27%	0.272	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-44.2	176.2	-174.7	-110.6	0	0	0	112	F63 F68 K121 K122 Y123 A129	F63-F125 HydrophobicContact CB-CZ 4.49Å; F63-F125 HydrophobicContact CD1-CZ 4.02Å; F63-F125 HydrophobicContact CD2-CE2 4.5Å; F63-F125 AromaticContact CD2-CZ 3.87Å; F63-F125 HydrophobicContact CD2-CZ 3.87Å; F63-F125 HydrophobicContact CE1-CE2 4.43Å; F63-F125 HydrophobicContact CE1-CZ 4.2Å; F63-F125 HydrophobicContact CE2-CE2 4.21Å; F63-F125 HydrophobicContact CE2-CZ 4.03Å; F63-F125 AromaticContact CG-CZ 3.86Å; F63-F125 HydrophobicContact CG-CZ 3.86Å; F63-F125 HydrophobicContact CZ-CE2 4.19Å; F63-F125 HydrophobicContact CZ-CZ 4.2Å; F68-F125 AromaticContact CD1-CD1 3.72Å; F68-F125 HydrophobicContact CD1-CD1 3.72Å; F68-F125 AromaticContact CD1-CE1 3.53Å; F68-F125 HydrophobicContact CD1-CE1 3.53Å; F68-F125 HydrophobicContact CD2-CE1 4.3Å; F68-F125 AromaticContact CE1-CD1 3.8Å; F68-F125 HydrophobicContact CE1-CD1 3.8Å; F68-F125 AromaticContact CE1-CE1 3.34Å; F68-F125 HydrophobicContact CE1-CE1 3.34Å; F68-F125 HydrophobicContact CE1-CZ 4.1Å; F68-F125 HydrophobicContact CE2-CE1 4.16Å; F68-F125 HydrophobicContact CG-CD1 4.42Å; F68-F125 HydrophobicContact CG-CE1 4.01Å; F68-F125 AromaticContact CZ-CE1 3.68Å; F68-F125 HydrophobicContact CZ-CE1 3.68Å; F68-F125 HydrophobicContact CZ-CZ 4.12Å; K121-F125 WeakPolarHBondContact O-CB 3.2Å; K121-F125 PolarHBondContact O-N 3.31Å; K122-F125 WeakPolarHBondContact O-CB 3.37Å; K122-F125 PolarHBondContact O-N 2.89Å; Y123-F125 VanDerWaalsContact C-N 3.28Å; Y123-F125 PolarHBondContact O-N 3.5Å; F125-A129 VanDerWaalsContact O-CB 3.3Å; F125-A129 WeakPolarHBondContact O-CB 3.41Å; F125-A129 PolarHBondContact O-N 2.86Å
126	I	91.4	Very high	89.5	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-48.3	176.3	-66.8	168.2	0	0	0	110.8	F68 D69 Y115 K122 Y123 K128 A129 I130 L190	F68-I126 HydrophobicContact CD1-CG1 4.22Å; D69-I126 HydrophobicContact CB-CD1 4.43Å; Y115-I126 HydrophobicContact CE1-CD1 4.47Å; Y115-I126 WeakPolarHBondContact OH-CD1 3.37Å; K122-I126 PolarHBondContact O-N 3.47Å; K122-I126 VanDerWaalsContact O-N 3.15Å; Y123-I126 PolarHBondContact O-N 3.15Å; I126-K128 PolarHBondContact O-N 3.36Å; I126-A129 PolarHBondContact O-N 3.04Å; I126-A129 VanDerWaalsContact O-N 3.17Å; I126-I130 HydrophobicContact CG2-CD1 4.09Å; I126-I130 WeakPolarHBondContact O-CG1 3.48Å; I126-I130 PolarHBondContact O-N 3.3Å; I126-L190 HydrophobicContact CG2-CD1 4.13Å
127	T	90.6	Very high	89.8	Confident	11 Å²	11	54.7 Å²	54.7	7%	0.067	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-44.9	179.2	49.7	0	0	0	0	111.8	Y123 L124 A129 I130 M131 L245	Y123-T127 HydrophobicContact CD1-CG2 4.45Å; Y123-T127 HydrophobicContact CE1-CG2 3.96Å; Y123-T127 HydrophobicContact CE2-CG2 4.2Å; Y123-T127 PolarHBondContact O-N 3.43Å; Y123-T127 PolarHBondContact O-OG1 3.1Å; L124-T127 VanDerWaalsContact CA-OG1 3.28Å; L124-T127 WeakPolarHBondContact CA-OG1 3.22Å; L124-T127 PolarHBondContact O-OG1 3.45Å; T127-A129 VanDerWaalsContact C-N 3.32Å; T127-A129 PolarHBondContact O-N 3Å; T127-I130 PolarHBondContact O-N 2.93Å; T127-M131 WeakPolarHBondContact O-CG 3.22Å; T127-M131 PolarHBondContact O-N 3.32Å; T127-L245 HydrophobicContact CG2-CB 4.23Å; T127-L245 HydrophobicContact CG2-CD1 3.68Å
128	K	90.9	Very high	90.3	Very high	137 Å²	137	48.3 Å²	48.3	60%	0.596	24%	0.239	S	C	*	.	H	α-helix	trans	-61.8	-38.9	174.4	-173.9	175.1	-178.9	178.8	0	112.2	L124 I126 I130 M131 M132	L124-K128 VanDerWaalsContact O-CB 3.24Å; L124-K128 WeakPolarHBondContact O-CB 3.49Å; L124-K128 PolarHBondContact O-N 2.91Å; I126-K128 PolarHBondContact O-N 3.36Å; K128-I130 VanDerWaalsContact C-N 3.35Å; K128-M131 PolarHBondContact O-N 3.19Å; K128-M132 HydrophobicContact CG-CG 4.49Å; K128-M132 WeakPolarHBondContact O-CB 3.42Å; K128-M132 WeakPolarHBondContact O-CG 3.35Å; K128-M132 PolarHBondContact O-N 3.34Å
129	A	92.1	Very high	90.7	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-36.6	177.5	0	0	0	0	0	112.5	F68 F125 I126 T127 M132 G133 Y134 L164	F68-A129 HydrophobicContact CE1-CB 3.54Å; F68-A129 HydrophobicContact CZ-CB 4.12Å; F125-A129 VanDerWaalsContact O-CB 3.3Å; F125-A129 WeakPolarHBondContact O-CB 3.41Å; F125-A129 PolarHBondContact O-N 2.86Å; I126-A129 PolarHBondContact O-N 3.04Å; I126-A129 VanDerWaalsContact O-N 3.17Å; T127-A129 VanDerWaalsContact C-N 3.32Å; T127-A129 PolarHBondContact O-N 3Å; A129-M132 CarbonylContact O-C 3.46Å; A129-M132 PolarHBondContact O-N 3.46Å; A129-G133 PolarHBondContact O-N 3.26Å; A129-G133 VanDerWaalsContact O-N 3.11Å; A129-Y134 HydrophobicContact CB-CD2 3.8Å; A129-Y134 HydrophobicContact CB-CG 4.24Å; A129-Y134 WeakPolarHBondContact O-CD2 3.36Å; A129-Y134 PolarHBondContact O-N 2.91Å; A129-L164 HydrophobicContact CB-CD2 3.88Å
130	I	91.3	Very high	91	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-45.1	171.7	-64.6	165.1	0	0	0	110.4	I126 T127 K128 M132 G133 L164 F167 T188 L190 L245	I126-I130 HydrophobicContact CG2-CD1 4.09Å; I126-I130 WeakPolarHBondContact O-CG1 3.48Å; I126-I130 PolarHBondContact O-N 3.3Å; T127-I130 PolarHBondContact O-N 2.93Å; K128-I130 VanDerWaalsContact C-N 3.35Å; I130-M132 VanDerWaalsContact C-N 3.28Å; I130-M132 PolarHBondContact O-N 2.96Å; I130-G133 PolarHBondContact O-N 2.94Å; I130-L164 HydrophobicContact CG1-CB 4.5Å; I130-L164 HydrophobicContact CG1-CD2 3.96Å; I130-L164 HydrophobicContact CG1-CG 3.83Å; I130-F167 HydrophobicContact CG2-CB 4.32Å; I130-T188 HydrophobicContact CB-CG2 3.8Å; I130-T188 HydrophobicContact CD1-CG2 3.8Å; I130-T188 HydrophobicContact CG1-CG2 4.42Å; I130-T188 HydrophobicContact CG2-CG2 3.6Å; I130-L190 HydrophobicContact CD1-CB 4.23Å; I130-L190 HydrophobicContact CD1-CD1 3.89Å; I130-L245 HydrophobicContact CD1-CD1 3.87Å
131	M	88.1	Confident	91.1	Very high	73 Å²	73	39 Å²	39	36%	0.36	18%	0.183	S	C	.	.	H	α-helix	trans	-62.2	-35.8	177.4	-65.9	173.2	-175.8	0	0	112.8	K58 T127 K128 G133 F167 T188	K58-M131 PolarHBondContact NZ-O 3.42Å; T127-M131 WeakPolarHBondContact O-CG 3.22Å; T127-M131 PolarHBondContact O-N 3.32Å; K128-M131 PolarHBondContact O-N 3.19Å; M131-G133 PolarHBondContact O-N 2.92Å; M131-F167 HydrophobicContact CB-CD1 4.42Å; M131-F167 HydrophobicContact CE-CE2 4.3Å; M131-F167 HydrophobicContact CG-CD1 4.28Å; M131-F167 HydrophobicContact CG-CD2 4.05Å; M131-F167 HydrophobicContact CG-CE1 4.41Å; M131-F167 HydrophobicContact CG-CE2 4.19Å; M131-F167 HydrophobicContact CG-CG 4.1Å; M131-F167 HydrophobicContact CG-CZ 4.37Å; M131-T188 WeakPolarHBondContact CE-OG1 3.42Å
132	M	89.1	Confident	91.1	Very high	39 Å²	39	31.7 Å²	31.7	19%	0.192	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-2	174.7	-68.8	-59.8	-65.2	0	0	113.3	S56 K58 K128 A129 I130 Y134	S56-M132 PolarHBondContact OG-O 3.18Å; K58-M132 HydrophobicContact CB-CE 3.85Å; K128-M132 HydrophobicContact CG-CG 4.49Å; K128-M132 WeakPolarHBondContact O-CB 3.42Å; K128-M132 WeakPolarHBondContact O-CG 3.35Å; K128-M132 PolarHBondContact O-N 3.34Å; A129-M132 CarbonylContact O-C 3.46Å; A129-M132 PolarHBondContact O-N 3.46Å; I130-M132 VanDerWaalsContact C-N 3.28Å; I130-M132 PolarHBondContact O-N 2.96Å; M132-Y134 HydrophobicContact CB-CD2 3.77Å; M132-Y134 HydrophobicContact CB-CE2 3.7Å; M132-Y134 HydrophobicContact CG-CE2 4.47Å
133	G	89.2	Confident	91.1	Very high	8 Å²	8	27 Å²	27	8%	0.082	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	43.3	178.1	0	0	0	0	0	113.7	A129 I130 M131 N170	A129-G133 PolarHBondContact O-N 3.26Å; A129-G133 VanDerWaalsContact O-N 3.11Å; I130-G133 PolarHBondContact O-N 2.94Å; M131-G133 PolarHBondContact O-N 2.92Å; G133-N170 WeakPolarHBondContact CA-ND2 3.39Å
134	Y	92.6	Very high	91.2	Very high	12 Å²	12	27.5 Å²	27.5	5%	0.047	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.6	171.7	-83	-88.7	0	0	0	111.6	L54 T55 I61 F63 A129 M132 L164	L54-Y134 HydrophobicContact CB-CD1 4.05Å; T55-Y134 CarbonylContact O-C 3.57Å; T55-Y134 WeakPolarHBondContact O-CA 3.41Å; I61-Y134 WeakPolarHBondContact O-CE1 3.17Å; I61-Y134 PolarHBondContact O-OH 2.93Å; F63-Y134 HydrophobicContact CD2-CD1 4.43Å; F63-Y134 AromaticContact CD2-CE1 3.68Å; F63-Y134 HydrophobicContact CD2-CE1 3.68Å; F63-Y134 HydrophobicContact CD2-CE2 4.34Å; F63-Y134 AromaticContact CD2-CZ 3.63Å; F63-Y134 HydrophobicContact CE2-CE1 4.13Å; F63-Y134 HydrophobicContact CE2-CE2 4.19Å; F63-Y134 AromaticContact CE2-CZ 3.59Å; F63-Y134 VanDerWaalsContact CE2-OH 3.22Å; F63-Y134 WeakPolarHBondContact CE2-OH 3.18Å; A129-Y134 HydrophobicContact CB-CD2 3.8Å; A129-Y134 HydrophobicContact CB-CG 4.24Å; A129-Y134 WeakPolarHBondContact O-CD2 3.36Å; A129-Y134 PolarHBondContact O-N 2.91Å; M132-Y134 HydrophobicContact CB-CD2 3.77Å; M132-Y134 HydrophobicContact CB-CE2 3.7Å; M132-Y134 HydrophobicContact CG-CE2 4.47Å; Y134-L164 WeakPolarHBondContact O-CB 3.41Å; Y134-L164 PolarHBondContact O-N 2.77Å; Y134-L164 VanDerWaalsContact O-N 3.1Å
135	E	92.7	Very high	91.5	Very high	14 Å²	14	23.4 Å²	23.4	7%	0.065	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	143.9	-176.5	-52.5	178.3	165.6	0	0	110.1	L54 T55 K159 S161 I162	L54-E135 WeakPolarHBondContact CA-O 3.32Å; L54-E135 WeakPolarHBondContact CB-O 3.44Å; T55-E135 PolarHBondContact N-O 3.02Å; T55-E135 VanDerWaalsContact N-O 3.15Å; T55-E135 PolarHBondContact O-N 3.41Å; E135-K159 VanDerWaalsContact CD-NZ 3.3Å; E135-K159 VanDerWaalsContact OE1-CE 3.29Å; E135-K159 WeakPolarHBondContact OE1-CE 3.3Å; E135-K159 IonicContact OE1-NZ 3.81Å; E135-K159 PolarHBondContact OE1-NZ 3.3Å; E135-K159 VanDerWaalsContact OE2-CE 3.23Å; E135-K159 WeakPolarHBondContact OE2-CE 3.37Å; E135-K159 IonicContact OE2-NZ 3.15Å; E135-K159 PolarHBondContact OE2-NZ 3.33Å; E135-S161 VanDerWaalsContact OE2-CB 3.26Å; E135-S161 WeakPolarHBondContact OE2-CB 3.26Å; E135-S161 PolarHBondContact OE2-OG 2.7Å; E135-I162 CarbonylContact C-O 3.44Å; E135-I162 VanDerWaalsContact CA-O 3.3Å; E135-I162 WeakPolarHBondContact CA-O 3.47Å
136	H	93.4	Very high	91.5	Very high	14 Å²	14	20.5 Å²	20.5	7%	0.065	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	142	173.7	-61.8	-83.3	0	0	0	111.8	Y65 F70 W138 S161 I162 L164	Y65-H136 AromaticContact CE2-ND1 3.97Å; F70-H136 AromaticContact CE2-CE1 3.47Å; F70-H136 VanDerWaalsContact CE2-CE1 3.47Å; F70-H136 WeakPolarHBondContact CE2-CE1 3.47Å; F70-H136 AromaticContact CZ-CE1 3.73Å; H136-W138 HydrophobicContact CB-CZ2 4.5Å; H136-W138 AromaticContact CG-NE1 3.81Å; H136-W138 AromaticContact ND1-NE1 3.78Å; H136-S161 CarbonylContact O-C 3.56Å; H136-S161 VanDerWaalsContact O-CA 3.25Å; H136-S161 WeakPolarHBondContact O-CA 3.49Å; H136-I162 HydrophobicContact CB-CB 4.23Å; H136-I162 PolarHBondContact N-O 3.23Å; H136-I162 PolarHBondContact O-N 3.43Å; H136-L164 VanDerWaalsContact NE2-CD1 3.28Å; H136-L164 WeakPolarHBondContact NE2-CD1 3.29Å
137	H	93.1	Very high	91.5	Very high	34 Å²	34	20.8 Å²	20.8	16%	0.157	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.9	168.3	-66.6	-89.6	0	0	0	108.5	N52 T55	N52-H137 HydrophobicContact CB-CB 4.11Å; N52-H137 WeakPolarHBondContact CB-O 3.41Å; N52-H137 PolarHBondContact N-O 2.97Å; T55-H137 PolarHBondContact OG1-NE2 3.32Å
138	W	94.5	Very high	91.3	Very high	10 Å²	10	21.7 Å²	21.7	4%	0.038	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	152.3	179.3	-60.8	-11.4	0	0	0	110.5	L49 L50 V51 Y97 H136 P144 V145 I162 V194	L49-W138 HydrophobicContact CD1-CB 4.06Å; L49-W138 HydrophobicContact CD1-CE3 4.38Å; L49-W138 HydrophobicContact CD2-CD2 4.44Å; L49-W138 HydrophobicContact CD2-CE3 3.92Å; L49-W138 HydrophobicContact CD2-CZ3 4.23Å; L50-W138 CarbonylContact O-C 3.44Å; L50-W138 WeakPolarHBondContact O-CA 3.39Å; V51-W138 HydrophobicContact CG1-CD2 4.48Å; V51-W138 HydrophobicContact CG1-CG 4.19Å; Y97-W138 HydrophobicContact CE2-CH2 4.49Å; Y97-W138 WeakPolarHBondContact OH-CH2 3.44Å; H136-W138 HydrophobicContact CB-CZ2 4.5Å; H136-W138 AromaticContact CG-NE1 3.81Å; H136-W138 AromaticContact ND1-NE1 3.78Å; W138-P144 WeakPolarHBondContact O-CA 3.48Å; W138-V145 HydrophobicContact CB-CB 4Å; W138-V145 HydrophobicContact CB-CG2 3.76Å; W138-V145 PolarHBondContact O-N 3.22Å; W138-I162 HydrophobicContact CD2-CD1 3.7Å; W138-I162 HydrophobicContact CE3-CD1 3.42Å; W138-I162 VanDerWaalsContact CE3-CD1 3.42Å; W138-I162 HydrophobicContact CG-CD1 4.26Å; W138-I162 HydrophobicContact CH2-CD1 4.35Å; W138-I162 HydrophobicContact CZ3-CD1 3.79Å; W138-V194 HydrophobicContact CH2-CB 4.36Å; W138-V194 HydrophobicContact CH2-CG1 3.98Å; W138-V194 HydrophobicContact CH2-CG2 4.34Å; W138-V194 HydrophobicContact CZ3-CB 4.35Å; W138-V194 HydrophobicContact CZ3-CG1 3.97Å; W138-V194 HydrophobicContact CZ3-CG2 3.92Å
139	V	92.5	Very high	90.7	Very high	12 Å²	12	17.2 Å²	17.2	7%	0.073	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	132.5	-177.9	-179	0	0	0	0	109.8	L50 L92 L143	L50-V139 HydrophobicContact CB-CB 4.41Å; L50-V139 WeakPolarHBondContact CB-O 3.28Å; L50-V139 PolarHBondContact N-O 2.96Å; L50-V139 PolarHBondContact O-N 3.23Å; L92-V139 HydrophobicContact CD2-CG2 4.29Å; V139-L143 CarbonylContact C-O 3.59Å; V139-L143 VanDerWaalsContact CA-O 3.29Å; V139-L143 WeakPolarHBondContact CA-O 3.43Å; V139-L143 WeakPolarHBondContact CG1-O 3.35Å
140	M	92.3	Very high	90	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129.6	176.1	-178.9	-178.1	-74.2	0	0	108.5	I47 L49 I99 N142 L143 V145 L196 I198 I218 V221	I47-M140 HydrophobicContact CG2-CE 3.98Å; I47-M140 HydrophobicContact CG2-CG 3.4Å; I47-M140 VanDerWaalsContact CG2-CG 3.4Å; I47-M140 HydrophobicContact CG2-SD 3.48Å; I47-M140 WeakPolarHBondContact CG2-SD 3.26Å; L49-M140 HydrophobicContact CB-CE 4.22Å; L49-M140 HydrophobicContact CD1-CB 4.25Å; L49-M140 HydrophobicContact CD1-CE 4Å; I99-M140 HydrophobicContact CD1-CE 3.42Å; I99-M140 VanDerWaalsContact CD1-CE 3.42Å; M140-N142 PolarHBondContact O-N 3.43Å; M140-N142 VanDerWaalsContact O-N 3.15Å; M140-L143 PolarHBondContact N-O 2.8Å; M140-L143 WeakPolarHBondContact O-CA 3.33Å; M140-L143 WeakPolarHBondContact O-CB 3.5Å; M140-L143 PolarHBondContact O-N 3.45Å; M140-V145 HydrophobicContact CB-CG2 4.37Å; M140-L196 HydrophobicContact CE-CD1 4.49Å; M140-I198 HydrophobicContact CE-CD1 4.13Å; M140-I198 HydrophobicContact SD-CD1 3.82Å; M140-I198 HydrophobicContact SD-CG1 4.23Å; M140-I218 HydrophobicContact CG-CD1 4.42Å; M140-I218 HydrophobicContact SD-CD1 4.32Å; M140-V221 HydrophobicContact CB-CG2 4.09Å; M140-V221 HydrophobicContact CE-CG1 4.34Å; M140-V221 HydrophobicContact CG-CG2 4.2Å; M140-V221 HydrophobicContact SD-CB 4.46Å; M140-V221 HydrophobicContact SD-CG1 3.91Å; M140-V221 HydrophobicContact SD-CG2 3.7Å
141	D	89.5	Confident	88.9	Confident	16 Å²	16	25.2 Å²	25.2	9%	0.086	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	39.4	-176.2	-172.5	36.4	0	0	0	114.2	Y32 L143 I218 R274	Y32-D141 HydrophobicContact CE2-CB 4.36Å; D141-L143 PolarHBondContact O-N 2.97Å; D141-L143 VanDerWaalsContact O-N 3.16Å; D141-I218 HydrophobicContact CB-CB 4.35Å; D141-I218 HydrophobicContact CB-CD1 4.05Å; D141-R274 PolarHBondContact O-NH1 2.84Å; D141-R274 VanDerWaalsContact O-NH1 3.08Å; D141-R274 PolarHBondContact O-NH2 3.36Å; D141-R274 IonicContact OD2-CZ 3.92Å; D141-R274 IonicContact OD2-NH1 3.75Å; D141-R274 PolarHBondContact OD2-NH1 3.22Å
142	N	88.3	Confident	87.8	Confident	29 Å²	29	29 Å²	29	16%	0.155	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	22.3	-175.5	-164.2	57.8	0	0	0	114.4	G26 M140 A382 R384	G26-N142 WeakPolarHBondContact CA-ND2 3.37Å; M140-N142 PolarHBondContact O-N 3.43Å; M140-N142 VanDerWaalsContact O-N 3.15Å; N142-A382 PolarHBondContact ND2-O 3.42Å; N142-R384 VanDerWaalsContact OD1-CZ 3.24Å; N142-R384 PolarHBondContact OD1-NE 3.47Å; N142-R384 PolarHBondContact OD1-NH2 3.2Å
143	L	90.3	Very high	86.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	139.3	167.9	-76.7	167.8	0	0	0	110.3	V139 M140 D141 I218 L219 R274 W275 I278	V139-L143 CarbonylContact C-O 3.59Å; V139-L143 VanDerWaalsContact CA-O 3.29Å; V139-L143 WeakPolarHBondContact CA-O 3.43Å; V139-L143 WeakPolarHBondContact CG1-O 3.35Å; M140-L143 PolarHBondContact N-O 2.8Å; M140-L143 WeakPolarHBondContact O-CA 3.33Å; M140-L143 WeakPolarHBondContact O-CB 3.5Å; M140-L143 PolarHBondContact O-N 3.45Å; D141-L143 PolarHBondContact O-N 2.97Å; D141-L143 VanDerWaalsContact O-N 3.16Å; L143-I218 HydrophobicContact CD1-CG2 4.43Å; L143-L219 WeakPolarHBondContact CD1-O 3.23Å; L143-R274 HydrophobicContact CD1-CB 4.35Å; L143-R274 HydrophobicContact CD1-CG 4.31Å; L143-R274 HydrophobicContact CD2-CG 4.07Å; L143-W275 HydrophobicContact CD2-CD2 4.25Å; L143-W275 HydrophobicContact CD2-CG 4.33Å; L143-W275 HydrophobicContact CD2-CZ2 4.3Å; L143-I278 HydrophobicContact CD2-CD1 4.44Å
144	P	92.4	Very high	85.5	Confident	14 Å²	14	35.5 Å²	35.5	9%	0.091	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	139.2	170.5	30.4	-33.8	0	0	0	109.8	W138 T160 W275 I278	W138-P144 WeakPolarHBondContact O-CA 3.48Å; P144-T160 HydrophobicContact CB-CG2 4.18Å; P144-T160 HydrophobicContact CG-CG2 3.94Å; P144-W275 HydrophobicContact CG-CH2 4.26Å; P144-W275 HydrophobicContact CG-CZ3 4.33Å; P144-I278 HydrophobicContact CG-CD1 3.62Å
145	V	94.4	Very high	84.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.235	C	C	.	.			trans	-73.1	130.6	169.2	-179	0	0	0	0	108.1	L49 W138 M140 I162 L196 V221 A223	L49-V145 HydrophobicContact CD1-CG2 3.89Å; W138-V145 HydrophobicContact CB-CB 4Å; W138-V145 HydrophobicContact CB-CG2 3.76Å; W138-V145 PolarHBondContact O-N 3.22Å; M140-V145 HydrophobicContact CB-CG2 4.37Å; V145-I162 HydrophobicContact CB-CD1 4.43Å; V145-I162 HydrophobicContact CG1-CD1 3.96Å; V145-L196 HydrophobicContact CG1-CD2 4.07Å; V145-V221 HydrophobicContact CB-CG1 4.48Å; V145-V221 HydrophobicContact CG1-CG1 4.11Å; V145-V221 HydrophobicContact CG2-CB 4.33Å; V145-V221 HydrophobicContact CG2-CG1 3.93Å; V145-A223 HydrophobicContact CG1-CB 3.52Å
146	T	92.4	Very high	83.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-116	146	-171.4	59.3	0	0	0	0	112.8	K159 T160 V221 I222 A223 Y277 I278	T146-K159 CarbonylContact C-O 3.6Å; T146-K159 WeakPolarHBondContact CA-O 3.21Å; T146-K159 WeakPolarHBondContact CB-O 3.38Å; T146-T160 HydrophobicContact CG2-CG2 3.96Å; T146-V221 PolarHBondContact N-O 3.29Å; T146-V221 PolarHBondContact OG1-O 3.32Å; T146-I222 CarbonylContact O-C 3.48Å; T146-I222 VanDerWaalsContact O-CA 3.29Å; T146-I222 WeakPolarHBondContact O-CA 3.23Å; T146-A223 PolarHBondContact O-N 3.33Å; T146-Y277 HydrophobicContact CG2-CE2 3.98Å; T146-Y277 WeakPolarHBondContact OG1-CE2 3.38Å; T146-Y277 PolarHBondContact OG1-OH 3.06Å; T146-I278 HydrophobicContact CG2-CD1 4.28Å; T146-I278 HydrophobicContact CG2-CG1 4.07Å
147	V	91.1	Very high	82.9	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.055	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.8	168.3	-178.7	0	0	0	0	107.8	V149 C158 K159 I162 V177 A223 P225	V147-V149 HydrophobicContact CG1-CG2 4.33Å; V147-C158 CarbonylContact O-C 3.58Å; V147-C158 WeakPolarHBondContact O-CA 3.47Å; V147-K159 PolarHBondContact N-O 3.21Å; V147-K159 PolarHBondContact O-N 3.33Å; V147-I162 HydrophobicContact CG2-CB 4.16Å; V147-I162 HydrophobicContact CG2-CG1 3.7Å; V147-I162 HydrophobicContact CG2-CG2 4.31Å; V147-V177 HydrophobicContact CG1-CG2 3.64Å; V147-A223 HydrophobicContact CG2-CB 4.39Å; V147-P225 HydrophobicContact CG1-CG 4.46Å; V147-P225 HydrophobicContact CG2-CG 4.29Å
148	C	87.3	Confident	82.5	Confident	30 Å²	30	49.8 Å²	49.8	20%	0.203	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.7	-177.6	-64.2	0	0	0	0	110.9	Y157 C158 I222	C148-Y157 CarbonylContact C-O 3.59Å; C148-Y157 VanDerWaalsContact CA-O 3.3Å; C148-Y157 WeakPolarHBondContact CA-O 3.47Å; C148-C158 HydrophobicContact CB-CB 4.15Å; C148-C158 WeakPolarHBondContact CB-SG 3.46Å; C148-C158 WeakPolarHBondContact SG-CB 3.06Å; C148-C158 CovalentContact SG-SG 2.04Å; C148-C158 PolarHBondContact SG-SG 2.97Å; C148-I222 HydrophobicContact CB-CG2 4.01Å
149	V	78.8	Confident	82.1	Confident	42 Å²	42	51.7 Å²	51.7	26%	0.255	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.7	-178.5	-174.3	0	0	0	0	109.1	V147 K156 Y157 S176 V177	V147-V149 HydrophobicContact CG1-CG2 4.33Å; V149-K156 WeakPolarHBondContact O-CA 3.4Å; V149-Y157 PolarHBondContact N-O 3.47Å; V149-Y157 PolarHBondContact O-N 2.85Å; V149-S176 WeakPolarHBondContact CB-OG 3.45Å; V149-S176 VanDerWaalsContact CG1-CB 3.47Å; V149-S176 WeakPolarHBondContact CG1-OG 3.36Å; V149-S176 WeakPolarHBondContact CG2-OG 3.28Å; V149-V177 HydrophobicContact CG2-CG2 4.43Å
150	Q	76.3	Confident	82	Confident	136 Å²	136	51.7 Å²	51.7	64%	0.636	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	120.7	170.4	-77.1	175.3	-35.2	0	0	109.7	K156	Q150-K156 HydrophobicContact CG-CG 3.7Å
151	A	68	Low	81.9	Confident	37 Å²	37	52 Å²	52	31%	0.306	28%	0.281	S	S	.	.			trans	-75.5	167.7	168.5	0	0	0	0	0	111.2	D153 G154 K155 Y157	A151-D153 PolarHBondContact O-N 3.35Å; A151-G154 PolarHBondContact O-N 3.24Å; A151-K155 PolarHBondContact N-O 3.1Å; A151-Y157 HydrophobicContact CB-CD2 3.61Å; A151-Y157 HydrophobicContact CB-CE2 3.42Å; A151-Y157 VanDerWaalsContact CB-CE2 3.42Å
152	V	65.8	Low	82	Confident	151 Å²	151	51.4 Å²	51.4	92%	0.915	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.1	176.8	-174.8	0	0	0	0	111.8	G154	V152-G154 PolarHBondContact O-N 2.88Å
153	D	62.6	Low	82.2	Confident	131 Å²	131	50.5 Å²	50.5	70%	0.701	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	5	177	-65.2	-9.2	0	0	0	113.8	A151 K155	A151-D153 PolarHBondContact O-N 3.35Å; D153-K155 PolarHBondContact O-N 2.98Å; D153-K155 VanDerWaalsContact O-N 3.12Å
154	G	67.7	Low	82.3	Confident	53 Å²	53	50.7 Å²	50.7	55%	0.546	28%	0.275	S	S	.	.	S	Bend	trans	75.2	-9.7	-175.9	0	0	0	0	0	114.5	A151 V152	A151-G154 PolarHBondContact O-N 3.24Å; V152-G154 PolarHBondContact O-N 2.88Å
155	K	70.6	Confident	82.2	Confident	133 Å²	133	50.2 Å²	50.2	58%	0.578	27%	0.272	S	S	*	.			trans	-70.3	133.8	175.8	-67.8	-176	-178.7	175.5	0	110.8	A151 D153 Y157	A151-K155 PolarHBondContact N-O 3.1Å; D153-K155 PolarHBondContact O-N 2.98Å; D153-K155 VanDerWaalsContact O-N 3.12Å; K155-Y157 HydrophobicContact CB-CE2 3.89Å
156	K	75	Confident	81.9	Confident	132 Å²	132	50.2 Å²	50.2	57%	0.574	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	128.6	171.1	-69.1	-178.6	179	-176.3	0	108.9	V149 Q150 T281	V149-K156 WeakPolarHBondContact O-CA 3.4Å; Q150-K156 HydrophobicContact CG-CG 3.7Å; K156-T281 VanDerWaalsContact O-CG2 3.24Å; K156-T281 WeakPolarHBondContact O-CG2 3.35Å
157	Y	77.9	Confident	81.5	Confident	95 Å²	95	52 Å²	52	37%	0.373	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.2	172.2	-70.1	-86.5	0	0	0	108.7	C148 V149 A151 K155	C148-Y157 CarbonylContact C-O 3.59Å; C148-Y157 VanDerWaalsContact CA-O 3.3Å; C148-Y157 WeakPolarHBondContact CA-O 3.47Å; V149-Y157 PolarHBondContact N-O 3.47Å; V149-Y157 PolarHBondContact O-N 2.85Å; A151-Y157 HydrophobicContact CB-CD2 3.61Å; A151-Y157 HydrophobicContact CB-CE2 3.42Å; A151-Y157 VanDerWaalsContact CB-CE2 3.42Å; K155-Y157 HydrophobicContact CB-CE2 3.89Å
158	C	85.7	Confident	80.4	Confident	14 Å²	14	55.3 Å²	55.3	10%	0.095	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.5	-178.3	-61.8	0	0	0	0	110.5	V147 C148 T281	V147-C158 CarbonylContact O-C 3.58Å; V147-C158 WeakPolarHBondContact O-CA 3.47Å; C148-C158 HydrophobicContact CB-CB 4.15Å; C148-C158 WeakPolarHBondContact CB-SG 3.46Å; C148-C158 WeakPolarHBondContact SG-CB 3.06Å; C148-C158 CovalentContact SG-SG 2.04Å; C148-C158 PolarHBondContact SG-SG 2.97Å; C158-T281 HydrophobicContact CB-CG2 4.27Å
159	K	86.4	Confident	79.3	Confident	50 Å²	50	56.5 Å²	56.5	22%	0.217	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	143.4	174.1	-173.6	-173.9	-166.4	176.1	0	109	E135 T146 V147 S161 D175	E135-K159 VanDerWaalsContact CD-NZ 3.3Å; E135-K159 VanDerWaalsContact OE1-CE 3.29Å; E135-K159 WeakPolarHBondContact OE1-CE 3.3Å; E135-K159 IonicContact OE1-NZ 3.81Å; E135-K159 PolarHBondContact OE1-NZ 3.3Å; E135-K159 VanDerWaalsContact OE2-CE 3.23Å; E135-K159 WeakPolarHBondContact OE2-CE 3.37Å; E135-K159 IonicContact OE2-NZ 3.15Å; E135-K159 PolarHBondContact OE2-NZ 3.33Å; T146-K159 CarbonylContact C-O 3.6Å; T146-K159 WeakPolarHBondContact CA-O 3.21Å; T146-K159 WeakPolarHBondContact CB-O 3.38Å; V147-K159 PolarHBondContact N-O 3.21Å; V147-K159 PolarHBondContact O-N 3.33Å; K159-S161 VanDerWaalsContact C-N 3.26Å; K159-S161 WeakPolarHBondContact CD-OG 3.16Å; K159-S161 WeakPolarHBondContact CE-OG 3.47Å; K159-S161 WeakPolarHBondContact CG-OG 3.25Å; K159-S161 PolarHBondContact O-N 3.4Å; K159-D175 IonicContact NZ-OD1 3.21Å; K159-D175 PolarHBondContact NZ-OD1 3.44Å; K159-D175 IonicContact NZ-OD2 3.87Å; K159-D175 PolarHBondContact NZ-OD2 3.46Å
160	T	89.3	Confident	78.4	Confident	13 Å²	13	56 Å²	56	8%	0.08	31%	0.308	C	S	.	.	S	Bend	trans	-91.3	18.6	179.9	59.6	0	0	0	0	114.2	P144 T146 I278 F539	P144-T160 HydrophobicContact CB-CG2 4.18Å; P144-T160 HydrophobicContact CG-CG2 3.94Å; T146-T160 HydrophobicContact CG2-CG2 3.96Å; T160-I278 HydrophobicContact CG2-CG2 3.62Å; T160-F539 HydrophobicContact CG2-CD2 4.49Å; T160-F539 HydrophobicContact CG2-CE2 3.64Å
161	S	90.2	Very high	77.4	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.042	30%	0.3	C	S	.	.	S	Bend	trans	-136.9	150.6	177.7	57.8	0	0	0	0	110.1	E135 H136 K159	E135-S161 VanDerWaalsContact OE2-CB 3.26Å; E135-S161 WeakPolarHBondContact OE2-CB 3.26Å; E135-S161 PolarHBondContact OE2-OG 2.7Å; H136-S161 CarbonylContact O-C 3.56Å; H136-S161 VanDerWaalsContact O-CA 3.25Å; H136-S161 WeakPolarHBondContact O-CA 3.49Å; K159-S161 VanDerWaalsContact C-N 3.26Å; K159-S161 WeakPolarHBondContact CD-OG 3.16Å; K159-S161 WeakPolarHBondContact CE-OG 3.47Å; K159-S161 WeakPolarHBondContact CG-OG 3.25Å; K159-S161 PolarHBondContact O-N 3.4Å
162	I	92.4	Very high	76.7	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.8	-177.5	-56.2	162.5	0	0	0	107.4	E135 H136 W138 V145 V147 L164 A223 P225	E135-I162 CarbonylContact C-O 3.44Å; E135-I162 VanDerWaalsContact CA-O 3.3Å; E135-I162 WeakPolarHBondContact CA-O 3.47Å; H136-I162 HydrophobicContact CB-CB 4.23Å; H136-I162 PolarHBondContact N-O 3.23Å; H136-I162 PolarHBondContact O-N 3.43Å; W138-I162 HydrophobicContact CD2-CD1 3.7Å; W138-I162 HydrophobicContact CE3-CD1 3.42Å; W138-I162 VanDerWaalsContact CE3-CD1 3.42Å; W138-I162 HydrophobicContact CG-CD1 4.26Å; W138-I162 HydrophobicContact CH2-CD1 4.35Å; W138-I162 HydrophobicContact CZ3-CD1 3.79Å; V145-I162 HydrophobicContact CB-CD1 4.43Å; V145-I162 HydrophobicContact CG1-CD1 3.96Å; V147-I162 HydrophobicContact CG2-CB 4.16Å; V147-I162 HydrophobicContact CG2-CG1 3.7Å; V147-I162 HydrophobicContact CG2-CG2 4.31Å; I162-L164 PolarHBondContact O-N 2.82Å; I162-A223 HydrophobicContact CD1-CB 3.79Å; I162-A223 HydrophobicContact CG1-CB 4.08Å; I162-P225 HydrophobicContact CG2-CB 3.87Å; I162-P225 HydrophobicContact CG2-CG 4.01Å
163	P	91.8	Very high	75.9	Confident	10 Å²	10	57.3 Å²	57.3	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	137.6	177.5	24.3	-31.8	0	0	0	110.7	G165 V177 L191 P225	P163-G165 VanDerWaalsContact C-N 3.31Å; P163-V177 HydrophobicContact CG-CB 4.45Å; P163-V177 HydrophobicContact CG-CG1 4.35Å; P163-L191 HydrophobicContact CB-CD1 4.04Å; P163-L191 HydrophobicContact CG-CD1 3.71Å; P163-L191 VanDerWaalsContact O-CD1 3.31Å; P163-L191 WeakPolarHBondContact O-CD1 3.43Å; P163-P225 HydrophobicContact CG-CG 4.48Å
164	L	92.1	Very high	75.2	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.016	29%	0.291	C	S	.	.	S	Bend	trans	-68.2	-35.2	174.6	174.8	60.1	0	0	0	111.5	L54 F68 F70 A129 I130 Y134 H136 I162 L190 L191	L54-L164 HydrophobicContact CD2-CD2 4.29Å; F68-L164 HydrophobicContact CE1-CD2 4.33Å; F70-L164 HydrophobicContact CE1-CD1 3.62Å; F70-L164 HydrophobicContact CE2-CD1 4.49Å; F70-L164 HydrophobicContact CZ-CD1 3.39Å; F70-L164 HydrophobicContact CZ-CD2 4.28Å; F70-L164 HydrophobicContact CZ-CG 4.5Å; A129-L164 HydrophobicContact CB-CD2 3.88Å; I130-L164 HydrophobicContact CG1-CB 4.5Å; I130-L164 HydrophobicContact CG1-CD2 3.96Å; I130-L164 HydrophobicContact CG1-CG 3.83Å; Y134-L164 WeakPolarHBondContact O-CB 3.41Å; Y134-L164 PolarHBondContact O-N 2.77Å; Y134-L164 VanDerWaalsContact O-N 3.1Å; H136-L164 VanDerWaalsContact NE2-CD1 3.28Å; H136-L164 WeakPolarHBondContact NE2-CD1 3.29Å; I162-L164 PolarHBondContact O-N 2.82Å; L164-L190 HydrophobicContact CD1-CD1 4Å; L164-L190 HydrophobicContact CG-CD1 4.4Å; L164-L191 PolarHBondContact O-N 3.26Å; L164-L191 VanDerWaalsContact O-N 3.12Å
165	G	90.3	Very high	74.5	Confident	4 Å²	4	53.4 Å²	53.4	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	178.4	-176.1	0	0	0	0	0	111.9	P163 I189	P163-G165 VanDerWaalsContact C-N 3.31Å; G165-I189 CarbonylContact C-O 3.42Å; G165-I189 WeakPolarHBondContact CA-O 3.34Å
166	C	87.5	Confident	74.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.7	-179.5	-58.4	0	0	0	0	110.4	C178 L183 I189	C166-C178 VanDerWaalsContact CA-SG 3.51Å; C166-C178 HydrophobicContact CB-CB 3.61Å; C166-C178 WeakPolarHBondContact CB-SG 3.17Å; C166-C178 WeakPolarHBondContact SG-CA 3.46Å; C166-C178 WeakPolarHBondContact SG-CB 3.43Å; C166-C178 CovalentContact SG-SG 2.03Å; C166-C178 PolarHBondContact SG-SG 3.49Å; C166-L183 HydrophobicContact CB-CD1 4.42Å; C166-L183 HydrophobicContact CB-CD2 4.48Å; C166-I189 HydrophobicContact CB-CB 4.29Å; C166-I189 PolarHBondContact N-O 3.05Å; C166-I189 PolarHBondContact O-N 3.47Å
167	F	84.5	Confident	74.1	Confident	39 Å²	39	44.2 Å²	44.2	17%	0.171	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.6	174	-179.3	-108.1	0	0	0	108.7	I130 M131 G169 N170	I130-F167 HydrophobicContact CG2-CB 4.32Å; M131-F167 HydrophobicContact CB-CD1 4.42Å; M131-F167 HydrophobicContact CE-CE2 4.3Å; M131-F167 HydrophobicContact CG-CD1 4.28Å; M131-F167 HydrophobicContact CG-CD2 4.05Å; M131-F167 HydrophobicContact CG-CE1 4.41Å; M131-F167 HydrophobicContact CG-CE2 4.19Å; M131-F167 HydrophobicContact CG-CG 4.1Å; M131-F167 HydrophobicContact CG-CZ 4.37Å; F167-G169 PolarHBondContact O-N 3.31Å; F167-N170 HydrophobicContact CB-CB 4.39Å; F167-N170 WeakPolarHBondContact O-CA 3.48Å; F167-N170 WeakPolarHBondContact O-CB 3.35Å; F167-N170 PolarHBondContact O-N 3.33Å
168	E	69.1	Low	74	Confident	78 Å²	78	40.3 Å²	40.3	36%	0.364	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-53.3	-40.6	-174.1	-170.9	177.3	-169	0	0	112.5	N170 L183 K185 H186	E168-N170 PolarHBondContact O-N 2.83Å; E168-L183 HydrophobicContact CB-CD2 4.48Å; E168-K185 WeakPolarHBondContact OE2-CA 3.4Å; E168-H186 PolarHBondContact OE2-N 3.4Å
169	G	63.2	Low	73.2	Confident	54 Å²	54	43.8 Å²	43.8	56%	0.557	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-76.6	8.6	177.3	0	0	0	0	0	115.7	K58 F167	K58-G169 PolarHBondContact NZ-O 3.34Å; F167-G169 PolarHBondContact O-N 3.31Å
170	N	60.9	Low	72.1	Confident	31 Å²	31	44.6 Å²	44.6	17%	0.166	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-118.9	13.8	-176.9	-140	48.8	0	0	0	112.9	K58 G133 F167 E168 D172	K58-N170 WeakPolarHBondContact CE-OD1 3.47Å; K58-N170 PolarHBondContact NZ-OD1 3.01Å; G133-N170 WeakPolarHBondContact CA-ND2 3.39Å; F167-N170 HydrophobicContact CB-CB 4.39Å; F167-N170 WeakPolarHBondContact O-CA 3.48Å; F167-N170 WeakPolarHBondContact O-CB 3.35Å; F167-N170 PolarHBondContact O-N 3.33Å; E168-N170 PolarHBondContact O-N 2.83Å; N170-D172 PolarHBondContact O-N 3.44Å
171	Q	54.5	Low	71.1	Confident	101 Å²	101	45.5 Å²	45.5	47%	0.472	27%	0.267	S	S	.	.			trans	-72.4	75.9	176.3	-66	-177.6	6.9	0	0	110.6	K173	Q171-K173 PolarHBondContact O-N 3.24Å
172	D	52.8	Low	70	Confident	50 Å²	50	50.6 Å²	50.6	27%	0.267	30%	0.3	S	S	.	.			trans	-54.3	125.5	150.4	-104.1	-20.7	0	0	0	106.4	K57 N170 S174 D175	K57-D172 IonicContact NZ-OD2 3.08Å; K57-D172 PolarHBondContact NZ-OD2 3.23Å; N170-D172 PolarHBondContact O-N 3.44Å; D172-S174 PolarHBondContact O-N 3.15Å; D172-D175 HydrophobicContact CB-CB 4.13Å; D172-D175 PolarHBondContact O-N 3.01Å
173	K	49.2	Very low	68.6	Low	202 Å²	202	52 Å²	52	88%	0.878	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-17.5	177	-72.7	-177	178	179.5	0	112.5	Q171	Q171-K173 PolarHBondContact O-N 3.24Å
174	S	49	Very low	67.4	Low	84 Å²	84	54.4 Å²	54.4	59%	0.587	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-19.6	173.6	56.4	0	0	0	0	115.1	D172 S176	D172-S174 PolarHBondContact O-N 3.15Å; S174-S176 PolarHBondContact O-N 3.48Å
175	D	53.3	Low	66.1	Low	17 Å²	17	62.4 Å²	62.4	9%	0.091	36%	0.363	C	S	.	.			trans	-84.4	68.6	-179.4	-84.9	-1.4	0	0	0	110.4	K159 D172 V177 C178 L179	K159-D175 IonicContact NZ-OD1 3.21Å; K159-D175 PolarHBondContact NZ-OD1 3.44Å; K159-D175 IonicContact NZ-OD2 3.87Å; K159-D175 PolarHBondContact NZ-OD2 3.46Å; D172-D175 HydrophobicContact CB-CB 4.13Å; D172-D175 PolarHBondContact O-N 3.01Å; D175-V177 PolarHBondContact O-N 2.67Å; D175-C178 PolarHBondContact O-N 3Å; D175-L179 PolarHBondContact O-N 2.91Å
176	S	61.8	Low	65.1	Low	40 Å²	40	68.7 Å²	68.7	28%	0.28	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-24	179.7	48.4	0	0	0	0	114.8	V149 S174 C178 L179	V149-S176 WeakPolarHBondContact CB-OG 3.45Å; V149-S176 VanDerWaalsContact CG1-CB 3.47Å; V149-S176 WeakPolarHBondContact CG1-OG 3.36Å; V149-S176 WeakPolarHBondContact CG2-OG 3.28Å; S174-S176 PolarHBondContact O-N 3.48Å; S176-C178 PolarHBondContact O-N 3.49Å; S176-L179 PolarHBondContact O-N 3.39Å
177	V	75	Confident	64.7	Low	33 Å²	33	69.1 Å²	69.1	20%	0.2	40%	0.395	C	S	.	.	H	α-helix	trans	-55.9	-43.4	174.7	179.6	0	0	0	0	110.6	V147 V149 P163 D175 L191 P225	V147-V177 HydrophobicContact CG1-CG2 3.64Å; V149-V177 HydrophobicContact CG2-CG2 4.43Å; P163-V177 HydrophobicContact CG-CB 4.45Å; P163-V177 HydrophobicContact CG-CG1 4.35Å; D175-V177 PolarHBondContact O-N 2.67Å; V177-L191 HydrophobicContact CG1-CD1 4.21Å; V177-P225 HydrophobicContact CG1-CG 3.86Å; V177-P225 HydrophobicContact CG2-CG 4.33Å
178	C	75.9	Confident	64.9	Low	12 Å²	12	67.5 Å²	67.5	8%	0.081	39%	0.388	C	S	.	.	H	α-helix	trans	-84.9	-25.3	-178.3	-65.9	0	0	0	0	113.2	C166 D175 S176 G180 I181	C166-C178 VanDerWaalsContact CA-SG 3.51Å; C166-C178 HydrophobicContact CB-CB 3.61Å; C166-C178 WeakPolarHBondContact CB-SG 3.17Å; C166-C178 WeakPolarHBondContact SG-CA 3.46Å; C166-C178 WeakPolarHBondContact SG-CB 3.43Å; C166-C178 CovalentContact SG-SG 2.03Å; C166-C178 PolarHBondContact SG-SG 3.49Å; D175-C178 PolarHBondContact O-N 3Å; S176-C178 PolarHBondContact O-N 3.49Å; C178-G180 PolarHBondContact O-N 2.94Å; C178-I181 PolarHBondContact O-N 2.63Å
179	L	68.3	Low	65.8	Low	87 Å²	87	63.8 Å²	63.8	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-27.7	179.3	-77.5	160.5	0	0	0	113.1	D175 S176 I181	D175-L179 PolarHBondContact O-N 2.91Å; S176-L179 PolarHBondContact O-N 3.39Å; L179-I181 VanDerWaalsContact C-N 3.3Å; L179-I181 PolarHBondContact O-N 3.39Å
180	G	64.2	Low	67.1	Low	67 Å²	67	61.2 Å²	61.2	69%	0.691	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.5	179.4	0	0	0	0	0	115.2	C178	C178-G180 PolarHBondContact O-N 2.94Å
181	I	67.7	Low	68.5	Low	32 Å²	32	60.6 Å²	60.6	16%	0.164	34%	0.341	C	S	.	.	S	Bend	trans	-103.6	121.1	-174	-51.4	173.5	0	0	0	108.6	C178 L179 L183 I189 L191 P242	C178-I181 PolarHBondContact O-N 2.63Å; L179-I181 VanDerWaalsContact C-N 3.3Å; L179-I181 PolarHBondContact O-N 3.39Å; I181-L183 HydrophobicContact CB-CD1 3.89Å; I181-L183 HydrophobicContact CG2-CD1 3.99Å; I181-L183 WeakPolarHBondContact O-CD1 3.4Å; I181-L183 PolarHBondContact O-N 3.37Å; I181-I189 HydrophobicContact CB-CD1 4.48Å; I181-I189 HydrophobicContact CG2-CD1 3.45Å; I181-I189 VanDerWaalsContact CG2-CD1 3.45Å; I181-L191 HydrophobicContact CD1-CD2 4.45Å; I181-P242 HydrophobicContact CG2-CB 4.01Å; I181-P242 HydrophobicContact CG2-CG 4.11Å
182	P	66.2	Low	70.3	Confident	113 Å²	113	56.1 Å²	56.1	73%	0.734	32%	0.32	S	S	*	.			trans	-67.6	100.6	175	25.8	-31	0	0	0	109.6
183	L	63.9	Low	72.2	Confident	35 Å²	35	54 Å²	54	18%	0.183	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-85.3	127.8	175.4	-89.3	75.5	0	0	0	110.2	C166 E168 I181 I189	C166-L183 HydrophobicContact CB-CD1 4.42Å; C166-L183 HydrophobicContact CB-CD2 4.48Å; E168-L183 HydrophobicContact CB-CD2 4.48Å; I181-L183 HydrophobicContact CB-CD1 3.89Å; I181-L183 HydrophobicContact CG2-CD1 3.99Å; I181-L183 WeakPolarHBondContact O-CD1 3.4Å; I181-L183 PolarHBondContact O-N 3.37Å; L183-I189 HydrophobicContact CD1-CD1 3.54Å; L183-I189 HydrophobicContact CD1-CG1 4.48Å; L183-I189 HydrophobicContact CG-CD1 3.66Å; L183-I189 HydrophobicContact CG-CG1 4.27Å
184	A	65.1	Low	74.4	Confident	61 Å²	61	44.7 Å²	44.7	50%	0.504	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-70	155.3	162.6	0	0	0	0	0	110	H186 S187	A184-H186 PolarHBondContact O-N 2.89Å; A184-S187 PolarHBondContact N-OG 2.91Å; A184-S187 VanDerWaalsContact N-OG 3.11Å; A184-S187 VanDerWaalsContact O-CB 3.29Å; A184-S187 WeakPolarHBondContact O-CB 3.34Å; A184-S187 PolarHBondContact O-N 3.15Å; A184-S187 PolarHBondContact O-OG 2.88Å
185	K	66.3	Low	76.5	Confident	170 Å²	170	42.5 Å²	42.5	74%	0.739	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	130.5	177.9	-79.6	-177.1	176.9	179.6	0	111.2	E168 S187	E168-K185 WeakPolarHBondContact OE2-CA 3.4Å; K185-S187 PolarHBondContact O-N 2.68Å
186	H	68.3	Low	78.6	Confident	136 Å²	136	41.8 Å²	41.8	63%	0.63	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	13.6	-178	-52.1	89.9	0	0	0	115.8	E168 A184	E168-H186 PolarHBondContact OE2-N 3.4Å; A184-H186 PolarHBondContact O-N 2.89Å
187	S	80.3	Confident	80.2	Confident	10 Å²	10	42.5 Å²	42.5	7%	0.07	25%	0.248	C	C	.	.			trans	-76.6	137.4	174.2	64.7	0	0	0	0	111.4	A184 K185	A184-S187 PolarHBondContact N-OG 2.91Å; A184-S187 VanDerWaalsContact N-OG 3.11Å; A184-S187 VanDerWaalsContact O-CB 3.29Å; A184-S187 WeakPolarHBondContact O-CB 3.34Å; A184-S187 PolarHBondContact O-N 3.15Å; A184-S187 PolarHBondContact O-OG 2.88Å; K185-S187 PolarHBondContact O-N 2.68Å
188	T	86.9	Confident	81.2	Confident	4 Å²	4	40.9 Å²	40.9	3%	0.025	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.3	174.5	-57.1	0	0	0	0	108	I130 M131 L245	I130-T188 HydrophobicContact CB-CG2 3.8Å; I130-T188 HydrophobicContact CD1-CG2 3.8Å; I130-T188 HydrophobicContact CG1-CG2 4.42Å; I130-T188 HydrophobicContact CG2-CG2 3.6Å; M131-T188 WeakPolarHBondContact CE-OG1 3.42Å; T188-L245 HydrophobicContact CG2-CD1 4.34Å; T188-L245 WeakPolarHBondContact O-CB 3.17Å; T188-L245 PolarHBondContact O-N 3.07Å
189	I	88.7	Confident	82.1	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131	-177.8	-60.7	-175.7	0	0	0	108.8	G165 C166 I181 L183 S227 P242 I244	G165-I189 CarbonylContact C-O 3.42Å; G165-I189 WeakPolarHBondContact CA-O 3.34Å; C166-I189 HydrophobicContact CB-CB 4.29Å; C166-I189 PolarHBondContact N-O 3.05Å; C166-I189 PolarHBondContact O-N 3.47Å; I181-I189 HydrophobicContact CB-CD1 4.48Å; I181-I189 HydrophobicContact CG2-CD1 3.45Å; I181-I189 VanDerWaalsContact CG2-CD1 3.45Å; L183-I189 HydrophobicContact CD1-CD1 3.54Å; L183-I189 HydrophobicContact CD1-CG1 4.48Å; L183-I189 HydrophobicContact CG-CD1 3.66Å; L183-I189 HydrophobicContact CG-CG1 4.27Å; I189-S227 VanDerWaalsContact CG2-CB 3.48Å; I189-S227 VanDerWaalsContact CG2-OG 3.23Å; I189-S227 WeakPolarHBondContact CG2-OG 3.11Å; I189-P242 HydrophobicContact CD1-CB 4.27Å; I189-P242 HydrophobicContact CG2-CB 4.29Å; I189-I244 HydrophobicContact CG1-CG1 4.3Å
190	L	90.8	Very high	83.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	134.7	175.1	178.9	69.1	0	0	0	110.3	I126 I130 L164 N192 S227 L243 L245 I255 Y257	I126-L190 HydrophobicContact CG2-CD1 4.13Å; I130-L190 HydrophobicContact CD1-CB 4.23Å; I130-L190 HydrophobicContact CD1-CD1 3.89Å; L164-L190 HydrophobicContact CD1-CD1 4Å; L164-L190 HydrophobicContact CG-CD1 4.4Å; L190-N192 HydrophobicContact CD2-CB 4.32Å; L190-N192 HydrophobicContact CG-CB 4.4Å; L190-N192 PolarHBondContact O-N 3.45Å; L190-S227 WeakPolarHBondContact O-CB 3.32Å; L190-S227 PolarHBondContact O-OG 3.41Å; L190-L243 HydrophobicContact CD2-CD2 4.4Å; L190-L243 PolarHBondContact N-O 3.05Å; L190-L245 HydrophobicContact CB-CD1 3.96Å; L190-L245 HydrophobicContact CB-CD2 4.17Å; L190-L245 HydrophobicContact CB-CG 4.06Å; L190-I255 HydrophobicContact CD2-CD1 3.76Å; L190-I255 HydrophobicContact CD2-CG2 3.64Å; L190-Y257 HydrophobicContact CD2-CE1 4.18Å
191	L	91.4	Very high	84.5	Confident	18 Å²	18	36.4 Å²	36.4	9%	0.094	20%	0.195	C	C	.	.			trans	-89.3	88.9	172.5	-63.8	167.8	0	0	0	108.5	P163 L164 V177 I181 P225 S226	P163-L191 HydrophobicContact CB-CD1 4.04Å; P163-L191 HydrophobicContact CG-CD1 3.71Å; P163-L191 VanDerWaalsContact O-CD1 3.31Å; P163-L191 WeakPolarHBondContact O-CD1 3.43Å; L164-L191 PolarHBondContact O-N 3.26Å; L164-L191 VanDerWaalsContact O-N 3.12Å; V177-L191 HydrophobicContact CG1-CD1 4.21Å; I181-L191 HydrophobicContact CD1-CD2 4.45Å; L191-P225 HydrophobicContact CB-CB 4.36Å; L191-P225 HydrophobicContact CD1-CB 4.19Å; L191-P225 HydrophobicContact CD1-CG 4.5Å; L191-S226 CarbonylContact C-O 3.59Å; L191-S226 WeakPolarHBondContact CA-O 3.43Å
192	N	91.7	Very high	85.5	Confident	6 Å²	6	35.9 Å²	35.9	3%	0.032	19%	0.194	C	C	.	.			trans	-94.3	-9.5	-175.6	64.3	-42.9	0	0	0	114	L190 S226 I228 L243 I255 T256 Y257 T258	L190-N192 HydrophobicContact CD2-CB 4.32Å; L190-N192 HydrophobicContact CG-CB 4.4Å; L190-N192 PolarHBondContact O-N 3.45Å; N192-S226 PolarHBondContact N-O 3.31Å; N192-I228 PolarHBondContact ND2-O 3.03Å; N192-I228 PolarHBondContact OD1-N 2.83Å; N192-I228 PolarHBondContact OD1-O 3Å; N192-L243 HydrophobicContact CB-CD2 4.39Å; N192-I255 HydrophobicContact CB-CG2 4.28Å; N192-T256 PolarHBondContact ND2-O 3.01Å; N192-Y257 HydrophobicContact CB-CD1 3.99Å; N192-Y257 HydrophobicContact CB-CE1 4.19Å; N192-Y257 WeakPolarHBondContact O-CA 3.43Å; N192-T258 PolarHBondContact O-N 3.38Å; N192-T258 VanDerWaalsContact O-N 3.15Å
193	H	93.1	Very high	86.1	Confident	6 Å²	6	31.6 Å²	31.6	3%	0.028	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.9	174.8	-176.6	75.7	0	0	0	111.5	S195 P225 S226 I228 C237 T258 S260	H193-S195 PolarHBondContact NE2-OG 2.97Å; H193-S195 VanDerWaalsContact NE2-OG 3.08Å; H193-P225 WeakPolarHBondContact O-CA 3.35Å; H193-S226 PolarHBondContact CD2-OG 3.06Å; H193-S226 VanDerWaalsContact CD2-OG 3.28Å; H193-S226 PolarHBondContact N-O 3.46Å; H193-S226 PolarHBondContact O-N 3.31Å; H193-S226 VanDerWaalsContact O-O 3.13Å; H193-I228 HydrophobicContact CB-CD1 3.52Å; H193-I228 HydrophobicContact CB-CG1 3.85Å; H193-C237 VanDerWaalsContact CE1-SG 3.55Å; H193-T258 WeakPolarHBondContact CA-O 3.34Å; H193-T258 PolarHBondContact ND1-O 3.28Å; H193-T258 PolarHBondContact ND1-OG1 3.38Å; H193-S260 PolarHBondContact CE1-OG 2.86Å; H193-S260 VanDerWaalsContact CE1-OG 3.23Å; H193-S260 PolarHBondContact NE2-OG 3.5Å
194	V	93.8	Very high	86.3	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.2	173.1	66.8	0	0	0	0	111.6	Y97 W138 L196 A223 T258 Y259 S260	Y97-V194 HydrophobicContact CE1-CG1 3.8Å; W138-V194 HydrophobicContact CH2-CB 4.36Å; W138-V194 HydrophobicContact CH2-CG1 3.98Å; W138-V194 HydrophobicContact CH2-CG2 4.34Å; W138-V194 HydrophobicContact CZ3-CB 4.35Å; W138-V194 HydrophobicContact CZ3-CG1 3.97Å; W138-V194 HydrophobicContact CZ3-CG2 3.92Å; V194-L196 HydrophobicContact CG2-CD2 4.09Å; V194-L196 HydrophobicContact CG2-CG 4.43Å; V194-A223 HydrophobicContact CG2-CB 3.88Å; V194-T258 PolarHBondContact N-O 3.36Å; V194-Y259 CarbonylContact O-C 3.5Å; V194-Y259 WeakPolarHBondContact O-CA 3.37Å; V194-Y259 WeakPolarHBondContact O-CB 3.26Å; V194-S260 PolarHBondContact O-N 3.08Å
195	S	94.8	Very high	85.7	Confident	38 Å²	38	40.2 Å²	40.2	27%	0.266	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.4	170.6	-74.5	0	0	0	0	109.7	H193 A223 S224	H193-S195 PolarHBondContact NE2-OG 2.97Å; H193-S195 VanDerWaalsContact NE2-OG 3.08Å; S195-A223 CarbonylContact O-C 3.44Å; S195-A223 WeakPolarHBondContact O-CA 3.49Å; S195-S224 PolarHBondContact N-O 2.69Å; S195-S224 PolarHBondContact O-N 3.23Å
196	L	96.8	Very high	84.8	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.5	177.3	-64	174.9	0	0	0	109.6	L49 I99 M140 V145 V194 V221 A223 S260 V261 T262	L49-L196 HydrophobicContact CD2-CD1 4.31Å; I99-L196 HydrophobicContact CD1-CD1 3.62Å; M140-L196 HydrophobicContact CE-CD1 4.49Å; V145-L196 HydrophobicContact CG1-CD2 4.07Å; V194-L196 HydrophobicContact CG2-CD2 4.09Å; V194-L196 HydrophobicContact CG2-CG 4.43Å; L196-V221 HydrophobicContact CD2-CG1 4.43Å; L196-A223 HydrophobicContact CD2-CB 4.04Å; L196-S260 PolarHBondContact N-O 3.38Å; L196-V261 CarbonylContact O-C 3.58Å; L196-V261 WeakPolarHBondContact O-CA 3.44Å; L196-T262 PolarHBondContact O-N 2.97Å; L196-T262 PolarHBondContact O-OG1 3.16Å
197	H	96.1	Very high	83.9	Confident	55 Å²	55	42.2 Å²	42.2	26%	0.255	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	107.5	176.2	-176.4	-81.3	0	0	0	109	I222 T262 E264	H197-I222 HydrophobicContact CB-CB 4.38Å; H197-I222 PolarHBondContact N-O 3.44Å; H197-I222 PolarHBondContact O-N 2.99Å; H197-T262 WeakPolarHBondContact CA-OG1 3.39Å; H197-T262 PolarHBondContact CD2-OG1 3.47Å; H197-T262 VanDerWaalsContact CD2-OG1 3.24Å; H197-E264 IonicContact CE1-OE2 2.67Å; H197-E264 PolarHBondContact CE1-OE2 3.15Å; H197-E264 IonicContact NE2-OE2 3.13Å
198	I	96	Very high	82.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	111.8	-173.5	-57.9	173.7	0	0	0	108.6	I47 I99 M140 I218 V221 V261 T262 F263 E264	I47-I198 HydrophobicContact CD1-CD1 4.36Å; I99-I198 HydrophobicContact CG2-CD1 3.84Å; M140-I198 HydrophobicContact CE-CD1 4.13Å; M140-I198 HydrophobicContact SD-CD1 3.82Å; M140-I198 HydrophobicContact SD-CG1 4.23Å; I198-I218 HydrophobicContact CG2-CD1 4.33Å; I198-I218 HydrophobicContact CG2-CG1 4.13Å; I198-I218 HydrophobicContact CG2-CG2 4.11Å; I198-V221 HydrophobicContact CG1-CG1 4.3Å; I198-V261 HydrophobicContact CD1-CG1 3.9Å; I198-T262 PolarHBondContact N-O 3.13Å; I198-F263 HydrophobicContact CB-CD1 3.83Å; I198-F263 HydrophobicContact CB-CE1 3.89Å; I198-F263 HydrophobicContact CD1-CD1 4.48Å; I198-F263 HydrophobicContact CD1-CE1 3.73Å; I198-F263 HydrophobicContact CD1-CZ 3.87Å; I198-F263 HydrophobicContact CG1-CE1 4.38Å; I198-F263 HydrophobicContact CG2-CD1 3.97Å; I198-F263 HydrophobicContact CG2-CE1 3.88Å; I198-F263 WeakPolarHBondContact O-CA 3.33Å; I198-E264 PolarHBondContact O-N 3.07Å
199	V	94.5	Very high	80.3	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.7	174.3	-169.9	0	0	0	0	108.9	L219 S220 E264 D266	V199-L219 HydrophobicContact CG1-CD1 4.4Å; V199-L219 WeakPolarHBondContact O-CB 3.37Å; V199-L219 PolarHBondContact O-N 3.26Å; V199-S220 VanDerWaalsContact CB-OG 3.31Å; V199-S220 WeakPolarHBondContact CB-OG 3.45Å; V199-S220 VanDerWaalsContact CG2-OG 3.3Å; V199-S220 WeakPolarHBondContact CG2-OG 3.12Å; V199-S220 PolarHBondContact N-O 3.32Å; V199-S220 PolarHBondContact O-N 3.18Å; V199-E264 CarbonylContact C-O 3.54Å; V199-E264 VanDerWaalsContact CA-O 3.3Å; V199-E264 WeakPolarHBondContact CA-O 3.4Å; V199-E264 HydrophobicContact CG2-CB 4.37Å; V199-D266 HydrophobicContact CG1-CB 3.54Å
200	Y	92.6	Very high	78.3	Confident	22 Å²	22	54.2 Å²	54.2	9%	0.086	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.1	-178.7	69.7	-83.4	0	0	0	112.6	F101 P202 R217 F263 E264 E265 D266	F101-Y200 HydrophobicContact CE2-CD1 4.1Å; F101-Y200 AromaticContact CE2-CD2 3.96Å; F101-Y200 HydrophobicContact CE2-CD2 3.96Å; F101-Y200 HydrophobicContact CE2-CE2 4.35Å; F101-Y200 AromaticContact CE2-CG 3.8Å; F101-Y200 HydrophobicContact CE2-CG 3.8Å; F101-Y200 HydrophobicContact CZ-CD1 4.34Å; F101-Y200 AromaticContact CZ-CD2 3.64Å; F101-Y200 HydrophobicContact CZ-CD2 3.64Å; F101-Y200 HydrophobicContact CZ-CE1 4.4Å; F101-Y200 AromaticContact CZ-CE2 3.68Å; F101-Y200 HydrophobicContact CZ-CE2 3.68Å; F101-Y200 AromaticContact CZ-CG 3.97Å; F101-Y200 HydrophobicContact CZ-CG 3.97Å; Y200-P202 HydrophobicContact CE2-CB 4.49Å; Y200-R217 CarbonylContact C-O 3.56Å; Y200-R217 VanDerWaalsContact CA-O 3.28Å; Y200-R217 WeakPolarHBondContact CA-O 3.2Å; Y200-R217 WeakPolarHBondContact CB-O 3.44Å; Y200-F263 HydrophobicContact CD1-CB 4.42Å; Y200-F263 HydrophobicContact CD1-CD1 4.28Å; Y200-F263 HydrophobicContact CE1-CB 4Å; Y200-F263 HydrophobicContact CE1-CD1 4.49Å; Y200-E264 VanDerWaalsContact CD1-O 3.23Å; Y200-E264 WeakPolarHBondContact CD1-O 3.39Å; Y200-E264 PolarHBondContact N-O 3.01Å; Y200-E265 HydrophobicContact CE1-CB 4.2Å; Y200-E265 HydrophobicContact CE2-CB 4.14Å; Y200-D266 PolarHBondContact O-N 3.35Å
201	H	90.6	Very high	76.3	Confident	46 Å²	46	57.1 Å²	57.1	21%	0.213	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.7	171.3	-171.4	73.8	0	0	0	109.5	G216 R217 L219 D266 R269	H201-G216 CarbonylContact O-C 3.59Å; H201-G216 VanDerWaalsContact O-CA 3.32Å; H201-G216 WeakPolarHBondContact O-CA 3.29Å; H201-R217 PolarHBondContact N-O 3.25Å; H201-R217 PolarHBondContact O-N 3.14Å; H201-L219 HydrophobicContact CB-CD1 3.94Å; H201-L219 HydrophobicContact CB-CD2 4.04Å; H201-L219 HydrophobicContact CB-CG 4.01Å; H201-D266 PolarHBondContact ND1-O 3.38Å; H201-R269 PolarHBondContact ND1-O 2.92Å
202	P	86.8	Confident	74.5	Confident	21 Å²	21	64.1 Å²	64.1	14%	0.136	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	133.1	178.5	29.5	-34.2	0	0	0	110.7	Y200 A215 L267	Y200-P202 HydrophobicContact CE2-CB 4.49Å; P202-A215 CarbonylContact C-O 3.56Å; P202-A215 WeakPolarHBondContact CA-O 3.47Å; P202-L267 HydrophobicContact CG-CD2 3.34Å; P202-L267 HydrophobicContact CG-CG 4.21Å
203	V	80	Confident	72.9	Confident	22 Å²	22	67.3 Å²	67.3	13%	0.133	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.5	174.3	-176.9	0	0	0	0	107.9	D205 A215 R217	V203-D205 WeakPolarHBondContact CG1-OD1 3.48Å; V203-D205 PolarHBondContact O-N 3.05Å; V203-A215 HydrophobicContact CB-CB 4.19Å; V203-A215 PolarHBondContact N-O 2.93Å; V203-R217 HydrophobicContact CG2-CG 3.69Å
204	K	68.1	Low	71.8	Confident	195 Å²	195	72.6 Å²	72.6	85%	0.848	40%	0.403	S	S	*	.			trans	-82.6	85.2	167.9	-62.9	-175.5	-177.1	-178.1	0	107.8	S206	K204-S206 PolarHBondContact O-N 3.37Å
205	D	53	Low	71.3	Confident	82 Å²	82	72.5 Å²	72.5	44%	0.439	40%	0.403	S	S	.	.			trans	-72.7	115.4	172.7	-87.2	-20.4	0	0	0	109.4	V203 W207	V203-D205 WeakPolarHBondContact CG1-OD1 3.48Å; V203-D205 PolarHBondContact O-N 3.05Å; D205-W207 PolarHBondContact O-N 2.82Å
206	S	46.4	Very low	71	Confident	112 Å²	112	70.7 Å²	70.7	78%	0.783	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-6.6	168.7	50.2	0	0	0	0	113.4	K204	K204-S206 PolarHBondContact O-N 3.37Å
207	W	49.1	Very low	70.7	Confident	236 Å²	236	74 Å²	74	89%	0.894	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-11.6	-176.1	-72	70.1	0	0	0	113.9	D205 S209	D205-W207 PolarHBondContact O-N 2.82Å; W207-S209 PolarHBondContact O-N 3.28Å
208	S	44.3	Very low	70.5	Confident	57 Å²	57	71.4 Å²	71.4	40%	0.399	39%	0.391	S	S	.	.			trans	-84.3	102.7	168.1	-171.3	0	0	0	0	108.5	S210	S208-S210 PolarHBondContact O-N 2.75Å; S208-S210 VanDerWaalsContact O-N 3.12Å; S208-S210 PolarHBondContact OG-N 2.72Å; S208-S210 PolarHBondContact OG-O 3.45Å
209	S	48.2	Very low	70.3	Confident	132 Å²	132	71.4 Å²	71.4	92%	0.923	39%	0.391	S	S	*	.	S	Bend	trans	-59.7	-14.6	168.6	-59.5	0	0	0	0	112.3	W207 G211	W207-S209 PolarHBondContact O-N 3.28Å; S209-G211 PolarHBondContact O-N 2.69Å; S209-G211 VanDerWaalsContact O-N 3.15Å
210	S	46.8	Very low	70.1	Confident	78 Å²	78	71.3 Å²	71.3	55%	0.545	39%	0.39	S	S	.	.	S	Bend	trans	-79.9	88.1	168.9	-51.8	0	0	0	0	109.4	S208 N212	S208-S210 PolarHBondContact O-N 2.75Å; S208-S210 VanDerWaalsContact O-N 3.12Å; S208-S210 PolarHBondContact OG-N 2.72Å; S208-S210 PolarHBondContact OG-O 3.45Å; S210-N212 PolarHBondContact O-N 3.36Å
211	G	47.8	Very low	70.2	Confident	62 Å²	62	70.3 Å²	70.3	64%	0.639	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	138	171.3	0	0	0	0	0	111.7	S209	S209-G211 PolarHBondContact O-N 2.69Å; S209-G211 VanDerWaalsContact O-N 3.15Å
212	N	53.8	Low	70.4	Confident	164 Å²	164	70 Å²	70	88%	0.877	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	2.5	170.9	-54.3	-19.6	0	0	0	119.5	S210 K214	S210-N212 PolarHBondContact O-N 3.36Å; N212-K214 PolarHBondContact O-N 2.74Å
213	V	58.5	Low	70.8	Confident	74 Å²	74	69 Å²	69	45%	0.448	38%	0.379	S	S	.	.			trans	-73.5	99.1	168.7	-172.3	0	0	0	0	108.9	C33 A215	C33-V213 HydrophobicContact CB-CG1 3.86Å; V213-A215 VanDerWaalsContact C-N 3.31Å; V213-A215 PolarHBondContact O-N 3.01Å
214	K	70.9	Confident	71.4	Confident	116 Å²	116	71 Å²	71	50%	0.504	40%	0.395	S	S	.	.			trans	-66.4	89.3	171.6	-73.6	-170.3	173	-164.6	0	108.7	P34 F101 N212 E265	P34-K214 WeakPolarHBondContact CD-O 3.45Å; F101-K214 WeakPolarHBondContact CE1-O 3.36Å; N212-K214 PolarHBondContact O-N 2.74Å; K214-E265 IonicContact NZ-OE2 3.1Å; K214-E265 PolarHBondContact NZ-OE2 3.42Å
215	A	82	Confident	72.5	Confident	5 Å²	5	62.5 Å²	62.5	4%	0.041	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	148	166.8	0	0	0	0	0	109.5	Y32 P202 V203 V213	Y32-A215 CarbonylContact O-C 3.58Å; Y32-A215 VanDerWaalsContact O-CA 3.22Å; Y32-A215 WeakPolarHBondContact O-CA 3.33Å; P202-A215 CarbonylContact C-O 3.56Å; P202-A215 WeakPolarHBondContact CA-O 3.47Å; V203-A215 HydrophobicContact CB-CB 4.19Å; V203-A215 PolarHBondContact N-O 2.93Å; V213-A215 VanDerWaalsContact C-N 3.31Å; V213-A215 PolarHBondContact O-N 3.01Å
216	G	88.2	Confident	74.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	149.4	179.1	0	0	0	0	0	112.5	Y32 H201	Y32-G216 PolarHBondContact N-O 3.24Å; Y32-G216 PolarHBondContact O-N 3.01Å; H201-G216 CarbonylContact O-C 3.59Å; H201-G216 VanDerWaalsContact O-CA 3.32Å; H201-G216 WeakPolarHBondContact O-CA 3.29Å
217	R	90.7	Very high	76.4	Confident	71 Å²	71	55.7 Å²	55.7	27%	0.268	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.6	170.4	-66.1	174.9	177.4	174.3	1.7	109.4	P29 N31 Y200 H201 V203 L219 W271	P29-R217 HydrophobicContact CB-CG 4.4Å; N31-R217 PolarHBondContact OD1-NE 3.08Å; N31-R217 PolarHBondContact OD1-NH2 3.31Å; Y200-R217 CarbonylContact C-O 3.56Å; Y200-R217 VanDerWaalsContact CA-O 3.28Å; Y200-R217 WeakPolarHBondContact CA-O 3.2Å; Y200-R217 WeakPolarHBondContact CB-O 3.44Å; H201-R217 PolarHBondContact N-O 3.25Å; H201-R217 PolarHBondContact O-N 3.14Å; V203-R217 HydrophobicContact CG2-CG 3.69Å; R217-L219 PolarHBondContact O-N 3.06Å; R217-W271 HydrophobicContact CB-CB 4.28Å; R217-W271 VanDerWaalsContact CB-CD1 3.47Å; R217-W271 HydrophobicContact CB-CG 4Å
218	I	92.4	Very high	78.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	129.4	-174.4	-61.3	174	0	0	0	110.4	Y32 I47 M140 D141 L143 I198 V221 W271	Y32-I218 HydrophobicContact CD2-CD1 4.01Å; Y32-I218 HydrophobicContact CD2-CG1 4.04Å; Y32-I218 HydrophobicContact CE2-CD1 3.72Å; Y32-I218 HydrophobicContact CE2-CG1 4.09Å; I47-I218 HydrophobicContact CD1-CD1 3.99Å; I47-I218 HydrophobicContact CG1-CD1 4.26Å; I47-I218 HydrophobicContact CG2-CD1 3.83Å; M140-I218 HydrophobicContact CG-CD1 4.42Å; M140-I218 HydrophobicContact SD-CD1 4.32Å; D141-I218 HydrophobicContact CB-CB 4.35Å; D141-I218 HydrophobicContact CB-CD1 4.05Å; L143-I218 HydrophobicContact CD1-CG2 4.43Å; I198-I218 HydrophobicContact CG2-CD1 4.33Å; I198-I218 HydrophobicContact CG2-CG1 4.13Å; I198-I218 HydrophobicContact CG2-CG2 4.11Å; I218-V221 HydrophobicContact CG2-CG2 3.74Å; I218-W271 PolarHBondContact O-NE1 3.46Å
219	L	90.8	Very high	80.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-47.3	179.1	-65.8	178.6	0	0	0	112.2	L143 V199 H201 R217 D266 R269 W271 R274	L143-L219 WeakPolarHBondContact CD1-O 3.23Å; V199-L219 HydrophobicContact CG1-CD1 4.4Å; V199-L219 WeakPolarHBondContact O-CB 3.37Å; V199-L219 PolarHBondContact O-N 3.26Å; H201-L219 HydrophobicContact CB-CD1 3.94Å; H201-L219 HydrophobicContact CB-CD2 4.04Å; H201-L219 HydrophobicContact CB-CG 4.01Å; R217-L219 PolarHBondContact O-N 3.06Å; L219-D266 HydrophobicContact CD1-CB 3.97Å; L219-R269 HydrophobicContact CD1-CB 3.92Å; L219-W271 VanDerWaalsContact CD2-CA 3.47Å; L219-W271 HydrophobicContact CD2-CB 4.23Å; L219-R274 HydrophobicContact CD2-CB 4.49Å; L219-R274 WeakPolarHBondContact O-CB 3.48Å
220	S	92.2	Very high	82.1	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	146.3	-179.1	53	0	0	0	0	111.1	V199 R269 Y277	V199-S220 VanDerWaalsContact CB-OG 3.31Å; V199-S220 WeakPolarHBondContact CB-OG 3.45Å; V199-S220 VanDerWaalsContact CG2-OG 3.3Å; V199-S220 WeakPolarHBondContact CG2-OG 3.12Å; V199-S220 PolarHBondContact N-O 3.32Å; V199-S220 PolarHBondContact O-N 3.18Å; S220-R269 PolarHBondContact OG-NH2 2.97Å; S220-Y277 VanDerWaalsContact CB-CE1 3.47Å
221	V	94.6	Very high	83.4	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	109	176.4	-169.7	0	0	0	0	107.7	M140 V145 T146 L196 I198 I218	M140-V221 HydrophobicContact CB-CG2 4.09Å; M140-V221 HydrophobicContact CE-CG1 4.34Å; M140-V221 HydrophobicContact CG-CG2 4.2Å; M140-V221 HydrophobicContact SD-CB 4.46Å; M140-V221 HydrophobicContact SD-CG1 3.91Å; M140-V221 HydrophobicContact SD-CG2 3.7Å; V145-V221 HydrophobicContact CB-CG1 4.48Å; V145-V221 HydrophobicContact CG1-CG1 4.11Å; V145-V221 HydrophobicContact CG2-CB 4.33Å; V145-V221 HydrophobicContact CG2-CG1 3.93Å; T146-V221 PolarHBondContact N-O 3.29Å; T146-V221 PolarHBondContact OG1-O 3.32Å; L196-V221 HydrophobicContact CD2-CG1 4.43Å; I198-V221 HydrophobicContact CG1-CG1 4.3Å; I218-V221 HydrophobicContact CG2-CG2 3.74Å
222	I	94.5	Very high	84.3	Confident	39 Å²	39	41.7 Å²	41.7	20%	0.2	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	118.7	-176	-57	172.3	0	0	0	108.1	T146 C148 H197	T146-I222 CarbonylContact O-C 3.48Å; T146-I222 VanDerWaalsContact O-CA 3.29Å; T146-I222 WeakPolarHBondContact O-CA 3.23Å; C148-I222 HydrophobicContact CB-CG2 4.01Å; H197-I222 HydrophobicContact CB-CB 4.38Å; H197-I222 PolarHBondContact N-O 3.44Å; H197-I222 PolarHBondContact O-N 2.99Å
223	A	94.8	Very high	84.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.5	171.7	0	0	0	0	0	110.3	V145 T146 V147 I162 V194 S195 L196 P225	V145-A223 HydrophobicContact CG1-CB 3.52Å; T146-A223 PolarHBondContact O-N 3.33Å; V147-A223 HydrophobicContact CG2-CB 4.39Å; I162-A223 HydrophobicContact CD1-CB 3.79Å; I162-A223 HydrophobicContact CG1-CB 4.08Å; V194-A223 HydrophobicContact CG2-CB 3.88Å; S195-A223 CarbonylContact O-C 3.44Å; S195-A223 WeakPolarHBondContact O-CA 3.49Å; L196-A223 HydrophobicContact CD2-CB 4.04Å; A223-P225 WeakPolarHBondContact O-CD 3.39Å
224	S	92.6	Very high	85.3	Confident	66 Å²	66	40.9 Å²	40.9	46%	0.462	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	91.8	167.2	-60.9	0	0	0	0	108.2	S195	S195-S224 PolarHBondContact N-O 2.69Å; S195-S224 PolarHBondContact O-N 3.23Å
225	P	92.2	Very high	85.4	Confident	15 Å²	15	38.4 Å²	38.4	10%	0.097	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	143.6	178.1	31.9	-36.3	0	0	0	110.7	V147 I162 P163 V177 L191 H193 A223	V147-P225 HydrophobicContact CG1-CG 4.46Å; V147-P225 HydrophobicContact CG2-CG 4.29Å; I162-P225 HydrophobicContact CG2-CB 3.87Å; I162-P225 HydrophobicContact CG2-CG 4.01Å; P163-P225 HydrophobicContact CG-CG 4.48Å; V177-P225 HydrophobicContact CG1-CG 3.86Å; V177-P225 HydrophobicContact CG2-CG 4.33Å; L191-P225 HydrophobicContact CB-CB 4.36Å; L191-P225 HydrophobicContact CD1-CB 4.19Å; L191-P225 HydrophobicContact CD1-CG 4.5Å; H193-P225 WeakPolarHBondContact O-CA 3.35Å; A223-P225 WeakPolarHBondContact O-CD 3.39Å
226	S	89.5	Confident	85.3	Confident	40 Å²	40	41 Å²	41	28%	0.28	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	162.3	176.5	58.7	0	0	0	0	111.1	L191 N192 H193	L191-S226 CarbonylContact C-O 3.59Å; L191-S226 WeakPolarHBondContact CA-O 3.43Å; N192-S226 PolarHBondContact N-O 3.31Å; H193-S226 PolarHBondContact CD2-OG 3.06Å; H193-S226 VanDerWaalsContact CD2-OG 3.28Å; H193-S226 PolarHBondContact N-O 3.46Å; H193-S226 PolarHBondContact O-N 3.31Å; H193-S226 VanDerWaalsContact O-O 3.13Å
227	S	90.4	Very high	85	Confident	11 Å²	11	42.8 Å²	42.8	8%	0.077	25%	0.253	C	S	.	.			trans	-108.2	123.9	177	-170.5	0	0	0	0	109.1	I189 L190 L243	I189-S227 VanDerWaalsContact CG2-CB 3.48Å; I189-S227 VanDerWaalsContact CG2-OG 3.23Å; I189-S227 WeakPolarHBondContact CG2-OG 3.11Å; L190-S227 WeakPolarHBondContact O-CB 3.32Å; L190-S227 PolarHBondContact O-OG 3.41Å; S227-L243 PolarHBondContact OG-N 2.87Å
228	I	88.9	Confident	84.5	Confident	9 Å²	9	44.7 Å²	44.7	5%	0.046	27%	0.273	C	S	.	.			trans	-131.7	117.9	-176.6	-52.7	-178.7	0	0	0	109.3	N192 H193 H230 D236 C237	N192-I228 PolarHBondContact ND2-O 3.03Å; N192-I228 PolarHBondContact OD1-N 2.83Å; N192-I228 PolarHBondContact OD1-O 3Å; H193-I228 HydrophobicContact CB-CD1 3.52Å; H193-I228 HydrophobicContact CB-CG1 3.85Å; I228-H230 VanDerWaalsContact C-N 3.34Å; I228-H230 VanDerWaalsContact CG2-CE1 3.45Å; I228-H230 WeakPolarHBondContact CG2-CE1 3.46Å; I228-H230 PolarHBondContact O-N 3.13Å; I228-D236 WeakPolarHBondContact CG2-O 3.3Å; I228-C237 HydrophobicContact CD1-CB 3.83Å
229	A	86.6	Confident	83.7	Confident	27 Å²	27	47.3 Å²	47.3	22%	0.223	29%	0.287	C	S	.	.			trans	-77.5	82.7	170.7	0	0	0	0	0	110	L239 Q241	A229-L239 VanDerWaalsContact O-CD2 3.23Å; A229-L239 WeakPolarHBondContact O-CD2 3.39Å; A229-Q241 HydrophobicContact CB-CB 4.44Å; A229-Q241 PolarHBondContact N-O 3.15Å
230	H	85.4	Confident	82.9	Confident	23 Å²	23	57.1 Å²	57.1	11%	0.106	33%	0.329	C	S	.	.			trans	-63.8	133.6	177.3	-65.8	-60.3	0	0	0	111.3	I228 D236 T256 T258	I228-H230 VanDerWaalsContact C-N 3.34Å; I228-H230 VanDerWaalsContact CG2-CE1 3.45Å; I228-H230 WeakPolarHBondContact CG2-CE1 3.46Å; I228-H230 PolarHBondContact O-N 3.13Å; H230-D236 PolarHBondContact ND1-N 2.97Å; H230-D236 PolarHBondContact ND1-O 3.23Å; H230-D236 VanDerWaalsContact ND1-O 3.13Å; H230-T256 PolarHBondContact CD2-O 3.5Å; H230-T258 PolarHBondContact CE1-OG1 3.44Å; H230-T258 VanDerWaalsContact NE2-CG2 3.27Å; H230-T258 WeakPolarHBondContact NE2-CG2 3.29Å; H230-T258 PolarHBondContact NE2-OG1 3.34Å
231	P	75.9	Confident	82.5	Confident	68 Å²	68	62.8 Å²	62.8	44%	0.442	36%	0.356	S	S	.	.			trans	-69.6	146.6	175	25.4	-28.5	0	0	0	110.9	N233 A234	P231-N233 PolarHBondContact O-N 2.95Å; P231-A234 VanDerWaalsContact CD-O 3.31Å; P231-A234 WeakPolarHBondContact CD-O 3.09Å; P231-A234 VanDerWaalsContact CG-O 3.26Å; P231-A234 WeakPolarHBondContact CG-O 3.22Å; P231-A234 PolarHBondContact O-N 3.38Å
232	N	66.2	Low	82	Confident	144 Å²	144	64.7 Å²	64.7	77%	0.77	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-16.6	-170.4	-77.7	-17	0	0	0	116
233	N	62	Low	81.6	Confident	166 Å²	166	63.7 Å²	63.7	89%	0.888	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-15.7	-172.9	-66.8	-14.9	0	0	0	115	P231	P231-N233 PolarHBondContact O-N 2.95Å
234	A	70.7	Confident	81.3	Confident	55 Å²	55	67.8 Å²	67.8	46%	0.455	38%	0.384	S	S	.	.	S	Bend	trans	-155	125.8	-178.7	0	0	0	0	0	111.5	P231 D236	P231-A234 VanDerWaalsContact CD-O 3.31Å; P231-A234 WeakPolarHBondContact CD-O 3.09Å; P231-A234 VanDerWaalsContact CG-O 3.26Å; P231-A234 WeakPolarHBondContact CG-O 3.22Å; P231-A234 PolarHBondContact O-N 3.38Å; A234-D236 PolarHBondContact O-N 3.1Å
235	P	73.8	Confident	81	Confident	65 Å²	65	64.8 Å²	64.8	42%	0.422	36%	0.363	S	S	.	.			trans	-67.8	107.4	173.6	30.7	-36	0	0	0	109.6	V109 T258	V109-P235 HydrophobicContact CG2-CB 3.51Å; V109-P235 HydrophobicContact CG2-CG 3.43Å; V109-P235 VanDerWaalsContact CG2-CG 3.43Å; P235-T258 HydrophobicContact CB-CG2 4.2Å
236	D	79.3	Confident	80.7	Confident	59 Å²	59	66.5 Å²	66.5	32%	0.316	37%	0.374	S	S	.	.			trans	-115.1	116.9	173.5	-174.8	3.6	0	0	0	109.7	I228 H230 A234 T238	I228-D236 WeakPolarHBondContact CG2-O 3.3Å; H230-D236 PolarHBondContact ND1-N 2.97Å; H230-D236 PolarHBondContact ND1-O 3.23Å; H230-D236 VanDerWaalsContact ND1-O 3.13Å; A234-D236 PolarHBondContact O-N 3.1Å; D236-T238 VanDerWaalsContact OD1-CB 3.3Å; D236-T238 WeakPolarHBondContact OD1-CB 3.28Å; D236-T238 WeakPolarHBondContact OD1-CG2 3.45Å; D236-T238 PolarHBondContact OD1-N 3.46Å; D236-T238 PolarHBondContact OD1-OG1 3.02Å; D236-T238 PolarHBondContact OD2-OG1 3.35Å; D236-T238 VanDerWaalsContact OD2-OG1 3.06Å
237	C	82.2	Confident	80.1	Confident	37 Å²	37	68.8 Å²	68.8	25%	0.25	39%	0.39	C	S	.	.	S	Bend	trans	-93.2	-1.3	176.2	-65.7	0	0	0	0	113	C107 H193 I228 L239	C107-C237 VanDerWaalsContact CA-SG 3.51Å; C107-C237 HydrophobicContact CB-CB 3.59Å; C107-C237 WeakPolarHBondContact CB-SG 3.41Å; C107-C237 WeakPolarHBondContact SG-CB 3.47Å; C107-C237 PolarHBondContact SG-N 2.95Å; C107-C237 CovalentContact SG-SG 2.02Å; C107-C237 PolarHBondContact SG-SG 3.29Å; H193-C237 VanDerWaalsContact CE1-SG 3.55Å; I228-C237 HydrophobicContact CD1-CB 3.83Å; C237-L239 VanDerWaalsContact C-N 3.3Å
238	T	80.6	Confident	79.5	Confident	111 Å²	111	73.6 Å²	73.6	68%	0.681	42%	0.415	S	S	*	.	S	Bend	trans	-77.2	-22.9	174.1	70.8	0	0	0	0	111.7	D236 K240	D236-T238 VanDerWaalsContact OD1-CB 3.3Å; D236-T238 WeakPolarHBondContact OD1-CB 3.28Å; D236-T238 WeakPolarHBondContact OD1-CG2 3.45Å; D236-T238 PolarHBondContact OD1-N 3.46Å; D236-T238 PolarHBondContact OD1-OG1 3.02Å; D236-T238 PolarHBondContact OD2-OG1 3.35Å; D236-T238 VanDerWaalsContact OD2-OG1 3.06Å; T238-K240 PolarHBondContact O-N 3.4Å
239	L	75.2	Confident	79.1	Confident	56 Å²	56	73.4 Å²	73.4	29%	0.293	41%	0.414	S	S	.	.			trans	-67.6	117.5	174.8	-158.8	88.8	0	0	0	110.5	A229 C237 Q241	A229-L239 VanDerWaalsContact O-CD2 3.23Å; A229-L239 WeakPolarHBondContact O-CD2 3.39Å; C237-L239 VanDerWaalsContact C-N 3.3Å; L239-Q241 VanDerWaalsContact C-N 3.28Å; L239-Q241 HydrophobicContact CD2-CB 3.85Å; L239-Q241 HydrophobicContact CD2-CG 4.17Å; L239-Q241 HydrophobicContact CG-CB 4.19Å; L239-Q241 HydrophobicContact CG-CG 4.17Å; L239-Q241 PolarHBondContact O-N 3.17Å
240	K	73.7	Confident	78.6	Confident	205 Å²	205	80.2 Å²	80.2	89%	0.891	44%	0.438	S	S	*	.			trans	-88.7	15.7	179.4	-61.9	-172.8	179.5	-178.6	0	114	T238	T238-K240 PolarHBondContact O-N 3.4Å
241	Q	84	Confident	78.3	Confident	123 Å²	123	85.7 Å²	85.7	58%	0.575	47%	0.468	S	S	*	.			trans	-83.2	125.5	-179.7	-66.7	-178.4	-9.2	0	0	110.1	A229 L239	A229-Q241 HydrophobicContact CB-CB 4.44Å; A229-Q241 PolarHBondContact N-O 3.15Å; L239-Q241 VanDerWaalsContact C-N 3.28Å; L239-Q241 HydrophobicContact CD2-CB 3.85Å; L239-Q241 HydrophobicContact CD2-CG 4.17Å; L239-Q241 HydrophobicContact CG-CB 4.19Å; L239-Q241 HydrophobicContact CG-CG 4.17Å; L239-Q241 PolarHBondContact O-N 3.17Å
242	P	84.7	Confident	78.8	Confident	39 Å²	39	89.4 Å²	89.4	25%	0.253	48%	0.48	S	S	.	.			trans	-73.1	144.7	-179.4	29.7	-34.2	0	0	0	111.9	I181 I189 I244	I181-P242 HydrophobicContact CG2-CB 4.01Å; I181-P242 HydrophobicContact CG2-CG 4.11Å; I189-P242 HydrophobicContact CD1-CB 4.27Å; I189-P242 HydrophobicContact CG2-CB 4.29Å; P242-I244 PolarHBondContact O-N 2.93Å
243	L	86.1	Confident	79.7	Confident	19 Å²	19	84 Å²	84	10%	0.099	45%	0.451	C	S	.	.			trans	-77.7	98.1	172	179.8	66.3	0	0	0	109.9	L190 N192 S227 L245 I255	L190-L243 HydrophobicContact CD2-CD2 4.4Å; L190-L243 PolarHBondContact N-O 3.05Å; N192-L243 HydrophobicContact CB-CD2 4.39Å; S227-L243 PolarHBondContact OG-N 2.87Å; L243-L245 HydrophobicContact CD2-CD2 4.48Å; L243-L245 HydrophobicContact CG-CD2 4.39Å; L243-I255 HydrophobicContact CD2-CG1 4.25Å; L243-I255 HydrophobicContact CD2-CG2 3.91Å
244	I	86.5	Confident	81	Confident	85 Å²	85	78 Å²	78	44%	0.436	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.2	174.6	-58.7	171	0	0	0	109	I189 P242 P246	I189-I244 HydrophobicContact CG1-CG1 4.3Å; P242-I244 PolarHBondContact O-N 2.93Å; I244-P246 WeakPolarHBondContact O-CD 3.35Å
245	L	87.7	Confident	81.9	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.021	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	119.1	175.5	-63.4	-169.5	0	0	0	109.9	Y123 T127 I130 T188 L190 L243 L253 I255	Y123-L245 HydrophobicContact CE2-CB 4.46Å; Y123-L245 HydrophobicContact CE2-CD1 4.42Å; Y123-L245 HydrophobicContact CE2-CD2 4.23Å; Y123-L245 WeakPolarHBondContact OH-CB 3.41Å; T127-L245 HydrophobicContact CG2-CB 4.23Å; T127-L245 HydrophobicContact CG2-CD1 3.68Å; I130-L245 HydrophobicContact CD1-CD1 3.87Å; T188-L245 HydrophobicContact CG2-CD1 4.34Å; T188-L245 WeakPolarHBondContact O-CB 3.17Å; T188-L245 PolarHBondContact O-N 3.07Å; L190-L245 HydrophobicContact CB-CD1 3.96Å; L190-L245 HydrophobicContact CB-CD2 4.17Å; L190-L245 HydrophobicContact CB-CG 4.06Å; L243-L245 HydrophobicContact CD2-CD2 4.48Å; L243-L245 HydrophobicContact CG-CD2 4.39Å; L245-L253 HydrophobicContact CD2-CD2 3.99Å; L245-I255 HydrophobicContact CD2-CD1 3.78Å
246	P	84.8	Confident	82.7	Confident	51 Å²	51	73.4 Å²	73.4	33%	0.331	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-65.9	138.3	177.9	27	-34.6	0	0	0	111.6	Y123 I244 D248 L249	Y123-P246 WeakPolarHBondContact OH-CD 3.39Å; Y123-P246 PolarHBondContact OH-O 2.96Å; I244-P246 WeakPolarHBondContact O-CD 3.35Å; P246-D248 VanDerWaalsContact C-N 3.33Å; P246-D248 PolarHBondContact O-N 2.91Å; P246-L249 HydrophobicContact CG-CD1 4.42Å
247	S	77.4	Confident	83.3	Confident	87 Å²	87	71.4 Å²	71.4	61%	0.608	37%	0.373	S	S	*	.	S	Bend	trans	-61.5	-42.6	178.5	-51	0	0	0	0	112
248	D	77.7	Confident	83.8	Confident	112 Å²	112	69.7 Å²	69.7	60%	0.599	36%	0.362	S	S	*	.	S	Bend	trans	-111.6	118.5	173.3	-68	-37.1	0	0	0	109.8	P246 K250	P246-D248 VanDerWaalsContact C-N 3.33Å; P246-D248 PolarHBondContact O-N 2.91Å; D248-K250 PolarHBondContact O-N 3.28Å
249	L	80.3	Confident	84.5	Confident	6 Å²	6	64.5 Å²	64.5	3%	0.031	33%	0.33	C	S	.	.			trans	-77.8	88.4	176.9	-170.3	77.7	0	0	0	109.6	H117 Y120 Y123 P246 D251 L253	H117-L249 PolarHBondContact CE1-O 3.41Å; Y120-L249 HydrophobicContact CD2-CB 3.96Å; Y120-L249 HydrophobicContact CD2-CD2 4.29Å; Y120-L249 HydrophobicContact CE2-CB 3.94Å; Y123-L249 HydrophobicContact CE1-CB 4.4Å; P246-L249 HydrophobicContact CG-CD1 4.42Å; L249-D251 WeakPolarHBondContact CD1-O 3.07Å; L249-D251 WeakPolarHBondContact CG-O 3.26Å; L249-L253 HydrophobicContact CD1-CB 3.53Å; L249-L253 HydrophobicContact CD1-CD2 4.35Å
250	K	77.5	Confident	85.5	Confident	170 Å²	170	62.5 Å²	62.5	74%	0.739	32%	0.321	S	S	*	.			trans	-82.1	-41.8	175.4	-64.7	-176.8	-177.9	178.8	0	112.2	D248	D248-K250 PolarHBondContact O-N 3.28Å
251	D	79	Confident	86.6	Confident	137 Å²	137	52.8 Å²	52.8	73%	0.733	28%	0.278	S	S	*	.	S	Bend	trans	-107.5	163.7	-179.1	-58.8	-49.1	0	0	0	110.9	L249 L253	L249-D251 WeakPolarHBondContact CD1-O 3.07Å; L249-D251 WeakPolarHBondContact CG-O 3.26Å; D251-L253 PolarHBondContact O-N 2.94Å
252	E	84.7	Confident	87.2	Confident	147 Å²	147	49.2 Å²	49.2	69%	0.687	27%	0.265	S	S	*	.			trans	-66.5	123.1	173.2	-63.9	-167.6	163.4	0	0	110.8	Y115	Y115-E252 WeakPolarHBondContact O-CA 3.45Å
253	L	86.4	Confident	87.7	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.157	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.4	176.9	-179.6	68.7	0	0	0	109.7	Y115 Y123 L245 L249 D251 I255	Y115-L253 PolarHBondContact N-O 3.39Å; Y115-L253 PolarHBondContact O-N 3.36Å; Y123-L253 HydrophobicContact CD2-CD2 4.49Å; Y123-L253 HydrophobicContact CE2-CD2 3.73Å; L245-L253 HydrophobicContact CD2-CD2 3.99Å; L249-L253 HydrophobicContact CD1-CB 3.53Å; L249-L253 HydrophobicContact CD1-CD2 4.35Å; D251-L253 PolarHBondContact O-N 2.94Å; L253-I255 HydrophobicContact CD2-CD1 4.1Å; L253-I255 HydrophobicContact CD2-CG1 4.08Å; L253-I255 HydrophobicContact CG-CG1 4.1Å
254	T	88.3	Confident	88	Confident	40 Å²	40	52.5 Å²	52.5	25%	0.245	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.6	170.7	-56.1	0	0	0	0	109.5	K113 K114	K113-T254 CarbonylContact O-C 3.57Å; K113-T254 WeakPolarHBondContact O-CA 3.32Å; K114-T254 HydrophobicContact CG-CG2 4.11Å
255	I	89.4	Confident	88.2	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	114	174.8	-57	-173.6	0	0	0	108	S112 K113 Y115 L190 N192 L243 L245 L253 Y257	S112-I255 CarbonylContact C-O 3.58Å; S112-I255 WeakPolarHBondContact CA-O 3.32Å; K113-I255 PolarHBondContact N-O 2.93Å; K113-I255 PolarHBondContact O-N 3.2Å; Y115-I255 HydrophobicContact CD2-CD1 3.94Å; Y115-I255 HydrophobicContact CD2-CG1 4.06Å; Y115-I255 HydrophobicContact CE2-CB 4.29Å; Y115-I255 HydrophobicContact CE2-CD1 3.63Å; Y115-I255 HydrophobicContact CE2-CG1 3.96Å; L190-I255 HydrophobicContact CD2-CD1 3.76Å; L190-I255 HydrophobicContact CD2-CG2 3.64Å; N192-I255 HydrophobicContact CB-CG2 4.28Å; L243-I255 HydrophobicContact CD2-CG1 4.25Å; L243-I255 HydrophobicContact CD2-CG2 3.91Å; L245-I255 HydrophobicContact CD2-CD1 3.78Å; L253-I255 HydrophobicContact CD2-CD1 4.1Å; L253-I255 HydrophobicContact CD2-CG1 4.08Å; L253-I255 HydrophobicContact CG-CG1 4.1Å; I255-Y257 HydrophobicContact CB-CE2 4.49Å; I255-Y257 HydrophobicContact CG2-CD2 4.3Å; I255-Y257 HydrophobicContact CG2-CE1 4.37Å; I255-Y257 HydrophobicContact CG2-CE2 3.8Å
256	T	90.6	Very high	88.3	Confident	22 Å²	22	53.8 Å²	53.8	14%	0.135	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.2	173.7	-57.2	0	0	0	0	109.1	V109 S112 N192 H230 T258	V109-T256 HydrophobicContact CG1-CG2 3.93Å; V109-T256 HydrophobicContact CG2-CG2 4.25Å; S112-T256 WeakPolarHBondContact OG-CG2 3.47Å; S112-T256 PolarHBondContact OG-OG1 3.47Å; N192-T256 PolarHBondContact ND2-O 3.01Å; H230-T256 PolarHBondContact CD2-O 3.5Å; T256-T258 HydrophobicContact CG2-CG2 4.04Å
257	Y	92.6	Very high	88.4	Confident	16 Å²	16	57 Å²	57	6%	0.063	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128.2	173.5	-66.1	-87.1	0	0	0	109	F70 L110 C111 K113 L190 N192 I255	F70-Y257 HydrophobicContact CD1-CE1 4.41Å; L110-Y257 PolarHBondContact N-O 2.8Å; C111-Y257 PolarHBondContact O-N 3.16Å; K113-Y257 HydrophobicContact CG-CE2 4.15Å; L190-Y257 HydrophobicContact CD2-CE1 4.18Å; N192-Y257 HydrophobicContact CB-CD1 3.99Å; N192-Y257 HydrophobicContact CB-CE1 4.19Å; N192-Y257 WeakPolarHBondContact O-CA 3.43Å; I255-Y257 HydrophobicContact CB-CE2 4.49Å; I255-Y257 HydrophobicContact CG2-CD2 4.3Å; I255-Y257 HydrophobicContact CG2-CE1 4.37Å; I255-Y257 HydrophobicContact CG2-CE2 3.8Å
258	T	93.4	Very high	88.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	159	-178.2	52.6	0	0	0	0	110.7	K108 V109 N192 H193 V194 H230 P235 T256	K108-T258 CarbonylContact O-C 3.41Å; K108-T258 WeakPolarHBondContact O-CA 3.41Å; V109-T258 HydrophobicContact CG2-CG2 4.05Å; N192-T258 PolarHBondContact O-N 3.38Å; N192-T258 VanDerWaalsContact O-N 3.15Å; H193-T258 WeakPolarHBondContact CA-O 3.34Å; H193-T258 PolarHBondContact ND1-O 3.28Å; H193-T258 PolarHBondContact ND1-OG1 3.38Å; V194-T258 PolarHBondContact N-O 3.36Å; H230-T258 PolarHBondContact CE1-OG1 3.44Å; H230-T258 VanDerWaalsContact NE2-CG2 3.27Å; H230-T258 WeakPolarHBondContact NE2-CG2 3.29Å; H230-T258 PolarHBondContact NE2-OG1 3.34Å; P235-T258 HydrophobicContact CB-CG2 4.2Å; T256-T258 HydrophobicContact CG2-CG2 4.04Å
259	Y	94.8	Very high	89.2	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.7	175.6	67.8	-80.4	0	0	0	112.3	Y97 E98 C107 K108 L110 V194 V261	Y97-Y259 AromaticContact CD1-CD1 3.71Å; Y97-Y259 HydrophobicContact CD1-CD1 3.71Å; Y97-Y259 AromaticContact CD1-CD2 3.89Å; Y97-Y259 HydrophobicContact CD1-CD2 3.89Å; Y97-Y259 HydrophobicContact CD1-CE1 4.1Å; Y97-Y259 HydrophobicContact CD1-CE2 4.27Å; Y97-Y259 AromaticContact CD1-CG 3.58Å; Y97-Y259 HydrophobicContact CD1-CG 3.58Å; Y97-Y259 AromaticContact CE1-CD1 3.93Å; Y97-Y259 HydrophobicContact CE1-CD1 3.93Å; Y97-Y259 HydrophobicContact CE1-CD2 4.5Å; Y97-Y259 AromaticContact CE1-CG 3.81Å; Y97-Y259 HydrophobicContact CE1-CG 3.81Å; E98-Y259 PolarHBondContact N-OH 2.78Å; E98-Y259 PolarHBondContact O-OH 3.06Å; C107-Y259 CarbonylContact C-O 3.56Å; C107-Y259 PolarHBondContact N-O 3.49Å; K108-Y259 HydrophobicContact CB-CD1 4.34Å; K108-Y259 HydrophobicContact CB-CE1 4Å; K108-Y259 HydrophobicContact CB-CE2 4.36Å; K108-Y259 HydrophobicContact CD-CE1 4.18Å; K108-Y259 HydrophobicContact CD-CE2 4.29Å; K108-Y259 WeakPolarHBondContact CD-OH 3.46Å; K108-Y259 WeakPolarHBondContact CE-OH 3.31Å; K108-Y259 HydrophobicContact CG-CE1 3.87Å; K108-Y259 PolarHBondContact N-O 3.18Å; K108-Y259 PolarHBondContact NZ-OH 3.18Å; K108-Y259 WeakPolarHBondContact O-CD1 3.41Å; K108-Y259 PolarHBondContact O-N 3.27Å; L110-Y259 HydrophobicContact CB-CD1 4.04Å; L110-Y259 HydrophobicContact CB-CE1 4.17Å; L110-Y259 HydrophobicContact CD1-CD1 4.49Å; L110-Y259 HydrophobicContact CD1-CE1 4.1Å; V194-Y259 CarbonylContact O-C 3.5Å; V194-Y259 WeakPolarHBondContact O-CA 3.37Å; V194-Y259 WeakPolarHBondContact O-CB 3.26Å; Y259-V261 HydrophobicContact CD2-CG2 3.83Å; Y259-V261 HydrophobicContact CE2-CG2 3.97Å
260	S	95.5	Very high	89.4	Confident	15 Å²	15	63.3 Å²	63.3	11%	0.105	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.2	171.7	-54.1	0	0	0	0	108.9	E105 C107 H193 V194 L196	E105-S260 CarbonylContact O-C 3.6Å; E105-S260 WeakPolarHBondContact O-CA 3.35Å; E105-S260 WeakPolarHBondContact O-CB 3.46Å; C107-S260 PolarHBondContact N-OG 3.21Å; H193-S260 PolarHBondContact CE1-OG 2.86Å; H193-S260 VanDerWaalsContact CE1-OG 3.23Å; H193-S260 PolarHBondContact NE2-OG 3.5Å; V194-S260 PolarHBondContact O-N 3.08Å; L196-S260 PolarHBondContact N-O 3.38Å
261	V	96.7	Very high	89.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128	177.2	-174.1	0	0	0	0	108.5	I99 E104 E105 L196 I198 Y259 F263	I99-V261 HydrophobicContact CG1-CG2 4.22Å; I99-V261 HydrophobicContact CG2-CG1 3.99Å; I99-V261 HydrophobicContact CG2-CG2 4.41Å; E104-V261 WeakPolarHBondContact CA-O 3.41Å; E105-V261 HydrophobicContact CB-CB 4.32Å; E105-V261 HydrophobicContact CB-CG2 4.43Å; E105-V261 PolarHBondContact N-O 3.48Å; E105-V261 PolarHBondContact O-N 3.45Å; L196-V261 CarbonylContact O-C 3.58Å; L196-V261 WeakPolarHBondContact O-CA 3.44Å; I198-V261 HydrophobicContact CD1-CG1 3.9Å; Y259-V261 HydrophobicContact CD2-CG2 3.83Å; Y259-V261 HydrophobicContact CE2-CG2 3.97Å; V261-F263 HydrophobicContact CG1-CD2 4.14Å; V261-F263 HydrophobicContact CG1-CE2 3.49Å; V261-F263 VanDerWaalsContact CG1-CE2 3.49Å; V261-F263 HydrophobicContact CG1-CZ 3.86Å
262	T	96.9	Very high	89.9	Confident	48 Å²	48	55.1 Å²	55.1	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.3	176.3	48.7	0	0	0	0	109.2	L196 H197 I198	L196-T262 PolarHBondContact O-N 2.97Å; L196-T262 PolarHBondContact O-OG1 3.16Å; H197-T262 WeakPolarHBondContact CA-OG1 3.39Å; H197-T262 PolarHBondContact CD2-OG1 3.47Å; H197-T262 VanDerWaalsContact CD2-OG1 3.24Å; I198-T262 PolarHBondContact N-O 3.13Å
263	F	94.8	Very high	89.9	Confident	24 Å²	24	49.6 Å²	49.6	11%	0.105	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.2	-177.6	-73	-86.7	0	0	0	110.5	I47 I99 I100 F101 K103 I198 Y200 V261	I47-F263 HydrophobicContact CD1-CE1 3.88Å; I47-F263 HydrophobicContact CD1-CZ 4.04Å; I99-F263 HydrophobicContact CG2-CZ 4.24Å; I100-F263 WeakPolarHBondContact O-CE2 3.4Å; I100-F263 WeakPolarHBondContact O-CZ 3.43Å; F101-F263 HydrophobicContact CD2-CD1 4.35Å; F101-F263 AromaticContact CD2-CE1 3.92Å; F101-F263 HydrophobicContact CD2-CE1 3.92Å; F101-F263 HydrophobicContact CE2-CD1 4.48Å; F101-F263 HydrophobicContact CE2-CE1 4.46Å; K103-F263 WeakPolarHBondContact O-CE2 3.33Å; I198-F263 HydrophobicContact CB-CD1 3.83Å; I198-F263 HydrophobicContact CB-CE1 3.89Å; I198-F263 HydrophobicContact CD1-CD1 4.48Å; I198-F263 HydrophobicContact CD1-CE1 3.73Å; I198-F263 HydrophobicContact CD1-CZ 3.87Å; I198-F263 HydrophobicContact CG1-CE1 4.38Å; I198-F263 HydrophobicContact CG2-CD1 3.97Å; I198-F263 HydrophobicContact CG2-CE1 3.88Å; I198-F263 WeakPolarHBondContact O-CA 3.33Å; Y200-F263 HydrophobicContact CD1-CB 4.42Å; Y200-F263 HydrophobicContact CD1-CD1 4.28Å; Y200-F263 HydrophobicContact CE1-CB 4Å; Y200-F263 HydrophobicContact CE1-CD1 4.49Å; V261-F263 HydrophobicContact CG1-CD2 4.14Å; V261-F263 HydrophobicContact CG1-CE2 3.49Å; V261-F263 VanDerWaalsContact CG1-CE2 3.49Å; V261-F263 HydrophobicContact CG1-CZ 3.86Å
264	E	93.6	Very high	89.9	Confident	102 Å²	102	48.6 Å²	48.6	48%	0.477	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.7	175.8	-174.3	-177.8	-165.3	0	0	110	H197 I198 V199 Y200	H197-E264 IonicContact CE1-OE2 2.67Å; H197-E264 PolarHBondContact CE1-OE2 3.15Å; H197-E264 IonicContact NE2-OE2 3.13Å; I198-E264 PolarHBondContact O-N 3.07Å; V199-E264 CarbonylContact C-O 3.54Å; V199-E264 VanDerWaalsContact CA-O 3.3Å; V199-E264 WeakPolarHBondContact CA-O 3.4Å; V199-E264 HydrophobicContact CG2-CB 4.37Å; Y200-E264 VanDerWaalsContact CD1-O 3.23Å; Y200-E264 WeakPolarHBondContact CD1-O 3.39Å; Y200-E264 PolarHBondContact N-O 3.01Å
265	E	90.8	Very high	89.7	Confident	91 Å²	91	48.1 Å²	48.1	43%	0.425	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.2	173.5	59.1	178	-147.2	0	0	111.1	Y200 K214	Y200-E265 HydrophobicContact CE1-CB 4.2Å; Y200-E265 HydrophobicContact CE2-CB 4.14Å; K214-E265 IonicContact NZ-OE2 3.1Å; K214-E265 PolarHBondContact NZ-OE2 3.42Å
266	D	89.4	Confident	89.4	Confident	25 Å²	25	51.7 Å²	51.7	13%	0.134	27%	0.269	C	S	.	.			trans	-126.1	109	177.6	-179.7	1.4	0	0	0	110.9	V199 Y200 H201 L219 T268 R269	V199-D266 HydrophobicContact CG1-CB 3.54Å; Y200-D266 PolarHBondContact O-N 3.35Å; H201-D266 PolarHBondContact ND1-O 3.38Å; L219-D266 HydrophobicContact CD1-CB 3.97Å; D266-T268 WeakPolarHBondContact OD1-CB 3.46Å; D266-T268 PolarHBondContact OD1-N 3.13Å; D266-T268 PolarHBondContact OD1-OG1 3.46Å; D266-R269 PolarHBondContact OD1-N 3.41Å; D266-R269 WeakPolarHBondContact OD2-CG 3.49Å; D266-R269 IonicContact OD2-CZ 2.89Å; D266-R269 IonicContact OD2-NE 3.12Å; D266-R269 PolarHBondContact OD2-NE 3.3Å; D266-R269 IonicContact OD2-NH2 3.17Å; D266-R269 PolarHBondContact OD2-NH2 3.02Å
267	L	86.8	Confident	89	Confident	118 Å²	118	52.1 Å²	52.1	62%	0.618	27%	0.268	S	S	*	.	S	Bend	trans	-83.3	-15.7	179.3	-69.7	166.3	0	0	0	113.2	P202	P202-L267 HydrophobicContact CG-CD2 3.34Å; P202-L267 HydrophobicContact CG-CG 4.21Å
268	T	86.2	Confident	88.4	Confident	125 Å²	125	51.3 Å²	51.3	77%	0.767	27%	0.265	S	S	*	.	S	Bend	trans	-83.6	-42.2	-171.7	68.3	0	0	0	0	111.7	D266	D266-T268 WeakPolarHBondContact OD1-CB 3.46Å; D266-T268 PolarHBondContact OD1-N 3.13Å; D266-T268 PolarHBondContact OD1-OG1 3.46Å
269	R	86.2	Confident	87.7	Confident	67 Å²	67	52.5 Å²	52.5	25%	0.253	27%	0.271	S	S	.	.	S	Bend	trans	-88.1	134.9	-179.1	-67.6	-169.9	-63.4	163.2	2.7	111.1	H201 L219 S220 D266	H201-R269 PolarHBondContact ND1-O 2.92Å; L219-R269 HydrophobicContact CD1-CB 3.92Å; S220-R269 PolarHBondContact OG-NH2 2.97Å; D266-R269 PolarHBondContact OD1-N 3.41Å; D266-R269 WeakPolarHBondContact OD2-CG 3.49Å; D266-R269 IonicContact OD2-CZ 2.89Å; D266-R269 IonicContact OD2-NE 3.12Å; D266-R269 PolarHBondContact OD2-NE 3.3Å; D266-R269 IonicContact OD2-NH2 3.17Å; D266-R269 PolarHBondContact OD2-NH2 3.02Å
270	K	84.9	Confident	86.6	Confident	146 Å²	146	57.9 Å²	57.9	64%	0.635	30%	0.3	S	S	*	.			trans	-83.4	153.8	171.8	-66.6	-179.8	-179.7	176.7	0	109.9	S272 S273	K270-S272 PolarHBondContact O-N 2.84Å; K270-S273 PolarHBondContact N-OG 3.34Å; K270-S273 PolarHBondContact O-N 2.89Å; K270-S273 VanDerWaalsContact O-N 3.16Å; K270-S273 PolarHBondContact O-OG 3.28Å
271	W	83.7	Confident	85.2	Confident	35 Å²	35	58.1 Å²	58.1	13%	0.133	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-60.2	-32.2	175.8	-177.4	84.6	0	0	0	113.5	I27 P29 R217 I218 L219 S273 R274	I27-W271 WeakPolarHBondContact O-CH2 3.4Å; P29-W271 HydrophobicContact CB-CD2 3.9Å; P29-W271 HydrophobicContact CB-CE3 4Å; P29-W271 HydrophobicContact CB-CH2 4.07Å; P29-W271 HydrophobicContact CB-CZ2 3.96Å; P29-W271 HydrophobicContact CB-CZ3 4.09Å; R217-W271 HydrophobicContact CB-CB 4.28Å; R217-W271 VanDerWaalsContact CB-CD1 3.47Å; R217-W271 HydrophobicContact CB-CG 4Å; I218-W271 PolarHBondContact O-NE1 3.46Å; L219-W271 VanDerWaalsContact CD2-CA 3.47Å; L219-W271 HydrophobicContact CD2-CB 4.23Å; W271-S273 PolarHBondContact O-N 3.1Å; W271-R274 VanDerWaalsContact O-CB 3.27Å; W271-R274 WeakPolarHBondContact O-CB 3.1Å; W271-R274 WeakPolarHBondContact O-CD 3.47Å; W271-R274 WeakPolarHBondContact O-CG 3.32Å; W271-R274 PolarHBondContact O-N 3.44Å
272	S	82.9	Confident	83.6	Confident	100 Å²	100	59.4 Å²	59.4	70%	0.699	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-63.2	-25.1	178.1	54.1	0	0	0	0	114.1	K270	K270-S272 PolarHBondContact O-N 2.84Å
273	S	83.1	Confident	81.7	Confident	31 Å²	31	61.3 Å²	61.3	22%	0.217	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-95.8	17.3	179.8	46.3	0	0	0	0	113.2	K270 W271 W275 D276	K270-S273 PolarHBondContact N-OG 3.34Å; K270-S273 PolarHBondContact O-N 2.89Å; K270-S273 VanDerWaalsContact O-N 3.16Å; K270-S273 PolarHBondContact O-OG 3.28Å; W271-S273 PolarHBondContact O-N 3.1Å; S273-W275 VanDerWaalsContact C-N 3.25Å; S273-W275 PolarHBondContact O-N 2.86Å; S273-D276 WeakPolarHBondContact CB-OD2 3.49Å; S273-D276 WeakPolarHBondContact O-CB 3.48Å; S273-D276 PolarHBondContact O-N 3.3Å; S273-D276 VanDerWaalsContact O-N 3.17Å
274	R	87.1	Confident	80.1	Confident	10 Å²	10	63.4 Å²	63.4	4%	0.038	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.8	-173.8	66.7	-174.5	-162.2	151.2	-2.8	115.2	D141 L143 L219 W271 Y277	D141-R274 PolarHBondContact O-NH1 2.84Å; D141-R274 VanDerWaalsContact O-NH1 3.08Å; D141-R274 PolarHBondContact O-NH2 3.36Å; D141-R274 IonicContact OD2-CZ 3.92Å; D141-R274 IonicContact OD2-NH1 3.75Å; D141-R274 PolarHBondContact OD2-NH1 3.22Å; L143-R274 HydrophobicContact CD1-CB 4.35Å; L143-R274 HydrophobicContact CD1-CG 4.31Å; L143-R274 HydrophobicContact CD2-CG 4.07Å; L219-R274 HydrophobicContact CD2-CB 4.49Å; L219-R274 WeakPolarHBondContact O-CB 3.48Å; W271-R274 VanDerWaalsContact O-CB 3.27Å; W271-R274 WeakPolarHBondContact O-CB 3.1Å; W271-R274 WeakPolarHBondContact O-CD 3.47Å; W271-R274 WeakPolarHBondContact O-CG 3.32Å; W271-R274 PolarHBondContact O-N 3.44Å; R274-Y277 WeakPolarHBondContact O-CD1 3.34Å; R274-Y277 WeakPolarHBondContact O-CE1 3.24Å
275	W	85.1	Confident	78.7	Confident	30 Å²	30	59.2 Å²	59.2	11%	0.114	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-16.1	175.9	-80.5	83.5	0	0	0	113.1	L143 P144 S273 Y277 I278 L279 P381 A382 F539	L143-W275 HydrophobicContact CD2-CD2 4.25Å; L143-W275 HydrophobicContact CD2-CG 4.33Å; L143-W275 HydrophobicContact CD2-CZ2 4.3Å; P144-W275 HydrophobicContact CG-CH2 4.26Å; P144-W275 HydrophobicContact CG-CZ3 4.33Å; S273-W275 VanDerWaalsContact C-N 3.25Å; S273-W275 PolarHBondContact O-N 2.86Å; W275-Y277 VanDerWaalsContact C-N 3.32Å; W275-Y277 PolarHBondContact O-N 3.39Å; W275-I278 HydrophobicContact CE3-CD1 4.1Å; W275-I278 HydrophobicContact CZ3-CD1 4.39Å; W275-I278 WeakPolarHBondContact O-CB 3.46Å; W275-I278 PolarHBondContact O-N 3.34Å; W275-L279 HydrophobicContact CB-CD1 4.28Å; W275-L279 WeakPolarHBondContact O-CG 3.32Å; W275-L279 PolarHBondContact O-N 3.48Å; W275-L279 VanDerWaalsContact O-N 3.1Å; W275-P381 HydrophobicContact CZ3-CB 4.27Å; W275-A382 HydrophobicContact CZ2-CB 4.17Å; W275-F539 HydrophobicContact CZ3-CE1 4.42Å; W275-F539 HydrophobicContact CZ3-CE2 4.43Å; W275-F539 HydrophobicContact CZ3-CZ 4.31Å
276	D	82.3	Confident	77.5	Confident	77 Å²	77	61 Å²	61	41%	0.412	33%	0.325	S	S	.	.	H	α-helix	trans	-61.1	-40.1	-170.4	-62.6	-2.8	0	0	0	111.5	S273 I278 L279 D280	S273-D276 WeakPolarHBondContact CB-OD2 3.49Å; S273-D276 WeakPolarHBondContact O-CB 3.48Å; S273-D276 PolarHBondContact O-N 3.3Å; S273-D276 VanDerWaalsContact O-N 3.17Å; D276-I278 PolarHBondContact O-N 3Å; D276-L279 PolarHBondContact O-N 2.88Å; D276-L279 VanDerWaalsContact O-N 3.16Å; D276-D280 VanDerWaalsContact O-CB 3.24Å; D276-D280 WeakPolarHBondContact O-CB 3.27Å; D276-D280 PolarHBondContact O-N 3.04Å
277	Y	81.7	Confident	76.4	Confident	30 Å²	30	65.3 Å²	65.3	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-25.6	178.7	85.7	-85.7	0	0	0	113.8	T146 S220 R274 W275 T281	T146-Y277 HydrophobicContact CG2-CE2 3.98Å; T146-Y277 WeakPolarHBondContact OG1-CE2 3.38Å; T146-Y277 PolarHBondContact OG1-OH 3.06Å; S220-Y277 VanDerWaalsContact CB-CE1 3.47Å; R274-Y277 WeakPolarHBondContact O-CD1 3.34Å; R274-Y277 WeakPolarHBondContact O-CE1 3.24Å; W275-Y277 VanDerWaalsContact C-N 3.32Å; W275-Y277 PolarHBondContact O-N 3.39Å; Y277-T281 WeakPolarHBondContact O-CG2 3.33Å; Y277-T281 PolarHBondContact O-OG1 3.11Å
278	I	81	Confident	75.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-82.3	-42.1	176.8	-57.6	166.7	0	0	0	109.5	L143 P144 T146 T160 W275 D276 T281 M282 F539	L143-I278 HydrophobicContact CD2-CD1 4.44Å; P144-I278 HydrophobicContact CG-CD1 3.62Å; T146-I278 HydrophobicContact CG2-CD1 4.28Å; T146-I278 HydrophobicContact CG2-CG1 4.07Å; T160-I278 HydrophobicContact CG2-CG2 3.62Å; W275-I278 HydrophobicContact CE3-CD1 4.1Å; W275-I278 HydrophobicContact CZ3-CD1 4.39Å; W275-I278 WeakPolarHBondContact O-CB 3.46Å; W275-I278 PolarHBondContact O-N 3.34Å; D276-I278 PolarHBondContact O-N 3Å; I278-T281 PolarHBondContact O-OG1 3.16Å; I278-T281 VanDerWaalsContact O-OG1 3.12Å; I278-M282 HydrophobicContact CG2-CE 4.17Å; I278-F539 HydrophobicContact CG2-CD2 4.28Å; I278-F539 HydrophobicContact CG2-CE2 4.36Å
279	L	77.8	Confident	75	Confident	26 Å²	26	59.6 Å²	59.6	14%	0.136	30%	0.304	C	S	.	.	H	α-helix	trans	-72.5	-37.9	-177	-62.4	177.3	0	0	0	111.9	W275 D276 T281 M282 F539 Y541	W275-L279 HydrophobicContact CB-CD1 4.28Å; W275-L279 WeakPolarHBondContact O-CG 3.32Å; W275-L279 PolarHBondContact O-N 3.48Å; W275-L279 VanDerWaalsContact O-N 3.1Å; D276-L279 PolarHBondContact O-N 2.88Å; D276-L279 VanDerWaalsContact O-N 3.16Å; L279-T281 VanDerWaalsContact C-N 3.32Å; L279-T281 PolarHBondContact O-N 3.23Å; L279-M282 PolarHBondContact O-N 3.42Å; L279-F539 HydrophobicContact CD2-CB 4.39Å; L279-Y541 HydrophobicContact CD1-CD2 4.42Å; L279-Y541 HydrophobicContact CD1-CG 4.39Å; L279-Y541 HydrophobicContact CD2-CD1 4.07Å; L279-Y541 HydrophobicContact CD2-CG 4.04Å
280	D	71.6	Confident	74.8	Confident	114 Å²	114	60.7 Å²	60.7	61%	0.61	31%	0.314	S	S	*	.	H	α-helix	trans	-69.3	-29.8	180	-73.1	-16.5	0	0	0	112.8	D276 M282	D276-D280 VanDerWaalsContact O-CB 3.24Å; D276-D280 WeakPolarHBondContact O-CB 3.27Å; D276-D280 PolarHBondContact O-N 3.04Å; D280-M282 VanDerWaalsContact C-N 3.3Å; D280-M282 PolarHBondContact O-N 3.43Å
281	T	66.3	Low	74.3	Confident	21 Å²	21	55.5 Å²	55.5	13%	0.129	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-5.2	-176.4	52.1	0	0	0	0	113.8	K156 C158 Y277 I278 L279	K156-T281 VanDerWaalsContact O-CG2 3.24Å; K156-T281 WeakPolarHBondContact O-CG2 3.35Å; C158-T281 HydrophobicContact CB-CG2 4.27Å; Y277-T281 WeakPolarHBondContact O-CG2 3.33Å; Y277-T281 PolarHBondContact O-OG1 3.11Å; I278-T281 PolarHBondContact O-OG1 3.16Å; I278-T281 VanDerWaalsContact O-OG1 3.12Å; L279-T281 VanDerWaalsContact C-N 3.32Å; L279-T281 PolarHBondContact O-N 3.23Å
282	M	64.3	Low	74.1	Confident	27 Å²	27	53.9 Å²	53.9	13%	0.133	29%	0.29	C	S	.	.	S	Bend	trans	-64.4	125.4	173.4	-67	-68.1	159.1	0	0	109.4	I278 L279 D280 Q284 S285 Q538 F539	I278-M282 HydrophobicContact CG2-CE 4.17Å; L279-M282 PolarHBondContact O-N 3.42Å; D280-M282 VanDerWaalsContact C-N 3.3Å; D280-M282 PolarHBondContact O-N 3.43Å; M282-Q284 PolarHBondContact O-N 3.12Å; M282-S285 PolarHBondContact O-N 3.25Å; M282-Q538 HydrophobicContact SD-CG 4.48Å; M282-F539 HydrophobicContact CE-CD2 4.13Å
283	P	57.2	Low	74	Confident	88 Å²	88	52 Å²	52	57%	0.571	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-4.5	-164.7	21.9	-33.3	0	0	0	115.2
284	Q	60.1	Low	74	Confident	68 Å²	68	55.2 Å²	55.2	32%	0.318	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	8.8	-172.4	-62	-173	-21.8	0	0	114.2	M282 N286 I287 Q288	M282-Q284 PolarHBondContact O-N 3.12Å; Q284-N286 PolarHBondContact O-N 3Å; Q284-I287 PolarHBondContact O-N 3.05Å; Q284-Q288 WeakPolarHBondContact O-CA 3.28Å; Q284-Q288 WeakPolarHBondContact O-CB 3.19Å; Q284-Q288 PolarHBondContact O-N 2.69Å
285	S	64.7	Low	73.8	Confident	14 Å²	14	55.4 Å²	55.4	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-53.6	-51.2	-173.6	56.3	0	0	0	0	114.3	M282 Q288 W289 Y541	M282-S285 PolarHBondContact O-N 3.25Å; S285-Q288 WeakPolarHBondContact O-CB 3.46Å; S285-Q288 PolarHBondContact O-N 3.45Å; S285-W289 PolarHBondContact O-N 2.92Å; S285-Y541 WeakPolarHBondContact CB-OH 3.36Å
286	N	65	Low	73.8	Confident	128 Å²	128	54.7 Å²	54.7	68%	0.684	29%	0.289	S	S	*	.	H	α-helix	trans	-67.5	-41.5	179.2	-72.1	-30.7	0	0	0	112.7	Q284 Q288 L290	Q284-N286 PolarHBondContact O-N 3Å; N286-Q288 VanDerWaalsContact C-N 3.29Å; N286-L290 PolarHBondContact O-N 3.27Å
287	I	66.5	Low	74	Confident	117 Å²	117	55.2 Å²	55.2	60%	0.6	29%	0.294	S	S	*	.	H	α-helix	trans	-67.6	-37.1	178.2	-62.1	169.9	0	0	0	109.8	Q284 S291	Q284-I287 PolarHBondContact O-N 3.05Å; I287-S291 WeakPolarHBondContact O-CB 3.41Å; I287-S291 PolarHBondContact O-N 2.92Å
288	Q	69.5	Low	74.1	Confident	16 Å²	16	58.6 Å²	58.6	8%	0.075	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-53.2	177.9	174.4	172.2	15.6	0	0	110.1	Q284 S285 N286 L290 S291 I292 F529	Q284-Q288 WeakPolarHBondContact O-CA 3.28Å; Q284-Q288 WeakPolarHBondContact O-CB 3.19Å; Q284-Q288 PolarHBondContact O-N 2.69Å; S285-Q288 WeakPolarHBondContact O-CB 3.46Å; S285-Q288 PolarHBondContact O-N 3.45Å; N286-Q288 VanDerWaalsContact C-N 3.29Å; Q288-L290 PolarHBondContact O-N 2.86Å; Q288-S291 PolarHBondContact O-N 2.61Å; Q288-I292 HydrophobicContact CG-CD1 3.59Å; Q288-I292 HydrophobicContact CG-CG1 4.38Å; Q288-I292 WeakPolarHBondContact O-CB 3.49Å; Q288-I292 WeakPolarHBondContact O-CD1 3.46Å; Q288-I292 WeakPolarHBondContact O-CG1 3.18Å; Q288-I292 PolarHBondContact O-N 3.1Å; Q288-F529 HydrophobicContact CB-CD1 4.25Å; Q288-F529 HydrophobicContact CB-CE1 3.59Å; Q288-F529 HydrophobicContact CB-CE2 4.3Å; Q288-F529 HydrophobicContact CB-CZ 3.63Å; Q288-F529 VanDerWaalsContact CD-CD1 3.43Å; Q288-F529 HydrophobicContact CG-CD1 3.68Å; Q288-F529 HydrophobicContact CG-CD2 3.97Å; Q288-F529 HydrophobicContact CG-CE1 3.49Å; Q288-F529 VanDerWaalsContact CG-CE1 3.49Å; Q288-F529 HydrophobicContact CG-CE2 3.79Å; Q288-F529 HydrophobicContact CG-CG 3.94Å; Q288-F529 HydrophobicContact CG-CZ 3.56Å; Q288-F529 VanDerWaalsContact NE2-CG 3.33Å
289	W	74.8	Confident	74.3	Confident	107 Å²	107	58.9 Å²	58.9	41%	0.405	32%	0.316	S	S	.	.	H	α-helix	trans	-59.3	-44.4	179.8	-176.2	84.5	0	0	0	112.9	S285 I292 L293 M542 F545	S285-W289 PolarHBondContact O-N 2.92Å; W289-I292 PolarHBondContact O-N 2.92Å; W289-L293 HydrophobicContact CH2-CD1 3.7Å; W289-L293 HydrophobicContact CZ2-CD1 3.76Å; W289-L293 HydrophobicContact CZ3-CD1 4.34Å; W289-L293 WeakPolarHBondContact O-CB 3.33Å; W289-L293 PolarHBondContact O-N 3.3Å; W289-M542 HydrophobicContact CB-CE 4.2Å; W289-M542 HydrophobicContact CG-CE 4.44Å; W289-F545 AromaticContact CD1-CE2 3.32Å; W289-F545 AromaticContact CD1-CZ 3.48Å; W289-F545 VanDerWaalsContact CD1-CZ 3.48Å; W289-F545 AromaticContact CE2-CZ 3.98Å; W289-F545 AromaticContact NE1-CE2 3.29Å; W289-F545 VanDerWaalsContact NE1-CE2 3.29Å; W289-F545 AromaticContact NE1-CZ 3.02Å
290	L	80.3	Confident	74.8	Confident	90 Å²	90	62.2 Å²	62.2	47%	0.471	33%	0.333	S	S	.	.	H	α-helix	trans	-65.6	-44.6	177	-73.5	171.4	0	0	0	112.5	N286 Q288 I292 L293 N294	N286-L290 PolarHBondContact O-N 3.27Å; Q288-L290 PolarHBondContact O-N 2.86Å; L290-I292 VanDerWaalsContact C-N 3.29Å; L290-I292 PolarHBondContact O-N 3.27Å; L290-L293 PolarHBondContact O-N 2.76Å; L290-N294 WeakPolarHBondContact O-CB 3.23Å; L290-N294 PolarHBondContact O-N 3.47Å; L290-N294 PolarHBondContact O-ND2 3.5Å
291	S	75.9	Confident	75.7	Confident	37 Å²	37	63.7 Å²	63.7	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-60.6	-42.1	177.7	-174.5	0	0	0	0	111.3	I287 Q288 S295 I525	I287-S291 WeakPolarHBondContact O-CB 3.41Å; I287-S291 PolarHBondContact O-N 2.92Å; Q288-S291 PolarHBondContact O-N 2.61Å; S291-S295 WeakPolarHBondContact O-CB 3.48Å; S291-S295 PolarHBondContact O-N 3.46Å; S291-S295 PolarHBondContact O-OG 3.5Å; S291-I525 VanDerWaalsContact OG-CG2 3.22Å; S291-I525 WeakPolarHBondContact OG-CG2 3.41Å
292	I	78.6	Confident	76.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-51.2	176.4	-69.8	174	0	0	0	110.7	Q288 W289 L290 N294 S295 C296 Q526 F529 F545	Q288-I292 HydrophobicContact CG-CD1 3.59Å; Q288-I292 HydrophobicContact CG-CG1 4.38Å; Q288-I292 WeakPolarHBondContact O-CB 3.49Å; Q288-I292 WeakPolarHBondContact O-CD1 3.46Å; Q288-I292 WeakPolarHBondContact O-CG1 3.18Å; Q288-I292 PolarHBondContact O-N 3.1Å; W289-I292 PolarHBondContact O-N 2.92Å; L290-I292 VanDerWaalsContact C-N 3.29Å; L290-I292 PolarHBondContact O-N 3.27Å; I292-N294 VanDerWaalsContact C-N 3.33Å; I292-N294 PolarHBondContact O-N 3.31Å; I292-S295 PolarHBondContact O-N 2.96Å; I292-S295 VanDerWaalsContact O-N 3.16Å; I292-S295 PolarHBondContact O-OG 2.93Å; I292-C296 PolarHBondContact O-N 3.29Å; I292-C296 PolarHBondContact O-SG 3.38Å; I292-C296 VanDerWaalsContact O-SG 3.36Å; I292-Q526 VanDerWaalsContact CG2-NE2 3.3Å; I292-F529 HydrophobicContact CD1-CD2 4.23Å; I292-F529 HydrophobicContact CD1-CE2 4.36Å; I292-F529 HydrophobicContact CG1-CD2 4.27Å; I292-F529 HydrophobicContact CG1-CE2 4.08Å; I292-F545 HydrophobicContact CG2-CB 3.69Å; I292-F545 HydrophobicContact CG2-CD1 3.54Å; I292-F545 HydrophobicContact CG2-CE1 4.4Å; I292-F545 HydrophobicContact CG2-CG 3.69Å
293	L	82	Confident	77.8	Confident	60 Å²	60	64.6 Å²	64.6	31%	0.314	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-44.3	-179.1	-174.9	144.6	0	0	0	111.2	W289 L290 S295 C296 V297	W289-L293 HydrophobicContact CH2-CD1 3.7Å; W289-L293 HydrophobicContact CZ2-CD1 3.76Å; W289-L293 HydrophobicContact CZ3-CD1 4.34Å; W289-L293 WeakPolarHBondContact O-CB 3.33Å; W289-L293 PolarHBondContact O-N 3.3Å; L290-L293 PolarHBondContact O-N 2.76Å; L293-S295 PolarHBondContact O-N 3.2Å; L293-C296 WeakPolarHBondContact O-CB 3.18Å; L293-C296 PolarHBondContact O-N 2.87Å; L293-V297 HydrophobicContact CD2-CG2 4.23Å; L293-V297 WeakPolarHBondContact O-CG2 3.25Å; L293-V297 PolarHBondContact O-N 3.22Å
294	N	82.3	Confident	79.4	Confident	100 Å²	100	62 Å²	62	54%	0.535	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-43.7	175.3	-72.2	-21.6	0	0	0	112	L290 I292 C296 V297 L298	L290-N294 WeakPolarHBondContact O-CB 3.23Å; L290-N294 PolarHBondContact O-N 3.47Å; L290-N294 PolarHBondContact O-ND2 3.5Å; I292-N294 VanDerWaalsContact C-N 3.33Å; I292-N294 PolarHBondContact O-N 3.31Å; N294-C296 VanDerWaalsContact C-N 3.27Å; N294-C296 PolarHBondContact O-N 3.34Å; N294-V297 PolarHBondContact O-N 2.95Å; N294-L298 WeakPolarHBondContact O-CB 3.32Å; N294-L298 PolarHBondContact O-N 2.72Å
295	S	82.5	Confident	80.8	Confident	13 Å²	13	62.8 Å²	62.8	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-64.5	-33.6	177.7	75.4	0	0	0	0	112.3	S291 I292 L293 T299	S291-S295 WeakPolarHBondContact O-CB 3.48Å; S291-S295 PolarHBondContact O-N 3.46Å; S291-S295 PolarHBondContact O-OG 3.5Å; I292-S295 PolarHBondContact O-N 2.96Å; I292-S295 VanDerWaalsContact O-N 3.16Å; I292-S295 PolarHBondContact O-OG 2.93Å; L293-S295 PolarHBondContact O-N 3.2Å; S295-T299 VanDerWaalsContact O-CB 3.28Å; S295-T299 WeakPolarHBondContact O-CB 3.25Å; S295-T299 PolarHBondContact O-N 3.3Å; S295-T299 PolarHBondContact O-OG1 3.43Å
296	C	85.8	Confident	81.9	Confident	15 Å²	15	64.1 Å²	64.1	10%	0.101	34%	0.341	C	S	.	.	H	α-helix	trans	-66.7	-49.8	173.5	-69.9	0	0	0	0	110.7	I292 L293 N294 L298 T299 L300 M552	I292-C296 PolarHBondContact O-N 3.29Å; I292-C296 PolarHBondContact O-SG 3.38Å; I292-C296 VanDerWaalsContact O-SG 3.36Å; L293-C296 WeakPolarHBondContact O-CB 3.18Å; L293-C296 PolarHBondContact O-N 2.87Å; N294-C296 VanDerWaalsContact C-N 3.27Å; N294-C296 PolarHBondContact O-N 3.34Å; C296-L298 VanDerWaalsContact C-N 3.33Å; C296-L298 PolarHBondContact O-N 2.88Å; C296-T299 PolarHBondContact O-N 3.4Å; C296-L300 WeakPolarHBondContact O-CG 3.35Å; C296-L300 PolarHBondContact O-N 3.43Å; C296-M552 HydrophobicContact CB-CE 4.22Å; C296-M552 HydrophobicContact CB-SD 4.06Å; C296-M552 VanDerWaalsContact O-CE 3.26Å; C296-M552 WeakPolarHBondContact O-CE 3.13Å
297	V	86.9	Confident	83.1	Confident	88 Å²	88	59.3 Å²	59.3	53%	0.533	32%	0.318	S	S	.	.	H	α-helix	trans	-59.1	-46.5	179.5	173.1	0	0	0	0	111.1	L293 N294 T299 L300 F301	L293-V297 HydrophobicContact CD2-CG2 4.23Å; L293-V297 WeakPolarHBondContact O-CG2 3.25Å; L293-V297 PolarHBondContact O-N 3.22Å; N294-V297 PolarHBondContact O-N 2.95Å; V297-T299 VanDerWaalsContact C-N 3.34Å; V297-T299 PolarHBondContact O-N 3.3Å; V297-L300 PolarHBondContact O-N 3.44Å; V297-F301 PolarHBondContact O-N 3.41Å
298	L	83.9	Confident	84.2	Confident	102 Å²	102	57.9 Å²	57.9	53%	0.534	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-45.5	177.8	178.7	62.5	0	0	0	111.7	N294 C296 F301 L302	N294-L298 WeakPolarHBondContact O-CB 3.32Å; N294-L298 PolarHBondContact O-N 2.72Å; C296-L298 VanDerWaalsContact C-N 3.33Å; C296-L298 PolarHBondContact O-N 2.88Å; L298-F301 PolarHBondContact O-N 2.79Å; L298-L302 HydrophobicContact CD1-CD1 4.14Å; L298-L302 HydrophobicContact CD1-CG 4.32Å; L298-L302 HydrophobicContact CG-CD1 3.99Å; L298-L302 WeakPolarHBondContact O-CG 3.4Å; L298-L302 PolarHBondContact O-N 2.95Å
299	T	84.6	Confident	85	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-42.5	-179.7	-65.7	0	0	0	0	111.9	S295 C296 V297 F301 L302 S303 C522 M552 T556	S295-T299 VanDerWaalsContact O-CB 3.28Å; S295-T299 WeakPolarHBondContact O-CB 3.25Å; S295-T299 PolarHBondContact O-N 3.3Å; S295-T299 PolarHBondContact O-OG1 3.43Å; C296-T299 PolarHBondContact O-N 3.4Å; V297-T299 VanDerWaalsContact C-N 3.34Å; V297-T299 PolarHBondContact O-N 3.3Å; T299-F301 VanDerWaalsContact C-N 3.28Å; T299-F301 PolarHBondContact O-N 3.24Å; T299-L302 PolarHBondContact O-N 3.23Å; T299-S303 WeakPolarHBondContact O-CB 3.49Å; T299-S303 PolarHBondContact O-N 2.96Å; T299-S303 PolarHBondContact O-OG 3.42Å; T299-C522 HydrophobicContact CG2-CB 3.66Å; T299-C522 WeakPolarHBondContact CG2-SG 3.49Å; T299-C522 WeakPolarHBondContact OG1-CA 3.4Å; T299-M552 HydrophobicContact CG2-CB 4.29Å; T299-M552 HydrophobicContact CG2-CE 3.24Å; T299-T556 HydrophobicContact CG2-CG2 3.83Å
300	L	88.2	Confident	85.6	Confident	96 Å²	96	56.7 Å²	56.7	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-37.5	176.3	-72.8	172.9	0	0	0	111.9	C296 V297 S303 G304 M552	C296-L300 WeakPolarHBondContact O-CG 3.35Å; C296-L300 PolarHBondContact O-N 3.43Å; V297-L300 PolarHBondContact O-N 3.44Å; L300-S303 WeakPolarHBondContact CA-OG 3.43Å; L300-S303 PolarHBondContact O-OG 2.86Å; L300-G304 PolarHBondContact O-N 3.23Å; L300-M552 HydrophobicContact CD2-CE 4.05Å; L300-M552 HydrophobicContact CD2-CG 4.18Å; L300-M552 HydrophobicContact CD2-SD 4.25Å; L300-M552 HydrophobicContact CG-CE 3.72Å; L300-M552 HydrophobicContact CG-SD 4.18Å
301	F	89.4	Confident	85.9	Confident	144 Å²	144	57 Å²	57	63%	0.632	32%	0.318	S	S	*	.	H	α-helix	trans	-67.3	-46.5	175.7	-178	-99.3	0	0	0	111.7	V297 L298 T299 G304 L305	V297-F301 PolarHBondContact O-N 3.41Å; L298-F301 PolarHBondContact O-N 2.79Å; T299-F301 VanDerWaalsContact C-N 3.28Å; T299-F301 PolarHBondContact O-N 3.24Å; F301-G304 PolarHBondContact O-N 2.93Å; F301-L305 WeakPolarHBondContact O-CB 3.48Å; F301-L305 PolarHBondContact O-N 2.65Å
302	L	87.7	Confident	86.5	Confident	58 Å²	58	64.5 Å²	64.5	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-62.6	-42.1	177.4	-72.8	170.6	0	0	0	112	L298 T299 L305 L306 L518	L298-L302 HydrophobicContact CD1-CD1 4.14Å; L298-L302 HydrophobicContact CD1-CG 4.32Å; L298-L302 HydrophobicContact CG-CD1 3.99Å; L298-L302 WeakPolarHBondContact O-CG 3.4Å; L298-L302 PolarHBondContact O-N 2.95Å; T299-L302 PolarHBondContact O-N 3.23Å; L302-L305 PolarHBondContact O-N 3.19Å; L302-L306 WeakPolarHBondContact O-CG 3.32Å; L302-L306 PolarHBondContact O-N 2.89Å; L302-L518 HydrophobicContact CB-CD1 4.4Å; L302-L518 HydrophobicContact CD1-CD1 4.37Å
303	S	87.7	Confident	86.8	Confident	10 Å²	10	66 Å²	66	7%	0.07	35%	0.35	C	S	.	.	H	α-helix	trans	-65.5	-44	175.3	64	0	0	0	0	111.2	T299 L300 L305 L306 A307 E559	T299-S303 WeakPolarHBondContact O-CB 3.49Å; T299-S303 PolarHBondContact O-N 2.96Å; T299-S303 PolarHBondContact O-OG 3.42Å; L300-S303 WeakPolarHBondContact CA-OG 3.43Å; L300-S303 PolarHBondContact O-OG 2.86Å; S303-L305 VanDerWaalsContact C-N 3.33Å; S303-L305 PolarHBondContact O-N 3.26Å; S303-L306 PolarHBondContact O-N 2.9Å; S303-A307 WeakPolarHBondContact O-CB 3.02Å; S303-A307 PolarHBondContact O-N 3.19Å; S303-E559 WeakPolarHBondContact CA-OE2 3.41Å; S303-E559 WeakPolarHBondContact CB-OE2 3.23Å
304	G	91	Very high	86.9	Confident	33 Å²	33	64.2 Å²	64.2	34%	0.34	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-40.3	176	0	0	0	0	0	113.4	L300 F301 T308	L300-G304 PolarHBondContact O-N 3.23Å; F301-G304 PolarHBondContact O-N 2.93Å; G304-T308 WeakPolarHBondContact O-CB 3.45Å; G304-T308 PolarHBondContact O-N 2.69Å; G304-T308 PolarHBondContact O-OG1 2.9Å
305	L	89.2	Confident	87.1	Confident	84 Å²	84	68.4 Å²	68.4	44%	0.44	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-47.6	174.1	178.2	63.1	0	0	0	111.4	F301 L302 S303 T308 I309	F301-L305 WeakPolarHBondContact O-CB 3.48Å; F301-L305 PolarHBondContact O-N 2.65Å; L302-L305 PolarHBondContact O-N 3.19Å; S303-L305 VanDerWaalsContact C-N 3.33Å; S303-L305 PolarHBondContact O-N 3.26Å; L305-T308 PolarHBondContact O-N 2.91Å; L305-I309 HydrophobicContact CD1-CD1 4.12Å; L305-I309 HydrophobicContact CD1-CG1 4.41Å; L305-I309 HydrophobicContact CG-CD1 3.98Å; L305-I309 VanDerWaalsContact O-CG1 3.32Å; L305-I309 WeakPolarHBondContact O-CG1 3.36Å; L305-I309 PolarHBondContact O-N 3.49Å
306	L	88	Confident	87.2	Confident	43 Å²	43	75.4 Å²	75.4	23%	0.225	37%	0.374	C	S	.	.	H	α-helix	trans	-63.3	-43.5	178.9	-74.8	167.7	0	0	0	112.4	L302 S303 T308 I309 L310 L518 L563	L302-L306 WeakPolarHBondContact O-CG 3.32Å; L302-L306 PolarHBondContact O-N 2.89Å; S303-L306 PolarHBondContact O-N 2.9Å; L306-T308 VanDerWaalsContact C-N 3.31Å; L306-T308 PolarHBondContact O-N 3.09Å; L306-I309 PolarHBondContact O-N 3.48Å; L306-L310 WeakPolarHBondContact O-CB 3.48Å; L306-L310 PolarHBondContact O-N 3.36Å; L306-L518 HydrophobicContact CD1-CD1 4.21Å; L306-L518 HydrophobicContact CD1-CD2 3.13Å; L306-L518 HydrophobicContact CD1-CG 4.26Å; L306-L563 HydrophobicContact CD2-CD2 4.3Å
307	A	90.2	Very high	87	Confident	26 Å²	26	75.5 Å²	75.5	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-59.2	-42.4	173.8	0	0	0	0	0	111.4	S303 L310 L311	S303-A307 WeakPolarHBondContact O-CB 3.02Å; S303-A307 PolarHBondContact O-N 3.19Å; A307-L310 PolarHBondContact O-N 3.33Å; A307-L311 VanDerWaalsContact O-CB 3.32Å; A307-L311 WeakPolarHBondContact O-CB 3.47Å; A307-L311 WeakPolarHBondContact O-CG 3.43Å; A307-L311 PolarHBondContact O-N 3.44Å
308	T	89.5	Confident	86.7	Confident	87 Å²	87	74.1 Å²	74.1	53%	0.534	36%	0.362	S	S	.	.	H	α-helix	trans	-65.1	-44.2	177.7	-58.2	0	0	0	0	111.8	G304 L305 L306 L311 R312	G304-T308 WeakPolarHBondContact O-CB 3.45Å; G304-T308 PolarHBondContact O-N 2.69Å; G304-T308 PolarHBondContact O-OG1 2.9Å; L305-T308 PolarHBondContact O-N 2.91Å; L306-T308 VanDerWaalsContact C-N 3.31Å; L306-T308 PolarHBondContact O-N 3.09Å; T308-L311 PolarHBondContact O-N 3.38Å; T308-R312 WeakPolarHBondContact O-CB 3.31Å; T308-R312 PolarHBondContact O-N 3.41Å
309	I	86.6	Confident	86.5	Confident	80 Å²	80	71.4 Å²	71.4	41%	0.41	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-50.5	176.3	-68.5	165.8	0	0	0	109.7	L305 L306 L311 R312 T313	L305-I309 HydrophobicContact CD1-CD1 4.12Å; L305-I309 HydrophobicContact CD1-CG1 4.41Å; L305-I309 HydrophobicContact CG-CD1 3.98Å; L305-I309 VanDerWaalsContact O-CG1 3.32Å; L305-I309 WeakPolarHBondContact O-CG1 3.36Å; L305-I309 PolarHBondContact O-N 3.49Å; L306-I309 PolarHBondContact O-N 3.48Å; I309-L311 PolarHBondContact O-N 3.26Å; I309-R312 PolarHBondContact O-N 3.1Å; I309-T313 HydrophobicContact CG2-CG2 4.38Å; I309-T313 WeakPolarHBondContact O-CG2 3.34Å; I309-T313 PolarHBondContact O-N 3.39Å; I309-T313 PolarHBondContact O-OG1 2.97Å
310	L	86.4	Confident	86.3	Confident	18 Å²	18	76.3 Å²	76.3	9%	0.094	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-47.3	179.5	179.3	69.3	0	0	0	111.9	L306 A307 T313 L314 I562 L563 Y566	L306-L310 WeakPolarHBondContact O-CB 3.48Å; L306-L310 PolarHBondContact O-N 3.36Å; A307-L310 PolarHBondContact O-N 3.33Å; L310-T313 PolarHBondContact O-OG1 3.44Å; L310-L314 HydrophobicContact CD1-CD1 3.96Å; L310-L314 HydrophobicContact CD1-CG 4.33Å; L310-L314 HydrophobicContact CG-CD1 3.87Å; L310-L314 VanDerWaalsContact O-CB 3.28Å; L310-L314 WeakPolarHBondContact O-CB 3.39Å; L310-L314 WeakPolarHBondContact O-CD1 3.28Å; L310-L314 WeakPolarHBondContact O-CG 3.35Å; L310-L314 PolarHBondContact O-N 3.42Å; L310-I562 HydrophobicContact CD1-CG2 4.25Å; L310-I562 HydrophobicContact CD2-CB 4.41Å; L310-I562 HydrophobicContact CD2-CG2 3.64Å; L310-L563 HydrophobicContact CD1-CD1 3.97Å; L310-Y566 HydrophobicContact CD1-CD1 4.48Å
311	L	87.3	Confident	85.6	Confident	98 Å²	98	73 Å²	73	51%	0.513	35%	0.353	S	S	.	.	H	α-helix	trans	-65.8	-39.7	178.9	-72.5	172.8	0	0	0	111.8	A307 T308 I309 R315	A307-L311 VanDerWaalsContact O-CB 3.32Å; A307-L311 WeakPolarHBondContact O-CB 3.47Å; A307-L311 WeakPolarHBondContact O-CG 3.43Å; A307-L311 PolarHBondContact O-N 3.44Å; T308-L311 PolarHBondContact O-N 3.38Å; I309-L311 PolarHBondContact O-N 3.26Å; L311-R315 VanDerWaalsContact O-CB 3.3Å; L311-R315 WeakPolarHBondContact O-CB 3.31Å; L311-R315 VanDerWaalsContact O-CG 3.25Å; L311-R315 WeakPolarHBondContact O-CG 3.48Å; L311-R315 PolarHBondContact O-N 2.94Å
312	R	89.4	Confident	84.8	Confident	193 Å²	193	70 Å²	70	73%	0.728	35%	0.347	S	S	*	.	H	α-helix	trans	-67	-45	178.4	-176.3	179.6	177.1	-174.1	-0.4	111.4	T308 I309 R316	T308-R312 WeakPolarHBondContact O-CB 3.31Å; T308-R312 PolarHBondContact O-N 3.41Å; I309-R312 PolarHBondContact O-N 3.1Å; R312-R316 VanDerWaalsContact O-CB 3.31Å; R312-R316 WeakPolarHBondContact O-CB 3.26Å; R312-R316 PolarHBondContact O-N 3.45Å
313	T	84.3	Confident	84.2	Confident	33 Å²	33	73.6 Å²	73.6	20%	0.202	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-46.4	177.7	52.9	0	0	0	0	110.7	I309 L310 R315 R316 D317	I309-T313 HydrophobicContact CG2-CG2 4.38Å; I309-T313 WeakPolarHBondContact O-CG2 3.34Å; I309-T313 PolarHBondContact O-N 3.39Å; I309-T313 PolarHBondContact O-OG1 2.97Å; L310-T313 PolarHBondContact O-OG1 3.44Å; T313-R315 PolarHBondContact O-N 3.28Å; T313-R316 PolarHBondContact O-N 2.98Å; T313-D317 WeakPolarHBondContact O-CB 3.2Å; T313-D317 PolarHBondContact O-N 2.91Å
314	L	84.3	Confident	83.3	Confident	22 Å²	22	76 Å²	76	12%	0.115	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-46.9	176.9	-74	170.5	0	0	0	112.5	L310 D317 I318 Y566 F640	L310-L314 HydrophobicContact CD1-CD1 3.96Å; L310-L314 HydrophobicContact CD1-CG 4.33Å; L310-L314 HydrophobicContact CG-CD1 3.87Å; L310-L314 VanDerWaalsContact O-CB 3.28Å; L310-L314 WeakPolarHBondContact O-CB 3.39Å; L310-L314 WeakPolarHBondContact O-CD1 3.28Å; L310-L314 WeakPolarHBondContact O-CG 3.35Å; L310-L314 PolarHBondContact O-N 3.42Å; L314-D317 PolarHBondContact O-N 3.11Å; L314-I318 WeakPolarHBondContact O-CB 3.19Å; L314-I318 WeakPolarHBondContact O-CG1 3.49Å; L314-I318 PolarHBondContact O-N 3.39Å; L314-Y566 HydrophobicContact CD2-CD1 4.42Å; L314-Y566 HydrophobicContact CD2-CD2 3.65Å; L314-Y566 HydrophobicContact CD2-CE1 4.13Å; L314-Y566 HydrophobicContact CD2-CE2 3.32Å; L314-Y566 HydrophobicContact CD2-CG 4.18Å; L314-F640 HydrophobicContact CD1-CE2 3.77Å; L314-F640 HydrophobicContact CD1-CZ 4.37Å; L314-F640 HydrophobicContact CD2-CE2 4.11Å; L314-F640 HydrophobicContact CD2-CZ 4.03Å
315	R	86.5	Confident	82.2	Confident	188 Å²	188	80.5 Å²	80.5	71%	0.709	39%	0.386	S	S	*	.	H	α-helix	trans	-61.8	-45.7	178.2	-78.1	179.7	-177.1	-85.3	2	111.8	L311 T313 A319	L311-R315 VanDerWaalsContact O-CB 3.3Å; L311-R315 WeakPolarHBondContact O-CB 3.31Å; L311-R315 VanDerWaalsContact O-CG 3.25Å; L311-R315 WeakPolarHBondContact O-CG 3.48Å; L311-R315 PolarHBondContact O-N 2.94Å; T313-R315 PolarHBondContact O-N 3.28Å; R315-A319 VanDerWaalsContact O-CB 3.3Å; R315-A319 WeakPolarHBondContact O-CB 3.49Å; R315-A319 PolarHBondContact O-N 3.05Å
316	R	85	Confident	81.2	Confident	160 Å²	160	81 Å²	81	60%	0.604	40%	0.397	S	S	*	.	H	α-helix	trans	-62	-44.8	178.2	-175.5	-177.7	67.3	166.4	-0.4	111.3	R312 T313 A319 R320	R312-R316 VanDerWaalsContact O-CB 3.31Å; R312-R316 WeakPolarHBondContact O-CB 3.26Å; R312-R316 PolarHBondContact O-N 3.45Å; T313-R316 PolarHBondContact O-N 2.98Å; R316-A319 PolarHBondContact O-N 3.41Å; R316-R320 WeakPolarHBondContact O-CB 3.33Å; R316-R320 PolarHBondContact O-N 3.42Å
317	D	81.6	Confident	80	Confident	17 Å²	17	81.8 Å²	81.8	9%	0.091	41%	0.409	C	S	.	.	H	α-helix	trans	-67.6	-43.9	-179.1	-86.3	24.8	0	0	0	111.5	T313 L314 R320 Y321 Y566	T313-D317 WeakPolarHBondContact O-CB 3.2Å; T313-D317 PolarHBondContact O-N 2.91Å; L314-D317 PolarHBondContact O-N 3.11Å; D317-R320 PolarHBondContact O-N 3.45Å; D317-R320 IonicContact OD1-CZ 3.83Å; D317-R320 IonicContact OD1-NH2 3.32Å; D317-R320 PolarHBondContact OD1-NH2 3.21Å; D317-R320 IonicContact OD2-NH2 3.46Å; D317-R320 PolarHBondContact OD2-NH2 2.96Å; D317-Y321 HydrophobicContact CB-CE2 4.37Å; D317-Y321 WeakPolarHBondContact O-CD2 3.45Å; D317-Y321 PolarHBondContact O-N 3.46Å; D317-Y321 VanDerWaalsContact O-N 3.08Å; D317-Y566 PolarHBondContact OD2-OH 3.26Å
318	I	79.7	Confident	78.5	Confident	59 Å²	59	86.8 Å²	86.8	30%	0.303	44%	0.437	S	S	.	.	H	α-helix	trans	-60.7	-47.5	175.5	-68.6	166.8	0	0	0	110.7	L314 R320 Y321 T322 W336	L314-I318 WeakPolarHBondContact O-CB 3.19Å; L314-I318 WeakPolarHBondContact O-CG1 3.49Å; L314-I318 PolarHBondContact O-N 3.39Å; I318-R320 PolarHBondContact O-N 3Å; I318-Y321 PolarHBondContact O-N 2.95Å; I318-T322 PolarHBondContact O-N 2.66Å; I318-T322 PolarHBondContact O-OG1 2.95Å; I318-W336 HydrophobicContact CG1-CZ2 4.42Å
319	A	80.6	Confident	76.8	Confident	45 Å²	45	85.1 Å²	85.1	37%	0.372	43%	0.432	S	S	.	.	H	α-helix	trans	-59.2	-46.2	178.7	0	0	0	0	0	112	R315 R316 Y321 T322 E323	R315-A319 VanDerWaalsContact O-CB 3.3Å; R315-A319 WeakPolarHBondContact O-CB 3.49Å; R315-A319 PolarHBondContact O-N 3.05Å; R316-A319 PolarHBondContact O-N 3.41Å; A319-Y321 VanDerWaalsContact C-N 3.3Å; A319-Y321 PolarHBondContact O-N 2.98Å; A319-T322 PolarHBondContact O-N 3.45Å; A319-T322 VanDerWaalsContact O-N 3.14Å; A319-E323 PolarHBondContact O-N 3.45Å
320	R	80	Confident	75.3	Confident	108 Å²	108	88.4 Å²	88.4	41%	0.408	46%	0.455	S	S	.	.	H	α-helix	trans	-57.1	-42.7	176.1	-177.8	179.6	64.3	-163.4	-7.9	112	R316 D317 I318 L324	R316-R320 WeakPolarHBondContact O-CB 3.33Å; R316-R320 PolarHBondContact O-N 3.42Å; D317-R320 PolarHBondContact O-N 3.45Å; D317-R320 IonicContact OD1-CZ 3.83Å; D317-R320 IonicContact OD1-NH2 3.32Å; D317-R320 PolarHBondContact OD1-NH2 3.21Å; D317-R320 IonicContact OD2-NH2 3.46Å; D317-R320 PolarHBondContact OD2-NH2 2.96Å; I318-R320 PolarHBondContact O-N 3Å; R320-L324 HydrophobicContact CG-CD1 4.13Å; R320-L324 VanDerWaalsContact O-CG 3.3Å; R320-L324 WeakPolarHBondContact O-CG 3.32Å; R320-L324 PolarHBondContact O-N 3.44Å; R320-L324 VanDerWaalsContact O-N 3.14Å
321	Y	73.6	Confident	73.7	Confident	27 Å²	27	93.1 Å²	93.1	11%	0.106	48%	0.477	C	S	.	.	H	α-helix	trans	-69.4	-35.6	178.2	-69.9	-62.5	0	0	0	112.9	D317 I318 A319 E325 S334 W336 K337	D317-Y321 HydrophobicContact CB-CE2 4.37Å; D317-Y321 WeakPolarHBondContact O-CD2 3.45Å; D317-Y321 PolarHBondContact O-N 3.46Å; D317-Y321 VanDerWaalsContact O-N 3.08Å; I318-Y321 PolarHBondContact O-N 2.95Å; A319-Y321 VanDerWaalsContact C-N 3.3Å; A319-Y321 PolarHBondContact O-N 2.98Å; Y321-E325 WeakPolarHBondContact O-CB 3.39Å; Y321-E325 PolarHBondContact O-N 2.94Å; Y321-S334 PolarHBondContact OH-O 3.21Å; Y321-S334 VanDerWaalsContact OH-O 3.11Å; Y321-W336 AromaticContact CE2-NE1 3.68Å; Y321-K337 HydrophobicContact CD1-CD 4.16Å; Y321-K337 HydrophobicContact CD2-CD 4.09Å; Y321-K337 HydrophobicContact CD2-CG 4.48Å; Y321-K337 HydrophobicContact CG-CD 3.89Å
322	T	73.1	Confident	72.2	Confident	81 Å²	81	96.5 Å²	96.5	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-67.3	-40.2	176.5	-59.8	0	0	0	0	111.9	I318 A319 E325 S326	I318-T322 PolarHBondContact O-N 2.66Å; I318-T322 PolarHBondContact O-OG1 2.95Å; A319-T322 PolarHBondContact O-N 3.45Å; A319-T322 VanDerWaalsContact O-N 3.14Å; T322-E325 PolarHBondContact O-N 3.38Å; T322-S326 PolarHBondContact O-N 3.3Å
323	E	74.6	Confident	70.9	Confident	134 Å²	134	91 Å²	91	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-62.7	-44.3	174.8	-73	172.3	-173.1	0	0	111.6	A319 S326 A327	A319-E323 PolarHBondContact O-N 3.45Å; E323-S326 PolarHBondContact O-N 3.26Å; E323-S326 PolarHBondContact O-OG 3.19Å; E323-A327 PolarHBondContact O-N 3.46Å
324	L	68.5	Low	70.1	Confident	61 Å²	61	91.7 Å²	91.7	32%	0.319	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-40.2	178	-72.4	167.9	0	0	0	112.8	R320 S326 A327	R320-L324 HydrophobicContact CG-CD1 4.13Å; R320-L324 VanDerWaalsContact O-CG 3.3Å; R320-L324 WeakPolarHBondContact O-CG 3.32Å; R320-L324 PolarHBondContact O-N 3.44Å; R320-L324 VanDerWaalsContact O-N 3.14Å; L324-S326 VanDerWaalsContact C-N 3.26Å; L324-S326 PolarHBondContact O-N 2.94Å; L324-A327 PolarHBondContact O-N 2.87Å; L324-A327 VanDerWaalsContact O-N 3.15Å
325	E	67.9	Low	69.8	Low	126 Å²	126	91.2 Å²	91.2	59%	0.589	48%	0.479	S	S	*	.	H	α-helix	trans	-61.3	-35.7	175.7	-168.5	177.4	168.2	0	0	111.6	Y321 T322	Y321-E325 WeakPolarHBondContact O-CB 3.39Å; Y321-E325 PolarHBondContact O-N 2.94Å; T322-E325 PolarHBondContact O-N 3.38Å
326	S	68.2	Low	69.7	Low	96 Å²	96	82.5 Å²	82.5	67%	0.671	45%	0.446	S	S	*	.	H	α-helix	trans	-72.8	-25.5	176.1	75.8	0	0	0	0	114.1	T322 E323 L324 T328	T322-S326 PolarHBondContact O-N 3.3Å; E323-S326 PolarHBondContact O-N 3.26Å; E323-S326 PolarHBondContact O-OG 3.19Å; L324-S326 VanDerWaalsContact C-N 3.26Å; L324-S326 PolarHBondContact O-N 2.94Å; S326-T328 PolarHBondContact O-N 3.35Å
327	A	63.5	Low	69.6	Low	58 Å²	58	76.2 Å²	76.2	48%	0.479	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	6.8	-173.3	0	0	0	0	0	114.1	E323 L324 A329	E323-A327 PolarHBondContact O-N 3.46Å; L324-A327 PolarHBondContact O-N 2.87Å; L324-A327 VanDerWaalsContact O-N 3.15Å; A327-A329 PolarHBondContact O-N 3.45Å
328	T	57.2	Low	69.8	Low	132 Å²	132	77.4 Å²	77.4	81%	0.81	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	1.6	-175.6	61.6	0	0	0	0	115.8	S326 V330	S326-T328 PolarHBondContact O-N 3.35Å; T328-V330 PolarHBondContact O-N 3.24Å; T328-V330 VanDerWaalsContact O-N 3.1Å
329	A	54.5	Low	70.2	Confident	51 Å²	51	74.7 Å²	74.7	42%	0.421	42%	0.416	S	S	.	.			trans	-64.8	114.1	168.3	0	0	0	0	0	106.9	A327 Q331	A327-A329 PolarHBondContact O-N 3.45Å; A329-Q331 PolarHBondContact O-N 3.28Å
330	V	55.4	Low	70.5	Confident	149 Å²	149	74 Å²	74	90%	0.903	41%	0.405	S	S	*	.			trans	-64.5	70.9	163.8	-176.6	0	0	0	0	106.7	T328 E332	T328-V330 PolarHBondContact O-N 3.24Å; T328-V330 VanDerWaalsContact O-N 3.1Å; V330-E332 PolarHBondContact O-N 3.24Å
331	Q	51.5	Low	70.9	Confident	117 Å²	117	69 Å²	69	55%	0.547	39%	0.387	S	S	.	.			trans	-72.8	122.5	169.1	-170.4	73.2	16.4	0	0	105.3	A329 E333	A329-Q331 PolarHBondContact O-N 3.28Å; Q331-E333 PolarHBondContact O-N 3.25Å; Q331-E333 VanDerWaalsContact O-N 3.07Å
332	E	57.4	Low	71.8	Confident	170 Å²	170	68 Å²	68	79%	0.794	38%	0.383	S	S	*	.			trans	-46.3	119.2	163.2	-64	178.3	162.1	0	0	107.4	V330 S334	V330-E332 PolarHBondContact O-N 3.24Å; E332-S334 PolarHBondContact O-N 2.94Å
333	E	60.8	Low	72.7	Confident	78 Å²	78	64.1 Å²	64.1	36%	0.364	36%	0.359	S	S	.	.			trans	-45.6	121.8	171.9	-66.6	-176.2	169.4	0	0	106.3	Q331 L338 H340	Q331-E333 PolarHBondContact O-N 3.25Å; Q331-E333 VanDerWaalsContact O-N 3.07Å; E333-L338 HydrophobicContact CB-CB 4.12Å; E333-L338 HydrophobicContact CB-CD1 4Å; E333-L338 WeakPolarHBondContact O-CB 3.47Å; E333-L338 VanDerWaalsContact O-CD1 3.3Å; E333-L338 WeakPolarHBondContact O-CD1 3.46Å; E333-L338 WeakPolarHBondContact O-CD2 3.26Å; E333-L338 WeakPolarHBondContact O-CG 3.49Å; E333-H340 IonicContact OE2-CE1 3.18Å; E333-H340 PolarHBondContact OE2-CE1 3.31Å; E333-H340 IonicContact OE2-ND1 3.09Å; E333-H340 PolarHBondContact OE2-ND1 3.17Å; E333-H340 VanDerWaalsContact OE2-ND1 3.09Å
334	S	67.4	Low	73.6	Confident	47 Å²	47	58.1 Å²	58.1	33%	0.329	33%	0.331	S	S	.	.			trans	-119.6	153.1	-176.8	44.7	0	0	0	0	110	Y321 E332	Y321-S334 PolarHBondContact OH-O 3.21Å; Y321-S334 VanDerWaalsContact OH-O 3.11Å; E332-S334 PolarHBondContact O-N 2.94Å
335	G	78.4	Confident	74.8	Confident	11 Å²	11	58.2 Å²	58.2	11%	0.113	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	66.1	-136.2	179.1	0	0	0	0	0	113	K337 L338 E572	G335-K337 VanDerWaalsContact C-N 3.34Å; G335-K337 PolarHBondContact O-N 3.46Å; G335-L338 WeakPolarHBondContact O-CB 3.39Å; G335-L338 PolarHBondContact O-N 3.4Å; G335-E572 PolarHBondContact N-OE1 3.28Å
336	W	84.7	Confident	76.1	Confident	5 Å²	5	55.3 Å²	55.3	2%	0.019	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-67.3	-29	-169.7	72.3	-92.7	0	0	0	114.1	I318 Y321 L338 V339 Y566 L569 I644 Y645 V648	I318-W336 HydrophobicContact CG1-CZ2 4.42Å; Y321-W336 AromaticContact CE2-NE1 3.68Å; W336-L338 VanDerWaalsContact C-N 3.3Å; W336-L338 PolarHBondContact O-N 3.03Å; W336-V339 VanDerWaalsContact O-CG2 3.3Å; W336-V339 WeakPolarHBondContact O-CG2 3.31Å; W336-V339 PolarHBondContact O-N 3.36Å; W336-Y566 AromaticContact CD1-CE2 3.87Å; W336-Y566 HydrophobicContact CG-CE2 4.4Å; W336-L569 VanDerWaalsContact CA-O 3.25Å; W336-L569 WeakPolarHBondContact CA-O 3.37Å; W336-L569 HydrophobicContact CB-CB 3.75Å; W336-L569 PolarHBondContact N-O 2.96Å; W336-I644 HydrophobicContact CE3-CD1 3.95Å; W336-I644 HydrophobicContact CE3-CG1 4.34Å; W336-I644 HydrophobicContact CH2-CB 4.08Å; W336-I644 HydrophobicContact CZ3-CB 3.98Å; W336-I644 HydrophobicContact CZ3-CD1 4.09Å; W336-I644 HydrophobicContact CZ3-CG1 3.98Å; W336-Y645 HydrophobicContact CE3-CD1 4.45Å; W336-Y645 AromaticContact CE3-CE1 3.86Å; W336-Y645 HydrophobicContact CE3-CE1 3.86Å; W336-Y645 HydrophobicContact CE3-CE2 4.29Å; W336-Y645 AromaticContact CE3-CZ 3.79Å; W336-Y645 HydrophobicContact CZ3-CD1 4.15Å; W336-Y645 HydrophobicContact CZ3-CE1 4.02Å; W336-Y645 PolarHBondContact O-OH 3.07Å; W336-V648 HydrophobicContact CH2-CG2 3.6Å; W336-V648 HydrophobicContact CZ3-CG2 3.58Å
337	K	83.9	Confident	77.3	Confident	28 Å²	28	51.6 Å²	51.6	12%	0.122	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-65	-36.5	178.2	-74.9	-168	173.7	-165.2	0	112.1	Y321 G335 V339 H340 V648	Y321-K337 HydrophobicContact CD1-CD 4.16Å; Y321-K337 HydrophobicContact CD2-CD 4.09Å; Y321-K337 HydrophobicContact CD2-CG 4.48Å; Y321-K337 HydrophobicContact CG-CD 3.89Å; G335-K337 VanDerWaalsContact C-N 3.34Å; G335-K337 PolarHBondContact O-N 3.46Å; K337-V339 PolarHBondContact O-N 2.85Å; K337-H340 VanDerWaalsContact O-CB 3.31Å; K337-H340 WeakPolarHBondContact O-CB 3.33Å; K337-H340 PolarHBondContact O-N 2.82Å; K337-H340 VanDerWaalsContact O-N 3.13Å; K337-H340 PolarHBondContact O-ND1 3.47Å; K337-V648 HydrophobicContact CG-CG2 4.42Å
338	L	84	Confident	78.6	Confident	42 Å²	42	55.2 Å²	55.2	22%	0.22	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-62.2	-26.7	-177.3	-175.1	53.7	0	0	0	113.7	E333 G335 W336 H340	E333-L338 HydrophobicContact CB-CB 4.12Å; E333-L338 HydrophobicContact CB-CD1 4Å; E333-L338 WeakPolarHBondContact O-CB 3.47Å; E333-L338 VanDerWaalsContact O-CD1 3.3Å; E333-L338 WeakPolarHBondContact O-CD1 3.46Å; E333-L338 WeakPolarHBondContact O-CD2 3.26Å; E333-L338 WeakPolarHBondContact O-CG 3.49Å; G335-L338 WeakPolarHBondContact O-CB 3.39Å; G335-L338 PolarHBondContact O-N 3.4Å; W336-L338 VanDerWaalsContact C-N 3.3Å; W336-L338 PolarHBondContact O-N 3.03Å; L338-H340 VanDerWaalsContact C-N 3.32Å
339	V	88.5	Confident	80.4	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-93	13.9	-179.2	-60.1	0	0	0	0	113.4	W336 K337 G341 D342 V343 L569 E572 Y645	W336-V339 VanDerWaalsContact O-CG2 3.3Å; W336-V339 WeakPolarHBondContact O-CG2 3.31Å; W336-V339 PolarHBondContact O-N 3.36Å; K337-V339 PolarHBondContact O-N 2.85Å; V339-G341 PolarHBondContact O-N 3.29Å; V339-D342 PolarHBondContact O-N 3.16Å; V339-V343 PolarHBondContact O-N 2.98Å; V339-V343 VanDerWaalsContact O-N 3.09Å; V339-L569 HydrophobicContact CG2-CD2 4.15Å; V339-E572 HydrophobicContact CG1-CB 4Å; V339-Y645 WeakPolarHBondContact CG2-OH 3.47Å
340	H	87.6	Confident	82.4	Confident	30 Å²	30	56.6 Å²	56.6	14%	0.139	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-39.5	177.7	69.5	-91.1	0	0	0	112.4	E333 K337 L338 D342 V490 Y645	E333-H340 IonicContact OE2-CE1 3.18Å; E333-H340 PolarHBondContact OE2-CE1 3.31Å; E333-H340 IonicContact OE2-ND1 3.09Å; E333-H340 PolarHBondContact OE2-ND1 3.17Å; E333-H340 VanDerWaalsContact OE2-ND1 3.09Å; K337-H340 VanDerWaalsContact O-CB 3.31Å; K337-H340 WeakPolarHBondContact O-CB 3.33Å; K337-H340 PolarHBondContact O-N 2.82Å; K337-H340 VanDerWaalsContact O-N 3.13Å; K337-H340 PolarHBondContact O-ND1 3.47Å; L338-H340 VanDerWaalsContact C-N 3.32Å; H340-D342 VanDerWaalsContact C-N 3.26Å; H340-D342 PolarHBondContact O-N 3.45Å; H340-V490 HydrophobicContact CB-CG2 4.48Å; H340-V490 VanDerWaalsContact O-CG2 3.23Å; H340-V490 WeakPolarHBondContact O-CG2 3.35Å; H340-Y645 VanDerWaalsContact CA-CE1 3.42Å; H340-Y645 HydrophobicContact CB-CD1 3.72Å; H340-Y645 HydrophobicContact CB-CE1 3.65Å
341	G	87.9	Confident	84.3	Confident	3 Å²	3	51.2 Å²	51.2	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-8.7	-179.2	0	0	0	0	0	115.3	V339 T492 N493	V339-G341 PolarHBondContact O-N 3.29Å; G341-T492 CarbonylContact O-C 3.55Å; G341-T492 WeakPolarHBondContact O-CA 3.36Å; G341-N493 PolarHBondContact O-N 2.79Å
342	D	91.9	Very high	86.5	Confident	6 Å²	6	49 Å²	49	3%	0.032	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-11.9	-177.6	-81.2	-50.7	0	0	0	114	V339 H340 F344 R345 R497 Y574	V339-D342 PolarHBondContact O-N 3.16Å; H340-D342 VanDerWaalsContact C-N 3.26Å; H340-D342 PolarHBondContact O-N 3.45Å; D342-F344 VanDerWaalsContact C-N 3.28Å; D342-F344 PolarHBondContact O-N 3.44Å; D342-R345 WeakPolarHBondContact O-CB 3.18Å; D342-R345 PolarHBondContact O-N 2.89Å; D342-R345 IonicContact OD1-CZ 3.6Å; D342-R345 IonicContact OD1-NE 3.41Å; D342-R345 PolarHBondContact OD1-NE 3.29Å; D342-R345 VanDerWaalsContact OD1-NE 3.16Å; D342-R345 IonicContact OD1-NH2 2.76Å; D342-R345 PolarHBondContact OD1-NH2 2.91Å; D342-R497 WeakPolarHBondContact OD2-CB 3.12Å; D342-R497 PolarHBondContact OD2-N 2.87Å; D342-Y574 HydrophobicContact CB-CD1 3.68Å; D342-Y574 HydrophobicContact CB-CD2 3.83Å; D342-Y574 HydrophobicContact CB-CE1 4.03Å; D342-Y574 HydrophobicContact CB-CE2 4.18Å; D342-Y574 HydrophobicContact CB-CG 3.58Å; D342-Y574 WeakPolarHBondContact O-CD2 3.32Å
343	V	92.1	Very high	88.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.7	-171.4	75.5	0	0	0	0	114.6	V339 V490 L569 W576 V641 Y645	V339-V343 PolarHBondContact O-N 2.98Å; V339-V343 VanDerWaalsContact O-N 3.09Å; V343-V490 HydrophobicContact CG1-CG2 4.32Å; V343-L569 HydrophobicContact CG2-CD2 3.88Å; V343-W576 PolarHBondContact O-NE1 2.92Å; V343-V641 HydrophobicContact CG1-CG1 4.42Å; V343-V641 HydrophobicContact CG2-CG1 3.6Å; V343-Y645 HydrophobicContact CB-CE2 4.02Å; V343-Y645 HydrophobicContact CG1-CD1 4.39Å; V343-Y645 HydrophobicContact CG1-CD2 3.86Å; V343-Y645 HydrophobicContact CG1-CE1 4.32Å; V343-Y645 HydrophobicContact CG1-CE2 3.82Å; V343-Y645 HydrophobicContact CG1-CG 4.16Å; V343-Y645 HydrophobicContact CG2-CD2 4.3Å; V343-Y645 HydrophobicContact CG2-CE2 3.63Å
344	F	94.2	Very high	90.1	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.035	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	8	177.8	-68	-68.6	0	0	0	113.9	D342 F412 T488 P489 V490 T492 W577 V641 R642	D342-F344 VanDerWaalsContact C-N 3.28Å; D342-F344 PolarHBondContact O-N 3.44Å; F344-F412 HydrophobicContact CD1-CZ 4.06Å; F344-T488 HydrophobicContact CB-CG2 3.82Å; F344-T488 HydrophobicContact CD1-CG2 3.92Å; F344-T488 HydrophobicContact CD2-CG2 4.11Å; F344-T488 HydrophobicContact CG-CG2 3.66Å; F344-P489 HydrophobicContact CE2-CG 3.67Å; F344-P489 HydrophobicContact CZ-CG 3.91Å; F344-V490 HydrophobicContact CD2-CG2 3.74Å; F344-V490 HydrophobicContact CE2-CG2 3.77Å; F344-T492 HydrophobicContact CB-CG2 3.85Å; F344-W577 HydrophobicContact CD1-CZ2 4.4Å; F344-V641 HydrophobicContact CE1-CG1 3.96Å; F344-V641 HydrophobicContact CZ-CG1 3.79Å; F344-R642 HydrophobicContact CE1-CG 3.72Å; F344-R642 HydrophobicContact CZ-CG 3.84Å
345	R	94.2	Very high	91.6	Very high	63 Å²	63	35 Å²	35	24%	0.238	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-59.8	131.5	175.5	-175	176.5	-64.3	-83.1	-3.1	109.8	D342 N493 W577	D342-R345 WeakPolarHBondContact O-CB 3.18Å; D342-R345 PolarHBondContact O-N 2.89Å; D342-R345 IonicContact OD1-CZ 3.6Å; D342-R345 IonicContact OD1-NE 3.41Å; D342-R345 PolarHBondContact OD1-NE 3.29Å; D342-R345 VanDerWaalsContact OD1-NE 3.16Å; D342-R345 IonicContact OD1-NH2 2.76Å; D342-R345 PolarHBondContact OD1-NH2 2.91Å; R345-N493 PolarHBondContact NH2-O 3.5Å; R345-W577 PolarHBondContact O-NE1 2.78Å
346	P	93.6	Very high	92.5	Very high	65 Å²	65	35.3 Å²	35.3	42%	0.422	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-54.9	141.2	178.5	-28.5	35.6	0	0	0	112.7	F413	P346-F413 HydrophobicContact CB-CB 4.04Å; P346-F413 HydrophobicContact CB-CD1 4.23Å; P346-F413 HydrophobicContact CB-CG 4.34Å; P346-F413 HydrophobicContact CG-CB 4.47Å
347	P	95	Very high	93.1	Very high	18 Å²	18	35 Å²	35	12%	0.117	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-72.2	155.9	176.8	29.3	-33.3	0	0	0	112.2	G350 F353 F413 W577	P347-G350 PolarHBondContact O-N 2.83Å; P347-F353 HydrophobicContact CG-CG 4.37Å; P347-F413 HydrophobicContact CG-CD2 4.2Å; P347-F413 HydrophobicContact CG-CE1 4.05Å; P347-F413 HydrophobicContact CG-CE2 3.68Å; P347-F413 HydrophobicContact CG-CZ 3.61Å; P347-W577 HydrophobicContact CB-CB 3.67Å; P347-W577 HydrophobicContact CB-CG 3.83Å; P347-W577 HydrophobicContact CG-CB 3.98Å; P347-W577 HydrophobicContact CG-CD2 4.4Å; P347-W577 HydrophobicContact CG-CG 3.92Å
348	N	91.3	Very high	93.8	Very high	133 Å²	133	33.7 Å²	33.7	71%	0.711	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	141.5	164.5	-66.7	-5.9	0	0	0	109.3	G350 W578	N348-G350 VanDerWaalsContact C-N 3.3Å; N348-G350 PolarHBondContact O-N 3.26Å; N348-W578 PolarHBondContact O-NE1 2.86Å
349	W	94.8	Very high	94.4	Very high	201 Å²	201	31.8 Å²	31.8	76%	0.761	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	38.3	179.9	-50.5	-12.9	0	0	0	114.3	M351 L352 F353 W578	W349-M351 PolarHBondContact O-N 3.37Å; W349-L352 HydrophobicContact CB-CB 4.48Å; W349-L352 HydrophobicContact CE3-CD2 4.37Å; W349-L352 PolarHBondContact O-N 2.92Å; W349-F353 PolarHBondContact O-N 3.39Å; W349-F353 VanDerWaalsContact O-N 3.17Å; W349-W578 HydrophobicContact CB-CZ2 3.97Å
350	G	95.3	Very high	94.9	Very high	12 Å²	12	31.7 Å²	31.7	12%	0.124	16%	0.156	C	C	.	.	H	α-helix	trans	-52.8	-23.4	179.6	0	0	0	0	0	115.6	P347 N348 S354	P347-G350 PolarHBondContact O-N 2.83Å; N348-G350 VanDerWaalsContact C-N 3.3Å; N348-G350 PolarHBondContact O-N 3.26Å; G350-S354 PolarHBondContact O-N 3.09Å; G350-S354 PolarHBondContact O-OG 3.45Å
351	M	96.5	Very high	95.4	Very high	36 Å²	36	31 Å²	31	18%	0.177	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-49.1	170.9	178.9	63.1	87.3	0	0	113	W349 F353 S354 V355 Y410 R417 T420 N421 L424	W349-M351 PolarHBondContact O-N 3.37Å; M351-F353 VanDerWaalsContact C-N 3.31Å; M351-S354 PolarHBondContact O-OG 2.99Å; M351-V355 VanDerWaalsContact O-CG2 3.26Å; M351-V355 WeakPolarHBondContact O-CG2 3.31Å; M351-V355 PolarHBondContact O-N 3.24Å; M351-Y410 HydrophobicContact CB-CD2 4.41Å; M351-Y410 HydrophobicContact CB-CE2 3.8Å; M351-Y410 HydrophobicContact CE-CD2 4.5Å; M351-Y410 HydrophobicContact CE-CE1 3.88Å; M351-Y410 HydrophobicContact CE-CE2 3.7Å; M351-Y410 WeakPolarHBondContact CE-OH 3.38Å; M351-Y410 HydrophobicContact CG-CE2 4.42Å; M351-Y410 HydrophobicContact SD-CD2 4.1Å; M351-Y410 HydrophobicContact SD-CE2 3.77Å; M351-R417 HydrophobicContact CE-CB 4.39Å; M351-T420 HydrophobicContact CE-CG2 4.08Å; M351-N421 HydrophobicContact CE-CB 3.8Å; M351-N421 WeakPolarHBondContact SD-CA 3.49Å; M351-N421 HydrophobicContact SD-CB 3.41Å; M351-N421 WeakPolarHBondContact SD-CB 3.3Å; M351-L424 HydrophobicContact CG-CD2 3.92Å
352	L	96.1	Very high	95.8	Very high	69 Å²	69	31 Å²	31	36%	0.361	15%	0.153	S	C	.	.	H	α-helix	trans	-68.4	-38.6	179.2	179.9	63.6	0	0	0	110	W349 S354 V355 V356 W578	W349-L352 HydrophobicContact CB-CB 4.48Å; W349-L352 HydrophobicContact CE3-CD2 4.37Å; W349-L352 PolarHBondContact O-N 2.92Å; L352-S354 PolarHBondContact O-N 3.22Å; L352-V355 PolarHBondContact O-N 3.34Å; L352-V356 HydrophobicContact CD1-CG2 4.35Å; L352-V356 HydrophobicContact CG-CG2 4.47Å; L352-V356 WeakPolarHBondContact O-CG2 3.35Å; L352-V356 PolarHBondContact O-N 3Å; L352-W578 HydrophobicContact CB-CH2 4.08Å; L352-W578 HydrophobicContact CD2-CH2 4.05Å; L352-W578 HydrophobicContact CG-CH2 3.96Å
353	F	97.6	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.1	-52.2	176	-171.7	-83.7	0	0	0	111.8	P347 W349 M351 V355 V356 V357 I409 F413 W577 W578 L581 F634	P347-F353 HydrophobicContact CG-CG 4.37Å; W349-F353 PolarHBondContact O-N 3.39Å; W349-F353 VanDerWaalsContact O-N 3.17Å; M351-F353 VanDerWaalsContact C-N 3.31Å; F353-V355 VanDerWaalsContact C-N 3.31Å; F353-V355 PolarHBondContact O-N 2.69Å; F353-V356 PolarHBondContact O-N 3.03Å; F353-V357 HydrophobicContact CD1-CG2 3.99Å; F353-V357 HydrophobicContact CE1-CG2 3.67Å; F353-V357 HydrophobicContact CZ-CG2 4.19Å; F353-V357 WeakPolarHBondContact O-CG2 3.18Å; F353-V357 PolarHBondContact O-N 3.09Å; F353-I409 HydrophobicContact CD1-CG2 3.99Å; F353-I409 HydrophobicContact CE1-CG2 4.16Å; F353-F413 HydrophobicContact CB-CE2 4.37Å; F353-F413 AromaticContact CD1-CE2 3.56Å; F353-F413 HydrophobicContact CD1-CE2 3.56Å; F353-F413 AromaticContact CD1-CZ 3.79Å; F353-F413 HydrophobicContact CD1-CZ 3.79Å; F353-F413 HydrophobicContact CE1-CE2 4.17Å; F353-F413 AromaticContact CE1-CZ 3.92Å; F353-F413 HydrophobicContact CE1-CZ 3.92Å; F353-F413 HydrophobicContact CG-CE2 4.16Å; F353-W577 HydrophobicContact CE1-CE3 4.39Å; F353-W577 VanDerWaalsContact CE2-C 3.47Å; F353-W577 HydrophobicContact CE2-CB 3.94Å; F353-W577 WeakPolarHBondContact CE2-O 3.5Å; F353-W577 HydrophobicContact CZ-CB 4.24Å; F353-W577 HydrophobicContact CZ-CE3 4.21Å; F353-W578 HydrophobicContact CB-CH2 3.85Å; F353-W578 HydrophobicContact CB-CZ2 3.67Å; F353-W578 AromaticContact CD2-CD2 3.84Å; F353-W578 HydrophobicContact CD2-CD2 3.84Å; F353-W578 AromaticContact CD2-CE2 3.88Å; F353-W578 AromaticContact CD2-CE3 3.98Å; F353-W578 HydrophobicContact CD2-CE3 3.98Å; F353-W578 HydrophobicContact CD2-CG 4.38Å; F353-W578 HydrophobicContact CD2-CH2 4.2Å; F353-W578 HydrophobicContact CD2-CZ2 4.07Å; F353-W578 HydrophobicContact CD2-CZ3 4.16Å; F353-W578 HydrophobicContact CG-CZ2 4.4Å; F353-L581 HydrophobicContact CD2-CD1 3.41Å; F353-L581 VanDerWaalsContact CD2-CD1 3.41Å; F353-L581 HydrophobicContact CD2-CG 4.28Å; F353-L581 HydrophobicContact CE2-CD1 3.23Å; F353-L581 HydrophobicContact CE2-CD2 4.46Å; F353-L581 HydrophobicContact CE2-CG 3.59Å; F353-L581 HydrophobicContact CG-CD1 4.2Å; F353-L581 HydrophobicContact CZ-CD1 3.92Å; F353-L581 HydrophobicContact CZ-CD2 4.44Å; F353-L581 HydrophobicContact CZ-CG 3.99Å; F353-F634 HydrophobicContact CE1-CD1 4.49Å; F353-F634 AromaticContact CE1-CD2 3.89Å; F353-F634 HydrophobicContact CE1-CD2 3.89Å; F353-F634 HydrophobicContact CE1-CE1 4.32Å; F353-F634 AromaticContact CE1-CE2 3.7Å; F353-F634 HydrophobicContact CE1-CE2 3.7Å; F353-F634 HydrophobicContact CE1-CG 4.27Å; F353-F634 AromaticContact CE1-CZ 3.92Å; F353-F634 HydrophobicContact CE1-CZ 3.92Å; F353-F634 AromaticContact CZ-CD2 3.46Å; F353-F634 HydrophobicContact CZ-CD2 3.46Å; F353-F634 VanDerWaalsContact CZ-CD2 3.46Å; F353-F634 AromaticContact CZ-CE2 3.65Å; F353-F634 HydrophobicContact CZ-CE2 3.65Å; F353-F634 AromaticContact CZ-CG 3.98Å; F353-F634 HydrophobicContact CZ-CG 3.98Å; F353-F634 HydrophobicContact CZ-CZ 4.32Å
354	S	97.4	Very high	96.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-36.6	-179.4	57.4	0	0	0	0	112.5	G350 M351 L352 G358 S406 N421	G350-S354 PolarHBondContact O-N 3.09Å; G350-S354 PolarHBondContact O-OG 3.45Å; M351-S354 PolarHBondContact O-OG 2.99Å; L352-S354 PolarHBondContact O-N 3.22Å; S354-G358 PolarHBondContact O-N 3.41Å; S354-S406 WeakPolarHBondContact CB-O 3.2Å; S354-S406 WeakPolarHBondContact O-CA 3.45Å; S354-S406 WeakPolarHBondContact O-CB 3.47Å; S354-S406 PolarHBondContact O-OG 2.98Å; S354-N421 PolarHBondContact OG-ND2 3.25Å
355	V	97.8	Very high	96.5	Very high	2 Å²	2	36 Å²	36	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-51.5	174.6	164.7	0	0	0	0	111.6	M351 L352 F353 V357 G358 S359 L424 T425 V428	M351-V355 VanDerWaalsContact O-CG2 3.26Å; M351-V355 WeakPolarHBondContact O-CG2 3.31Å; M351-V355 PolarHBondContact O-N 3.24Å; L352-V355 PolarHBondContact O-N 3.34Å; F353-V355 VanDerWaalsContact C-N 3.31Å; F353-V355 PolarHBondContact O-N 2.69Å; V355-V357 VanDerWaalsContact C-N 3.33Å; V355-V357 PolarHBondContact O-N 3.25Å; V355-G358 PolarHBondContact O-N 3.23Å; V355-S359 PolarHBondContact O-N 2.98Å; V355-S359 PolarHBondContact O-OG 3.5Å; V355-L424 HydrophobicContact CG1-CG 4.39Å; V355-L424 HydrophobicContact CG2-CB 3.83Å; V355-L424 HydrophobicContact CG2-CD2 3.9Å; V355-L424 HydrophobicContact CG2-CG 3.87Å; V355-T425 WeakPolarHBondContact CG2-OG1 3.38Å; V355-V428 HydrophobicContact CG1-CB 4.22Å; V355-V428 HydrophobicContact CG1-CG2 4.46Å
356	V	97.2	Very high	96.6	Very high	17 Å²	17	34 Å²	34	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-44.5	179.1	168.2	0	0	0	0	110.9	L352 F353 G360 L581 L627	L352-V356 HydrophobicContact CD1-CG2 4.35Å; L352-V356 HydrophobicContact CG-CG2 4.47Å; L352-V356 WeakPolarHBondContact O-CG2 3.35Å; L352-V356 PolarHBondContact O-N 3Å; F353-V356 PolarHBondContact O-N 3.03Å; V356-G360 PolarHBondContact O-N 3.42Å; V356-L581 HydrophobicContact CG1-CD1 4.22Å; V356-L627 HydrophobicContact CB-CD2 4.49Å; V356-L627 HydrophobicContact CG1-CD2 3.86Å
357	V	97.9	Very high	96.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.6	-45.6	176.8	171.8	0	0	0	0	111.4	F353 V355 G360 V361 I409 L581 F634 Y635	F353-V357 HydrophobicContact CD1-CG2 3.99Å; F353-V357 HydrophobicContact CE1-CG2 3.67Å; F353-V357 HydrophobicContact CZ-CG2 4.19Å; F353-V357 WeakPolarHBondContact O-CG2 3.18Å; F353-V357 PolarHBondContact O-N 3.09Å; V355-V357 VanDerWaalsContact C-N 3.33Å; V355-V357 PolarHBondContact O-N 3.25Å; V357-G360 PolarHBondContact O-N 3.46Å; V357-V361 WeakPolarHBondContact O-CG2 3.43Å; V357-V361 PolarHBondContact O-N 2.9Å; V357-I409 HydrophobicContact CG1-CG1 4.28Å; V357-L581 HydrophobicContact CG2-CD1 4.5Å; V357-L581 HydrophobicContact CG2-CD2 3.8Å; V357-F634 HydrophobicContact CB-CD1 4.37Å; V357-F634 HydrophobicContact CG1-CD1 3.71Å; V357-F634 HydrophobicContact CG1-CE1 3.81Å; V357-F634 HydrophobicContact CG2-CD1 3.61Å; V357-F634 HydrophobicContact CG2-CE1 4.05Å; V357-F634 HydrophobicContact CG2-CG 4.08Å; V357-Y635 HydrophobicContact CG1-CD2 4.48Å; V357-Y635 HydrophobicContact CG1-CE2 3.57Å
358	G	98	Very high	96.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-49.3	178.3	0	0	0	0	0	112.5	S354 V355 G360 V361 Q362 S402	S354-G358 PolarHBondContact O-N 3.41Å; V355-G358 PolarHBondContact O-N 3.23Å; G358-G360 VanDerWaalsContact C-N 3.31Å; G358-G360 PolarHBondContact O-N 3.47Å; G358-V361 PolarHBondContact O-N 2.93Å; G358-Q362 PolarHBondContact O-N 3.44Å; G358-Q362 VanDerWaalsContact O-N 3.11Å; G358-S402 WeakPolarHBondContact O-CA 3.49Å; G358-S402 PolarHBondContact O-OG 2.89Å
359	S	97.7	Very high	97.1	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.014	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-40	175.4	-58.5	0	0	0	0	111.9	V355 V361 Q362 I363 C429	V355-S359 PolarHBondContact O-N 2.98Å; V355-S359 PolarHBondContact O-OG 3.5Å; S359-V361 PolarHBondContact O-N 3.41Å; S359-Q362 WeakPolarHBondContact O-CB 3.4Å; S359-Q362 PolarHBondContact O-N 3.46Å; S359-I363 WeakPolarHBondContact O-CG1 3.37Å; S359-I363 PolarHBondContact O-N 2.95Å; S359-I363 VanDerWaalsContact O-N 3.09Å; S359-C429 WeakPolarHBondContact OG-CB 3.47Å
360	G	98	Very high	97	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-40.9	176.3	0	0	0	0	0	113.6	V356 V357 G358 Q362 I363 F364 L627 S631	V356-G360 PolarHBondContact O-N 3.42Å; V357-G360 PolarHBondContact O-N 3.46Å; G358-G360 VanDerWaalsContact C-N 3.31Å; G358-G360 PolarHBondContact O-N 3.47Å; G360-Q362 VanDerWaalsContact C-N 3.3Å; G360-Q362 PolarHBondContact O-N 3.34Å; G360-I363 PolarHBondContact O-N 3.16Å; G360-F364 WeakPolarHBondContact O-CB 3.4Å; G360-F364 PolarHBondContact O-N 3.21Å; G360-L627 VanDerWaalsContact CA-O 3.29Å; G360-L627 WeakPolarHBondContact CA-O 3.3Å; G360-S631 WeakPolarHBondContact CA-OG 3.21Å; G360-S631 PolarHBondContact O-OG 2.02Å
361	V	98.2	Very high	96.9	Very high	15 Å²	15	23 Å²	23	9%	0.091	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-40	173.9	172.1	0	0	0	0	111.5	V357 G358 S359 F364 Q365 A405 Y635	V357-V361 WeakPolarHBondContact O-CG2 3.43Å; V357-V361 PolarHBondContact O-N 2.9Å; G358-V361 PolarHBondContact O-N 2.93Å; S359-V361 PolarHBondContact O-N 3.41Å; V361-F364 PolarHBondContact O-N 3.3Å; V361-Q365 HydrophobicContact CG1-CG 4.44Å; V361-Q365 WeakPolarHBondContact O-CB 3.43Å; V361-Q365 WeakPolarHBondContact O-CG 3.42Å; V361-Q365 PolarHBondContact O-N 3.05Å; V361-A405 HydrophobicContact CB-CB 4.1Å; V361-A405 HydrophobicContact CG1-CB 4.19Å; V361-A405 HydrophobicContact CG2-CB 3.95Å; V361-Y635 HydrophobicContact CG2-CD2 4.21Å; V361-Y635 HydrophobicContact CG2-CE2 3.32Å
362	Q	97.8	Very high	96.8	Very high	4 Å²	4	26 Å²	26	2%	0.019	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-47.6	176.9	-170.8	176.9	2.9	0	0	111.5	G358 S359 G360 M366 F395 L398 S402	G358-Q362 PolarHBondContact O-N 3.44Å; G358-Q362 VanDerWaalsContact O-N 3.11Å; S359-Q362 WeakPolarHBondContact O-CB 3.4Å; S359-Q362 PolarHBondContact O-N 3.46Å; G360-Q362 VanDerWaalsContact C-N 3.3Å; G360-Q362 PolarHBondContact O-N 3.34Å; Q362-M366 VanDerWaalsContact O-CB 3.31Å; Q362-M366 WeakPolarHBondContact O-CB 3.07Å; Q362-M366 PolarHBondContact O-N 2.89Å; Q362-F395 VanDerWaalsContact CD-CE2 3.41Å; Q362-F395 HydrophobicContact CG-CD2 3.91Å; Q362-F395 HydrophobicContact CG-CE2 3.71Å; Q362-F395 HydrophobicContact CG-CZ 4.48Å; Q362-F395 PolarHBondContact NE2-O 3.49Å; Q362-L398 HydrophobicContact CG-CB 4.15Å; Q362-S402 VanDerWaalsContact OE1-CB 3.27Å; Q362-S402 PolarHBondContact OE1-OG 3.44Å; Q362-S402 VanDerWaalsContact OE1-OG 3.05Å
363	I	97.5	Very high	96.6	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-66.3	-42.7	177.7	-59.8	-58.4	0	0	0	111.2	S359 G360 Q365 M366 L367 F395 L624 F628	S359-I363 WeakPolarHBondContact O-CG1 3.37Å; S359-I363 PolarHBondContact O-N 2.95Å; S359-I363 VanDerWaalsContact O-N 3.09Å; G360-I363 PolarHBondContact O-N 3.16Å; I363-Q365 PolarHBondContact O-N 3.03Å; I363-M366 HydrophobicContact CD1-CE 4.2Å; I363-M366 HydrophobicContact CG2-CE 4.17Å; I363-M366 PolarHBondContact O-N 2.9Å; I363-L367 HydrophobicContact CG2-CD1 3.97Å; I363-L367 HydrophobicContact CG2-CG 4.26Å; I363-L367 WeakPolarHBondContact O-CB 3.25Å; I363-L367 WeakPolarHBondContact O-CG 3.45Å; I363-L367 PolarHBondContact O-N 2.83Å; I363-F395 HydrophobicContact CD1-CD2 3.75Å; I363-F395 HydrophobicContact CD1-CE2 3.37Å; I363-F395 HydrophobicContact CD1-CZ 4.44Å; I363-F395 HydrophobicContact CG1-CE2 4.46Å; I363-L624 HydrophobicContact CD1-CD2 3.71Å; I363-L624 HydrophobicContact CG1-CD2 4.21Å; I363-F628 HydrophobicContact CB-CB 4.34Å; I363-F628 HydrophobicContact CG2-CB 3.85Å
364	F	97.8	Very high	96.2	Very high	56 Å²	56	26.8 Å²	26.8	25%	0.246	13%	0.133	C	C	.	.	H	α-helix	trans	-55.5	-51.5	176.6	170.3	-114.1	0	0	0	111.8	G360 V361 L367 L368 F550 V554 F628 V632	G360-F364 WeakPolarHBondContact O-CB 3.4Å; G360-F364 PolarHBondContact O-N 3.21Å; V361-F364 PolarHBondContact O-N 3.3Å; F364-L367 PolarHBondContact O-N 2.97Å; F364-L368 WeakPolarHBondContact O-CB 3.36Å; F364-L368 PolarHBondContact O-N 3.33Å; F364-F550 HydrophobicContact CD2-CE2 4.49Å; F364-F550 AromaticContact CD2-CZ 3.73Å; F364-F550 HydrophobicContact CD2-CZ 3.73Å; F364-F550 HydrophobicContact CE2-CE1 4.1Å; F364-F550 AromaticContact CE2-CZ 3.67Å; F364-F550 HydrophobicContact CE2-CZ 3.67Å; F364-V554 HydrophobicContact CD2-CG2 4.45Å; F364-V554 HydrophobicContact CE2-CG1 4.47Å; F364-V554 HydrophobicContact CE2-CG2 3.77Å; F364-F628 HydrophobicContact CB-CD2 3.95Å; F364-F628 HydrophobicContact CB-CE2 4.45Å; F364-F628 AromaticContact CD2-CD2 3.96Å; F364-F628 HydrophobicContact CD2-CD2 3.96Å; F364-F628 AromaticContact CD2-CE2 3.59Å; F364-F628 HydrophobicContact CD2-CE2 3.59Å; F364-F628 HydrophobicContact CE2-CE2 4.36Å; F364-F628 HydrophobicContact CG-CD2 4.44Å; F364-F628 HydrophobicContact CG-CE2 4.47Å; F364-V632 HydrophobicContact CD2-CG2 4.23Å
365	Q	97.3	Very high	95.8	Very high	61 Å²	61	29.4 Å²	29.4	29%	0.285	15%	0.15	S	C	.	.	H	α-helix	trans	-68.6	-35.9	-179.3	-72.9	-174.9	-9.5	0	0	112.1	V361 I363 L368 V369 L398 S401	V361-Q365 HydrophobicContact CG1-CG 4.44Å; V361-Q365 WeakPolarHBondContact O-CB 3.43Å; V361-Q365 WeakPolarHBondContact O-CG 3.42Å; V361-Q365 PolarHBondContact O-N 3.05Å; I363-Q365 PolarHBondContact O-N 3.03Å; Q365-L368 PolarHBondContact O-N 3.34Å; Q365-V369 WeakPolarHBondContact O-CB 3.12Å; Q365-V369 VanDerWaalsContact O-CG2 3.31Å; Q365-V369 WeakPolarHBondContact O-CG2 3.33Å; Q365-V369 PolarHBondContact O-N 2.92Å; Q365-L398 VanDerWaalsContact C-CD1 3.48Å; Q365-L398 HydrophobicContact CB-CD1 3.6Å; Q365-L398 HydrophobicContact CB-CD2 4.34Å; Q365-S401 PolarHBondContact OE1-OG 3.38Å
366	M	97	Very high	95.3	Very high	21 Å²	21	34 Å²	34	10%	0.103	17%	0.174	C	C	.	.	H	α-helix	trans	-60	-51.5	173.8	176.8	-158.1	70.8	0	0	110.7	Q362 I363 L368 V369 T370 A391 V394 F395 L398	Q362-M366 VanDerWaalsContact O-CB 3.31Å; Q362-M366 WeakPolarHBondContact O-CB 3.07Å; Q362-M366 PolarHBondContact O-N 2.89Å; I363-M366 HydrophobicContact CD1-CE 4.2Å; I363-M366 HydrophobicContact CG2-CE 4.17Å; I363-M366 PolarHBondContact O-N 2.9Å; M366-L368 VanDerWaalsContact C-N 3.35Å; M366-L368 PolarHBondContact O-N 2.94Å; M366-V369 PolarHBondContact O-N 3.11Å; M366-T370 WeakPolarHBondContact O-CB 3.48Å; M366-T370 PolarHBondContact O-N 2.98Å; M366-T370 PolarHBondContact O-OG1 3.37Å; M366-T370 VanDerWaalsContact O-OG1 3.06Å; M366-A391 HydrophobicContact SD-CB 4.46Å; M366-V394 HydrophobicContact CB-CG1 4.27Å; M366-V394 HydrophobicContact CG-CG1 4.24Å; M366-F395 HydrophobicContact CG-CB 4.15Å; M366-F395 HydrophobicContact SD-CB 3.65Å; M366-F395 HydrophobicContact SD-CD2 3.82Å; M366-F395 HydrophobicContact SD-CG 4.12Å; M366-L398 HydrophobicContact CB-CD1 4.08Å; M366-L398 VanDerWaalsContact N-CD1 3.27Å
367	L	96	Very high	94.6	Very high	54 Å²	54	35 Å²	35	28%	0.283	19%	0.187	S	C	.	.	H	α-helix	trans	-59.8	-44.9	177.8	-70.4	175	0	0	0	111.5	I363 F364 V369 L371 F550 F628	I363-L367 HydrophobicContact CG2-CD1 3.97Å; I363-L367 HydrophobicContact CG2-CG 4.26Å; I363-L367 WeakPolarHBondContact O-CB 3.25Å; I363-L367 WeakPolarHBondContact O-CG 3.45Å; I363-L367 PolarHBondContact O-N 2.83Å; F364-L367 PolarHBondContact O-N 2.97Å; L367-V369 PolarHBondContact O-N 3.24Å; L367-L371 WeakPolarHBondContact O-CB 3.39Å; L367-L371 WeakPolarHBondContact O-CG 3.43Å; L367-L371 PolarHBondContact O-N 3.47Å; L367-F550 HydrophobicContact CB-CE2 3.83Å; L367-F550 HydrophobicContact CB-CZ 4.07Å; L367-F550 HydrophobicContact CD1-CE2 4.17Å; L367-F628 HydrophobicContact CD1-CD1 4.2Å; L367-F628 HydrophobicContact CD1-CG 4.21Å
368	L	96.7	Very high	93.9	Very high	64 Å²	64	40.1 Å²	40.1	34%	0.335	21%	0.21	S	C	.	.	H	α-helix	trans	-58.1	-50.5	178.7	179.6	70.3	0	0	0	111.7	F364 Q365 M366 F372 F547 F550	F364-L368 WeakPolarHBondContact O-CB 3.36Å; F364-L368 PolarHBondContact O-N 3.33Å; Q365-L368 PolarHBondContact O-N 3.34Å; M366-L368 VanDerWaalsContact C-N 3.35Å; M366-L368 PolarHBondContact O-N 2.94Å; L368-F372 VanDerWaalsContact O-CB 3.24Å; L368-F372 WeakPolarHBondContact O-CB 3.27Å; L368-F372 PolarHBondContact O-N 3.4Å; L368-F547 HydrophobicContact CD1-CE2 3.98Å; L368-F547 HydrophobicContact CD1-CZ 4.39Å; L368-F550 HydrophobicContact CB-CE1 4.03Å; L368-F550 HydrophobicContact CB-CZ 4.3Å; L368-F550 HydrophobicContact CD1-CD1 4.48Å; L368-F550 HydrophobicContact CD1-CE1 3.81Å
369	V	96	Very high	93.3	Very high	49 Å²	49	40.8 Å²	40.8	30%	0.297	21%	0.214	S	C	.	.	H	α-helix	trans	-69	-45.6	-177.4	172.7	0	0	0	0	111.2	Q365 M366 L367 F372 F373 V394	Q365-V369 WeakPolarHBondContact O-CB 3.12Å; Q365-V369 VanDerWaalsContact O-CG2 3.31Å; Q365-V369 WeakPolarHBondContact O-CG2 3.33Å; Q365-V369 PolarHBondContact O-N 2.92Å; M366-V369 PolarHBondContact O-N 3.11Å; L367-V369 PolarHBondContact O-N 3.24Å; V369-F372 PolarHBondContact O-N 3.48Å; V369-F373 HydrophobicContact CG1-CD2 3.85Å; V369-F373 HydrophobicContact CG1-CE2 3.68Å; V369-F373 VanDerWaalsContact O-CD2 3.26Å; V369-F373 WeakPolarHBondContact O-CD2 3.29Å; V369-F373 PolarHBondContact O-N 3.38Å; V369-F373 VanDerWaalsContact O-N 3.11Å; V369-V394 HydrophobicContact CB-CG1 4.06Å; V369-V394 HydrophobicContact CG1-CG1 4.09Å; V369-V394 HydrophobicContact CG1-CG2 4.03Å
370	T	94.2	Very high	92.5	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.055	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-44.4	179.3	-60.5	0	0	0	0	111.3	M366 F372 F373 A374 L379 L387 A391	M366-T370 WeakPolarHBondContact O-CB 3.48Å; M366-T370 PolarHBondContact O-N 2.98Å; M366-T370 PolarHBondContact O-OG1 3.37Å; M366-T370 VanDerWaalsContact O-OG1 3.06Å; T370-F372 VanDerWaalsContact C-N 3.33Å; T370-F372 PolarHBondContact O-N 3.49Å; T370-F373 PolarHBondContact O-N 3.06Å; T370-A374 WeakPolarHBondContact O-CB 3.34Å; T370-A374 PolarHBondContact O-N 3.36Å; T370-L379 HydrophobicContact CG2-CD1 3.88Å; T370-L379 WeakPolarHBondContact O-CD1 3.32Å; T370-L387 HydrophobicContact CG2-CG 4.34Å; T370-A391 HydrophobicContact CG2-CB 4.32Å
371	L	93.3	Very high	91.6	Very high	20 Å²	20	44 Å²	44	11%	0.105	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-33.3	177.7	-69.7	176	0	0	0	112.4	L367 A374 C375 L546 F547 F550	L367-L371 WeakPolarHBondContact O-CB 3.39Å; L367-L371 WeakPolarHBondContact O-CG 3.43Å; L367-L371 PolarHBondContact O-N 3.47Å; L371-A374 PolarHBondContact O-N 2.87Å; L371-C375 WeakPolarHBondContact O-CB 3.31Å; L371-C375 PolarHBondContact O-N 3.3Å; L371-L546 HydrophobicContact CD2-CD2 3.58Å; L371-L546 HydrophobicContact CD2-CG 3.84Å; L371-F547 HydrophobicContact CB-CD2 3.78Å; L371-F550 HydrophobicContact CD1-CB 3.72Å; L371-F550 HydrophobicContact CD1-CD1 4.24Å; L371-F550 HydrophobicContact CD1-CD2 3.98Å; L371-F550 HydrophobicContact CD1-CG 3.71Å
372	F	93.6	Very high	90.8	Very high	99 Å²	99	44.2 Å²	44.2	43%	0.434	24%	0.239	S	C	.	.	H	α-helix	trans	-61.2	-50.2	173.8	177.5	-101.3	0	0	0	111.5	L368 V369 T370 A374 C375 L376 F547	L368-F372 VanDerWaalsContact O-CB 3.24Å; L368-F372 WeakPolarHBondContact O-CB 3.27Å; L368-F372 PolarHBondContact O-N 3.4Å; V369-F372 PolarHBondContact O-N 3.48Å; T370-F372 VanDerWaalsContact C-N 3.33Å; T370-F372 PolarHBondContact O-N 3.49Å; F372-A374 VanDerWaalsContact C-N 3.3Å; F372-A374 PolarHBondContact O-N 3.05Å; F372-C375 WeakPolarHBondContact O-CB 3.44Å; F372-C375 PolarHBondContact O-N 3.39Å; F372-L376 HydrophobicContact CD1-CD1 4.26Å; F372-L376 HydrophobicContact CE1-CD1 3.69Å; F372-L376 HydrophobicContact CZ-CD1 3.94Å; F372-L376 PolarHBondContact O-N 2.9Å; F372-L376 VanDerWaalsContact O-N 3.16Å; F372-F547 HydrophobicContact CB-CE2 4.28Å; F372-F547 HydrophobicContact CD2-CZ 4.32Å
373	F	91.3	Very high	90	Very high	85 Å²	85	45 Å²	45	37%	0.373	24%	0.243	S	C	.	.	H	α-helix	trans	-65.5	-32.6	175.7	-75.1	-64.1	0	0	0	113.1	V369 T370 L376 G377 F378 L379	V369-F373 HydrophobicContact CG1-CD2 3.85Å; V369-F373 HydrophobicContact CG1-CE2 3.68Å; V369-F373 VanDerWaalsContact O-CD2 3.26Å; V369-F373 WeakPolarHBondContact O-CD2 3.29Å; V369-F373 PolarHBondContact O-N 3.38Å; V369-F373 VanDerWaalsContact O-N 3.11Å; T370-F373 PolarHBondContact O-N 3.06Å; F373-L376 PolarHBondContact O-N 3.19Å; F373-G377 PolarHBondContact O-N 2.95Å; F373-F378 AromaticContact CD1-CD2 3.91Å; F373-F378 HydrophobicContact CD1-CD2 3.91Å; F373-F378 HydrophobicContact CD1-CE2 4.41Å; F373-F378 PolarHBondContact O-N 3.1Å; F373-L379 HydrophobicContact CB-CD1 4.01Å; F373-L379 HydrophobicContact CB-CG 4.3Å
374	A	90.1	Very high	89.4	Confident	2 Å²	2	46.9 Å²	46.9	2%	0.017	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-40.5	173.6	0	0	0	0	0	112.1	T370 L371 F372 L376 G377 L379 F543	T370-A374 WeakPolarHBondContact O-CB 3.34Å; T370-A374 PolarHBondContact O-N 3.36Å; L371-A374 PolarHBondContact O-N 2.87Å; F372-A374 VanDerWaalsContact C-N 3.3Å; F372-A374 PolarHBondContact O-N 3.05Å; A374-L376 VanDerWaalsContact C-N 3.27Å; A374-L376 PolarHBondContact O-N 3.2Å; A374-G377 PolarHBondContact O-N 3.22Å; A374-L379 HydrophobicContact CB-CB 4.06Å; A374-L379 HydrophobicContact CB-CD1 4.24Å; A374-F543 HydrophobicContact CB-CB 4.08Å; A374-F543 HydrophobicContact CB-CD1 3.6Å; A374-F543 HydrophobicContact CB-CE1 4.14Å; A374-F543 HydrophobicContact CB-CG 3.82Å; A374-F543 WeakPolarHBondContact O-CB 3.24Å
375	C	88	Confident	88.9	Confident	55 Å²	55	44.8 Å²	44.8	37%	0.372	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-33.1	175.6	-177.2	0	0	0	0	112.4	L371 F372 G377 F547	L371-C375 WeakPolarHBondContact O-CB 3.31Å; L371-C375 PolarHBondContact O-N 3.3Å; F372-C375 WeakPolarHBondContact O-CB 3.44Å; F372-C375 PolarHBondContact O-N 3.39Å; C375-G377 PolarHBondContact O-N 3.48Å; C375-F547 HydrophobicContact CB-CB 4.22Å; C375-F547 HydrophobicContact CB-CG 4.44Å
376	L	87.5	Confident	88.6	Confident	98 Å²	98	42.1 Å²	42.1	51%	0.513	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-7.3	173.4	-64.3	178.4	0	0	0	113.4	F372 F373 A374 F378	F372-L376 HydrophobicContact CD1-CD1 4.26Å; F372-L376 HydrophobicContact CE1-CD1 3.69Å; F372-L376 HydrophobicContact CZ-CD1 3.94Å; F372-L376 PolarHBondContact O-N 2.9Å; F372-L376 VanDerWaalsContact O-N 3.16Å; F373-L376 PolarHBondContact O-N 3.19Å; A374-L376 VanDerWaalsContact C-N 3.27Å; A374-L376 PolarHBondContact O-N 3.2Å; L376-F378 HydrophobicContact CB-CD2 3.69Å; L376-F378 HydrophobicContact CB-CE2 3.75Å; L376-F378 HydrophobicContact CD1-CD2 4.23Å; L376-F378 HydrophobicContact CD1-CE2 3.81Å; L376-F378 HydrophobicContact CG-CE2 4.44Å
377	G	82.1	Confident	88.3	Confident	37 Å²	37	44.2 Å²	44.2	38%	0.381	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	-3.3	177.7	0	0	0	0	0	115.4	F373 A374 C375 L379 S380	F373-G377 PolarHBondContact O-N 2.95Å; A374-G377 PolarHBondContact O-N 3.22Å; C375-G377 PolarHBondContact O-N 3.48Å; G377-L379 VanDerWaalsContact C-N 3.25Å; G377-L379 PolarHBondContact O-N 3.45Å; G377-S380 WeakPolarHBondContact O-CB 3.45Å; G377-S380 PolarHBondContact O-N 3.44Å; G377-S380 PolarHBondContact O-OG 3.16Å; G377-S380 VanDerWaalsContact O-OG 3.1Å
378	F	83.7	Confident	88.1	Confident	108 Å²	108	43.9 Å²	43.9	47%	0.474	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-24	-178.7	-63.7	-58.2	0	0	0	113.9	F373 L376 N383	F373-F378 AromaticContact CD1-CD2 3.91Å; F373-F378 HydrophobicContact CD1-CD2 3.91Å; F373-F378 HydrophobicContact CD1-CE2 4.41Å; F373-F378 PolarHBondContact O-N 3.1Å; L376-F378 HydrophobicContact CB-CD2 3.69Å; L376-F378 HydrophobicContact CB-CE2 3.75Å; L376-F378 HydrophobicContact CD1-CD2 4.23Å; L376-F378 HydrophobicContact CD1-CE2 3.81Å; L376-F378 HydrophobicContact CG-CE2 4.44Å; F378-N383 PolarHBondContact O-ND2 2.95Å
379	L	85.5	Confident	87.9	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.079	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	28.6	178.8	-51.9	175.7	0	0	0	111.8	T370 F373 A374 G377 L387 C390	T370-L379 HydrophobicContact CG2-CD1 3.88Å; T370-L379 WeakPolarHBondContact O-CD1 3.32Å; F373-L379 HydrophobicContact CB-CD1 4.01Å; F373-L379 HydrophobicContact CB-CG 4.3Å; A374-L379 HydrophobicContact CB-CB 4.06Å; A374-L379 HydrophobicContact CB-CD1 4.24Å; G377-L379 VanDerWaalsContact C-N 3.25Å; G377-L379 PolarHBondContact O-N 3.45Å; L379-L387 HydrophobicContact CB-CB 4.44Å; L379-C390 HydrophobicContact CD1-CB 3.88Å; L379-C390 HydrophobicContact CD2-CB 3.87Å
380	S	80.8	Confident	87.8	Confident	40 Å²	40	41.6 Å²	41.6	28%	0.28	23%	0.232	S	C	.	.	S	Bend	trans	-62.4	162.6	175.7	59.9	0	0	0	0	112.1	G377 A382 N383	G377-S380 WeakPolarHBondContact O-CB 3.45Å; G377-S380 PolarHBondContact O-N 3.44Å; G377-S380 PolarHBondContact O-OG 3.16Å; G377-S380 VanDerWaalsContact O-OG 3.1Å; S380-A382 PolarHBondContact O-N 2.99Å; S380-N383 PolarHBondContact O-N 3.1Å
381	P	79.7	Confident	87.8	Confident	30 Å²	30	42 Å²	42	20%	0.195	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-22.6	-179.2	-26.5	37.2	0	0	0	114.5	W275 N383 F539	W275-P381 HydrophobicContact CZ3-CB 4.27Å; P381-N383 PolarHBondContact O-N 3.38Å; P381-F539 HydrophobicContact CB-CD1 3.88Å; P381-F539 HydrophobicContact CB-CG 4.48Å; P381-F539 HydrophobicContact CG-CB 4.48Å
382	A	80.7	Confident	87.9	Confident	19 Å²	19	43 Å²	43	16%	0.157	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-30	173.3	0	0	0	0	0	112.9	N142 W275 S380 R384	N142-A382 PolarHBondContact ND2-O 3.42Å; W275-A382 HydrophobicContact CZ2-CB 4.17Å; S380-A382 PolarHBondContact O-N 2.99Å; A382-R384 PolarHBondContact O-N 3.16Å
383	N	82.2	Confident	88	Confident	20 Å²	20	40.5 Å²	40.5	11%	0.107	24%	0.239	C	C	.	.	S	Bend	trans	-94.6	78.6	174.7	-172.5	7	0	0	0	110.3	F378 S380 P381 G385 G386	F378-N383 PolarHBondContact O-ND2 2.95Å; S380-N383 PolarHBondContact O-N 3.1Å; P381-N383 PolarHBondContact O-N 3.38Å; N383-G385 PolarHBondContact O-N 3.16Å; N383-G386 PolarHBondContact O-N 3.48Å
384	R	84.7	Confident	88.2	Confident	42 Å²	42	37.6 Å²	37.6	16%	0.158	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	129.8	-176.3	-69.2	-178.4	-73.6	160.7	0.1	111.8	N82 Q85 N142 A382 G386	N82-R384 PolarHBondContact ND2-O 3.31Å; Q85-R384 HydrophobicContact CG-CB 4.16Å; Q85-R384 WeakPolarHBondContact CG-O 3.39Å; N142-R384 VanDerWaalsContact OD1-CZ 3.24Å; N142-R384 PolarHBondContact OD1-NE 3.47Å; N142-R384 PolarHBondContact OD1-NH2 3.2Å; A382-R384 PolarHBondContact O-N 3.16Å; R384-G386 PolarHBondContact O-N 3.23Å
385	G	87.5	Confident	88.4	Confident	12 Å²	12	39.3 Å²	39.3	12%	0.124	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-1.1	-177.3	0	0	0	0	0	115.9	G84 N383 L387 M388 T389	G84-G385 WeakPolarHBondContact CA-O 3.19Å; N383-G385 PolarHBondContact O-N 3.16Å; G385-L387 VanDerWaalsContact C-N 3.34Å; G385-L387 PolarHBondContact O-N 3.46Å; G385-M388 PolarHBondContact O-N 3.41Å; G385-T389 WeakPolarHBondContact O-CB 3.2Å; G385-T389 PolarHBondContact O-N 3.01Å; G385-T389 PolarHBondContact O-OG1 2.71Å
386	G	89.8	Confident	88.8	Confident	6 Å²	6	36.9 Å²	36.9	6%	0.062	22%	0.219	C	C	.	.	H	α-helix	trans	-60.6	-41.2	-179.4	0	0	0	0	0	112.7	N383 R384 M388 T389 C390	N383-G386 PolarHBondContact O-N 3.48Å; R384-G386 PolarHBondContact O-N 3.23Å; G386-M388 PolarHBondContact O-N 3.08Å; G386-T389 PolarHBondContact O-N 3.04Å; G386-C390 VanDerWaalsContact O-CB 3.28Å; G386-C390 WeakPolarHBondContact O-CB 3.49Å; G386-C390 PolarHBondContact O-N 3.5Å
387	L	90.3	Very high	89.1	Confident	64 Å²	64	36 Å²	36	34%	0.335	22%	0.22	S	C	.	.	H	α-helix	trans	-59.6	-49.6	179.9	-172.4	153.2	0	0	0	112.3	T370 L379 G385 C390 A391 F543	T370-L387 HydrophobicContact CG2-CG 4.34Å; L379-L387 HydrophobicContact CB-CB 4.44Å; G385-L387 VanDerWaalsContact C-N 3.34Å; G385-L387 PolarHBondContact O-N 3.46Å; L387-C390 PolarHBondContact O-N 2.92Å; L387-A391 WeakPolarHBondContact O-CB 3.28Å; L387-A391 PolarHBondContact O-N 2.94Å; L387-F543 HydrophobicContact CD1-CE1 3.57Å; L387-F543 HydrophobicContact CD1-CZ 3.83Å
388	M	92.3	Very high	89.8	Confident	47 Å²	47	35.6 Å²	35.6	23%	0.232	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-41.1	178.9	178.7	61	71.2	0	0	111.8	V87 F88 G385 G386 C390 A391 L392	V87-M388 HydrophobicContact CB-CG 4.48Å; V87-M388 HydrophobicContact CG1-CG 4.29Å; F88-M388 HydrophobicContact CD2-CB 4.04Å; F88-M388 HydrophobicContact CE1-CE 3.64Å; F88-M388 HydrophobicContact CE2-CB 3.31Å; F88-M388 HydrophobicContact CE2-CE 4.24Å; F88-M388 HydrophobicContact CE2-CG 4.08Å; F88-M388 HydrophobicContact CZ-CB 3.73Å; F88-M388 HydrophobicContact CZ-CE 3.44Å; F88-M388 VanDerWaalsContact CZ-CE 3.44Å; F88-M388 HydrophobicContact CZ-CG 4.23Å; G385-M388 PolarHBondContact O-N 3.41Å; G386-M388 PolarHBondContact O-N 3.08Å; M388-C390 VanDerWaalsContact C-N 3.32Å; M388-C390 PolarHBondContact O-N 3.38Å; M388-A391 PolarHBondContact O-N 3.46Å; M388-L392 HydrophobicContact CG-CD1 4.02Å; M388-L392 HydrophobicContact CG-CG 4.4Å; M388-L392 WeakPolarHBondContact O-CB 3.22Å; M388-L392 WeakPolarHBondContact O-CG 3.26Å; M388-L392 PolarHBondContact O-N 2.87Å; M388-L392 HydrophobicContact SD-CD1 4.08Å; M388-L392 HydrophobicContact SD-CD2 4.46Å; M388-L392 HydrophobicContact SD-CG 3.96Å
389	T	93.3	Very high	90.4	Very high	42 Å²	42	30.5 Å²	30.5	26%	0.258	19%	0.187	S	C	.	.	H	α-helix	trans	-58	-47	175.2	-55.9	0	0	0	0	110.9	N82 L83 G84 G385 G386 A393	N82-T389 PolarHBondContact OD1-OG1 3.27Å; L83-T389 HydrophobicContact CB-CG2 4.42Å; G84-T389 WeakPolarHBondContact CA-OG1 3.42Å; G84-T389 PolarHBondContact N-OG1 3.43Å; G385-T389 WeakPolarHBondContact O-CB 3.2Å; G385-T389 PolarHBondContact O-N 3.01Å; G385-T389 PolarHBondContact O-OG1 2.71Å; G386-T389 PolarHBondContact O-N 3.04Å; T389-A393 WeakPolarHBondContact O-CB 3.41Å; T389-A393 PolarHBondContact O-N 3.38Å
390	C	93.8	Very high	90.9	Very high	24 Å²	24	31 Å²	31	16%	0.162	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-47.7	177	-178	0	0	0	0	111.3	L379 G386 L387 M388 L392 A393 V394	L379-C390 HydrophobicContact CD1-CB 3.88Å; L379-C390 HydrophobicContact CD2-CB 3.87Å; G386-C390 VanDerWaalsContact O-CB 3.28Å; G386-C390 WeakPolarHBondContact O-CB 3.49Å; G386-C390 PolarHBondContact O-N 3.5Å; L387-C390 PolarHBondContact O-N 2.92Å; M388-C390 VanDerWaalsContact C-N 3.32Å; M388-C390 PolarHBondContact O-N 3.38Å; C390-L392 PolarHBondContact O-N 3.14Å; C390-A393 PolarHBondContact O-N 3.4Å; C390-V394 VanDerWaalsContact O-CB 3.26Å; C390-V394 WeakPolarHBondContact O-CB 3.37Å; C390-V394 WeakPolarHBondContact O-CG2 3.37Å; C390-V394 PolarHBondContact O-N 3.19Å
391	A	94.9	Very high	91.7	Very high	16 Å²	16	30.5 Å²	30.5	13%	0.132	19%	0.19	C	C	.	.	H	α-helix	trans	-57.9	-47.2	178.9	0	0	0	0	0	112.1	M366 T370 L387 M388 F395	M366-A391 HydrophobicContact SD-CB 4.46Å; T370-A391 HydrophobicContact CG2-CB 4.32Å; L387-A391 WeakPolarHBondContact O-CB 3.28Å; L387-A391 PolarHBondContact O-N 2.94Å; M388-A391 PolarHBondContact O-N 3.46Å; A391-F395 WeakPolarHBondContact O-CB 3.42Å; A391-F395 PolarHBondContact O-N 2.99Å
392	L	95.1	Very high	92.6	Very high	41 Å²	41	29.1 Å²	29.1	22%	0.215	18%	0.181	C	C	.	.	H	α-helix	trans	-65.2	-43.4	178.6	-70.1	172.8	0	0	0	112.5	L83 V87 M388 C390 F395 A396 L461	L83-L392 HydrophobicContact CD2-CD1 4.01Å; L83-L392 HydrophobicContact CG-CD1 4.23Å; V87-L392 HydrophobicContact CG2-CD1 4.42Å; M388-L392 HydrophobicContact CG-CD1 4.02Å; M388-L392 HydrophobicContact CG-CG 4.4Å; M388-L392 WeakPolarHBondContact O-CB 3.22Å; M388-L392 WeakPolarHBondContact O-CG 3.26Å; M388-L392 PolarHBondContact O-N 2.87Å; M388-L392 HydrophobicContact SD-CD1 4.08Å; M388-L392 HydrophobicContact SD-CD2 4.46Å; M388-L392 HydrophobicContact SD-CG 3.96Å; C390-L392 PolarHBondContact O-N 3.14Å; L392-F395 PolarHBondContact O-N 3.43Å; L392-A396 WeakPolarHBondContact O-CB 3.4Å; L392-A396 PolarHBondContact O-N 3.27Å; L392-L461 HydrophobicContact CD1-CD2 4.02Å
393	A	94.3	Very high	93.4	Very high	48 Å²	48	28.2 Å²	28.2	40%	0.397	17%	0.173	S	C	.	.	H	α-helix	trans	-64	-48.1	178.2	0	0	0	0	0	111.3	T389 C390 F395 A396 C397	T389-A393 WeakPolarHBondContact O-CB 3.41Å; T389-A393 PolarHBondContact O-N 3.38Å; C390-A393 PolarHBondContact O-N 3.4Å; A393-F395 PolarHBondContact O-N 2.92Å; A393-A396 PolarHBondContact O-N 2.83Å; A393-C397 PolarHBondContact O-N 3.5Å; A393-C397 PolarHBondContact O-SG 3.29Å; A393-C397 VanDerWaalsContact O-SG 3.34Å
394	V	95.5	Very high	94.1	Very high	24 Å²	24	31.3 Å²	31.3	15%	0.145	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-42.7	177.5	171.1	0	0	0	0	110.5	M366 V369 C390 A396 C397 L398	M366-V394 HydrophobicContact CB-CG1 4.27Å; M366-V394 HydrophobicContact CG-CG1 4.24Å; V369-V394 HydrophobicContact CB-CG1 4.06Å; V369-V394 HydrophobicContact CG1-CG1 4.09Å; V369-V394 HydrophobicContact CG1-CG2 4.03Å; C390-V394 VanDerWaalsContact O-CB 3.26Å; C390-V394 WeakPolarHBondContact O-CB 3.37Å; C390-V394 WeakPolarHBondContact O-CG2 3.37Å; C390-V394 PolarHBondContact O-N 3.19Å; V394-A396 VanDerWaalsContact C-N 3.34Å; V394-A396 PolarHBondContact O-N 3.45Å; V394-C397 PolarHBondContact O-N 3.38Å; V394-L398 HydrophobicContact CG1-CD1 3.42Å; V394-L398 VanDerWaalsContact CG1-CD1 3.42Å; V394-L398 HydrophobicContact CG1-CG 4.02Å; V394-L398 VanDerWaalsContact O-CB 3.31Å; V394-L398 WeakPolarHBondContact O-CB 3.43Å; V394-L398 WeakPolarHBondContact O-CG 3.42Å; V394-L398 PolarHBondContact O-N 3Å
395	F	96	Very high	94.8	Very high	37 Å²	37	29.5 Å²	29.5	16%	0.162	18%	0.178	C	C	.	.	H	α-helix	trans	-56.5	-47	175.4	-177.7	-102.8	0	0	0	112.1	Q362 I363 M366 A391 L392 A393 L398 G399 P430	Q362-F395 VanDerWaalsContact CD-CE2 3.41Å; Q362-F395 HydrophobicContact CG-CD2 3.91Å; Q362-F395 HydrophobicContact CG-CE2 3.71Å; Q362-F395 HydrophobicContact CG-CZ 4.48Å; Q362-F395 PolarHBondContact NE2-O 3.49Å; I363-F395 HydrophobicContact CD1-CD2 3.75Å; I363-F395 HydrophobicContact CD1-CE2 3.37Å; I363-F395 HydrophobicContact CD1-CZ 4.44Å; I363-F395 HydrophobicContact CG1-CE2 4.46Å; M366-F395 HydrophobicContact CG-CB 4.15Å; M366-F395 HydrophobicContact SD-CB 3.65Å; M366-F395 HydrophobicContact SD-CD2 3.82Å; M366-F395 HydrophobicContact SD-CG 4.12Å; A391-F395 WeakPolarHBondContact O-CB 3.42Å; A391-F395 PolarHBondContact O-N 2.99Å; L392-F395 PolarHBondContact O-N 3.43Å; A393-F395 PolarHBondContact O-N 2.92Å; F395-L398 PolarHBondContact O-N 3.48Å; F395-G399 PolarHBondContact O-N 2.92Å; F395-P430 HydrophobicContact CE1-CG 4.36Å; F395-P430 HydrophobicContact CZ-CG 4.18Å
396	A	95.4	Very high	95.3	Very high	4 Å²	4	29 Å²	29	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-43.9	178.7	0	0	0	0	0	111.8	L392 A393 V394 L398 G399 L464 V468 L472	L392-A396 WeakPolarHBondContact O-CB 3.4Å; L392-A396 PolarHBondContact O-N 3.27Å; A393-A396 PolarHBondContact O-N 2.83Å; V394-A396 VanDerWaalsContact C-N 3.34Å; V394-A396 PolarHBondContact O-N 3.45Å; A396-L398 VanDerWaalsContact C-N 3.35Å; A396-L398 PolarHBondContact O-N 3.42Å; A396-G399 PolarHBondContact O-N 3.26Å; A396-L464 HydrophobicContact CB-CD1 3.91Å; A396-L464 HydrophobicContact CB-CD2 4.18Å; A396-L464 HydrophobicContact CB-CG 3.89Å; A396-V468 HydrophobicContact CB-CG1 4.49Å; A396-L472 WeakPolarHBondContact O-CD1 3.3Å
397	C	94.5	Very high	95.7	Very high	80 Å²	80	28.7 Å²	28.7	54%	0.541	17%	0.17	S	C	.	.	H	α-helix	trans	-64	-38.2	176.8	-69.5	0	0	0	0	112.7	A393 V394 G399	A393-C397 PolarHBondContact O-N 3.5Å; A393-C397 PolarHBondContact O-SG 3.29Å; A393-C397 VanDerWaalsContact O-SG 3.34Å; V394-C397 PolarHBondContact O-N 3.38Å; C397-G399 PolarHBondContact O-N 2.94Å
398	L	96.7	Very high	96	Very high	29 Å²	29	27.3 Å²	27.3	15%	0.152	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	6.6	-179.7	-65.9	175.3	0	0	0	113.9	Q362 Q365 M366 V394 F395 A396 A400 S401 S402	Q362-L398 HydrophobicContact CG-CB 4.15Å; Q365-L398 VanDerWaalsContact C-CD1 3.48Å; Q365-L398 HydrophobicContact CB-CD1 3.6Å; Q365-L398 HydrophobicContact CB-CD2 4.34Å; M366-L398 HydrophobicContact CB-CD1 4.08Å; M366-L398 VanDerWaalsContact N-CD1 3.27Å; V394-L398 HydrophobicContact CG1-CD1 3.42Å; V394-L398 VanDerWaalsContact CG1-CD1 3.42Å; V394-L398 HydrophobicContact CG1-CG 4.02Å; V394-L398 VanDerWaalsContact O-CB 3.31Å; V394-L398 WeakPolarHBondContact O-CB 3.43Å; V394-L398 WeakPolarHBondContact O-CG 3.42Å; V394-L398 PolarHBondContact O-N 3Å; F395-L398 PolarHBondContact O-N 3.48Å; A396-L398 VanDerWaalsContact C-N 3.35Å; A396-L398 PolarHBondContact O-N 3.42Å; L398-A400 PolarHBondContact O-N 3.09Å; L398-S401 WeakPolarHBondContact O-CB 3.28Å; L398-S401 PolarHBondContact O-N 3.15Å; L398-S402 PolarHBondContact O-N 3.26Å
399	G	95.9	Very high	96.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-51.8	-36	165.9	0	0	0	0	0	112	F395 A396 C397 S401 S402 G403 C473	F395-G399 PolarHBondContact O-N 2.92Å; A396-G399 PolarHBondContact O-N 3.26Å; C397-G399 PolarHBondContact O-N 2.94Å; G399-S401 PolarHBondContact O-N 3.37Å; G399-S402 VanDerWaalsContact O-CB 3.26Å; G399-S402 WeakPolarHBondContact O-CB 3.46Å; G399-S402 PolarHBondContact O-N 3.41Å; G399-G403 PolarHBondContact O-N 2.82Å; G399-C473 WeakPolarHBondContact O-CA 3.3Å; G399-C473 WeakPolarHBondContact O-CB 2.84Å
400	A	96.6	Very high	96.4	Very high	25 Å²	25	24.3 Å²	24.3	21%	0.207	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-41.9	175.5	0	0	0	0	0	113.2	L398 S402 G403 Y404 L472 G476	L398-A400 PolarHBondContact O-N 3.09Å; A400-S402 VanDerWaalsContact C-N 3.31Å; A400-S402 PolarHBondContact O-N 3.25Å; A400-G403 PolarHBondContact O-N 2.87Å; A400-Y404 VanDerWaalsContact O-CB 3.32Å; A400-Y404 WeakPolarHBondContact O-CB 3.26Å; A400-Y404 PolarHBondContact O-N 3.36Å; A400-L472 WeakPolarHBondContact CA-O 3.37Å; A400-L472 HydrophobicContact CB-CB 4.35Å; A400-L472 HydrophobicContact CB-CD2 4.39Å; A400-L472 WeakPolarHBondContact CB-O 3.32Å; A400-G476 VanDerWaalsContact O-CA 3.27Å; A400-G476 WeakPolarHBondContact O-CA 3.48Å
401	S	96.9	Very high	96.5	Very high	30 Å²	30	25.8 Å²	25.8	21%	0.21	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-39.6	176	-59.8	0	0	0	0	111.9	Q365 L398 G399 Y404 A405	Q365-S401 PolarHBondContact OE1-OG 3.38Å; L398-S401 WeakPolarHBondContact O-CB 3.28Å; L398-S401 PolarHBondContact O-N 3.15Å; G399-S401 PolarHBondContact O-N 3.37Å; S401-Y404 PolarHBondContact O-N 3.23Å; S401-A405 WeakPolarHBondContact O-CB 3.29Å; S401-A405 PolarHBondContact O-N 2.98Å
402	S	97.8	Very high	96.6	Very high	1 Å²	1	26 Å²	26	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-57.8	-54.4	175.8	-161.7	0	0	0	0	111.7	G358 Q362 L398 G399 A400 Y404 A405 S406 T425	G358-S402 WeakPolarHBondContact O-CA 3.49Å; G358-S402 PolarHBondContact O-OG 2.89Å; Q362-S402 VanDerWaalsContact OE1-CB 3.27Å; Q362-S402 PolarHBondContact OE1-OG 3.44Å; Q362-S402 VanDerWaalsContact OE1-OG 3.05Å; L398-S402 PolarHBondContact O-N 3.26Å; G399-S402 VanDerWaalsContact O-CB 3.26Å; G399-S402 WeakPolarHBondContact O-CB 3.46Å; G399-S402 PolarHBondContact O-N 3.41Å; A400-S402 VanDerWaalsContact C-N 3.31Å; A400-S402 PolarHBondContact O-N 3.25Å; S402-Y404 PolarHBondContact O-N 2.77Å; S402-A405 PolarHBondContact O-N 2.95Å; S402-S406 WeakPolarHBondContact O-CB 3.19Å; S402-S406 PolarHBondContact O-N 3.47Å; S402-T425 WeakPolarHBondContact OG-CG2 3.37Å
403	G	97.8	Very high	96.6	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-40.9	179.3	0	0	0	0	0	112.6	G399 A400 A407 C473 A477	G399-G403 PolarHBondContact O-N 2.82Å; A400-G403 PolarHBondContact O-N 2.87Å; G403-A407 WeakPolarHBondContact O-CB 3.46Å; G403-A407 PolarHBondContact O-N 2.91Å; G403-C473 WeakPolarHBondContact CA-O 3.39Å; G403-C473 WeakPolarHBondContact CA-SG 3.43Å; G403-A477 WeakPolarHBondContact O-CA 3.03Å; G403-A477 WeakPolarHBondContact O-CB 3.41Å
404	Y	98	Very high	96.5	Very high	85 Å²	85	25.4 Å²	25.4	33%	0.333	15%	0.146	S	C	.	.	H	α-helix	trans	-61.1	-51.1	176.4	179.3	-92	0	0	0	111.9	A400 S401 S402 A407 R408 G476 F479 K483	A400-Y404 VanDerWaalsContact O-CB 3.32Å; A400-Y404 WeakPolarHBondContact O-CB 3.26Å; A400-Y404 PolarHBondContact O-N 3.36Å; S401-Y404 PolarHBondContact O-N 3.23Å; S402-Y404 PolarHBondContact O-N 2.77Å; Y404-A407 PolarHBondContact O-N 2.86Å; Y404-R408 HydrophobicContact CD1-CG 4.22Å; Y404-R408 HydrophobicContact CE1-CG 3.9Å; Y404-R408 HydrophobicContact CE2-CG 4.35Å; Y404-R408 VanDerWaalsContact O-CG 3.23Å; Y404-R408 WeakPolarHBondContact O-CG 2.95Å; Y404-R408 PolarHBondContact O-N 2.83Å; Y404-R408 PolarHBondContact OH-NH1 3.41Å; Y404-G476 WeakPolarHBondContact CA-O 3.42Å; Y404-F479 HydrophobicContact CD2-CB 4.36Å; Y404-K483 HydrophobicContact CE2-CG 4.46Å
405	A	97.7	Very high	96.4	Very high	5 Å²	5	24.9 Å²	24.9	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-49.2	-178.7	0	0	0	0	0	111.7	V361 S401 S402 A407 R408 I409	V361-A405 HydrophobicContact CB-CB 4.1Å; V361-A405 HydrophobicContact CG1-CB 4.19Å; V361-A405 HydrophobicContact CG2-CB 3.95Å; S401-A405 WeakPolarHBondContact O-CB 3.29Å; S401-A405 PolarHBondContact O-N 2.98Å; S402-A405 PolarHBondContact O-N 2.95Å; A405-A407 PolarHBondContact O-N 2.87Å; A405-R408 PolarHBondContact O-N 3.34Å; A405-I409 WeakPolarHBondContact O-CG1 3.19Å; A405-I409 PolarHBondContact O-N 3.3Å; A405-I409 VanDerWaalsContact O-N 3.13Å
406	S	98.1	Very high	96.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-46.9	177.8	-178.5	0	0	0	0	111.9	S354 S402 R408 I409 Y410 N421 T425	S354-S406 WeakPolarHBondContact CB-O 3.2Å; S354-S406 WeakPolarHBondContact O-CA 3.45Å; S354-S406 WeakPolarHBondContact O-CB 3.47Å; S354-S406 PolarHBondContact O-OG 2.98Å; S402-S406 WeakPolarHBondContact O-CB 3.19Å; S402-S406 PolarHBondContact O-N 3.47Å; S406-R408 PolarHBondContact O-N 3.28Å; S406-I409 PolarHBondContact O-N 3.02Å; S406-Y410 WeakPolarHBondContact O-CB 3.24Å; S406-Y410 PolarHBondContact O-N 3.14Å; S406-N421 PolarHBondContact OG-ND2 3.39Å; S406-N421 PolarHBondContact OG-OD1 3.4Å; S406-T425 VanDerWaalsContact CB-OG1 3.31Å; S406-T425 WeakPolarHBondContact CB-OG1 3.49Å; S406-T425 PolarHBondContact OG-OG1 3.02Å
407	A	98	Very high	96.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-43.6	178	0	0	0	0	0	112.8	G403 Y404 A405 Y410 K411 A477 F481	G403-A407 WeakPolarHBondContact O-CB 3.46Å; G403-A407 PolarHBondContact O-N 2.91Å; Y404-A407 PolarHBondContact O-N 2.86Å; A405-A407 PolarHBondContact O-N 2.87Å; A407-Y410 PolarHBondContact O-N 3.42Å; A407-K411 VanDerWaalsContact O-CB 3.23Å; A407-K411 WeakPolarHBondContact O-CB 3.5Å; A407-K411 PolarHBondContact O-N 3.26Å; A407-A477 HydrophobicContact CB-CB 3.95Å; A407-F481 HydrophobicContact CB-CD2 3.38Å; A407-F481 HydrophobicContact CB-CE2 3.27Å; A407-F481 HydrophobicContact CB-CG 4.2Å; A407-F481 HydrophobicContact CB-CZ 4.05Å
408	R	97	Very high	96.1	Very high	36 Å²	36	40.2 Å²	40.2	14%	0.136	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-45.3	179.4	-72.5	-64.5	-61	-79.4	7	111.8	Y404 A405 S406 F412 G480 F486	Y404-R408 HydrophobicContact CD1-CG 4.22Å; Y404-R408 HydrophobicContact CE1-CG 3.9Å; Y404-R408 HydrophobicContact CE2-CG 4.35Å; Y404-R408 VanDerWaalsContact O-CG 3.23Å; Y404-R408 WeakPolarHBondContact O-CG 2.95Å; Y404-R408 PolarHBondContact O-N 2.83Å; Y404-R408 PolarHBondContact OH-NH1 3.41Å; A405-R408 PolarHBondContact O-N 3.34Å; S406-R408 PolarHBondContact O-N 3.28Å; R408-F412 WeakPolarHBondContact O-CB 3.38Å; R408-F412 PolarHBondContact O-N 3Å; R408-G480 WeakPolarHBondContact CD-O 3.27Å; R408-F486 HydrophobicContact CB-CE2 4.04Å; R408-F486 HydrophobicContact CB-CZ 4.31Å; R408-F486 VanDerWaalsContact NH2-CZ 3.35Å
409	I	96.8	Very high	96	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.7	-43.1	179.2	-62.4	-55.8	0	0	0	111.1	F353 V357 A405 S406 K411 F412 F413 F486 F634	F353-I409 HydrophobicContact CD1-CG2 3.99Å; F353-I409 HydrophobicContact CE1-CG2 4.16Å; V357-I409 HydrophobicContact CG1-CG1 4.28Å; A405-I409 WeakPolarHBondContact O-CG1 3.19Å; A405-I409 PolarHBondContact O-N 3.3Å; A405-I409 VanDerWaalsContact O-N 3.13Å; S406-I409 PolarHBondContact O-N 3.02Å; I409-K411 PolarHBondContact O-N 3.49Å; I409-F412 WeakPolarHBondContact O-CB 3.15Å; I409-F412 PolarHBondContact O-N 3.45Å; I409-F412 VanDerWaalsContact O-N 3.15Å; I409-F413 HydrophobicContact CG2-CD2 4.12Å; I409-F413 HydrophobicContact CG2-CE2 3.43Å; I409-F413 VanDerWaalsContact CG2-CE2 3.43Å; I409-F413 HydrophobicContact CG2-CZ 3.66Å; I409-F413 WeakPolarHBondContact O-CD2 3.33Å; I409-F413 PolarHBondContact O-N 3.34Å; I409-F413 VanDerWaalsContact O-N 3.13Å; I409-F486 HydrophobicContact CD1-CE2 4.24Å; I409-F634 HydrophobicContact CD1-CE1 3.85Å; I409-F634 HydrophobicContact CD1-CZ 3.81Å; I409-F634 HydrophobicContact CG1-CE1 4.22Å; I409-F634 HydrophobicContact CG1-CZ 4.47Å
410	Y	97.6	Very high	96	Very high	25 Å²	25	48.6 Å²	48.6	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-42.2	178.9	-169.7	-112.8	0	0	0	112.3	M351 S406 A407 F412 F413 G415 N421 F481	M351-Y410 HydrophobicContact CB-CD2 4.41Å; M351-Y410 HydrophobicContact CB-CE2 3.8Å; M351-Y410 HydrophobicContact CE-CD2 4.5Å; M351-Y410 HydrophobicContact CE-CE1 3.88Å; M351-Y410 HydrophobicContact CE-CE2 3.7Å; M351-Y410 WeakPolarHBondContact CE-OH 3.38Å; M351-Y410 HydrophobicContact CG-CE2 4.42Å; M351-Y410 HydrophobicContact SD-CD2 4.1Å; M351-Y410 HydrophobicContact SD-CE2 3.77Å; S406-Y410 WeakPolarHBondContact O-CB 3.24Å; S406-Y410 PolarHBondContact O-N 3.14Å; A407-Y410 PolarHBondContact O-N 3.42Å; Y410-F412 VanDerWaalsContact C-N 3.29Å; Y410-F412 PolarHBondContact O-N 3.38Å; Y410-F413 PolarHBondContact O-N 3.3Å; Y410-G415 VanDerWaalsContact CE1-CA 3.42Å; Y410-G415 WeakPolarHBondContact O-CA 3.44Å; Y410-G415 PolarHBondContact O-N 3Å; Y410-N421 HydrophobicContact CD1-CB 3.87Å; Y410-N421 HydrophobicContact CE1-CB 4.13Å; Y410-N421 HydrophobicContact CG-CB 4.14Å; Y410-F481 HydrophobicContact CD1-CE1 4.18Å; Y410-F481 AromaticContact CD1-CZ 3.81Å; Y410-F481 HydrophobicContact CD1-CZ 3.81Å
411	K	96.7	Very high	96.1	Very high	56 Å²	56	47.4 Å²	47.4	24%	0.243	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-38	173.7	-166.6	-172.5	177.3	176.7	0	111.4	A407 I409 F413 G414 F481 K483 V485	A407-K411 VanDerWaalsContact O-CB 3.23Å; A407-K411 WeakPolarHBondContact O-CB 3.5Å; A407-K411 PolarHBondContact O-N 3.26Å; I409-K411 PolarHBondContact O-N 3.49Å; K411-F413 VanDerWaalsContact C-N 3.26Å; K411-F413 PolarHBondContact O-N 3.46Å; K411-G414 PolarHBondContact O-N 2.86Å; K411-F481 HydrophobicContact CB-CD1 3.91Å; K411-F481 HydrophobicContact CB-CE1 3.84Å; K411-F481 HydrophobicContact CD-CD1 4.19Å; K411-F481 WeakPolarHBondContact CD-O 3.42Å; K411-F481 WeakPolarHBondContact CE-O 3.41Å; K411-F481 HydrophobicContact CG-CD1 4.08Å; K411-F481 HydrophobicContact CG-CE1 4.36Å; K411-F481 PolarHBondContact NZ-O 3.1Å; K411-K483 PolarHBondContact NZ-O 3.24Å; K411-V485 HydrophobicContact CD-CG2 4.04Å; K411-V485 HydrophobicContact CG-CG2 3.92Å
412	F	95.5	Very high	96.1	Very high	19 Å²	19	46 Å²	46	8%	0.083	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-33.9	176.7	175.2	-101.7	0	0	0	113	F344 R408 I409 Y410 G414 V485 F486 T488 W577 F638	F344-F412 HydrophobicContact CD1-CZ 4.06Å; R408-F412 WeakPolarHBondContact O-CB 3.38Å; R408-F412 PolarHBondContact O-N 3Å; I409-F412 WeakPolarHBondContact O-CB 3.15Å; I409-F412 PolarHBondContact O-N 3.45Å; I409-F412 VanDerWaalsContact O-N 3.15Å; Y410-F412 VanDerWaalsContact C-N 3.29Å; Y410-F412 PolarHBondContact O-N 3.38Å; F412-G414 PolarHBondContact O-N 3.42Å; F412-V485 HydrophobicContact CB-CG1 4.41Å; F412-V485 HydrophobicContact CD2-CG1 3.77Å; F412-F486 HydrophobicContact CB-CD2 4.04Å; F412-F486 HydrophobicContact CD2-CB 3.64Å; F412-F486 HydrophobicContact CD2-CD2 4.03Å; F412-F486 HydrophobicContact CD2-CG 4.34Å; F412-F486 HydrophobicContact CE2-CB 3.89Å; F412-F486 WeakPolarHBondContact CE2-O 3.2Å; F412-F486 HydrophobicContact CG-CD2 4.1Å; F412-T488 HydrophobicContact CE2-CG2 3.63Å; F412-T488 HydrophobicContact CZ-CG2 3.7Å; F412-W577 HydrophobicContact CD1-CH2 4.34Å; F412-W577 AromaticContact CE1-CH2 3.52Å; F412-W577 HydrophobicContact CE1-CH2 3.52Å; F412-W577 HydrophobicContact CE1-CZ2 4.05Å; F412-W577 HydrophobicContact CE1-CZ3 4.37Å; F412-W577 HydrophobicContact CZ-CH2 4.35Å; F412-F638 HydrophobicContact CE1-CE2 4.01Å; F412-F638 HydrophobicContact CZ-CE2 4.12Å
413	F	95	Very high	96	Very high	22 Å²	22	50.2 Å²	50.2	10%	0.096	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	6.3	173.2	-60.6	-30.4	0	0	0	114.7	P346 P347 F353 I409 Y410 K411 G415 W577	P346-F413 HydrophobicContact CB-CB 4.04Å; P346-F413 HydrophobicContact CB-CD1 4.23Å; P346-F413 HydrophobicContact CB-CG 4.34Å; P346-F413 HydrophobicContact CG-CB 4.47Å; P347-F413 HydrophobicContact CG-CD2 4.2Å; P347-F413 HydrophobicContact CG-CE1 4.05Å; P347-F413 HydrophobicContact CG-CE2 3.68Å; P347-F413 HydrophobicContact CG-CZ 3.61Å; F353-F413 HydrophobicContact CB-CE2 4.37Å; F353-F413 AromaticContact CD1-CE2 3.56Å; F353-F413 HydrophobicContact CD1-CE2 3.56Å; F353-F413 AromaticContact CD1-CZ 3.79Å; F353-F413 HydrophobicContact CD1-CZ 3.79Å; F353-F413 HydrophobicContact CE1-CE2 4.17Å; F353-F413 AromaticContact CE1-CZ 3.92Å; F353-F413 HydrophobicContact CE1-CZ 3.92Å; F353-F413 HydrophobicContact CG-CE2 4.16Å; I409-F413 HydrophobicContact CG2-CD2 4.12Å; I409-F413 HydrophobicContact CG2-CE2 3.43Å; I409-F413 VanDerWaalsContact CG2-CE2 3.43Å; I409-F413 HydrophobicContact CG2-CZ 3.66Å; I409-F413 WeakPolarHBondContact O-CD2 3.33Å; I409-F413 PolarHBondContact O-N 3.34Å; I409-F413 VanDerWaalsContact O-N 3.13Å; Y410-F413 PolarHBondContact O-N 3.3Å; K411-F413 VanDerWaalsContact C-N 3.26Å; K411-F413 PolarHBondContact O-N 3.46Å; F413-G415 VanDerWaalsContact C-N 3.3Å; F413-W577 HydrophobicContact CE1-CD2 4.16Å; F413-W577 AromaticContact CE1-CE3 3.91Å; F413-W577 HydrophobicContact CE1-CE3 3.91Å; F413-W577 AromaticContact CE1-CH2 3.92Å; F413-W577 HydrophobicContact CE1-CH2 3.92Å; F413-W577 HydrophobicContact CE1-CZ2 4.09Å; F413-W577 AromaticContact CE1-CZ3 3.78Å; F413-W577 HydrophobicContact CE1-CZ3 3.78Å; F413-W577 HydrophobicContact CZ-CD2 4.28Å; F413-W577 AromaticContact CZ-CE3 3.84Å; F413-W577 HydrophobicContact CZ-CE3 3.84Å; F413-W577 HydrophobicContact CZ-CZ3 4Å
414	G	92.9	Very high	96	Very high	56 Å²	56	52.8 Å²	52.8	58%	0.577	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	15.1	-174.6	0	0	0	0	0	113.8	K411 F412 L416	K411-G414 PolarHBondContact O-N 2.86Å; F412-G414 PolarHBondContact O-N 3.42Å; G414-L416 PolarHBondContact O-N 3.42Å
415	G	93.7	Very high	96	Very high	12 Å²	12	48.7 Å²	48.7	12%	0.124	24%	0.241	C	C	.	.			trans	-70	119.8	-179.8	0	0	0	0	0	112.9	Y410 F413	Y410-G415 VanDerWaalsContact CE1-CA 3.42Å; Y410-G415 WeakPolarHBondContact O-CA 3.44Å; Y410-G415 PolarHBondContact O-N 3Å; F413-G415 VanDerWaalsContact C-N 3.3Å
416	L	91.4	Very high	95.9	Very high	155 Å²	155	48.7 Å²	48.7	81%	0.812	24%	0.241	S	C	*	.			trans	-95.8	-25.2	-177.9	-59.4	177.5	0	0	0	114	G414 W418	G414-L416 PolarHBondContact O-N 3.42Å; L416-W418 PolarHBondContact O-N 3.31Å
417	R	95.4	Very high	95.7	Very high	190 Å²	190	50.7 Å²	50.7	72%	0.717	25%	0.254	S	S	*	.			trans	-77.3	62.3	-177	-60.9	-177.6	-175.6	171.3	1.3	112.5	M351 K419 T420 N421	M351-R417 HydrophobicContact CE-CB 4.39Å; R417-K419 PolarHBondContact O-N 2.99Å; R417-T420 PolarHBondContact O-N 3.28Å; R417-N421 PolarHBondContact O-N 3.46Å
418	W	92.3	Very high	95.5	Very high	98 Å²	98	52.8 Å²	52.8	37%	0.371	27%	0.266	S	S	.	.	H	α-helix	trans	-60.7	-42.3	-173.9	70.6	-89.8	0	0	0	112.8	L416 T420 N421 V422 F474 F481	L416-W418 PolarHBondContact O-N 3.31Å; W418-T420 VanDerWaalsContact C-N 3.34Å; W418-T420 PolarHBondContact O-N 2.94Å; W418-N421 WeakPolarHBondContact O-CB 3.46Å; W418-N421 PolarHBondContact O-N 3.35Å; W418-N421 VanDerWaalsContact O-N 3.09Å; W418-V422 HydrophobicContact CE3-CG2 4.24Å; W418-V422 WeakPolarHBondContact O-CG2 3.48Å; W418-V422 PolarHBondContact O-N 3.45Å; W418-F474 HydrophobicContact CZ3-CD1 4.45Å; W418-F481 HydrophobicContact CB-CD1 4Å; W418-F481 HydrophobicContact CB-CD2 3.65Å; W418-F481 HydrophobicContact CB-CE1 3.67Å; W418-F481 HydrophobicContact CB-CE2 3.31Å; W418-F481 HydrophobicContact CB-CG 4.01Å; W418-F481 HydrophobicContact CB-CZ 3.33Å; W418-F481 HydrophobicContact CG-CD2 4.49Å
419	K	95.2	Very high	95.3	Very high	129 Å²	129	51.2 Å²	51.2	56%	0.561	26%	0.261	S	S	*	.	H	α-helix	trans	-56.9	-46.6	180	-64.6	-175.9	-179.2	179.8	0	112.1	R417 V422 I423	R417-K419 PolarHBondContact O-N 2.99Å; K419-V422 PolarHBondContact O-N 3.44Å; K419-I423 WeakPolarHBondContact O-CG1 3.33Å; K419-I423 PolarHBondContact O-N 2.96Å
420	T	96.6	Very high	95.2	Very high	76 Å²	76	51.8 Å²	51.8	47%	0.466	27%	0.265	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176.9	-50.3	0	0	0	0	111.4	M351 R417 W418 V422 I423 L424	M351-T420 HydrophobicContact CE-CG2 4.08Å; R417-T420 PolarHBondContact O-N 3.28Å; W418-T420 VanDerWaalsContact C-N 3.34Å; W418-T420 PolarHBondContact O-N 2.94Å; T420-V422 PolarHBondContact O-N 3.41Å; T420-I423 PolarHBondContact O-N 2.89Å; T420-L424 VanDerWaalsContact O-CB 3.28Å; T420-L424 WeakPolarHBondContact O-CB 3.09Å; T420-L424 PolarHBondContact O-N 2.96Å
421	N	97	Very high	95.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-46.4	176.6	172.4	-110.8	0	0	0	112.1	M351 S354 S406 Y410 R417 W418 L424 T425	M351-N421 HydrophobicContact CE-CB 3.8Å; M351-N421 WeakPolarHBondContact SD-CA 3.49Å; M351-N421 HydrophobicContact SD-CB 3.41Å; M351-N421 WeakPolarHBondContact SD-CB 3.3Å; S354-N421 PolarHBondContact OG-ND2 3.25Å; S406-N421 PolarHBondContact OG-ND2 3.39Å; S406-N421 PolarHBondContact OG-OD1 3.4Å; Y410-N421 HydrophobicContact CD1-CB 3.87Å; Y410-N421 HydrophobicContact CE1-CB 4.13Å; Y410-N421 HydrophobicContact CG-CB 4.14Å; R417-N421 PolarHBondContact O-N 3.46Å; W418-N421 WeakPolarHBondContact O-CB 3.46Å; W418-N421 PolarHBondContact O-N 3.35Å; W418-N421 VanDerWaalsContact O-N 3.09Å; N421-L424 PolarHBondContact O-N 3.49Å; N421-T425 WeakPolarHBondContact O-CB 3.37Å; N421-T425 PolarHBondContact O-N 2.95Å; N421-T425 PolarHBondContact O-OG1 3.29Å
422	V	96.7	Very high	95.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-46.9	179.9	-178.7	0	0	0	0	111.7	W418 K419 T420 L424 T425 A426 F474 A477	W418-V422 HydrophobicContact CE3-CG2 4.24Å; W418-V422 WeakPolarHBondContact O-CG2 3.48Å; W418-V422 PolarHBondContact O-N 3.45Å; K419-V422 PolarHBondContact O-N 3.44Å; T420-V422 PolarHBondContact O-N 3.41Å; V422-L424 VanDerWaalsContact C-N 3.31Å; V422-L424 PolarHBondContact O-N 3.3Å; V422-T425 PolarHBondContact O-N 3.49Å; V422-A426 WeakPolarHBondContact O-CB 3.44Å; V422-A426 PolarHBondContact O-N 3.22Å; V422-F474 HydrophobicContact CB-CD1 4.38Å; V422-F474 HydrophobicContact CB-CE1 4.21Å; V422-F474 HydrophobicContact CB-CZ 4.39Å; V422-F474 HydrophobicContact CG1-CB 4.26Å; V422-F474 HydrophobicContact CG1-CD1 3.71Å; V422-F474 HydrophobicContact CG1-CD2 3.66Å; V422-F474 HydrophobicContact CG1-CE1 3.88Å; V422-F474 HydrophobicContact CG1-CE2 3.83Å; V422-F474 HydrophobicContact CG1-CG 3.6Å; V422-F474 HydrophobicContact CG1-CZ 3.95Å; V422-A477 HydrophobicContact CB-CB 4.26Å; V422-A477 HydrophobicContact CG1-CB 4.09Å; V422-A477 HydrophobicContact CG2-CB 3.15Å
423	I	97	Very high	95.1	Very high	90 Å²	90	54.2 Å²	54.2	46%	0.462	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-48.9	178.1	-68.4	168.7	0	0	0	109.5	K419 T420 T425 A426 T427 F474	K419-I423 WeakPolarHBondContact O-CG1 3.33Å; K419-I423 PolarHBondContact O-N 2.96Å; T420-I423 PolarHBondContact O-N 2.89Å; I423-T425 VanDerWaalsContact C-N 3.33Å; I423-T425 PolarHBondContact O-N 3.44Å; I423-A426 PolarHBondContact O-N 2.8Å; I423-T427 HydrophobicContact CG2-CG2 4.38Å; I423-T427 WeakPolarHBondContact O-CB 3.32Å; I423-T427 VanDerWaalsContact O-CG2 3.31Å; I423-T427 WeakPolarHBondContact O-CG2 3.47Å; I423-T427 PolarHBondContact O-N 3.43Å; I423-T427 PolarHBondContact O-OG1 3.4Å; I423-F474 HydrophobicContact CD1-CZ 4.5Å; I423-F474 HydrophobicContact CG1-CE2 4.33Å; I423-F474 HydrophobicContact CG1-CZ 3.72Å
424	L	97.4	Very high	95.2	Very high	54 Å²	54	54.9 Å²	54.9	28%	0.283	29%	0.291	S	S	.	.	H	α-helix	trans	-64.9	-37.1	-179	-162.4	68.3	0	0	0	112.1	M351 V355 T420 N421 V422 T427 V428	M351-L424 HydrophobicContact CG-CD2 3.92Å; V355-L424 HydrophobicContact CG1-CG 4.39Å; V355-L424 HydrophobicContact CG2-CB 3.83Å; V355-L424 HydrophobicContact CG2-CD2 3.9Å; V355-L424 HydrophobicContact CG2-CG 3.87Å; T420-L424 VanDerWaalsContact O-CB 3.28Å; T420-L424 WeakPolarHBondContact O-CB 3.09Å; T420-L424 PolarHBondContact O-N 2.96Å; N421-L424 PolarHBondContact O-N 3.49Å; V422-L424 VanDerWaalsContact C-N 3.31Å; V422-L424 PolarHBondContact O-N 3.3Å; L424-T427 PolarHBondContact O-N 3.44Å; L424-V428 HydrophobicContact CD1-CG2 3.2Å; L424-V428 HydrophobicContact CG-CG2 3.53Å; L424-V428 WeakPolarHBondContact O-CB 3.48Å; L424-V428 VanDerWaalsContact O-CG2 3.32Å; L424-V428 WeakPolarHBondContact O-CG2 3.28Å; L424-V428 PolarHBondContact O-N 2.75Å
425	T	97.1	Very high	95.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-42.7	175.7	-54.1	0	0	0	0	111.4	V355 S402 S406 N421 V422 I423 T427	V355-T425 WeakPolarHBondContact CG2-OG1 3.38Å; S402-T425 WeakPolarHBondContact OG-CG2 3.37Å; S406-T425 VanDerWaalsContact CB-OG1 3.31Å; S406-T425 WeakPolarHBondContact CB-OG1 3.49Å; S406-T425 PolarHBondContact OG-OG1 3.02Å; N421-T425 WeakPolarHBondContact O-CB 3.37Å; N421-T425 PolarHBondContact O-N 2.95Å; N421-T425 PolarHBondContact O-OG1 3.29Å; V422-T425 PolarHBondContact O-N 3.49Å; I423-T425 VanDerWaalsContact C-N 3.33Å; I423-T425 PolarHBondContact O-N 3.44Å; T425-T427 VanDerWaalsContact C-N 3.33Å
426	A	96.2	Very high	95.5	Very high	5 Å²	5	57 Å²	57	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-74.6	-22.5	-179.5	0	0	0	0	0	113.2	V422 I423 W465 L470 C473	V422-A426 WeakPolarHBondContact O-CB 3.44Å; V422-A426 PolarHBondContact O-N 3.22Å; I423-A426 PolarHBondContact O-N 2.8Å; A426-W465 PolarHBondContact O-NE1 2.9Å; A426-L470 HydrophobicContact CB-CB 4.42Å; A426-L470 HydrophobicContact CB-CG 4.11Å; A426-C473 HydrophobicContact CB-CB 4.01Å
427	T	94.5	Very high	95.7	Very high	42 Å²	42	50.7 Å²	50.7	26%	0.258	26%	0.259	S	S	.	.	H	α-helix	trans	-107.6	-44.2	-172.3	61.2	0	0	0	0	115.1	I423 L424 T425 C429 A431	I423-T427 HydrophobicContact CG2-CG2 4.38Å; I423-T427 WeakPolarHBondContact O-CB 3.32Å; I423-T427 VanDerWaalsContact O-CG2 3.31Å; I423-T427 WeakPolarHBondContact O-CG2 3.47Å; I423-T427 PolarHBondContact O-N 3.43Å; I423-T427 PolarHBondContact O-OG1 3.4Å; L424-T427 PolarHBondContact O-N 3.44Å; T425-T427 VanDerWaalsContact C-N 3.33Å; T427-C429 PolarHBondContact O-N 3.46Å; T427-A431 WeakPolarHBondContact O-CA 3.47Å; T427-A431 WeakPolarHBondContact O-CB 3.39Å; T427-A431 PolarHBondContact O-N 3.34Å
428	V	94	Very high	95.8	Very high	43 Å²	43	44.7 Å²	44.7	26%	0.261	24%	0.241	S	C	.	.	H	α-helix	trans	-58.7	-54.3	-167.6	170	0	0	0	0	113.1	V355 L424 L432	V355-V428 HydrophobicContact CG1-CB 4.22Å; V355-V428 HydrophobicContact CG1-CG2 4.46Å; L424-V428 HydrophobicContact CD1-CG2 3.2Å; L424-V428 HydrophobicContact CG-CG2 3.53Å; L424-V428 WeakPolarHBondContact O-CB 3.48Å; L424-V428 VanDerWaalsContact O-CG2 3.32Å; L424-V428 WeakPolarHBondContact O-CG2 3.28Å; L424-V428 PolarHBondContact O-N 2.75Å; V428-L432 HydrophobicContact CG1-CD1 4.32Å; V428-L432 WeakPolarHBondContact O-CG 3.46Å; V428-L432 PolarHBondContact O-N 2.92Å
429	C	92.8	Very high	96	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.02	25%	0.248	C	C	.	.	H	α-helix	trans	-68	-53	-177.3	168.1	0	0	0	0	112	S359 T427 A431 L432 V433 L627	S359-C429 WeakPolarHBondContact OG-CB 3.47Å; T427-C429 PolarHBondContact O-N 3.46Å; C429-A431 VanDerWaalsContact C-N 3.32Å; C429-A431 PolarHBondContact O-N 3.11Å; C429-L432 PolarHBondContact O-N 3.41Å; C429-V433 PolarHBondContact O-N 2.84Å; C429-L627 HydrophobicContact CB-CD1 3.85Å; C429-L627 WeakPolarHBondContact SG-CD1 3.01Å
430	P	94	Very high	96	Very high	13 Å²	13	38.9 Å²	38.9	8%	0.084	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-35.7	179.3	-24.4	35.9	0	0	0	113.3	F395 V433 F434 W465	F395-P430 HydrophobicContact CE1-CG 4.36Å; F395-P430 HydrophobicContact CZ-CG 4.18Å; P430-V433 PolarHBondContact O-N 3.46Å; P430-F434 WeakPolarHBondContact O-CB 3.4Å; P430-F434 PolarHBondContact O-N 3.12Å; P430-W465 HydrophobicContact CB-CD2 4.03Å; P430-W465 HydrophobicContact CB-CG 4.32Å; P430-W465 HydrophobicContact CB-CZ2 3.9Å
431	A	95.7	Very high	96	Very high	31 Å²	31	35.2 Å²	35.2	26%	0.256	20%	0.199	S	C	.	.	H	α-helix	trans	-62.9	-45.5	178.2	0	0	0	0	0	111.6	T427 C429 V433 F434 S435 W465	T427-A431 WeakPolarHBondContact O-CA 3.47Å; T427-A431 WeakPolarHBondContact O-CB 3.39Å; T427-A431 PolarHBondContact O-N 3.34Å; C429-A431 VanDerWaalsContact C-N 3.32Å; C429-A431 PolarHBondContact O-N 3.11Å; A431-V433 PolarHBondContact O-N 2.99Å; A431-F434 PolarHBondContact O-N 3.49Å; A431-S435 VanDerWaalsContact O-CB 3.29Å; A431-S435 WeakPolarHBondContact O-CB 3.28Å; A431-S435 PolarHBondContact O-N 3.47Å; A431-S435 PolarHBondContact O-OG 2.81Å; A431-W465 VanDerWaalsContact CA-CH2 3.49Å; A431-W465 HydrophobicContact CB-CH2 3.64Å; A431-W465 HydrophobicContact CB-CZ2 4.06Å
432	L	96.1	Very high	95.9	Very high	86 Å²	86	38.2 Å²	38.2	45%	0.45	22%	0.217	S	C	.	.	H	α-helix	trans	-60.1	-46.7	177.8	-72.8	170.8	0	0	0	111.7	V428 C429 S435 V436 W623	V428-L432 HydrophobicContact CG1-CD1 4.32Å; V428-L432 WeakPolarHBondContact O-CG 3.46Å; V428-L432 PolarHBondContact O-N 2.92Å; C429-L432 PolarHBondContact O-N 3.41Å; L432-S435 PolarHBondContact O-N 3.47Å; L432-V436 WeakPolarHBondContact O-CG2 3.28Å; L432-V436 PolarHBondContact O-N 3.1Å; L432-V436 VanDerWaalsContact O-N 3.11Å; L432-W623 HydrophobicContact CD1-CH2 4.45Å; L432-W623 HydrophobicContact CD1-CZ2 3.77Å
433	V	96.3	Very high	95.8	Very high	34 Å²	34	39.1 Å²	39.1	21%	0.206	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-46.7	177.6	174.3	0	0	0	0	110.9	C429 P430 A431 V436 F437 I620 L624	C429-V433 PolarHBondContact O-N 2.84Å; P430-V433 PolarHBondContact O-N 3.46Å; A431-V433 PolarHBondContact O-N 2.99Å; V433-V436 PolarHBondContact O-N 3.16Å; V433-F437 VanDerWaalsContact O-CB 3.26Å; V433-F437 WeakPolarHBondContact O-CB 3.32Å; V433-F437 PolarHBondContact O-N 2.8Å; V433-I620 HydrophobicContact CG1-CG2 3.83Å; V433-I620 HydrophobicContact CG2-CG2 4.39Å; V433-L624 HydrophobicContact CG2-CD2 4.05Å
434	F	96.3	Very high	95.7	Very high	35 Å²	35	34.9 Å²	34.9	15%	0.154	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-38.9	-179.6	-172.7	-92.7	0	0	0	112.1	P430 A431 F437 L438 I458 L462 W465	P430-F434 WeakPolarHBondContact O-CB 3.4Å; P430-F434 PolarHBondContact O-N 3.12Å; A431-F434 PolarHBondContact O-N 3.49Å; F434-F437 PolarHBondContact O-N 3.43Å; F434-L438 HydrophobicContact CE1-CD2 4.5Å; F434-L438 VanDerWaalsContact O-CB 3.27Å; F434-L438 WeakPolarHBondContact O-CB 3.18Å; F434-L438 PolarHBondContact O-N 3.43Å; F434-I458 HydrophobicContact CE2-CG2 4.1Å; F434-I458 HydrophobicContact CZ-CG2 3.69Å; F434-L462 HydrophobicContact CE1-CD1 4.25Å; F434-L462 HydrophobicContact CE2-CB 4.19Å; F434-L462 HydrophobicContact CZ-CB 3.99Å; F434-L462 HydrophobicContact CZ-CD1 4.15Å; F434-L462 HydrophobicContact CZ-CG 4.5Å; F434-W465 HydrophobicContact CB-CZ3 4.15Å; F434-W465 HydrophobicContact CD1-CZ3 4.31Å; F434-W465 HydrophobicContact CG-CE3 4.43Å; F434-W465 HydrophobicContact CG-CZ3 4.18Å
435	S	96.8	Very high	95.5	Very high	62 Å²	62	36.2 Å²	36.2	43%	0.434	21%	0.205	S	C	.	.	H	α-helix	trans	-63.8	-47.5	176.7	-69	0	0	0	0	111.8	A431 L432 L438 I439	A431-S435 VanDerWaalsContact O-CB 3.29Å; A431-S435 WeakPolarHBondContact O-CB 3.28Å; A431-S435 PolarHBondContact O-N 3.47Å; A431-S435 PolarHBondContact O-OG 2.81Å; L432-S435 PolarHBondContact O-N 3.47Å; S435-L438 PolarHBondContact O-N 3.46Å; S435-I439 VanDerWaalsContact O-CG1 3.28Å; S435-I439 WeakPolarHBondContact O-CG1 3.27Å; S435-I439 PolarHBondContact O-N 3.43Å
436	V	97.3	Very high	95.3	Very high	51 Å²	51	42.6 Å²	42.6	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-62.2	-47.3	175.5	177.1	0	0	0	0	109.8	L432 V433 L438 I439 L440 I620	L432-V436 WeakPolarHBondContact O-CG2 3.28Å; L432-V436 PolarHBondContact O-N 3.1Å; L432-V436 VanDerWaalsContact O-N 3.11Å; V433-V436 PolarHBondContact O-N 3.16Å; V436-L438 VanDerWaalsContact C-N 3.31Å; V436-L438 PolarHBondContact O-N 3.12Å; V436-I439 PolarHBondContact O-N 3.29Å; V436-L440 HydrophobicContact CG1-CD1 3.97Å; V436-L440 HydrophobicContact CG1-CG 4.31Å; V436-L440 VanDerWaalsContact O-CG 3.28Å; V436-L440 WeakPolarHBondContact O-CG 3.48Å; V436-L440 PolarHBondContact O-N 3.34Å; V436-I620 HydrophobicContact CB-CD1 4.27Å; V436-I620 HydrophobicContact CB-CG1 4.14Å; V436-I620 HydrophobicContact CG1-CD1 3.94Å; V436-I620 HydrophobicContact CG1-CG1 3.83Å
437	F	96.2	Very high	95	Very high	22 Å²	22	45 Å²	45	10%	0.096	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-42.9	177.3	-179	-107.2	0	0	0	112.5	V87 V433 F434 L440 N441 T453 I458 L461 Y617 I620	V87-F437 HydrophobicContact CG1-CE2 4.46Å; V87-F437 HydrophobicContact CG1-CZ 4.42Å; V433-F437 VanDerWaalsContact O-CB 3.26Å; V433-F437 WeakPolarHBondContact O-CB 3.32Å; V433-F437 PolarHBondContact O-N 2.8Å; F434-F437 PolarHBondContact O-N 3.43Å; F437-L440 PolarHBondContact O-N 2.92Å; F437-N441 WeakPolarHBondContact CD2-ND2 3.46Å; F437-N441 VanDerWaalsContact CE1-ND2 3.32Å; F437-N441 WeakPolarHBondContact CE1-ND2 3.37Å; F437-N441 WeakPolarHBondContact CE2-ND2 3.3Å; F437-N441 WeakPolarHBondContact CZ-ND2 3.44Å; F437-N441 PolarHBondContact O-N 3.5Å; F437-N441 PolarHBondContact O-ND2 2.93Å; F437-T453 HydrophobicContact CZ-CG2 4.35Å; F437-T453 WeakPolarHBondContact CZ-OG1 3.42Å; F437-I458 HydrophobicContact CE1-CG1 4.17Å; F437-L461 HydrophobicContact CE1-CD1 4Å; F437-L461 HydrophobicContact CZ-CD1 4.43Å; F437-Y617 HydrophobicContact CD2-CE1 4.25Å; F437-Y617 HydrophobicContact CE2-CE1 4.47Å; F437-I620 HydrophobicContact CB-CD1 4.36Å
438	L	96.2	Very high	94.7	Very high	65 Å²	65	49.2 Å²	49.2	34%	0.34	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-44.9	177.8	-176.1	66.9	0	0	0	111.5	F434 S435 V436 L440 N441 V442 I458	F434-L438 HydrophobicContact CE1-CD2 4.5Å; F434-L438 VanDerWaalsContact O-CB 3.27Å; F434-L438 WeakPolarHBondContact O-CB 3.18Å; F434-L438 PolarHBondContact O-N 3.43Å; S435-L438 PolarHBondContact O-N 3.46Å; V436-L438 VanDerWaalsContact C-N 3.31Å; V436-L438 PolarHBondContact O-N 3.12Å; L438-L440 VanDerWaalsContact C-N 3.33Å; L438-L440 PolarHBondContact O-N 3.31Å; L438-N441 PolarHBondContact O-N 3.37Å; L438-V442 WeakPolarHBondContact O-CG2 3.08Å; L438-V442 PolarHBondContact O-N 3.28Å; L438-I458 HydrophobicContact CD1-CD1 4.39Å; L438-I458 HydrophobicContact CD1-CG2 4.1Å
439	I	96.8	Very high	94.6	Very high	102 Å²	102	47.5 Å²	47.5	52%	0.523	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-44.4	177.5	-68.5	164.7	0	0	0	110.8	S435 V436 V442 A443 F612	S435-I439 VanDerWaalsContact O-CG1 3.28Å; S435-I439 WeakPolarHBondContact O-CG1 3.27Å; S435-I439 PolarHBondContact O-N 3.43Å; V436-I439 PolarHBondContact O-N 3.29Å; I439-V442 PolarHBondContact O-N 3.17Å; I439-A443 PolarHBondContact O-N 3.02Å; I439-A443 VanDerWaalsContact O-N 3.07Å; I439-F612 HydrophobicContact CG2-CZ 4.07Å
440	L	96.1	Very high	94.4	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-40.9	177.4	-61.1	173.6	0	0	0	111.7	V436 F437 L438 A443 L444 F612 L613 Y617 I620	V436-L440 HydrophobicContact CG1-CD1 3.97Å; V436-L440 HydrophobicContact CG1-CG 4.31Å; V436-L440 VanDerWaalsContact O-CG 3.28Å; V436-L440 WeakPolarHBondContact O-CG 3.48Å; V436-L440 PolarHBondContact O-N 3.34Å; F437-L440 PolarHBondContact O-N 2.92Å; L438-L440 VanDerWaalsContact C-N 3.33Å; L438-L440 PolarHBondContact O-N 3.31Å; L440-A443 PolarHBondContact O-N 2.99Å; L440-L444 WeakPolarHBondContact O-CG 3.24Å; L440-L444 PolarHBondContact O-N 2.9Å; L440-F612 HydrophobicContact CD2-CD1 4.25Å; L440-F612 HydrophobicContact CD2-CE1 3.7Å; L440-F612 HydrophobicContact CD2-CZ 4.01Å; L440-L613 HydrophobicContact CB-CD2 4.21Å; L440-L613 HydrophobicContact CD2-CD2 4Å; L440-Y617 HydrophobicContact CD1-CD1 3.89Å; L440-Y617 HydrophobicContact CD1-CD2 4.12Å; L440-Y617 HydrophobicContact CD1-CE1 3.96Å; L440-Y617 HydrophobicContact CD1-CE2 4.17Å; L440-Y617 HydrophobicContact CD1-CG 3.96Å; L440-I620 HydrophobicContact CD1-CD1 4.45Å
441	N	95.8	Very high	94.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.8	-34.9	177.2	-80.6	-80.9	0	0	0	112.8	F437 L438 A443 L444 W445 T453 I458	F437-N441 WeakPolarHBondContact CD2-ND2 3.46Å; F437-N441 VanDerWaalsContact CE1-ND2 3.32Å; F437-N441 WeakPolarHBondContact CE1-ND2 3.37Å; F437-N441 WeakPolarHBondContact CE2-ND2 3.3Å; F437-N441 WeakPolarHBondContact CZ-ND2 3.44Å; F437-N441 PolarHBondContact O-N 3.5Å; F437-N441 PolarHBondContact O-ND2 2.93Å; L438-N441 PolarHBondContact O-N 3.37Å; N441-A443 VanDerWaalsContact C-N 3.34Å; N441-L444 PolarHBondContact O-N 3.27Å; N441-W445 PolarHBondContact O-N 3.38Å; N441-T453 WeakPolarHBondContact OD1-CB 3.13Å; N441-T453 PolarHBondContact OD1-N 2.92Å; N441-T453 PolarHBondContact OD1-OG1 3.39Å; N441-T453 VanDerWaalsContact OD1-OG1 3.07Å; N441-I458 HydrophobicContact CB-CD1 3.94Å
442	V	95.7	Very high	94	Very high	62 Å²	62	46.6 Å²	46.6	38%	0.376	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-44.9	172.1	169.7	0	0	0	0	110.5	L438 I439 L444 W445 I446	L438-V442 WeakPolarHBondContact O-CG2 3.08Å; L438-V442 PolarHBondContact O-N 3.28Å; I439-V442 PolarHBondContact O-N 3.17Å; V442-L444 VanDerWaalsContact C-N 3.33Å; V442-L444 PolarHBondContact O-N 3.39Å; V442-W445 HydrophobicContact CG2-CE3 4.13Å; V442-W445 HydrophobicContact CG2-CZ3 4.07Å; V442-W445 PolarHBondContact O-N 3.03Å; V442-I446 HydrophobicContact CG1-CD1 4.01Å; V442-I446 WeakPolarHBondContact O-CG1 3.19Å; V442-I446 PolarHBondContact O-N 3.25Å
443	A	94.7	Very high	93.9	Very high	20 Å²	20	42.5 Å²	42.5	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-42.6	174.6	0	0	0	0	0	111.9	I439 L440 N441 W445 I446 L447 F612	I439-A443 PolarHBondContact O-N 3.02Å; I439-A443 VanDerWaalsContact O-N 3.07Å; L440-A443 PolarHBondContact O-N 2.99Å; N441-A443 VanDerWaalsContact C-N 3.34Å; A443-W445 PolarHBondContact O-N 3Å; A443-I446 PolarHBondContact O-N 2.79Å; A443-L447 VanDerWaalsContact O-CD1 3.24Å; A443-L447 WeakPolarHBondContact O-CD1 3.46Å; A443-L447 VanDerWaalsContact O-CG 3.27Å; A443-L447 WeakPolarHBondContact O-CG 3.36Å; A443-L447 PolarHBondContact O-N 2.78Å; A443-F612 HydrophobicContact CB-CE1 4.21Å
444	L	93.8	Very high	93.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-36.6	177.2	-72.1	168.8	0	0	0	113	F60 L440 N441 V442 L447 D448 S449 T451 A452 L613 Y617	F60-L444 HydrophobicContact CE1-CD2 4.38Å; L440-L444 WeakPolarHBondContact O-CG 3.24Å; L440-L444 PolarHBondContact O-N 2.9Å; N441-L444 PolarHBondContact O-N 3.27Å; V442-L444 VanDerWaalsContact C-N 3.33Å; V442-L444 PolarHBondContact O-N 3.39Å; L444-L447 PolarHBondContact O-N 3.48Å; L444-D448 PolarHBondContact O-N 3.43Å; L444-S449 WeakPolarHBondContact O-CB 3.07Å; L444-S449 PolarHBondContact O-N 2.86Å; L444-T451 HydrophobicContact CD1-CG2 4.44Å; L444-A452 HydrophobicContact CB-CB 3.67Å; L444-L613 HydrophobicContact CD1-CD2 4.47Å; L444-L613 HydrophobicContact CD2-CD1 3.68Å; L444-L613 HydrophobicContact CD2-CD2 4.14Å; L444-L613 HydrophobicContact CG-CD1 4.38Å; L444-L613 HydrophobicContact CG-CD2 3.94Å; L444-Y617 WeakPolarHBondContact CD1-OH 3.34Å
445	W	93.5	Very high	93.6	Very high	83 Å²	83	48.6 Å²	48.6	31%	0.314	26%	0.26	S	S	.	.	H	α-helix	trans	-68.2	-40.4	174.6	-71	-36.8	0	0	0	112.6	N441 V442 A443 L447 D448 A452 T453 F455 I458	N441-W445 PolarHBondContact O-N 3.38Å; V442-W445 HydrophobicContact CG2-CE3 4.13Å; V442-W445 HydrophobicContact CG2-CZ3 4.07Å; V442-W445 PolarHBondContact O-N 3.03Å; A443-W445 PolarHBondContact O-N 3Å; W445-L447 PolarHBondContact O-N 3.24Å; W445-D448 PolarHBondContact O-N 3.3Å; W445-A452 HydrophobicContact CG-CB 4.22Å; W445-T453 VanDerWaalsContact CE2-O 3.22Å; W445-T453 WeakPolarHBondContact CZ2-O 3.5Å; W445-T453 PolarHBondContact NE1-O 3.06Å; W445-F455 HydrophobicContact CH2-CB 4.29Å; W445-F455 HydrophobicContact CH2-CD2 4.13Å; W445-F455 HydrophobicContact CZ2-CB 4.18Å; W445-I458 HydrophobicContact CH2-CD1 3.46Å; W445-I458 VanDerWaalsContact CH2-CD1 3.46Å; W445-I458 HydrophobicContact CZ2-CD1 3.55Å; W445-I458 HydrophobicContact CZ3-CD1 4.49Å
446	I	92.9	Very high	93.4	Very high	133 Å²	133	48.1 Å²	48.1	68%	0.682	27%	0.265	S	S	*	.	H	α-helix	trans	-60	-28.9	176.6	-68.3	165	0	0	0	111.2	V442 A443	V442-I446 HydrophobicContact CG1-CD1 4.01Å; V442-I446 WeakPolarHBondContact O-CG1 3.19Å; V442-I446 PolarHBondContact O-N 3.25Å; A443-I446 PolarHBondContact O-N 2.79Å
447	L	89.9	Confident	93.2	Very high	56 Å²	56	46.9 Å²	46.9	29%	0.293	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	5.7	-179.2	-59.8	159.4	0	0	0	113.3	I61 A443 L444 W445 S449 V609	I61-L447 HydrophobicContact CD1-CD1 3.99Å; I61-L447 HydrophobicContact CD1-CD2 4.36Å; I61-L447 HydrophobicContact CG1-CD1 4.45Å; A443-L447 VanDerWaalsContact O-CD1 3.24Å; A443-L447 WeakPolarHBondContact O-CD1 3.46Å; A443-L447 VanDerWaalsContact O-CG 3.27Å; A443-L447 WeakPolarHBondContact O-CG 3.36Å; A443-L447 PolarHBondContact O-N 2.78Å; L444-L447 PolarHBondContact O-N 3.48Å; W445-L447 PolarHBondContact O-N 3.24Å; L447-S449 PolarHBondContact O-N 3.16Å; L447-S449 VanDerWaalsContact O-N 3.12Å; L447-V609 HydrophobicContact CD1-CG1 3.41Å; L447-V609 VanDerWaalsContact CD1-CG1 3.41Å
448	D	88.3	Confident	93.2	Very high	130 Å²	130	46.2 Å²	46.2	70%	0.695	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	36.3	-174.4	-69.6	-45.3	0	0	0	113.4	L444 W445	L444-D448 PolarHBondContact O-N 3.43Å; W445-D448 PolarHBondContact O-N 3.3Å
449	S	90.8	Very high	93.1	Very high	7 Å²	7	46.4 Å²	46.4	5%	0.049	26%	0.259	C	S	.	.			trans	-73.8	134.4	-178.9	-178.7	0	0	0	0	111.4	S62 L444 L447 T451 A452	S62-S449 CarbonylContact O-C 3.6Å; S62-S449 WeakPolarHBondContact O-CA 3.29Å; S62-S449 PolarHBondContact O-OG 2.88Å; S62-S449 PolarHBondContact OG-OG 2.97Å; L444-S449 WeakPolarHBondContact O-CB 3.07Å; L444-S449 PolarHBondContact O-N 2.86Å; L447-S449 PolarHBondContact O-N 3.16Å; L447-S449 VanDerWaalsContact O-N 3.12Å; S449-T451 PolarHBondContact O-N 3.32Å; S449-T451 PolarHBondContact OG-N 3.27Å; S449-A452 WeakPolarHBondContact O-CB 3.31Å; S449-A452 PolarHBondContact O-N 3.04Å
450	A	89.1	Confident	93	Very high	4 Å²	4	44.1 Å²	44.1	3%	0.033	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.8	173	0	0	0	0	0	113.5	K53 S62 R64 A452	K53-A450 HydrophobicContact CB-CB 3.74Å; K53-A450 HydrophobicContact CD-CB 4.22Å; S62-A450 PolarHBondContact O-N 3.48Å; R64-A450 HydrophobicContact CB-CB 4.29Å; R64-A450 HydrophobicContact CG-CB 3.44Å; R64-A450 VanDerWaalsContact CG-CB 3.44Å; A450-A452 PolarHBondContact O-N 3.05Å
451	T	89.4	Confident	93	Very high	15 Å²	15	45.1 Å²	45.1	9%	0.092	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-12.2	179	-64.3	0	0	0	0	111.9	K53 F60 S62 L444 S449 T453	K53-T451 PolarHBondContact NZ-OG1 3.26Å; F60-T451 HydrophobicContact CE1-CG2 4.43Å; S62-T451 WeakPolarHBondContact OG-CB 3.36Å; S62-T451 PolarHBondContact OG-N 2.97Å; S62-T451 VanDerWaalsContact OG-N 3.15Å; S62-T451 PolarHBondContact OG-OG1 2.9Å; L444-T451 HydrophobicContact CD1-CG2 4.44Å; S449-T451 PolarHBondContact O-N 3.32Å; S449-T451 PolarHBondContact OG-N 3.27Å; T451-T453 PolarHBondContact O-N 3.36Å
452	A	93	Very high	93	Very high	10 Å²	10	48 Å²	48	8%	0.083	28%	0.276	C	S	.	.	S	Bend	trans	-59.2	130.3	175	0	0	0	0	0	110.8	R91 L444 W445 S449 A450	R91-A452 PolarHBondContact NH2-O 3.31Å; L444-A452 HydrophobicContact CB-CB 3.67Å; W445-A452 HydrophobicContact CG-CB 4.22Å; S449-A452 WeakPolarHBondContact O-CB 3.31Å; S449-A452 PolarHBondContact O-N 3.04Å; A450-A452 PolarHBondContact O-N 3.05Å
453	T	93	Very high	93	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-72.3	133.9	174.7	-57.6	0	0	0	0	108.2	F437 N441 W445 T451 T457 I458	F437-T453 HydrophobicContact CZ-CG2 4.35Å; F437-T453 WeakPolarHBondContact CZ-OG1 3.42Å; N441-T453 WeakPolarHBondContact OD1-CB 3.13Å; N441-T453 PolarHBondContact OD1-N 2.92Å; N441-T453 PolarHBondContact OD1-OG1 3.39Å; N441-T453 VanDerWaalsContact OD1-OG1 3.07Å; W445-T453 VanDerWaalsContact CE2-O 3.22Å; W445-T453 WeakPolarHBondContact CZ2-O 3.5Å; W445-T453 PolarHBondContact NE1-O 3.06Å; T451-T453 PolarHBondContact O-N 3.36Å; T453-T457 HydrophobicContact CG2-CG2 3.84Å; T453-I458 HydrophobicContact CG2-CD1 4.5Å; T453-I458 HydrophobicContact CG2-CG1 3.85Å
454	P	92.7	Very high	92.9	Very high	52 Å²	52	48.7 Å²	48.7	34%	0.338	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-66	148.6	-179.8	-18.3	33.8	0	0	0	110.5	V86 G456 T457 I458	V86-P454 HydrophobicContact CG1-CG 4.15Å; P454-G456 PolarHBondContact O-N 3.41Å; P454-T457 PolarHBondContact O-N 3.15Å; P454-I458 PolarHBondContact O-N 3.49Å
455	F	93.2	Very high	93	Very high	145 Å²	145	50.5 Å²	50.5	64%	0.636	29%	0.287	S	S	*	.	H	α-helix	trans	-54.2	-41.9	-178.5	177.8	-101.3	0	0	0	112.6	W445 T457 I458 V459	W445-F455 HydrophobicContact CH2-CB 4.29Å; W445-F455 HydrophobicContact CH2-CD2 4.13Å; W445-F455 HydrophobicContact CZ2-CB 4.18Å; F455-T457 VanDerWaalsContact C-N 3.3Å; F455-T457 PolarHBondContact O-N 2.86Å; F455-I458 WeakPolarHBondContact O-CB 3.15Å; F455-I458 PolarHBondContact O-N 2.87Å; F455-I458 VanDerWaalsContact O-N 3.12Å; F455-V459 HydrophobicContact CD1-CG2 4.12Å; F455-V459 HydrophobicContact CE1-CG2 3.62Å; F455-V459 HydrophobicContact CE2-CG2 4.21Å; F455-V459 HydrophobicContact CZ-CG2 3.67Å; F455-V459 WeakPolarHBondContact O-CG2 3.5Å; F455-V459 PolarHBondContact O-N 3.29Å
456	G	92.7	Very high	93.1	Very high	52 Å²	52	50.3 Å²	50.3	54%	0.536	29%	0.292	S	S	.	.	H	α-helix	trans	-59.2	-38	177.8	0	0	0	0	0	113.5	P454 V459 A460	P454-G456 PolarHBondContact O-N 3.41Å; G456-V459 PolarHBondContact O-N 2.97Å; G456-A460 PolarHBondContact O-N 3.44Å
457	T	93.1	Very high	93.3	Very high	25 Å²	25	48.4 Å²	48.4	15%	0.153	29%	0.29	C	S	.	.	H	α-helix	trans	-70.4	-36.2	176.7	-50.6	0	0	0	0	111.6	L83 V86 V87 T453 P454 F455 V459 A460 L461	L83-T457 HydrophobicContact CD1-CG2 3.65Å; V86-T457 HydrophobicContact CB-CG2 4.49Å; V86-T457 HydrophobicContact CG1-CG2 3.82Å; V86-T457 WeakPolarHBondContact CG1-OG1 3.13Å; V87-T457 HydrophobicContact CG2-CG2 4.48Å; T453-T457 HydrophobicContact CG2-CG2 3.84Å; P454-T457 PolarHBondContact O-N 3.15Å; F455-T457 VanDerWaalsContact C-N 3.3Å; F455-T457 PolarHBondContact O-N 2.86Å; T457-V459 VanDerWaalsContact C-N 3.35Å; T457-A460 WeakPolarHBondContact O-CB 3.43Å; T457-A460 PolarHBondContact O-N 3.26Å; T457-L461 WeakPolarHBondContact O-CG 3.15Å; T457-L461 PolarHBondContact O-N 2.9Å
458	I	95.5	Very high	93.5	Very high	7 Å²	7	48.5 Å²	48.5	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-42.3	174	-67.8	175.3	0	0	0	110.7	F434 F437 L438 N441 W445 T453 P454 F455 A460 L461 L462	F434-I458 HydrophobicContact CE2-CG2 4.1Å; F434-I458 HydrophobicContact CZ-CG2 3.69Å; F437-I458 HydrophobicContact CE1-CG1 4.17Å; L438-I458 HydrophobicContact CD1-CD1 4.39Å; L438-I458 HydrophobicContact CD1-CG2 4.1Å; N441-I458 HydrophobicContact CB-CD1 3.94Å; W445-I458 HydrophobicContact CH2-CD1 3.46Å; W445-I458 VanDerWaalsContact CH2-CD1 3.46Å; W445-I458 HydrophobicContact CZ2-CD1 3.55Å; W445-I458 HydrophobicContact CZ3-CD1 4.49Å; T453-I458 HydrophobicContact CG2-CD1 4.5Å; T453-I458 HydrophobicContact CG2-CG1 3.85Å; P454-I458 PolarHBondContact O-N 3.49Å; F455-I458 WeakPolarHBondContact O-CB 3.15Å; F455-I458 PolarHBondContact O-N 2.87Å; F455-I458 VanDerWaalsContact O-N 3.12Å; I458-A460 VanDerWaalsContact C-N 3.32Å; I458-A460 PolarHBondContact O-N 3.43Å; I458-L461 PolarHBondContact O-N 3.16Å; I458-L462 PolarHBondContact O-N 3.42Å
459	V	96.1	Very high	93.9	Very high	69 Å²	69	42.5 Å²	42.5	42%	0.418	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-40.3	173.2	175.3	0	0	0	0	111.1	F455 G456 T457 L462 A463	F455-V459 HydrophobicContact CD1-CG2 4.12Å; F455-V459 HydrophobicContact CE1-CG2 3.62Å; F455-V459 HydrophobicContact CE2-CG2 4.21Å; F455-V459 HydrophobicContact CZ-CG2 3.67Å; F455-V459 WeakPolarHBondContact O-CG2 3.5Å; F455-V459 PolarHBondContact O-N 3.29Å; G456-V459 PolarHBondContact O-N 2.97Å; T457-V459 VanDerWaalsContact C-N 3.35Å; V459-L462 WeakPolarHBondContact O-CB 3.47Å; V459-L462 PolarHBondContact O-N 2.9Å; V459-A463 WeakPolarHBondContact O-CB 3.36Å; V459-A463 PolarHBondContact O-N 2.88Å
460	A	94.1	Very high	94.1	Very high	54 Å²	54	44.2 Å²	44.2	45%	0.446	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-40.2	175.8	0	0	0	0	0	112.6	G456 T457 I458 A463 L464	G456-A460 PolarHBondContact O-N 3.44Å; T457-A460 WeakPolarHBondContact O-CB 3.43Å; T457-A460 PolarHBondContact O-N 3.26Å; I458-A460 VanDerWaalsContact C-N 3.32Å; I458-A460 PolarHBondContact O-N 3.43Å; A460-A463 PolarHBondContact O-N 2.91Å; A460-L464 WeakPolarHBondContact O-CB 3.39Å; A460-L464 PolarHBondContact O-N 3.39Å
461	L	95	Very high	94.5	Very high	24 Å²	24	47 Å²	47	13%	0.126	29%	0.286	C	S	.	.	H	α-helix	trans	-65	-40.5	174.1	-70.1	174.3	0	0	0	111.8	L83 V87 L392 F437 T457 I458 L464 W465	L83-L461 HydrophobicContact CD1-CD2 4.16Å; L83-L461 HydrophobicContact CD2-CD2 4.13Å; V87-L461 HydrophobicContact CG2-CD1 4.13Å; L392-L461 HydrophobicContact CD1-CD2 4.02Å; F437-L461 HydrophobicContact CE1-CD1 4Å; F437-L461 HydrophobicContact CZ-CD1 4.43Å; T457-L461 WeakPolarHBondContact O-CG 3.15Å; T457-L461 PolarHBondContact O-N 2.9Å; I458-L461 PolarHBondContact O-N 3.16Å; L461-L464 PolarHBondContact O-N 3.34Å; L461-W465 PolarHBondContact O-N 2.99Å
462	L	95.6	Very high	94.8	Very high	60 Å²	60	48.5 Å²	48.5	31%	0.314	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-42.6	174	-176.8	63.3	0	0	0	111.3	F434 I458 V459 W465 L466	F434-L462 HydrophobicContact CE1-CD1 4.25Å; F434-L462 HydrophobicContact CE2-CB 4.19Å; F434-L462 HydrophobicContact CZ-CB 3.99Å; F434-L462 HydrophobicContact CZ-CD1 4.15Å; F434-L462 HydrophobicContact CZ-CG 4.5Å; I458-L462 PolarHBondContact O-N 3.42Å; V459-L462 WeakPolarHBondContact O-CB 3.47Å; V459-L462 PolarHBondContact O-N 2.9Å; L462-W465 HydrophobicContact CD1-CE3 3.71Å; L462-W465 HydrophobicContact CD1-CZ3 3.92Å; L462-W465 PolarHBondContact O-N 3.44Å; L462-L466 HydrophobicContact CD1-CD1 3.91Å; L462-L466 HydrophobicContact CD1-CG 4.16Å; L462-L466 HydrophobicContact CG-CD1 4.03Å; L462-L466 WeakPolarHBondContact O-CG 3.18Å; L462-L466 PolarHBondContact O-N 3.33Å
463	A	95.9	Very high	95.1	Very high	45 Å²	45	48 Å²	48	37%	0.372	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-41.9	175.5	0	0	0	0	0	111.8	V459 A460 W465 L466 C467	V459-A463 WeakPolarHBondContact O-CB 3.36Å; V459-A463 PolarHBondContact O-N 2.88Å; A460-A463 PolarHBondContact O-N 2.91Å; A463-W465 VanDerWaalsContact C-N 3.28Å; A463-W465 PolarHBondContact O-N 3.42Å; A463-L466 PolarHBondContact O-N 3.35Å; A463-C467 WeakPolarHBondContact O-CA 3.39Å; A463-C467 WeakPolarHBondContact O-CB 3.43Å; A463-C467 PolarHBondContact O-N 3.04Å
464	L	94.1	Very high	95.3	Very high	52 Å²	52	51.1 Å²	51.1	27%	0.272	30%	0.304	S	S	.	.	I	π-helix	trans	-59.3	-40.6	174.5	-177.5	66.2	0	0	0	111.3	A396 A460 L461 V468 S469	A396-L464 HydrophobicContact CB-CD1 3.91Å; A396-L464 HydrophobicContact CB-CD2 4.18Å; A396-L464 HydrophobicContact CB-CG 3.89Å; A460-L464 WeakPolarHBondContact O-CB 3.39Å; A460-L464 PolarHBondContact O-N 3.39Å; L461-L464 PolarHBondContact O-N 3.34Å; L464-V468 HydrophobicContact CD1-CB 4.1Å; L464-V468 HydrophobicContact CD1-CG1 4.46Å; L464-V468 HydrophobicContact CD1-CG2 4.07Å; L464-V468 VanDerWaalsContact O-CB 3.3Å; L464-V468 WeakPolarHBondContact O-CB 3.27Å; L464-V468 PolarHBondContact O-N 2.67Å; L464-S469 PolarHBondContact O-N 3.12Å
465	W	95.5	Very high	95.5	Very high	37 Å²	37	52.9 Å²	52.9	14%	0.14	31%	0.31	C	S	.	.	I	π-helix	trans	-66.7	-52.8	175.6	172.6	26.3	0	0	0	112.4	A426 P430 A431 F434 L461 L462 A463 S469 L470	A426-W465 PolarHBondContact O-NE1 2.9Å; P430-W465 HydrophobicContact CB-CD2 4.03Å; P430-W465 HydrophobicContact CB-CG 4.32Å; P430-W465 HydrophobicContact CB-CZ2 3.9Å; A431-W465 VanDerWaalsContact CA-CH2 3.49Å; A431-W465 HydrophobicContact CB-CH2 3.64Å; A431-W465 HydrophobicContact CB-CZ2 4.06Å; F434-W465 HydrophobicContact CB-CZ3 4.15Å; F434-W465 HydrophobicContact CD1-CZ3 4.31Å; F434-W465 HydrophobicContact CG-CE3 4.43Å; F434-W465 HydrophobicContact CG-CZ3 4.18Å; L461-W465 PolarHBondContact O-N 2.99Å; L462-W465 HydrophobicContact CD1-CE3 3.71Å; L462-W465 HydrophobicContact CD1-CZ3 3.92Å; L462-W465 PolarHBondContact O-N 3.44Å; A463-W465 VanDerWaalsContact C-N 3.28Å; A463-W465 PolarHBondContact O-N 3.42Å; W465-S469 WeakPolarHBondContact O-CB 3.38Å; W465-S469 PolarHBondContact O-N 3.21Å; W465-L470 WeakPolarHBondContact O-CB 3.12Å; W465-L470 PolarHBondContact O-N 3.02Å
466	L	95.6	Very high	95.7	Very high	79 Å²	79	46.2 Å²	46.2	41%	0.414	28%	0.282	S	S	.	.	I	π-helix	trans	-78.5	-34.8	-172.5	-63.1	-179.3	0	0	0	114	L462 A463 L470 P471	L462-L466 HydrophobicContact CD1-CD1 3.91Å; L462-L466 HydrophobicContact CD1-CG 4.16Å; L462-L466 HydrophobicContact CG-CD1 4.03Å; L462-L466 WeakPolarHBondContact O-CG 3.18Å; L462-L466 PolarHBondContact O-N 3.33Å; A463-L466 PolarHBondContact O-N 3.35Å; L466-L470 HydrophobicContact CD2-CD1 4.13Å; L466-P471 VanDerWaalsContact O-CD 3.3Å; L466-P471 WeakPolarHBondContact O-CD 3.28Å
467	C	95.9	Very high	95.9	Very high	94 Å²	94	43.8 Å²	43.8	64%	0.635	26%	0.256	S	S	*	.	I	π-helix	trans	-95.5	-21.3	-175	-58.9	0	0	0	0	113.5	A463 P471	A463-C467 WeakPolarHBondContact O-CA 3.39Å; A463-C467 WeakPolarHBondContact O-CB 3.43Å; A463-C467 PolarHBondContact O-N 3.04Å; C467-P471 WeakPolarHBondContact O-CG 3.24Å
468	V	95.3	Very high	96.1	Very high	58 Å²	58	46.6 Å²	46.6	35%	0.352	27%	0.267	S	S	.	.	I	π-helix	trans	-115	-62.9	-179.6	-177.4	0	0	0	0	110.9	A396 L464 L470 P471 L472	A396-V468 HydrophobicContact CB-CG1 4.49Å; L464-V468 HydrophobicContact CD1-CB 4.1Å; L464-V468 HydrophobicContact CD1-CG1 4.46Å; L464-V468 HydrophobicContact CD1-CG2 4.07Å; L464-V468 VanDerWaalsContact O-CB 3.3Å; L464-V468 WeakPolarHBondContact O-CB 3.27Å; L464-V468 PolarHBondContact O-N 2.67Å; V468-L470 PolarHBondContact O-N 2.94Å; V468-P471 WeakPolarHBondContact O-CD 3.2Å; V468-L472 HydrophobicContact CG1-CD1 3.68Å; V468-L472 WeakPolarHBondContact O-CB 3.36Å; V468-L472 WeakPolarHBondContact O-CD1 3.35Å; V468-L472 WeakPolarHBondContact O-CG 3.21Å; V468-L472 PolarHBondContact O-N 2.86Å; V468-L472 VanDerWaalsContact O-N 3.14Å
469	S	95.3	Very high	96.1	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.028	29%	0.288	C	S	.	.	I	π-helix	trans	-64.5	-41.2	-173.2	-173	0	0	0	0	113.2	L464 W465 C473	L464-S469 PolarHBondContact O-N 3.12Å; W465-S469 WeakPolarHBondContact O-CB 3.38Å; W465-S469 PolarHBondContact O-N 3.21Å; S469-C473 WeakPolarHBondContact O-CB 3.2Å; S469-C473 PolarHBondContact O-N 2.78Å
470	L	95.6	Very high	96.1	Very high	42 Å²	42	48.3 Å²	48.3	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-66.3	-51.3	-178.9	179.7	162.6	0	0	0	111.7	A426 W465 L466 V468 L472 C473 F474	A426-L470 HydrophobicContact CB-CB 4.42Å; A426-L470 HydrophobicContact CB-CG 4.11Å; W465-L470 WeakPolarHBondContact O-CB 3.12Å; W465-L470 PolarHBondContact O-N 3.02Å; L466-L470 HydrophobicContact CD2-CD1 4.13Å; V468-L470 PolarHBondContact O-N 2.94Å; L470-L472 VanDerWaalsContact C-N 3.32Å; L470-L472 PolarHBondContact O-N 2.8Å; L470-C473 WeakPolarHBondContact O-CB 3.09Å; L470-C473 PolarHBondContact O-N 2.97Å; L470-C473 VanDerWaalsContact O-N 3.1Å; L470-F474 HydrophobicContact CD2-CD2 3.79Å; L470-F474 HydrophobicContact CD2-CE2 3.67Å; L470-F474 HydrophobicContact CG-CD2 4.49Å; L470-F474 HydrophobicContact CG-CE2 4.31Å; L470-F474 WeakPolarHBondContact O-CD2 3.35Å; L470-F474 PolarHBondContact O-N 2.83Å; L470-F474 VanDerWaalsContact O-N 3.1Å
471	P	97.4	Very high	96.1	Very high	62 Å²	62	47.4 Å²	47.4	40%	0.403	25%	0.254	S	S	.	.	H	α-helix	trans	-58.9	-39.4	174.6	-29.2	37.3	0	0	0	113.7	L466 C467 V468 C473 F474 L475	L466-P471 VanDerWaalsContact O-CD 3.3Å; L466-P471 WeakPolarHBondContact O-CD 3.28Å; C467-P471 WeakPolarHBondContact O-CG 3.24Å; V468-P471 WeakPolarHBondContact O-CD 3.2Å; P471-C473 VanDerWaalsContact C-N 3.3Å; P471-C473 PolarHBondContact O-N 3.42Å; P471-F474 WeakPolarHBondContact O-CB 3.08Å; P471-F474 PolarHBondContact O-N 2.83Å; P471-F474 VanDerWaalsContact O-N 3.16Å; P471-L475 PolarHBondContact O-N 2.98Å
472	L	97.1	Very high	96.1	Very high	47 Å²	47	54.8 Å²	54.8	25%	0.246	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-40.3	174.5	-79.4	162.5	0	0	0	111.5	A396 A400 V468 L470 F474 L475 G476	A396-L472 WeakPolarHBondContact O-CD1 3.3Å; A400-L472 WeakPolarHBondContact CA-O 3.37Å; A400-L472 HydrophobicContact CB-CB 4.35Å; A400-L472 HydrophobicContact CB-CD2 4.39Å; A400-L472 WeakPolarHBondContact CB-O 3.32Å; V468-L472 HydrophobicContact CG1-CD1 3.68Å; V468-L472 WeakPolarHBondContact O-CB 3.36Å; V468-L472 WeakPolarHBondContact O-CD1 3.35Å; V468-L472 WeakPolarHBondContact O-CG 3.21Å; V468-L472 PolarHBondContact O-N 2.86Å; V468-L472 VanDerWaalsContact O-N 3.14Å; L470-L472 VanDerWaalsContact C-N 3.32Å; L470-L472 PolarHBondContact O-N 2.8Å; L472-F474 VanDerWaalsContact C-N 3.34Å; L472-F474 PolarHBondContact O-N 3.36Å; L472-L475 WeakPolarHBondContact O-CB 3.33Å; L472-L475 PolarHBondContact O-N 3.38Å; L472-G476 PolarHBondContact O-N 2.04Å
473	C	97.6	Very high	96.1	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-40.7	173.8	-173.6	0	0	0	0	112.4	G399 G403 A426 S469 L470 P471 G476 A477	G399-C473 WeakPolarHBondContact O-CA 3.3Å; G399-C473 WeakPolarHBondContact O-CB 2.84Å; G403-C473 WeakPolarHBondContact CA-O 3.39Å; G403-C473 WeakPolarHBondContact CA-SG 3.43Å; A426-C473 HydrophobicContact CB-CB 4.01Å; S469-C473 WeakPolarHBondContact O-CB 3.2Å; S469-C473 PolarHBondContact O-N 2.78Å; L470-C473 WeakPolarHBondContact O-CB 3.09Å; L470-C473 PolarHBondContact O-N 2.97Å; L470-C473 VanDerWaalsContact O-N 3.1Å; P471-C473 VanDerWaalsContact C-N 3.3Å; P471-C473 PolarHBondContact O-N 3.42Å; C473-G476 PolarHBondContact O-N 3.02Å; C473-A477 VanDerWaalsContact O-CB 3.28Å; C473-A477 WeakPolarHBondContact O-CB 3.38Å; C473-A477 PolarHBondContact O-N 2.9Å
474	F	97.7	Very high	96	Very high	65 Å²	65	59.3 Å²	59.3	29%	0.285	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-44.5	171.7	-86.5	-91.3	0	0	0	112.9	W418 V422 I423 L470 P471 L472 A477 F478	W418-F474 HydrophobicContact CZ3-CD1 4.45Å; V422-F474 HydrophobicContact CB-CD1 4.38Å; V422-F474 HydrophobicContact CB-CE1 4.21Å; V422-F474 HydrophobicContact CB-CZ 4.39Å; V422-F474 HydrophobicContact CG1-CB 4.26Å; V422-F474 HydrophobicContact CG1-CD1 3.71Å; V422-F474 HydrophobicContact CG1-CD2 3.66Å; V422-F474 HydrophobicContact CG1-CE1 3.88Å; V422-F474 HydrophobicContact CG1-CE2 3.83Å; V422-F474 HydrophobicContact CG1-CG 3.6Å; V422-F474 HydrophobicContact CG1-CZ 3.95Å; I423-F474 HydrophobicContact CD1-CZ 4.5Å; I423-F474 HydrophobicContact CG1-CE2 4.33Å; I423-F474 HydrophobicContact CG1-CZ 3.72Å; L470-F474 HydrophobicContact CD2-CD2 3.79Å; L470-F474 HydrophobicContact CD2-CE2 3.67Å; L470-F474 HydrophobicContact CG-CD2 4.49Å; L470-F474 HydrophobicContact CG-CE2 4.31Å; L470-F474 WeakPolarHBondContact O-CD2 3.35Å; L470-F474 PolarHBondContact O-N 2.83Å; L470-F474 VanDerWaalsContact O-N 3.1Å; P471-F474 WeakPolarHBondContact O-CB 3.08Å; P471-F474 PolarHBondContact O-N 2.83Å; P471-F474 VanDerWaalsContact O-N 3.16Å; L472-F474 VanDerWaalsContact C-N 3.34Å; L472-F474 PolarHBondContact O-N 3.36Å; F474-A477 PolarHBondContact O-N 3.41Å; F474-F478 WeakPolarHBondContact O-CB 3.23Å; F474-F478 PolarHBondContact O-N 2.99Å
475	L	97.2	Very high	96	Very high	89 Å²	89	60 Å²	60	47%	0.466	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-47.9	177.7	-177.1	66.1	0	0	0	111.5	P471 L472 F478 F479	P471-L475 PolarHBondContact O-N 2.98Å; L472-L475 WeakPolarHBondContact O-CB 3.33Å; L472-L475 PolarHBondContact O-N 3.38Å; L475-F478 WeakPolarHBondContact O-CB 3.29Å; L475-F478 PolarHBondContact O-N 3.27Å; L475-F479 HydrophobicContact CD1-CD2 4.3Å; L475-F479 HydrophobicContact CD1-CE2 3.63Å; L475-F479 HydrophobicContact CD1-CZ 4.4Å; L475-F479 HydrophobicContact CG-CD2 4.28Å; L475-F479 HydrophobicContact CG-CE2 3.91Å; L475-F479 WeakPolarHBondContact O-CD2 3.26Å; L475-F479 PolarHBondContact O-N 2.86Å
476	G	97.7	Very high	95.8	Very high	5 Å²	5	60.4 Å²	60.4	5%	0.052	31%	0.308	C	S	.	.	H	α-helix	trans	-60.7	-46.1	177	0	0	0	0	0	112.8	A400 Y404 L472 C473 F478 F479 G480	A400-G476 VanDerWaalsContact O-CA 3.27Å; A400-G476 WeakPolarHBondContact O-CA 3.48Å; Y404-G476 WeakPolarHBondContact CA-O 3.42Å; L472-G476 PolarHBondContact O-N 2.04Å; C473-G476 PolarHBondContact O-N 3.02Å; G476-F478 VanDerWaalsContact C-N 3.35Å; G476-F478 PolarHBondContact O-N 3.18Å; G476-F479 PolarHBondContact O-N 3.16Å; G476-G480 PolarHBondContact O-N 3.3Å
477	A	97.4	Very high	95.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-37.4	177.9	0	0	0	0	0	113.1	G403 A407 V422 C473 F474 F479 G480 F481	G403-A477 WeakPolarHBondContact O-CA 3.03Å; G403-A477 WeakPolarHBondContact O-CB 3.41Å; A407-A477 HydrophobicContact CB-CB 3.95Å; V422-A477 HydrophobicContact CB-CB 4.26Å; V422-A477 HydrophobicContact CG1-CB 4.09Å; V422-A477 HydrophobicContact CG2-CB 3.15Å; C473-A477 VanDerWaalsContact O-CB 3.28Å; C473-A477 WeakPolarHBondContact O-CB 3.38Å; C473-A477 PolarHBondContact O-N 2.9Å; F474-A477 PolarHBondContact O-N 3.41Å; A477-F479 VanDerWaalsContact C-N 3.34Å; A477-F479 PolarHBondContact O-N 3.48Å; A477-G480 CarbonylContact O-C 3.48Å; A477-G480 WeakPolarHBondContact O-CA 3.45Å; A477-G480 PolarHBondContact O-N 3.34Å; A477-G480 VanDerWaalsContact O-N 3.1Å; A477-F481 WeakPolarHBondContact O-CD2 3.14Å; A477-F481 PolarHBondContact O-N 3.3Å
478	F	96.5	Very high	95.2	Very high	85 Å²	85	62.6 Å²	62.6	37%	0.373	31%	0.311	S	S	.	.	H	α-helix	trans	-57	-47.1	174.3	173.6	-97.6	0	0	0	111.5	F474 L475 G476 G480 R482	F474-F478 WeakPolarHBondContact O-CB 3.23Å; F474-F478 PolarHBondContact O-N 2.99Å; L475-F478 WeakPolarHBondContact O-CB 3.29Å; L475-F478 PolarHBondContact O-N 3.27Å; G476-F478 VanDerWaalsContact C-N 3.35Å; G476-F478 PolarHBondContact O-N 3.18Å; F478-G480 VanDerWaalsContact C-N 3.34Å; F478-R482 VanDerWaalsContact CZ-NH2 3.31Å; F478-R482 WeakPolarHBondContact O-CG 3.16Å; F478-R482 PolarHBondContact O-N 2.94Å
479	F	96.3	Very high	94.8	Very high	111 Å²	111	62.5 Å²	62.5	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-67.4	-35	173.7	-70.3	-63.2	0	0	0	112.6	Y404 L475 G476 A477 R482 K483	Y404-F479 HydrophobicContact CD2-CB 4.36Å; L475-F479 HydrophobicContact CD1-CD2 4.3Å; L475-F479 HydrophobicContact CD1-CE2 3.63Å; L475-F479 HydrophobicContact CD1-CZ 4.4Å; L475-F479 HydrophobicContact CG-CD2 4.28Å; L475-F479 HydrophobicContact CG-CE2 3.91Å; L475-F479 WeakPolarHBondContact O-CD2 3.26Å; L475-F479 PolarHBondContact O-N 2.86Å; G476-F479 PolarHBondContact O-N 3.16Å; A477-F479 VanDerWaalsContact C-N 3.34Å; A477-F479 PolarHBondContact O-N 3.48Å; F479-R482 PolarHBondContact O-N 3.36Å; F479-K483 PolarHBondContact O-N 2.88Å
480	G	95.8	Very high	94.5	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-52.5	175.3	0	0	0	0	0	112.6	R408 G476 A477 F478 R482 K483	R408-G480 WeakPolarHBondContact CD-O 3.27Å; G476-G480 PolarHBondContact O-N 3.3Å; A477-G480 CarbonylContact O-C 3.48Å; A477-G480 WeakPolarHBondContact O-CA 3.45Å; A477-G480 PolarHBondContact O-N 3.34Å; A477-G480 VanDerWaalsContact O-N 3.1Å; F478-G480 VanDerWaalsContact C-N 3.34Å; G480-R482 VanDerWaalsContact C-N 3.28Å; G480-R482 PolarHBondContact O-N 2.85Å; G480-K483 PolarHBondContact O-N 2.86Å
481	F	93.9	Very high	94.1	Very high	35 Å²	35	70.2 Å²	70.2	15%	0.154	34%	0.337	C	S	.	.	H	α-helix	trans	-67.6	-25	179.8	-83.5	-77	0	0	0	113.7	A407 Y410 K411 W418 A477	A407-F481 HydrophobicContact CB-CD2 3.38Å; A407-F481 HydrophobicContact CB-CE2 3.27Å; A407-F481 HydrophobicContact CB-CG 4.2Å; A407-F481 HydrophobicContact CB-CZ 4.05Å; Y410-F481 HydrophobicContact CD1-CE1 4.18Å; Y410-F481 AromaticContact CD1-CZ 3.81Å; Y410-F481 HydrophobicContact CD1-CZ 3.81Å; K411-F481 HydrophobicContact CB-CD1 3.91Å; K411-F481 HydrophobicContact CB-CE1 3.84Å; K411-F481 HydrophobicContact CD-CD1 4.19Å; K411-F481 WeakPolarHBondContact CD-O 3.42Å; K411-F481 WeakPolarHBondContact CE-O 3.41Å; K411-F481 HydrophobicContact CG-CD1 4.08Å; K411-F481 HydrophobicContact CG-CE1 4.36Å; K411-F481 PolarHBondContact NZ-O 3.1Å; W418-F481 HydrophobicContact CB-CD1 4Å; W418-F481 HydrophobicContact CB-CD2 3.65Å; W418-F481 HydrophobicContact CB-CE1 3.67Å; W418-F481 HydrophobicContact CB-CE2 3.31Å; W418-F481 HydrophobicContact CB-CG 4.01Å; W418-F481 HydrophobicContact CB-CZ 3.33Å; W418-F481 HydrophobicContact CG-CD2 4.49Å; A477-F481 WeakPolarHBondContact O-CD2 3.14Å; A477-F481 PolarHBondContact O-N 3.3Å
482	R	95.3	Very high	93.6	Very high	180 Å²	180	70 Å²	70	68%	0.679	34%	0.335	S	S	*	.	H	α-helix	trans	-73.8	-25.8	175.1	-79.7	-172.5	170.5	-160	-2.9	113.5	F478 F479 G480	F478-R482 VanDerWaalsContact CZ-NH2 3.31Å; F478-R482 WeakPolarHBondContact O-CG 3.16Å; F478-R482 PolarHBondContact O-N 2.94Å; F479-R482 PolarHBondContact O-N 3.36Å; G480-R482 VanDerWaalsContact C-N 3.28Å; G480-R482 PolarHBondContact O-N 2.85Å
483	K	94.7	Very high	93.2	Very high	109 Å²	109	72 Å²	72	47%	0.474	35%	0.346	S	S	.	.	S	Bend	trans	-68.3	146.8	176.4	-73.6	-67.5	-173.7	-175.7	0	110.9	Y404 K411 F479 G480	Y404-K483 HydrophobicContact CE2-CG 4.46Å; K411-K483 PolarHBondContact NZ-O 3.24Å; F479-K483 PolarHBondContact O-N 2.88Å; G480-K483 PolarHBondContact O-N 2.86Å
484	P	95	Very high	92.7	Very high	91 Å²	91	80.6 Å²	80.6	59%	0.591	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-59.2	153.6	174.3	25.6	-33.6	0	0	0	110.7
485	V	93.6	Very high	92.3	Very high	66 Å²	66	84.3 Å²	84.3	40%	0.4	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-60.7	147.6	174.2	176.1	0	0	0	0	108.8	K411 F412 E487	K411-V485 HydrophobicContact CD-CG2 4.04Å; K411-V485 HydrophobicContact CG-CG2 3.92Å; F412-V485 HydrophobicContact CB-CG1 4.41Å; F412-V485 HydrophobicContact CD2-CG1 3.77Å; V485-E487 PolarHBondContact O-N 3.34Å
486	F	91.1	Very high	91.9	Very high	45 Å²	45	83.2 Å²	83.2	20%	0.197	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-62.9	129.5	173.4	-62.2	-76.1	0	0	0	109.9	R408 I409 F412 T488 F638	R408-F486 HydrophobicContact CB-CE2 4.04Å; R408-F486 HydrophobicContact CB-CZ 4.31Å; R408-F486 VanDerWaalsContact NH2-CZ 3.35Å; I409-F486 HydrophobicContact CD1-CE2 4.24Å; F412-F486 HydrophobicContact CB-CD2 4.04Å; F412-F486 HydrophobicContact CD2-CB 3.64Å; F412-F486 HydrophobicContact CD2-CD2 4.03Å; F412-F486 HydrophobicContact CD2-CG 4.34Å; F412-F486 HydrophobicContact CE2-CB 3.89Å; F412-F486 WeakPolarHBondContact CE2-O 3.2Å; F412-F486 HydrophobicContact CG-CD2 4.1Å; F486-T488 PolarHBondContact O-N 3.05Å; F486-F638 HydrophobicContact CB-CZ 4.41Å; F486-F638 HydrophobicContact CD2-CE1 4.45Å; F486-F638 HydrophobicContact CD2-CZ 4.11Å; F486-F638 HydrophobicContact CG-CZ 4.23Å
487	E	88.3	Confident	91.5	Very high	162 Å²	162	88 Å²	88	76%	0.757	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-70.2	126.8	174.3	-68.9	165.1	-167.9	0	0	109.9	V485 R642	V485-E487 PolarHBondContact O-N 3.34Å; E487-R642 PolarHBondContact O-NE 2.78Å; E487-R642 PolarHBondContact O-NH2 3.38Å
488	T	89.6	Confident	91.1	Very high	58 Å²	58	96.4 Å²	96.4	36%	0.356	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-85.4	134.5	173.2	53.8	0	0	0	0	108.8	F344 F412 F486 V490	F344-T488 HydrophobicContact CB-CG2 3.82Å; F344-T488 HydrophobicContact CD1-CG2 3.92Å; F344-T488 HydrophobicContact CD2-CG2 4.11Å; F344-T488 HydrophobicContact CG-CG2 3.66Å; F412-T488 HydrophobicContact CE2-CG2 3.63Å; F412-T488 HydrophobicContact CZ-CG2 3.7Å; F486-T488 PolarHBondContact O-N 3.05Å; T488-V490 WeakPolarHBondContact CB-O 3.32Å; T488-V490 PolarHBondContact O-N 2.98Å; T488-V490 PolarHBondContact OG1-O 3.37Å; T488-V490 VanDerWaalsContact OG1-O 3.14Å
489	P	88.3	Confident	90.7	Very high	55 Å²	55	94.5 Å²	94.5	36%	0.357	46%	0.455	S	S	.	.	S	Bend	trans	-67.1	-23.8	179.7	27.1	-35.2	0	0	0	113.2	F344	F344-P489 HydrophobicContact CE2-CG 3.67Å; F344-P489 HydrophobicContact CZ-CG 3.91Å
490	V	88.3	Confident	90.3	Very high	7 Å²	7	92 Å²	92	4%	0.042	45%	0.449	C	S	.	.	S	Bend	trans	-129.3	151.6	-179.7	-64.9	0	0	0	0	109.8	H340 V343 F344 T488	H340-V490 HydrophobicContact CB-CG2 4.48Å; H340-V490 VanDerWaalsContact O-CG2 3.23Å; H340-V490 WeakPolarHBondContact O-CG2 3.35Å; V343-V490 HydrophobicContact CG1-CG2 4.32Å; F344-V490 HydrophobicContact CD2-CG2 3.74Å; F344-V490 HydrophobicContact CE2-CG2 3.77Å; T488-V490 WeakPolarHBondContact CB-O 3.32Å; T488-V490 PolarHBondContact O-N 2.98Å; T488-V490 PolarHBondContact OG1-O 3.37Å; T488-V490 VanDerWaalsContact OG1-O 3.14Å
491	R	86.9	Confident	89.8	Confident	201 Å²	201	103.6 Å²	103.6	76%	0.758	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-82	141.1	178.3	-173.3	177.3	179.4	-179.4	0.4	110.2
492	T	88.2	Confident	89.3	Confident	59 Å²	59	103.8 Å²	103.8	36%	0.362	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-84.2	130.4	173.3	52.3	0	0	0	0	111.7	G341 F344	G341-T492 CarbonylContact O-C 3.55Å; G341-T492 WeakPolarHBondContact O-CA 3.36Å; F344-T492 HydrophobicContact CB-CG2 3.85Å
493	N	88.9	Confident	88.8	Confident	89 Å²	89	98.5 Å²	98.5	48%	0.476	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-66.8	152.2	172.8	-72.9	-23.7	0	0	0	111.6	G341 R345	G341-N493 PolarHBondContact O-N 2.79Å; R345-N493 PolarHBondContact NH2-O 3.5Å
494	Q	85.9	Confident	88.1	Confident	180 Å²	180	97.7 Å²	97.7	84%	0.841	49%	0.487	S	S	*	.	S	Bend	trans	-70.1	-43.6	-179.5	-67	-175.7	-3.7	0	0	111.7
495	I	89.8	Confident	87.3	Confident	144 Å²	144	102 Å²	102	74%	0.738	49%	0.493	S	S	*	.	S	Bend	trans	-94.8	125	-177.5	-57.5	174.3	0	0	0	109.1
496	P	89.5	Confident	86.5	Confident	65 Å²	65	100 Å²	100	42%	0.422	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-72.1	136.9	175.8	28.5	-32.4	0	0	0	111.5	Y574	P496-Y574 WeakPolarHBondContact CB-OH 3.45Å
497	R	88	Confident	86.3	Confident	105 Å²	105	104.4 Å²	104.4	40%	0.396	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-70.7	149.6	174.2	-169.5	164.7	-179.5	-104.3	-1.7	111.9	D342 E572	D342-R497 WeakPolarHBondContact OD2-CB 3.12Å; D342-R497 PolarHBondContact OD2-N 2.87Å; R497-E572 IonicContact CZ-OE2 3.49Å; R497-E572 IonicContact NH1-OE2 2.59Å; R497-E572 PolarHBondContact NH1-OE2 3.35Å; R497-E572 IonicContact NH2-OE2 3.52Å
498	Q	88.7	Confident	86.2	Confident	178 Å²	178	99.8 Å²	99.8	83%	0.832	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-71.5	135.5	172	-67	-175.1	-3.6	0	0	110.5
499	I	88.8	Confident	86.2	Confident	45 Å²	45	102.9 Å²	102.9	23%	0.231	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-91.6	126.9	-178.3	-61	164.5	0	0	0	108.5	Q502 D573 Y574 R575	I499-Q502 HydrophobicContact CG2-CG 4.46Å; I499-D573 HydrophobicContact CG2-CB 3.8Å; I499-Y574 HydrophobicContact CD1-CD1 4.32Å; I499-Y574 HydrophobicContact CD1-CE1 3.86Å; I499-Y574 HydrophobicContact CG1-CD1 4.18Å; I499-Y574 HydrophobicContact CG1-CE1 3.78Å; I499-R575 HydrophobicContact CD1-CG 4.05Å; I499-R575 VanDerWaalsContact CD1-CZ 3.47Å
500	P	88	Confident	86.2	Confident	57 Å²	57	103.6 Å²	103.6	37%	0.37	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-67.2	163.2	179	28.5	-34.8	0	0	0	111.8	Q502 E572	P500-Q502 PolarHBondContact O-N 3.2Å; P500-Q502 PolarHBondContact O-NE2 2.86Å; P500-E572 HydrophobicContact CG-CB 3.94Å
501	Y	85	Confident	86.2	Confident	245 Å²	245	103.7 Å²	103.7	96%	0.961	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-57.9	121.9	177.4	-76.2	-79.6	0	0	0	111.3
502	Q	83	Confident	86.5	Confident	39 Å²	39	96.1 Å²	96.1	18%	0.182	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-86.2	137.8	-177.8	-61.4	-61.5	-54.3	0	0	110.7	I499 P500 G571	I499-Q502 HydrophobicContact CG2-CG 4.46Å; P500-Q502 PolarHBondContact O-N 3.2Å; P500-Q502 PolarHBondContact O-NE2 2.86Å; Q502-G571 PolarHBondContact NE2-O 3.15Å
503	S	85.3	Confident	86.7	Confident	69 Å²	69	96.7 Å²	96.7	48%	0.483	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-58.6	162.9	169.8	77.8	0	0	0	0	111.7	Y505 S506 R507	S503-Y505 VanDerWaalsContact C-N 3.34Å; S503-Y505 PolarHBondContact O-N 3.29Å; S503-S506 WeakPolarHBondContact CA-OG 3.38Å; S503-S506 PolarHBondContact N-OG 3.34Å; S503-S506 PolarHBondContact O-N 2.64Å; S503-S506 PolarHBondContact O-OG 2.86Å; S503-S506 PolarHBondContact OG-OG 3.17Å; S503-R507 PolarHBondContact O-N 3.23Å
504	L	80.2	Confident	86.8	Confident	92 Å²	92	95.9 Å²	95.9	48%	0.482	46%	0.462	S	S	.	.	S	Bend	trans	-58.3	-43.8	-179.9	-177.4	62.4	0	0	0	112.5	S506 R507 M510	L504-S506 VanDerWaalsContact C-N 3.28Å; L504-S506 PolarHBondContact O-N 3.45Å; L504-R507 VanDerWaalsContact O-CB 3.29Å; L504-R507 WeakPolarHBondContact O-CB 3.25Å; L504-R507 WeakPolarHBondContact O-CG 3.24Å; L504-R507 PolarHBondContact O-N 3.21Å; L504-M510 HydrophobicContact CD1-CG 4.37Å; L504-M510 HydrophobicContact CG-CG 4.37Å; L504-M510 WeakPolarHBondContact O-CG 3.23Å
505	Y	77.6	Confident	87	Confident	180 Å²	180	87.3 Å²	87.3	71%	0.706	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-31.5	-179	-61	-72.6	0	0	0	112.8	S503 R507 I514	S503-Y505 VanDerWaalsContact C-N 3.34Å; S503-Y505 PolarHBondContact O-N 3.29Å; Y505-R507 PolarHBondContact O-N 3.35Å; Y505-I514 HydrophobicContact CD1-CD1 4.23Å
506	S	77.6	Confident	87.1	Confident	25 Å²	25	80.5 Å²	80.5	18%	0.175	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	2.9	175	45.9	0	0	0	0	113.9	S503 L504 R579	S503-S506 WeakPolarHBondContact CA-OG 3.38Å; S503-S506 PolarHBondContact N-OG 3.34Å; S503-S506 PolarHBondContact O-N 2.64Å; S503-S506 PolarHBondContact O-OG 2.86Å; S503-S506 PolarHBondContact OG-OG 3.17Å; L504-S506 VanDerWaalsContact C-N 3.28Å; L504-S506 PolarHBondContact O-N 3.45Å; S506-R579 PolarHBondContact O-NH1 3.15Å; S506-R579 PolarHBondContact O-NH2 2.76Å
507	R	86.6	Confident	87.2	Confident	137 Å²	137	81.5 Å²	81.5	52%	0.517	39%	0.388	S	S	.	.	S	Bend	trans	-76.7	146.8	175.5	-65	-170.5	-173.9	169.7	-3.6	111.1	S503 L504 Y505 L509 M510 A511	S503-R507 PolarHBondContact O-N 3.23Å; L504-R507 VanDerWaalsContact O-CB 3.29Å; L504-R507 WeakPolarHBondContact O-CB 3.25Å; L504-R507 WeakPolarHBondContact O-CG 3.24Å; L504-R507 PolarHBondContact O-N 3.21Å; Y505-R507 PolarHBondContact O-N 3.35Å; R507-L509 VanDerWaalsContact C-N 3.32Å; R507-L509 PolarHBondContact O-N 3.25Å; R507-M510 PolarHBondContact O-N 3.42Å; R507-M510 VanDerWaalsContact O-N 3.1Å; R507-A511 PolarHBondContact O-N 3.1Å
508	P	85.4	Confident	87.3	Confident	66 Å²	66	78 Å²	78	43%	0.429	38%	0.377	S	S	.	.	H	α-helix	trans	-59.5	-37	-173	22.5	-34.3	0	0	0	114	A511 F512 R579	P508-A511 PolarHBondContact O-N 2.95Å; P508-F512 WeakPolarHBondContact O-CB 3.5Å; P508-F512 PolarHBondContact O-N 3.04Å; P508-R579 HydrophobicContact CB-CG 4.43Å
509	L	89.3	Confident	87.5	Confident	123 Å²	123	69.5 Å²	69.5	64%	0.644	34%	0.337	S	S	*	.	H	α-helix	trans	-67.8	-39	178	-65.7	171	0	0	0	112.2	R507 F512 F513	R507-L509 VanDerWaalsContact C-N 3.32Å; R507-L509 PolarHBondContact O-N 3.25Å; L509-F512 WeakPolarHBondContact O-CB 3.48Å; L509-F512 PolarHBondContact O-N 2.96Å; L509-F513 WeakPolarHBondContact O-CD2 3.42Å; L509-F513 PolarHBondContact O-N 3.04Å
510	M	89.3	Confident	87.7	Confident	70 Å²	70	68.6 Å²	68.6	35%	0.345	33%	0.331	S	S	.	.	H	α-helix	trans	-70.4	-41.5	176.6	-63.1	-59.7	129.2	0	0	110.8	L504 R507 F512 F513 I514	L504-M510 HydrophobicContact CD1-CG 4.37Å; L504-M510 HydrophobicContact CG-CG 4.37Å; L504-M510 WeakPolarHBondContact O-CG 3.23Å; R507-M510 PolarHBondContact O-N 3.42Å; R507-M510 VanDerWaalsContact O-N 3.1Å; M510-F512 VanDerWaalsContact C-N 3.28Å; M510-F512 PolarHBondContact O-N 3.05Å; M510-F513 PolarHBondContact O-N 3.15Å; M510-I514 HydrophobicContact CB-CD1 4.34Å; M510-I514 WeakPolarHBondContact O-CB 3.47Å; M510-I514 VanDerWaalsContact O-CG1 3.22Å; M510-I514 WeakPolarHBondContact O-CG1 3.42Å; M510-I514 PolarHBondContact O-N 3.28Å
511	A	87.9	Confident	87.7	Confident	9 Å²	9	68.9 Å²	68.9	7%	0.074	34%	0.335	C	S	.	.	H	α-helix	trans	-59.5	-37.5	174.6	0	0	0	0	0	112.6	R507 P508 G515	R507-A511 PolarHBondContact O-N 3.1Å; P508-A511 PolarHBondContact O-N 2.95Å; A511-G515 WeakPolarHBondContact O-CA 3.45Å; A511-G515 PolarHBondContact O-N 3.12Å
512	F	92.8	Very high	87.8	Confident	42 Å²	42	57.6 Å²	57.6	18%	0.184	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-51.7	173.1	174.8	-91.5	0	0	0	111.7	P508 L509 M510 G516 C582 A585 G586 F589	P508-F512 WeakPolarHBondContact O-CB 3.5Å; P508-F512 PolarHBondContact O-N 3.04Å; L509-F512 WeakPolarHBondContact O-CB 3.48Å; L509-F512 PolarHBondContact O-N 2.96Å; M510-F512 VanDerWaalsContact C-N 3.28Å; M510-F512 PolarHBondContact O-N 3.05Å; F512-G516 PolarHBondContact O-N 3.23Å; F512-C582 HydrophobicContact CD2-CB 4.28Å; F512-C582 WeakPolarHBondContact CD2-O 3.39Å; F512-A585 HydrophobicContact CE2-CB 4.06Å; F512-G586 VanDerWaalsContact O-CA 3.3Å; F512-G586 WeakPolarHBondContact O-CA 3.42Å; F512-F589 HydrophobicContact CE1-CB 3.57Å; F512-F589 HydrophobicContact CE1-CD2 4.45Å; F512-F589 HydrophobicContact CE1-CG 4.01Å; F512-F589 HydrophobicContact CZ-CB 3.73Å
513	F	94	Very high	88.1	Confident	70 Å²	70	56.3 Å²	56.3	31%	0.307	29%	0.286	S	S	.	.	H	α-helix	trans	-69.1	-41.3	-179.6	-66.2	-59.6	0	0	0	113.1	L509 M510 F589 Y590	L509-F513 WeakPolarHBondContact O-CD2 3.42Å; L509-F513 PolarHBondContact O-N 3.04Å; M510-F513 PolarHBondContact O-N 3.15Å; F513-F589 AromaticContact CD1-CD1 3.67Å; F513-F589 HydrophobicContact CD1-CD1 3.67Å; F513-F589 AromaticContact CD1-CE1 3.67Å; F513-F589 HydrophobicContact CD1-CE1 3.67Å; F513-F589 HydrophobicContact CD1-CG 4.24Å; F513-F589 HydrophobicContact CD1-CZ 4.24Å; F513-F589 AromaticContact CE1-CD1 3.64Å; F513-F589 HydrophobicContact CE1-CD1 3.64Å; F513-F589 AromaticContact CE1-CD2 3.98Å; F513-F589 HydrophobicContact CE1-CD2 3.98Å; F513-F589 AromaticContact CE1-CE1 3.48Å; F513-F589 HydrophobicContact CE1-CE1 3.48Å; F513-F589 VanDerWaalsContact CE1-CE1 3.48Å; F513-F589 AromaticContact CE1-CE2 3.83Å; F513-F589 HydrophobicContact CE1-CE2 3.83Å; F513-F589 AromaticContact CE1-CG 3.88Å; F513-F589 HydrophobicContact CE1-CG 3.88Å; F513-F589 AromaticContact CE1-CZ 3.58Å; F513-F589 HydrophobicContact CE1-CZ 3.58Å; F513-F589 HydrophobicContact CZ-CZ 4.48Å; F513-Y590 WeakPolarHBondContact O-CE2 3.04Å; F513-Y590 PolarHBondContact O-OH 2.84Å
514	I	90.6	Very high	88.4	Confident	73 Å²	73	57 Å²	57	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-72.1	-40.4	-178.4	-57.6	164.4	0	0	0	110.3	Y505 M510 G516 L517 M564	Y505-I514 HydrophobicContact CD1-CD1 4.23Å; M510-I514 HydrophobicContact CB-CD1 4.34Å; M510-I514 WeakPolarHBondContact O-CB 3.47Å; M510-I514 VanDerWaalsContact O-CG1 3.22Å; M510-I514 WeakPolarHBondContact O-CG1 3.42Å; M510-I514 PolarHBondContact O-N 3.28Å; I514-G516 VanDerWaalsContact C-N 3.28Å; I514-G516 PolarHBondContact O-N 3.2Å; I514-L517 PolarHBondContact O-N 3.27Å; I514-M564 HydrophobicContact CB-CE 3.77Å; I514-M564 HydrophobicContact CG2-CE 3.27Å
515	G	88.8	Confident	88.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-33.7	-179.7	0	0	0	0	0	114.3	A511 P519 T560 T583	A511-G515 WeakPolarHBondContact O-CA 3.45Å; A511-G515 PolarHBondContact O-N 3.12Å; G515-P519 WeakPolarHBondContact O-CD 3.46Å; G515-T560 PolarHBondContact O-OG1 2.84Å; G515-T583 CarbonylContact C-O 3.56Å
516	G	91.9	Very high	89.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-83.8	-16.6	179.6	0	0	0	0	0	115.9	F512 I514 P519 F520 G586 Y590	F512-G516 PolarHBondContact O-N 3.23Å; I514-G516 VanDerWaalsContact C-N 3.28Å; I514-G516 PolarHBondContact O-N 3.2Å; G516-P519 WeakPolarHBondContact O-CD 3.3Å; G516-F520 VanDerWaalsContact O-CB 3.25Å; G516-F520 WeakPolarHBondContact O-CB 3.43Å; G516-F520 PolarHBondContact O-N 2.64Å; G516-F520 VanDerWaalsContact O-N 3.14Å; G516-G586 VanDerWaalsContact CA-C 3.46Å; G516-Y590 VanDerWaalsContact C-CE2 3.47Å
517	L	91.9	Very high	89.6	Confident	86 Å²	86	46.2 Å²	46.2	45%	0.45	23%	0.233	S	C	.	.	H	α-helix	trans	-66.2	-49.2	-170.6	-179.5	63.1	0	0	0	112.2	I514 S521 Y590	I514-L517 PolarHBondContact O-N 3.27Å; L517-S521 WeakPolarHBondContact O-CB 3.29Å; L517-S521 PolarHBondContact O-N 2.98Å; L517-S521 PolarHBondContact O-OG 3.19Å; L517-Y590 HydrophobicContact CB-CE2 4.12Å; L517-Y590 HydrophobicContact CD1-CE1 3.81Å
518	L	90.4	Very high	89.7	Confident	32 Å²	32	41.5 Å²	41.5	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-50.6	-178.7	-177.9	88.2	0	0	0	111.7	L302 L306 F520 S521 C522 T560	L302-L518 HydrophobicContact CB-CD1 4.4Å; L302-L518 HydrophobicContact CD1-CD1 4.37Å; L306-L518 HydrophobicContact CD1-CD1 4.21Å; L306-L518 HydrophobicContact CD1-CD2 3.13Å; L306-L518 HydrophobicContact CD1-CG 4.26Å; L518-F520 PolarHBondContact O-N 2.8Å; L518-S521 WeakPolarHBondContact O-CB 3.45Å; L518-S521 PolarHBondContact O-N 3.33Å; L518-C522 PolarHBondContact O-N 3.22Å; L518-C522 PolarHBondContact O-SG 2.83Å; L518-T560 HydrophobicContact CB-CG2 3.99Å; L518-T560 HydrophobicContact CD2-CG2 3.51Å; L518-T560 HydrophobicContact CG-CG2 4.4Å
519	P	92.9	Very high	89.8	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-35.4	179.1	-25.1	36.8	0	0	0	113	G515 G516 C522 I523 L553 I557 T560 T587	G515-P519 WeakPolarHBondContact O-CD 3.46Å; G516-P519 WeakPolarHBondContact O-CD 3.3Å; P519-C522 WeakPolarHBondContact O-CB 3.49Å; P519-C522 PolarHBondContact O-N 3.43Å; P519-I523 PolarHBondContact O-N 2.94Å; P519-L553 HydrophobicContact CB-CD1 3.84Å; P519-I557 HydrophobicContact CB-CG1 3.71Å; P519-I557 HydrophobicContact CG-CG1 3.92Å; P519-T560 HydrophobicContact CG-CG2 4.3Å; P519-T587 HydrophobicContact CB-CG2 4.12Å
520	F	93.2	Very high	89.7	Confident	25 Å²	25	35.2 Å²	35.2	11%	0.11	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-45.6	172.6	171.9	-102.9	0	0	0	112.1	G516 L518 C522 I523 F524 L527 T587 Y590 Y594	G516-F520 VanDerWaalsContact O-CB 3.25Å; G516-F520 WeakPolarHBondContact O-CB 3.43Å; G516-F520 PolarHBondContact O-N 2.64Å; G516-F520 VanDerWaalsContact O-N 3.14Å; L518-F520 PolarHBondContact O-N 2.8Å; F520-C522 PolarHBondContact O-N 3.14Å; F520-I523 CarbonylContact O-C 3.51Å; F520-I523 WeakPolarHBondContact O-CG1 3.31Å; F520-I523 PolarHBondContact O-N 2.84Å; F520-F524 HydrophobicContact CE1-CB 4.48Å; F520-F524 AromaticContact CE1-CD2 3.84Å; F520-F524 HydrophobicContact CE1-CD2 3.84Å; F520-F524 HydrophobicContact CE1-CG 4.49Å; F520-F524 HydrophobicContact CE2-CD2 4.38Å; F520-F524 AromaticContact CZ-CD2 3.55Å; F520-F524 HydrophobicContact CZ-CD2 3.55Å; F520-F524 HydrophobicContact CZ-CE2 4.23Å; F520-F524 HydrophobicContact CZ-CG 4.49Å; F520-F524 PolarHBondContact O-N 2.83Å; F520-L527 HydrophobicContact CD2-CD1 4.03Å; F520-L527 HydrophobicContact CE2-CD1 3.74Å; F520-T587 HydrophobicContact CB-CG2 4.33Å; F520-Y590 HydrophobicContact CB-CD2 4.24Å; F520-Y590 HydrophobicContact CB-CG 4.1Å; F520-Y590 HydrophobicContact CD1-CD1 4.27Å; F520-Y590 HydrophobicContact CD1-CG 4.05Å; F520-Y590 VanDerWaalsContact CD2-CB 3.41Å; F520-Y590 AromaticContact CG-CG 3.99Å; F520-Y590 HydrophobicContact CG-CG 3.99Å; F520-Y594 HydrophobicContact CE2-CG 4.47Å; F520-Y594 HydrophobicContact CZ-CG 4.41Å
521	S	89	Confident	89.8	Confident	64 Å²	64	32 Å²	32	45%	0.448	16%	0.163	S	C	.	.	H	α-helix	trans	-57.3	-36.3	178.4	-58.3	0	0	0	0	111.9	L517 L518 I523	L517-S521 WeakPolarHBondContact O-CB 3.29Å; L517-S521 PolarHBondContact O-N 2.98Å; L517-S521 PolarHBondContact O-OG 3.19Å; L518-S521 WeakPolarHBondContact O-CB 3.45Å; L518-S521 PolarHBondContact O-N 3.33Å; S521-I523 VanDerWaalsContact C-N 3.31Å; S521-I523 PolarHBondContact O-N 2.98Å
522	C	87	Confident	89.8	Confident	7 Å²	7	32.1 Å²	32.1	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-65.4	-29.9	177.5	-62.3	0	0	0	0	114.1	T299 L518 P519 F520	T299-C522 HydrophobicContact CG2-CB 3.66Å; T299-C522 WeakPolarHBondContact CG2-SG 3.49Å; T299-C522 WeakPolarHBondContact OG1-CA 3.4Å; L518-C522 PolarHBondContact O-N 3.22Å; L518-C522 PolarHBondContact O-SG 2.83Å; P519-C522 WeakPolarHBondContact O-CB 3.49Å; P519-C522 PolarHBondContact O-N 3.43Å; F520-C522 PolarHBondContact O-N 3.14Å
523	I	89.3	Confident	89.4	Confident	12 Å²	12	31.3 Å²	31.3	6%	0.062	16%	0.161	C	C	.	.	H	α-helix	trans	-106.4	-7.9	-177.9	64.3	173.7	0	0	0	113.4	P519 F520 S521 I525 Q526 L527 V549 L553 T587	P519-I523 PolarHBondContact O-N 2.94Å; F520-I523 CarbonylContact O-C 3.51Å; F520-I523 WeakPolarHBondContact O-CG1 3.31Å; F520-I523 PolarHBondContact O-N 2.84Å; S521-I523 VanDerWaalsContact C-N 3.31Å; S521-I523 PolarHBondContact O-N 2.98Å; I523-I525 PolarHBondContact O-N 3.44Å; I523-Q526 CarbonylContact O-C 3.45Å; I523-Q526 WeakPolarHBondContact O-CA 3.43Å; I523-Q526 WeakPolarHBondContact O-CB 3.28Å; I523-Q526 PolarHBondContact O-N 2.95Å; I523-L527 HydrophobicContact CB-CG 4.43Å; I523-L527 HydrophobicContact CD1-CD1 3.87Å; I523-L527 HydrophobicContact CD1-CD2 4.33Å; I523-L527 HydrophobicContact CD1-CG 4.19Å; I523-L527 HydrophobicContact CG1-CD1 3.79Å; I523-L527 HydrophobicContact CG1-CG 4.1Å; I523-L527 WeakPolarHBondContact O-CG 3.5Å; I523-L527 PolarHBondContact O-N 3.4Å; I523-V549 HydrophobicContact CG2-CG1 3.79Å; I523-L553 HydrophobicContact CD1-CD1 4.38Å; I523-L553 HydrophobicContact CD1-CD2 4.44Å; I523-L553 HydrophobicContact CG2-CB 4.05Å; I523-L553 HydrophobicContact CG2-CD1 3.85Å; I523-L553 HydrophobicContact CG2-CD2 4.11Å; I523-L553 HydrophobicContact CG2-CG 4.21Å; I523-T587 HydrophobicContact CD1-CG2 4.29Å
524	F	89.9	Confident	89.1	Confident	85 Å²	85	32.2 Å²	32.2	37%	0.373	17%	0.169	S	C	.	.	H	α-helix	trans	-50.9	-50.6	-172.7	174.4	-108	0	0	0	113.4	F520 Q526 L527 F528 Y594	F520-F524 HydrophobicContact CE1-CB 4.48Å; F520-F524 AromaticContact CE1-CD2 3.84Å; F520-F524 HydrophobicContact CE1-CD2 3.84Å; F520-F524 HydrophobicContact CE1-CG 4.49Å; F520-F524 HydrophobicContact CE2-CD2 4.38Å; F520-F524 AromaticContact CZ-CD2 3.55Å; F520-F524 HydrophobicContact CZ-CD2 3.55Å; F520-F524 HydrophobicContact CZ-CE2 4.23Å; F520-F524 HydrophobicContact CZ-CG 4.49Å; F520-F524 PolarHBondContact O-N 2.83Å; F524-Q526 PolarHBondContact O-N 3.26Å; F524-L527 PolarHBondContact O-N 3.32Å; F524-F528 PolarHBondContact O-N 2.87Å; F524-Y594 HydrophobicContact CD2-CD2 4.09Å; F524-Y594 HydrophobicContact CD2-CE2 4.21Å; F524-Y594 AromaticContact CE2-CD2 3.59Å; F524-Y594 HydrophobicContact CE2-CD2 3.59Å; F524-Y594 AromaticContact CE2-CE2 3.59Å; F524-Y594 HydrophobicContact CE2-CE2 3.59Å; F524-Y594 HydrophobicContact CZ-CE2 4.32Å
525	I	87.1	Confident	88.9	Confident	53 Å²	53	30.4 Å²	30.4	27%	0.272	16%	0.157	S	C	.	.	H	α-helix	trans	-61.3	-35.5	178.6	-64.1	-58.7	0	0	0	111.6	S291 I523 F528 F529	S291-I525 VanDerWaalsContact OG-CG2 3.22Å; S291-I525 WeakPolarHBondContact OG-CG2 3.41Å; I523-I525 PolarHBondContact O-N 3.44Å; I525-F528 WeakPolarHBondContact O-CB 3.39Å; I525-F528 PolarHBondContact O-N 3.28Å; I525-F529 HydrophobicContact CG2-CD2 4.48Å; I525-F529 HydrophobicContact CG2-CE2 3.84Å; I525-F529 WeakPolarHBondContact O-CD2 3.33Å
526	Q	86.3	Confident	88.2	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.009	18%	0.175	C	C	.	.	H	α-helix	trans	-78.4	-33.5	-179.5	-64.7	-72.5	49.5	0	0	113.2	I292 I523 F524 F528 F529 I530 V549	I292-Q526 VanDerWaalsContact CG2-NE2 3.3Å; I523-Q526 CarbonylContact O-C 3.45Å; I523-Q526 WeakPolarHBondContact O-CA 3.43Å; I523-Q526 WeakPolarHBondContact O-CB 3.28Å; I523-Q526 PolarHBondContact O-N 2.95Å; F524-Q526 PolarHBondContact O-N 3.26Å; Q526-F528 PolarHBondContact O-N 2.85Å; Q526-F529 PolarHBondContact O-N 3.49Å; Q526-F529 VanDerWaalsContact O-N 3.17Å; Q526-I530 VanDerWaalsContact O-CG1 3.25Å; Q526-I530 WeakPolarHBondContact O-CG1 3.37Å; Q526-I530 PolarHBondContact O-N 3.46Å; Q526-V549 HydrophobicContact CB-CG1 4.48Å; Q526-V549 HydrophobicContact CG-CB 4.44Å; Q526-V549 HydrophobicContact CG-CG1 4.08Å; Q526-V549 HydrophobicContact CG-CG2 3.94Å
527	L	88.6	Confident	87.2	Confident	14 Å²	14	35.2 Å²	35.2	7%	0.073	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-35.1	171.7	-69.3	173.6	0	0	0	111.1	F520 I523 F524 I530 F531 L591 Y594	F520-L527 HydrophobicContact CD2-CD1 4.03Å; F520-L527 HydrophobicContact CE2-CD1 3.74Å; I523-L527 HydrophobicContact CB-CG 4.43Å; I523-L527 HydrophobicContact CD1-CD1 3.87Å; I523-L527 HydrophobicContact CD1-CD2 4.33Å; I523-L527 HydrophobicContact CD1-CG 4.19Å; I523-L527 HydrophobicContact CG1-CD1 3.79Å; I523-L527 HydrophobicContact CG1-CG 4.1Å; I523-L527 WeakPolarHBondContact O-CG 3.5Å; I523-L527 PolarHBondContact O-N 3.4Å; F524-L527 PolarHBondContact O-N 3.32Å; L527-I530 PolarHBondContact O-N 3.07Å; L527-F531 HydrophobicContact CD2-CE2 4.31Å; L527-F531 WeakPolarHBondContact O-CB 3.38Å; L527-F531 WeakPolarHBondContact O-CD2 3.32Å; L527-F531 PolarHBondContact O-N 3.36Å; L527-L591 HydrophobicContact CD1-CD1 3.55Å; L527-L591 HydrophobicContact CD2-CD1 3.59Å; L527-L591 HydrophobicContact CG-CD1 4.14Å; L527-Y594 HydrophobicContact CB-CD1 4.22Å; L527-Y594 HydrophobicContact CB-CE1 3.93Å
528	F	88.2	Confident	86.5	Confident	39 Å²	39	34.5 Å²	34.5	17%	0.171	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-51.2	173	176.6	-102.4	0	0	0	112.7	F524 I525 Q526 F531 N532 Y594	F524-F528 PolarHBondContact O-N 2.87Å; I525-F528 WeakPolarHBondContact O-CB 3.39Å; I525-F528 PolarHBondContact O-N 3.28Å; Q526-F528 PolarHBondContact O-N 2.85Å; F528-F531 PolarHBondContact O-N 3.41Å; F528-N532 WeakPolarHBondContact CE1-ND2 3.27Å; F528-N532 WeakPolarHBondContact CZ-ND2 3.49Å; F528-N532 PolarHBondContact O-N 2.85Å; F528-N532 PolarHBondContact O-ND2 2.83Å; F528-Y594 WeakPolarHBondContact CA-OH 3.27Å; F528-Y594 WeakPolarHBondContact CB-OH 3.36Å
529	F	86.6	Confident	85.9	Confident	12 Å²	12	35.8 Å²	35.8	5%	0.053	20%	0.199	C	C	.	.	H	α-helix	trans	-66.6	-40.3	179	-62.4	-63.7	0	0	0	112.4	Q288 I292 I525 Q526 F531 N532 S533 Y540	Q288-F529 HydrophobicContact CB-CD1 4.25Å; Q288-F529 HydrophobicContact CB-CE1 3.59Å; Q288-F529 HydrophobicContact CB-CE2 4.3Å; Q288-F529 HydrophobicContact CB-CZ 3.63Å; Q288-F529 VanDerWaalsContact CD-CD1 3.43Å; Q288-F529 HydrophobicContact CG-CD1 3.68Å; Q288-F529 HydrophobicContact CG-CD2 3.97Å; Q288-F529 HydrophobicContact CG-CE1 3.49Å; Q288-F529 VanDerWaalsContact CG-CE1 3.49Å; Q288-F529 HydrophobicContact CG-CE2 3.79Å; Q288-F529 HydrophobicContact CG-CG 3.94Å; Q288-F529 HydrophobicContact CG-CZ 3.56Å; Q288-F529 VanDerWaalsContact NE2-CG 3.33Å; I292-F529 HydrophobicContact CD1-CD2 4.23Å; I292-F529 HydrophobicContact CD1-CE2 4.36Å; I292-F529 HydrophobicContact CG1-CD2 4.27Å; I292-F529 HydrophobicContact CG1-CE2 4.08Å; I525-F529 HydrophobicContact CG2-CD2 4.48Å; I525-F529 HydrophobicContact CG2-CE2 3.84Å; I525-F529 WeakPolarHBondContact O-CD2 3.33Å; Q526-F529 PolarHBondContact O-N 3.49Å; Q526-F529 VanDerWaalsContact O-N 3.17Å; F529-F531 PolarHBondContact O-N 2.63Å; F529-N532 PolarHBondContact O-N 3.07Å; F529-S533 PolarHBondContact O-N 2.59Å; F529-S533 PolarHBondContact O-OG 2.53Å; F529-S533 VanDerWaalsContact O-OG 3.09Å; F529-Y540 HydrophobicContact CB-CD2 4.4Å; F529-Y540 HydrophobicContact CB-CE2 4.12Å
530	I	88.8	Confident	85.2	Confident	44 Å²	44	37 Å²	37	23%	0.226	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-45.3	177.2	-67.8	164	0	0	0	110.7	Q526 L527 S533 I534 Y540 L546	Q526-I530 VanDerWaalsContact O-CG1 3.25Å; Q526-I530 WeakPolarHBondContact O-CG1 3.37Å; Q526-I530 PolarHBondContact O-N 3.46Å; L527-I530 PolarHBondContact O-N 3.07Å; I530-S533 PolarHBondContact O-N 2.78Å; I530-I534 HydrophobicContact CG2-CD1 3.62Å; I530-I534 HydrophobicContact CG2-CG1 4.35Å; I530-I534 VanDerWaalsContact O-CG1 3.29Å; I530-I534 WeakPolarHBondContact O-CG1 3.48Å; I530-I534 PolarHBondContact O-N 3.04Å; I530-Y540 HydrophobicContact CG1-CE2 4.41Å; I530-L546 HydrophobicContact CD1-CD1 3.85Å
531	F	90.6	Very high	84.4	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-68.4	-39.3	179.6	-84.9	-119	0	0	0	111.8	L527 F528 F529 S533 I534 W535 L591 Y594 Y598	L527-F531 HydrophobicContact CD2-CE2 4.31Å; L527-F531 WeakPolarHBondContact O-CB 3.38Å; L527-F531 WeakPolarHBondContact O-CD2 3.32Å; L527-F531 PolarHBondContact O-N 3.36Å; F528-F531 PolarHBondContact O-N 3.41Å; F529-F531 PolarHBondContact O-N 2.63Å; F531-S533 VanDerWaalsContact C-N 3.27Å; F531-S533 PolarHBondContact O-N 2.87Å; F531-I534 PolarHBondContact O-N 2.85Å; F531-W535 AromaticContact CD1-CD1 3.84Å; F531-W535 AromaticContact CD1-NE1 3.79Å; F531-W535 WeakPolarHBondContact O-CB 3Å; F531-W535 VanDerWaalsContact O-CD1 3.23Å; F531-W535 PolarHBondContact O-N 2.97Å; F531-L591 HydrophobicContact CE2-CD1 3.95Å; F531-L591 HydrophobicContact CZ-CD1 4.04Å; F531-Y594 HydrophobicContact CD1-CE1 4.33Å; F531-Y594 HydrophobicContact CD2-CE1 4.1Å; F531-Y594 HydrophobicContact CE2-CD1 4.36Å; F531-Y594 HydrophobicContact CE2-CE1 4.33Å; F531-Y594 HydrophobicContact CG-CE1 4.09Å; F531-Y594 HydrophobicContact CZ-CD1 4.33Å; F531-Y598 HydrophobicContact CB-CD1 4.3Å; F531-Y598 HydrophobicContact CB-CD2 3.87Å; F531-Y598 HydrophobicContact CB-CE1 4.1Å; F531-Y598 HydrophobicContact CB-CE2 3.66Å; F531-Y598 HydrophobicContact CB-CG 4.19Å; F531-Y598 AromaticContact CD1-CD1 3.82Å; F531-Y598 HydrophobicContact CD1-CD1 3.82Å; F531-Y598 HydrophobicContact CD1-CD2 4.34Å; F531-Y598 HydrophobicContact CD1-CE1 4.3Å; F531-Y598 AromaticContact CD1-CG 3.84Å; F531-Y598 HydrophobicContact CD1-CG 3.84Å; F531-Y598 HydrophobicContact CG-CD2 4.48Å; F531-Y598 HydrophobicContact CG-CG 4.42Å; F531-Y598 PolarHBondContact O-OH 2.93Å
532	N	86.9	Confident	84	Confident	10 Å²	10	36.8 Å²	36.8	5%	0.053	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-36.9	172.5	-73	-18	0	0	0	112	F528 F529 G536 Y598	F528-N532 WeakPolarHBondContact CE1-ND2 3.27Å; F528-N532 WeakPolarHBondContact CZ-ND2 3.49Å; F528-N532 PolarHBondContact O-N 2.85Å; F528-N532 PolarHBondContact O-ND2 2.83Å; F529-N532 PolarHBondContact O-N 3.07Å; N532-G536 CarbonylContact O-C 3.5Å; N532-G536 WeakPolarHBondContact O-CA 3.38Å; N532-G536 PolarHBondContact O-N 3.3Å; N532-Y598 WeakPolarHBondContact CA-OH 3.41Å; N532-Y598 PolarHBondContact N-OH 2.94Å; N532-Y598 WeakPolarHBondContact OD1-CE2 3.01Å; N532-Y598 PolarHBondContact OD1-OH 3.23Å
533	S	85.4	Confident	83.9	Confident	25 Å²	25	37.5 Å²	37.5	18%	0.175	20%	0.197	C	C	.	.	H	α-helix	trans	-74	-41.2	178.2	-61.5	0	0	0	0	113.2	F529 I530 F531 Q538 Y540	F529-S533 PolarHBondContact O-N 2.59Å; F529-S533 PolarHBondContact O-OG 2.53Å; F529-S533 VanDerWaalsContact O-OG 3.09Å; I530-S533 PolarHBondContact O-N 2.78Å; F531-S533 VanDerWaalsContact C-N 3.27Å; F531-S533 PolarHBondContact O-N 2.87Å; S533-Q538 WeakPolarHBondContact CA-O 3.09Å; S533-Q538 VanDerWaalsContact CB-O 3.27Å; S533-Q538 WeakPolarHBondContact CB-O 3.36Å; S533-Q538 PolarHBondContact OG-O 2.81Å; S533-Y540 WeakPolarHBondContact OG-CB 3.33Å; S533-Y540 PolarHBondContact OG-N 3.4Å
534	I	87.9	Confident	83.7	Confident	90 Å²	90	38.4 Å²	38.4	46%	0.462	21%	0.209	S	C	.	.	H	α-helix	trans	-69.3	-43.6	179.4	-66.9	171.6	0	0	0	111	I530 F531 I621	I530-I534 HydrophobicContact CG2-CD1 3.62Å; I530-I534 HydrophobicContact CG2-CG1 4.35Å; I530-I534 VanDerWaalsContact O-CG1 3.29Å; I530-I534 WeakPolarHBondContact O-CG1 3.48Å; I530-I534 PolarHBondContact O-N 3.04Å; F531-I534 PolarHBondContact O-N 2.85Å; I534-I621 HydrophobicContact CD1-CD1 4.5Å
535	W	86.6	Confident	83.4	Confident	35 Å²	35	36.4 Å²	36.4	13%	0.133	20%	0.2	C	C	.	.	H	α-helix	trans	-106.7	-24.3	-170.3	-54.2	109.2	0	0	0	114.3	F60 F531 Y598 L603 Y614	F60-W535 HydrophobicContact CD2-CE3 4.23Å; F60-W535 AromaticContact CD2-CZ3 3.83Å; F60-W535 HydrophobicContact CD2-CZ3 3.83Å; F60-W535 HydrophobicContact CE2-CE3 4.01Å; F60-W535 HydrophobicContact CE2-CH2 4.45Å; F60-W535 AromaticContact CE2-CZ3 3.41Å; F60-W535 HydrophobicContact CE2-CZ3 3.41Å; F60-W535 VanDerWaalsContact CE2-CZ3 3.41Å; F60-W535 HydrophobicContact CZ-CZ3 4.37Å; F531-W535 AromaticContact CD1-CD1 3.84Å; F531-W535 AromaticContact CD1-NE1 3.79Å; F531-W535 WeakPolarHBondContact O-CB 3Å; F531-W535 VanDerWaalsContact O-CD1 3.23Å; F531-W535 PolarHBondContact O-N 2.97Å; W535-Y598 HydrophobicContact CB-CE1 4.13Å; W535-Y598 AromaticContact CD1-CE1 3.99Å; W535-Y598 HydrophobicContact CG-CE1 4.32Å; W535-L603 HydrophobicContact CB-CD2 3.98Å; W535-Y614 AromaticContact CD1-CE2 3.94Å; W535-Y614 AromaticContact CD2-CD2 3.7Å; W535-Y614 HydrophobicContact CD2-CD2 3.7Å; W535-Y614 AromaticContact CD2-CE2 3.74Å; W535-Y614 HydrophobicContact CD2-CE2 3.74Å; W535-Y614 AromaticContact CE2-CD2 3.59Å; W535-Y614 AromaticContact CE2-CE2 3.41Å; W535-Y614 VanDerWaalsContact CE2-CE2 3.41Å; W535-Y614 AromaticContact CE3-CD2 3.76Å; W535-Y614 HydrophobicContact CE3-CD2 3.76Å; W535-Y614 HydrophobicContact CE3-CE2 4.29Å; W535-Y614 HydrophobicContact CG-CD2 4.41Å; W535-Y614 HydrophobicContact CG-CE2 4.08Å; W535-Y614 AromaticContact CH2-CD2 3.65Å; W535-Y614 HydrophobicContact CH2-CD2 3.65Å; W535-Y614 HydrophobicContact CH2-CE2 4.27Å; W535-Y614 HydrophobicContact CH2-CG 4.39Å; W535-Y614 AromaticContact CZ2-CD2 3.6Å; W535-Y614 HydrophobicContact CZ2-CD2 3.6Å; W535-Y614 AromaticContact CZ2-CE2 3.74Å; W535-Y614 HydrophobicContact CZ2-CE2 3.74Å; W535-Y614 AromaticContact CZ3-CD2 3.71Å; W535-Y614 HydrophobicContact CZ3-CD2 3.71Å; W535-Y614 AromaticContact NE1-CE2 3.55Å
536	G	74.2	Confident	83.4	Confident	36 Å²	36	35.3 Å²	35.3	37%	0.371	19%	0.194	S	C	.	.	S	Bend	trans	-98.8	14	-174.1	0	0	0	0	0	115.2	N532 Q538	N532-G536 CarbonylContact O-C 3.5Å; N532-G536 WeakPolarHBondContact O-CA 3.38Å; N532-G536 PolarHBondContact O-N 3.3Å; G536-Q538 PolarHBondContact O-N 3.04Å; G536-Q538 VanDerWaalsContact O-N 3.12Å
537	A	70.2	Confident	83.7	Confident	64 Å²	64	36.9 Å²	36.9	53%	0.529	20%	0.201	S	C	.	.	S	Bend	trans	54.8	25.7	-177.7	0	0	0	0	0	114.8
538	Q	76.9	Confident	83.7	Confident	72 Å²	72	40.3 Å²	40.3	34%	0.336	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-96.6	148	176.7	-66.4	178.3	-0.4	0	0	111.2	M282 S533 G536	M282-Q538 HydrophobicContact SD-CG 4.48Å; S533-Q538 WeakPolarHBondContact CA-O 3.09Å; S533-Q538 VanDerWaalsContact CB-O 3.27Å; S533-Q538 WeakPolarHBondContact CB-O 3.36Å; S533-Q538 PolarHBondContact OG-O 2.81Å; G536-Q538 PolarHBondContact O-N 3.04Å; G536-Q538 VanDerWaalsContact O-N 3.12Å
539	F	78.4	Confident	83.8	Confident	59 Å²	59	38.9 Å²	38.9	26%	0.259	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-82.7	131.9	175.7	-64.6	-73.4	0	0	0	111.9	T160 W275 I278 L279 M282 P381	T160-F539 HydrophobicContact CG2-CD2 4.49Å; T160-F539 HydrophobicContact CG2-CE2 3.64Å; W275-F539 HydrophobicContact CZ3-CE1 4.42Å; W275-F539 HydrophobicContact CZ3-CE2 4.43Å; W275-F539 HydrophobicContact CZ3-CZ 4.31Å; I278-F539 HydrophobicContact CG2-CD2 4.28Å; I278-F539 HydrophobicContact CG2-CE2 4.36Å; L279-F539 HydrophobicContact CD2-CB 4.39Å; M282-F539 HydrophobicContact CE-CD2 4.13Å; P381-F539 HydrophobicContact CB-CD1 3.88Å; P381-F539 HydrophobicContact CB-CG 4.48Å; P381-F539 HydrophobicContact CG-CB 4.48Å
540	Y	78	Confident	84.1	Confident	24 Å²	24	39 Å²	39	9%	0.094	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-90.9	119.9	165.6	-167.1	-86.5	0	0	0	109.5	F529 I530 S533 M542 F543 L546	F529-Y540 HydrophobicContact CB-CD2 4.4Å; F529-Y540 HydrophobicContact CB-CE2 4.12Å; I530-Y540 HydrophobicContact CG1-CE2 4.41Å; S533-Y540 WeakPolarHBondContact OG-CB 3.33Å; S533-Y540 PolarHBondContact OG-N 3.4Å; Y540-M542 VanDerWaalsContact CE1-C 3.42Å; Y540-M542 HydrophobicContact CE1-CB 4.27Å; Y540-M542 VanDerWaalsContact CE1-O 3.31Å; Y540-M542 WeakPolarHBondContact CE1-O 3.22Å; Y540-M542 PolarHBondContact OH-O 3.05Å; Y540-F543 HydrophobicContact CD1-CD1 4.23Å; Y540-F543 HydrophobicContact CD1-CE1 4.08Å; Y540-F543 HydrophobicContact CD1-CZ 4.28Å; Y540-F543 HydrophobicContact CE1-CD1 4.32Å; Y540-F543 WeakPolarHBondContact O-CE2 3.4Å; Y540-L546 HydrophobicContact CE1-CB 4Å; Y540-L546 HydrophobicContact CE1-CD2 4.01Å
541	Y	75.6	Confident	84.4	Confident	56 Å²	56	40.1 Å²	40.1	22%	0.22	22%	0.22	C	C	.	.			trans	-119	-16.2	-178.3	69.9	-80.3	0	0	0	114	L279 S285 F543	L279-Y541 HydrophobicContact CD1-CD2 4.42Å; L279-Y541 HydrophobicContact CD1-CG 4.39Å; L279-Y541 HydrophobicContact CD2-CD1 4.07Å; L279-Y541 HydrophobicContact CD2-CG 4.04Å; S285-Y541 WeakPolarHBondContact CB-OH 3.36Å; Y541-F543 PolarHBondContact O-N 3.32Å
542	M	81.4	Confident	84.4	Confident	30 Å²	30	40.7 Å²	40.7	15%	0.148	22%	0.223	C	C	.	.			trans	-82.2	55	-175.4	-67.3	-60.2	-165.6	0	0	113.1	W289 Y540 G544 F545 L546	W289-M542 HydrophobicContact CB-CE 4.2Å; W289-M542 HydrophobicContact CG-CE 4.44Å; Y540-M542 VanDerWaalsContact CE1-C 3.42Å; Y540-M542 HydrophobicContact CE1-CB 4.27Å; Y540-M542 VanDerWaalsContact CE1-O 3.31Å; Y540-M542 WeakPolarHBondContact CE1-O 3.22Å; Y540-M542 PolarHBondContact OH-O 3.05Å; M542-G544 PolarHBondContact O-N 3.12Å; M542-F545 HydrophobicContact CB-CB 4.47Å; M542-F545 HydrophobicContact CB-CD2 4.06Å; M542-F545 HydrophobicContact CG-CD2 4.4Å; M542-F545 PolarHBondContact O-N 2.99Å; M542-F545 HydrophobicContact SD-CD2 4.02Å; M542-F545 HydrophobicContact SD-CE2 4.17Å; M542-L546 PolarHBondContact O-N 3.19Å; M542-L546 VanDerWaalsContact O-N 3.16Å
543	F	84.8	Confident	84.7	Confident	22 Å²	22	40.8 Å²	40.8	10%	0.096	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-33.2	-176.2	-73.9	-70.2	0	0	0	113.9	A374 L387 Y540 Y541 F545 L546 F547	A374-F543 HydrophobicContact CB-CB 4.08Å; A374-F543 HydrophobicContact CB-CD1 3.6Å; A374-F543 HydrophobicContact CB-CE1 4.14Å; A374-F543 HydrophobicContact CB-CG 3.82Å; A374-F543 WeakPolarHBondContact O-CB 3.24Å; L387-F543 HydrophobicContact CD1-CE1 3.57Å; L387-F543 HydrophobicContact CD1-CZ 3.83Å; Y540-F543 HydrophobicContact CD1-CD1 4.23Å; Y540-F543 HydrophobicContact CD1-CE1 4.08Å; Y540-F543 HydrophobicContact CD1-CZ 4.28Å; Y540-F543 HydrophobicContact CE1-CD1 4.32Å; Y540-F543 WeakPolarHBondContact O-CE2 3.4Å; Y541-F543 PolarHBondContact O-N 3.32Å; F543-F545 VanDerWaalsContact C-N 3.33Å; F543-F545 PolarHBondContact O-N 3.2Å; F543-L546 HydrophobicContact CD1-CD2 4.26Å; F543-L546 WeakPolarHBondContact O-CB 3.45Å; F543-L546 PolarHBondContact O-N 3.01Å; F543-F547 PolarHBondContact O-N 3.2Å
544	G	84.6	Confident	85.2	Confident	30 Å²	30	41 Å²	41	31%	0.309	22%	0.224	S	C	.	.	H	α-helix	trans	-60.4	-42.1	175.2	0	0	0	0	0	112.7	M542 F547 L548	M542-G544 PolarHBondContact O-N 3.12Å; G544-F547 PolarHBondContact O-N 2.94Å; G544-L548 PolarHBondContact O-N 2.89Å; G544-L548 VanDerWaalsContact O-N 3.1Å
545	F	83.8	Confident	85.5	Confident	43 Å²	43	40 Å²	40	19%	0.189	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-38.1	174.4	-70.6	-74.5	0	0	0	112.8	W289 I292 M542 F543 F547 L548 V549	W289-F545 AromaticContact CD1-CE2 3.32Å; W289-F545 AromaticContact CD1-CZ 3.48Å; W289-F545 VanDerWaalsContact CD1-CZ 3.48Å; W289-F545 AromaticContact CE2-CZ 3.98Å; W289-F545 AromaticContact NE1-CE2 3.29Å; W289-F545 VanDerWaalsContact NE1-CE2 3.29Å; W289-F545 AromaticContact NE1-CZ 3.02Å; I292-F545 HydrophobicContact CG2-CB 3.69Å; I292-F545 HydrophobicContact CG2-CD1 3.54Å; I292-F545 HydrophobicContact CG2-CE1 4.4Å; I292-F545 HydrophobicContact CG2-CG 3.69Å; M542-F545 HydrophobicContact CB-CB 4.47Å; M542-F545 HydrophobicContact CB-CD2 4.06Å; M542-F545 HydrophobicContact CG-CD2 4.4Å; M542-F545 PolarHBondContact O-N 2.99Å; M542-F545 HydrophobicContact SD-CD2 4.02Å; M542-F545 HydrophobicContact SD-CE2 4.17Å; F543-F545 VanDerWaalsContact C-N 3.33Å; F543-F545 PolarHBondContact O-N 3.2Å; F545-F547 VanDerWaalsContact C-N 3.25Å; F545-F547 PolarHBondContact O-N 3.46Å; F545-L548 HydrophobicContact CD1-CD1 4.49Å; F545-L548 PolarHBondContact O-N 2.8Å; F545-V549 WeakPolarHBondContact O-CB 3.32Å; F545-V549 VanDerWaalsContact O-CG2 3.32Å; F545-V549 WeakPolarHBondContact O-CG2 3.3Å; F545-V549 PolarHBondContact O-N 3.45Å
546	L	87.7	Confident	85.8	Confident	30 Å²	30	38.4 Å²	38.4	16%	0.157	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-39.7	175.8	-173.7	57.9	0	0	0	111.2	L371 I530 Y540 M542 F543 V549 F550	L371-L546 HydrophobicContact CD2-CD2 3.58Å; L371-L546 HydrophobicContact CD2-CG 3.84Å; I530-L546 HydrophobicContact CD1-CD1 3.85Å; Y540-L546 HydrophobicContact CE1-CB 4Å; Y540-L546 HydrophobicContact CE1-CD2 4.01Å; M542-L546 PolarHBondContact O-N 3.19Å; M542-L546 VanDerWaalsContact O-N 3.16Å; F543-L546 HydrophobicContact CD1-CD2 4.26Å; F543-L546 WeakPolarHBondContact O-CB 3.45Å; F543-L546 PolarHBondContact O-N 3.01Å; L546-V549 PolarHBondContact O-N 3.07Å; L546-F550 WeakPolarHBondContact O-CB 3.14Å; L546-F550 PolarHBondContact O-N 3.48Å
547	F	91.6	Very high	86.9	Confident	36 Å²	36	36.7 Å²	36.7	16%	0.158	20%	0.195	C	C	.	.	H	α-helix	trans	-66.2	-43.1	175.6	-175	-113.8	0	0	0	112.6	L368 L371 F372 C375 F543 G544 F545 V549 F550 I551	L368-F547 HydrophobicContact CD1-CE2 3.98Å; L368-F547 HydrophobicContact CD1-CZ 4.39Å; L371-F547 HydrophobicContact CB-CD2 3.78Å; F372-F547 HydrophobicContact CB-CE2 4.28Å; F372-F547 HydrophobicContact CD2-CZ 4.32Å; C375-F547 HydrophobicContact CB-CB 4.22Å; C375-F547 HydrophobicContact CB-CG 4.44Å; F543-F547 PolarHBondContact O-N 3.2Å; G544-F547 PolarHBondContact O-N 2.94Å; F545-F547 VanDerWaalsContact C-N 3.25Å; F545-F547 PolarHBondContact O-N 3.46Å; F547-V549 PolarHBondContact O-N 3.21Å; F547-F550 WeakPolarHBondContact O-CB 3.46Å; F547-F550 PolarHBondContact O-N 3.2Å; F547-I551 HydrophobicContact CD1-CD1 4.1Å; F547-I551 HydrophobicContact CE1-CD1 3.74Å; F547-I551 HydrophobicContact CZ-CD1 4.1Å; F547-I551 WeakPolarHBondContact O-CG1 3.4Å; F547-I551 PolarHBondContact O-N 2.9Å
548	L	89.8	Confident	88.1	Confident	86 Å²	86	35 Å²	35	45%	0.45	18%	0.179	S	C	.	.	H	α-helix	trans	-60.5	-45.6	174.1	-71.4	174.9	0	0	0	111.9	G544 F545 F550 I551 M552	G544-L548 PolarHBondContact O-N 2.89Å; G544-L548 VanDerWaalsContact O-N 3.1Å; F545-L548 HydrophobicContact CD1-CD1 4.49Å; F545-L548 PolarHBondContact O-N 2.8Å; L548-F550 VanDerWaalsContact C-N 3.3Å; L548-F550 PolarHBondContact O-N 2.89Å; L548-I551 WeakPolarHBondContact O-CB 3.34Å; L548-I551 PolarHBondContact O-N 2.88Å; L548-I551 VanDerWaalsContact O-N 3.16Å; L548-M552 VanDerWaalsContact O-CG 3.29Å; L548-M552 WeakPolarHBondContact O-CG 3.31Å; L548-M552 PolarHBondContact O-N 2.86Å
549	V	90.2	Very high	88.8	Confident	8 Å²	8	33.1 Å²	33.1	5%	0.048	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-36.8	178.2	169.4	0	0	0	0	111.2	I523 Q526 F545 L546 F547 I551 M552 L553	I523-V549 HydrophobicContact CG2-CG1 3.79Å; Q526-V549 HydrophobicContact CB-CG1 4.48Å; Q526-V549 HydrophobicContact CG-CB 4.44Å; Q526-V549 HydrophobicContact CG-CG1 4.08Å; Q526-V549 HydrophobicContact CG-CG2 3.94Å; F545-V549 WeakPolarHBondContact O-CB 3.32Å; F545-V549 VanDerWaalsContact O-CG2 3.32Å; F545-V549 WeakPolarHBondContact O-CG2 3.3Å; F545-V549 PolarHBondContact O-N 3.45Å; L546-V549 PolarHBondContact O-N 3.07Å; F547-V549 PolarHBondContact O-N 3.21Å; V549-I551 PolarHBondContact O-N 2.92Å; V549-M552 PolarHBondContact O-N 3.39Å; V549-L553 WeakPolarHBondContact O-CB 3.39Å; V549-L553 PolarHBondContact O-N 2.84Å
550	F	93.6	Very high	89.5	Confident	15 Å²	15	30.8 Å²	30.8	7%	0.066	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-44.1	172.5	173.2	-101	0	0	0	112	F364 L367 L368 L371 L546 F547 L548 M552 L553 V554 F628	F364-F550 HydrophobicContact CD2-CE2 4.49Å; F364-F550 AromaticContact CD2-CZ 3.73Å; F364-F550 HydrophobicContact CD2-CZ 3.73Å; F364-F550 HydrophobicContact CE2-CE1 4.1Å; F364-F550 AromaticContact CE2-CZ 3.67Å; F364-F550 HydrophobicContact CE2-CZ 3.67Å; L367-F550 HydrophobicContact CB-CE2 3.83Å; L367-F550 HydrophobicContact CB-CZ 4.07Å; L367-F550 HydrophobicContact CD1-CE2 4.17Å; L368-F550 HydrophobicContact CB-CE1 4.03Å; L368-F550 HydrophobicContact CB-CZ 4.3Å; L368-F550 HydrophobicContact CD1-CD1 4.48Å; L368-F550 HydrophobicContact CD1-CE1 3.81Å; L371-F550 HydrophobicContact CD1-CB 3.72Å; L371-F550 HydrophobicContact CD1-CD1 4.24Å; L371-F550 HydrophobicContact CD1-CD2 3.98Å; L371-F550 HydrophobicContact CD1-CG 3.71Å; L546-F550 WeakPolarHBondContact O-CB 3.14Å; L546-F550 PolarHBondContact O-N 3.48Å; F547-F550 WeakPolarHBondContact O-CB 3.46Å; F547-F550 PolarHBondContact O-N 3.2Å; L548-F550 VanDerWaalsContact C-N 3.3Å; L548-F550 PolarHBondContact O-N 2.89Å; F550-M552 VanDerWaalsContact C-N 3.34Å; F550-M552 PolarHBondContact O-N 3.16Å; F550-L553 PolarHBondContact O-N 2.86Å; F550-V554 HydrophobicContact CE1-CG2 4.35Å; F550-V554 HydrophobicContact CE2-CG2 4.43Å; F550-V554 HydrophobicContact CZ-CG2 4.23Å; F550-V554 WeakPolarHBondContact O-CG2 3.2Å; F550-V554 PolarHBondContact O-N 2.92Å; F550-F628 HydrophobicContact CD2-CZ 4.22Å; F550-F628 HydrophobicContact CE2-CE1 4.32Å; F550-F628 AromaticContact CE2-CE2 3.87Å; F550-F628 HydrophobicContact CE2-CE2 3.87Å; F550-F628 AromaticContact CE2-CZ 3.63Å; F550-F628 HydrophobicContact CE2-CZ 3.63Å; F550-F628 HydrophobicContact CZ-CE2 4.31Å; F550-F628 HydrophobicContact CZ-CZ 4.44Å
551	I	93.7	Very high	90.3	Very high	67 Å²	67	29.6 Å²	29.6	34%	0.344	16%	0.156	S	C	.	.	H	α-helix	trans	-60.9	-45.8	175.1	-67	167.8	0	0	0	110.6	F547 L548 V549 L553 V554 I555	F547-I551 HydrophobicContact CD1-CD1 4.1Å; F547-I551 HydrophobicContact CE1-CD1 3.74Å; F547-I551 HydrophobicContact CZ-CD1 4.1Å; F547-I551 WeakPolarHBondContact O-CG1 3.4Å; F547-I551 PolarHBondContact O-N 2.9Å; L548-I551 WeakPolarHBondContact O-CB 3.34Å; L548-I551 PolarHBondContact O-N 2.88Å; L548-I551 VanDerWaalsContact O-N 3.16Å; V549-I551 PolarHBondContact O-N 2.92Å; I551-L553 VanDerWaalsContact C-N 3.32Å; I551-L553 PolarHBondContact O-N 3.28Å; I551-V554 WeakPolarHBondContact O-CB 3.27Å; I551-V554 PolarHBondContact O-N 2.8Å; I551-I555 HydrophobicContact CG2-CD1 3.96Å; I551-I555 WeakPolarHBondContact O-CG1 3.21Å; I551-I555 PolarHBondContact O-N 3.41Å
552	M	91.5	Very high	91.2	Very high	17 Å²	17	28 Å²	28	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-66.2	-35	-179.9	-66.3	172	57.7	0	0	112.6	C296 T299 L300 L548 V549 F550 I555 T556	C296-M552 HydrophobicContact CB-CE 4.22Å; C296-M552 HydrophobicContact CB-SD 4.06Å; C296-M552 VanDerWaalsContact O-CE 3.26Å; C296-M552 WeakPolarHBondContact O-CE 3.13Å; T299-M552 HydrophobicContact CG2-CB 4.29Å; T299-M552 HydrophobicContact CG2-CE 3.24Å; L300-M552 HydrophobicContact CD2-CE 4.05Å; L300-M552 HydrophobicContact CD2-CG 4.18Å; L300-M552 HydrophobicContact CD2-SD 4.25Å; L300-M552 HydrophobicContact CG-CE 3.72Å; L300-M552 HydrophobicContact CG-SD 4.18Å; L548-M552 VanDerWaalsContact O-CG 3.29Å; L548-M552 WeakPolarHBondContact O-CG 3.31Å; L548-M552 PolarHBondContact O-N 2.86Å; V549-M552 PolarHBondContact O-N 3.39Å; F550-M552 VanDerWaalsContact C-N 3.34Å; F550-M552 PolarHBondContact O-N 3.16Å; M552-I555 PolarHBondContact O-N 3.39Å; M552-T556 WeakPolarHBondContact O-CB 3.06Å; M552-T556 VanDerWaalsContact O-CG2 3.26Å; M552-T556 WeakPolarHBondContact O-CG2 3.34Å; M552-T556 PolarHBondContact O-N 2.76Å; M552-T556 PolarHBondContact O-OG1 2.87Å
553	L	93.5	Very high	91.7	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.063	15%	0.151	C	C	.	.	H	α-helix	trans	-62.1	-44.4	172.2	178	63	0	0	0	110.7	P519 I523 V549 F550 I551 I555 T556 I557 F628	P519-L553 HydrophobicContact CB-CD1 3.84Å; I523-L553 HydrophobicContact CD1-CD1 4.38Å; I523-L553 HydrophobicContact CD1-CD2 4.44Å; I523-L553 HydrophobicContact CG2-CB 4.05Å; I523-L553 HydrophobicContact CG2-CD1 3.85Å; I523-L553 HydrophobicContact CG2-CD2 4.11Å; I523-L553 HydrophobicContact CG2-CG 4.21Å; V549-L553 WeakPolarHBondContact O-CB 3.39Å; V549-L553 PolarHBondContact O-N 2.84Å; F550-L553 PolarHBondContact O-N 2.86Å; I551-L553 VanDerWaalsContact C-N 3.32Å; I551-L553 PolarHBondContact O-N 3.28Å; L553-I555 VanDerWaalsContact C-N 3.34Å; L553-I555 PolarHBondContact O-N 3.05Å; L553-T556 WeakPolarHBondContact CA-OG1 3.39Å; L553-T556 PolarHBondContact O-N 3.08Å; L553-T556 PolarHBondContact O-OG1 2.78Å; L553-I557 HydrophobicContact CD1-CD1 3.67Å; L553-I557 HydrophobicContact CD1-CG1 3.96Å; L553-I557 HydrophobicContact CD2-CD1 4.41Å; L553-I557 HydrophobicContact CG-CD1 3.67Å; L553-I557 HydrophobicContact CG-CG1 4.36Å; L553-I557 WeakPolarHBondContact O-CB 3.29Å; L553-I557 WeakPolarHBondContact O-CD1 3.43Å; L553-I557 WeakPolarHBondContact O-CG1 3.15Å; L553-I557 PolarHBondContact O-N 3.31Å; L553-F628 HydrophobicContact CD2-CE1 3.69Å; L553-F628 HydrophobicContact CD2-CZ 4.1Å; L553-F628 HydrophobicContact CG-CE1 4.48Å
554	V	95.8	Very high	92	Very high	30 Å²	30	28.6 Å²	28.6	18%	0.182	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-42.7	177.3	173.2	0	0	0	0	111.2	F364 F550 I551 S558 F628 V632	F364-V554 HydrophobicContact CD2-CG2 4.45Å; F364-V554 HydrophobicContact CE2-CG1 4.47Å; F364-V554 HydrophobicContact CE2-CG2 3.77Å; F550-V554 HydrophobicContact CE1-CG2 4.35Å; F550-V554 HydrophobicContact CE2-CG2 4.43Å; F550-V554 HydrophobicContact CZ-CG2 4.23Å; F550-V554 WeakPolarHBondContact O-CG2 3.2Å; F550-V554 PolarHBondContact O-N 2.92Å; I551-V554 WeakPolarHBondContact O-CB 3.27Å; I551-V554 PolarHBondContact O-N 2.8Å; V554-S558 WeakPolarHBondContact O-CB 3.12Å; V554-S558 PolarHBondContact O-N 3.3Å; V554-S558 PolarHBondContact O-OG 3.44Å; V554-F628 HydrophobicContact CG2-CE2 4.19Å; V554-F628 HydrophobicContact CG2-CZ 4.12Å; V554-V632 HydrophobicContact CG1-CG1 4Å
555	I	94.3	Very high	92.4	Very high	68 Å²	68	27.3 Å²	27.3	35%	0.349	14%	0.142	S	C	.	.	H	α-helix	trans	-62.7	-51.9	176.5	-66.9	167.8	0	0	0	110.5	I551 M552 L553 I557 S558 E559	I551-I555 HydrophobicContact CG2-CD1 3.96Å; I551-I555 WeakPolarHBondContact O-CG1 3.21Å; I551-I555 PolarHBondContact O-N 3.41Å; M552-I555 PolarHBondContact O-N 3.39Å; L553-I555 VanDerWaalsContact C-N 3.34Å; L553-I555 PolarHBondContact O-N 3.05Å; I555-I557 PolarHBondContact O-N 2.83Å; I555-S558 WeakPolarHBondContact O-CA 3.45Å; I555-S558 WeakPolarHBondContact O-CB 3.45Å; I555-S558 PolarHBondContact O-N 3.17Å; I555-E559 HydrophobicContact CG2-CG 4.4Å; I555-E559 WeakPolarHBondContact O-CG 3.48Å; I555-E559 PolarHBondContact O-N 3.18Å
556	T	93	Very high	92.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-39.2	-176.3	51.3	0	0	0	0	112.4	T299 M552 L553 S558 E559 T560	T299-T556 HydrophobicContact CG2-CG2 3.83Å; M552-T556 WeakPolarHBondContact O-CB 3.06Å; M552-T556 VanDerWaalsContact O-CG2 3.26Å; M552-T556 WeakPolarHBondContact O-CG2 3.34Å; M552-T556 PolarHBondContact O-N 2.76Å; M552-T556 PolarHBondContact O-OG1 2.87Å; L553-T556 WeakPolarHBondContact CA-OG1 3.39Å; L553-T556 PolarHBondContact O-N 3.08Å; L553-T556 PolarHBondContact O-OG1 2.78Å; T556-S558 VanDerWaalsContact C-N 3.31Å; T556-S558 PolarHBondContact O-N 2.89Å; T556-E559 PolarHBondContact O-N 2.81Å; T556-T560 WeakPolarHBondContact O-CG2 3.3Å; T556-T560 PolarHBondContact O-N 3.36Å; T556-T560 PolarHBondContact O-OG1 3.36Å
557	I	95.9	Very high	92.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-42.6	171.6	-67.1	165.6	0	0	0	110.6	P519 L553 I555 T560 S561 T629 V632	P519-I557 HydrophobicContact CB-CG1 3.71Å; P519-I557 HydrophobicContact CG-CG1 3.92Å; L553-I557 HydrophobicContact CD1-CD1 3.67Å; L553-I557 HydrophobicContact CD1-CG1 3.96Å; L553-I557 HydrophobicContact CD2-CD1 4.41Å; L553-I557 HydrophobicContact CG-CD1 3.67Å; L553-I557 HydrophobicContact CG-CG1 4.36Å; L553-I557 WeakPolarHBondContact O-CB 3.29Å; L553-I557 WeakPolarHBondContact O-CD1 3.43Å; L553-I557 WeakPolarHBondContact O-CG1 3.15Å; L553-I557 PolarHBondContact O-N 3.31Å; I555-I557 PolarHBondContact O-N 2.83Å; I557-T560 PolarHBondContact O-OG1 2.92Å; I557-S561 WeakPolarHBondContact O-CB 3.37Å; I557-S561 PolarHBondContact O-N 3.22Å; I557-S561 PolarHBondContact O-OG 3.24Å; I557-T629 HydrophobicContact CD1-CG2 3.52Å; I557-V632 HydrophobicContact CB-CG1 4.08Å; I557-V632 HydrophobicContact CG2-CB 4.05Å; I557-V632 HydrophobicContact CG2-CG1 3.79Å
558	S	95.5	Very high	92.7	Very high	29 Å²	29	28.2 Å²	28.2	20%	0.203	14%	0.144	C	C	.	.	H	α-helix	trans	-63.9	-45.8	-179.2	-60	0	0	0	0	111.1	V554 I555 T556 S561 I562	V554-S558 WeakPolarHBondContact O-CB 3.12Å; V554-S558 PolarHBondContact O-N 3.3Å; V554-S558 PolarHBondContact O-OG 3.44Å; I555-S558 WeakPolarHBondContact O-CA 3.45Å; I555-S558 WeakPolarHBondContact O-CB 3.45Å; I555-S558 PolarHBondContact O-N 3.17Å; T556-S558 VanDerWaalsContact C-N 3.31Å; T556-S558 PolarHBondContact O-N 2.89Å; S558-S561 PolarHBondContact O-N 3.28Å; S558-I562 WeakPolarHBondContact O-CB 3.22Å; S558-I562 WeakPolarHBondContact O-CD1 2.98Å; S558-I562 WeakPolarHBondContact O-CG1 3.46Å; S558-I562 PolarHBondContact O-N 3.33Å
559	E	93.1	Very high	92.8	Very high	32 Å²	32	24.1 Å²	24.1	15%	0.15	12%	0.123	C	C	.	.	H	α-helix	trans	-63.1	-49.6	178.5	-72.6	176.2	176.2	0	0	112.5	S303 I555 T556 S561 I562 L563	S303-E559 WeakPolarHBondContact CA-OE2 3.41Å; S303-E559 WeakPolarHBondContact CB-OE2 3.23Å; I555-E559 HydrophobicContact CG2-CG 4.4Å; I555-E559 WeakPolarHBondContact O-CG 3.48Å; I555-E559 PolarHBondContact O-N 3.18Å; T556-E559 PolarHBondContact O-N 2.81Å; E559-S561 VanDerWaalsContact C-N 3.3Å; E559-S561 PolarHBondContact O-N 2.89Å; E559-I562 PolarHBondContact O-N 2.78Å; E559-L563 WeakPolarHBondContact O-CB 3.11Å; E559-L563 PolarHBondContact O-N 2.62Å
560	T	92.3	Very high	92.7	Very high	10 Å²	10	25.7 Å²	25.7	6%	0.061	13%	0.134	C	C	.	.	H	α-helix	trans	-64.5	-38.5	-179.9	58.6	0	0	0	0	111.6	G515 L518 P519 T556 I557 L563 M564	G515-T560 PolarHBondContact O-OG1 2.84Å; L518-T560 HydrophobicContact CB-CG2 3.99Å; L518-T560 HydrophobicContact CD2-CG2 3.51Å; L518-T560 HydrophobicContact CG-CG2 4.4Å; P519-T560 HydrophobicContact CG-CG2 4.3Å; T556-T560 WeakPolarHBondContact O-CG2 3.3Å; T556-T560 PolarHBondContact O-N 3.36Å; T556-T560 PolarHBondContact O-OG1 3.36Å; I557-T560 PolarHBondContact O-OG1 2.92Å; T560-L563 PolarHBondContact O-N 3.47Å; T560-M564 WeakPolarHBondContact O-CB 3.39Å; T560-M564 VanDerWaalsContact O-CG 3.27Å; T560-M564 WeakPolarHBondContact O-CG 3.29Å; T560-M564 PolarHBondContact O-N 3.29Å
561	S	94.5	Very high	92.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65	-45.7	177.3	-58.5	0	0	0	0	111.5	I557 S558 E559 M564 C565 G633 C637	I557-S561 WeakPolarHBondContact O-CB 3.37Å; I557-S561 PolarHBondContact O-N 3.22Å; I557-S561 PolarHBondContact O-OG 3.24Å; S558-S561 PolarHBondContact O-N 3.28Å; E559-S561 VanDerWaalsContact C-N 3.3Å; E559-S561 PolarHBondContact O-N 2.89Å; S561-M564 PolarHBondContact O-N 2.03Å; S561-C565 VanDerWaalsContact O-CB 3.24Å; S561-C565 WeakPolarHBondContact O-CB 3.34Å; S561-C565 PolarHBondContact O-N 3.11Å; S561-G633 WeakPolarHBondContact OG-CA 3.22Å; S561-C637 PolarHBondContact O-SG 3.43Å
562	I	94.6	Very high	92.3	Very high	21 Å²	21	24.9 Å²	24.9	11%	0.108	14%	0.135	C	C	.	.	H	α-helix	trans	-62.3	-45.3	176.9	-70.8	168.1	0	0	0	110.9	L310 S558 E559 M564 C565 Y566 A636 F640	L310-I562 HydrophobicContact CD1-CG2 4.25Å; L310-I562 HydrophobicContact CD2-CB 4.41Å; L310-I562 HydrophobicContact CD2-CG2 3.64Å; S558-I562 WeakPolarHBondContact O-CB 3.22Å; S558-I562 WeakPolarHBondContact O-CD1 2.98Å; S558-I562 WeakPolarHBondContact O-CG1 3.46Å; S558-I562 PolarHBondContact O-N 3.33Å; E559-I562 PolarHBondContact O-N 2.78Å; I562-M564 PolarHBondContact O-N 3.33Å; I562-C565 PolarHBondContact O-N 2.71Å; I562-Y566 WeakPolarHBondContact O-CB 3.24Å; I562-Y566 PolarHBondContact O-N 3.39Å; I562-A636 HydrophobicContact CD1-CB 4.12Å; I562-A636 HydrophobicContact CG1-CB 4.05Å; I562-F640 HydrophobicContact CB-CG 4.48Å; I562-F640 HydrophobicContact CD1-CB 4.2Å; I562-F640 HydrophobicContact CG1-CB 3.88Å; I562-F640 HydrophobicContact CG1-CG 4.28Å; I562-F640 HydrophobicContact CG2-CB 4.13Å; I562-F640 HydrophobicContact CG2-CD1 3.87Å; I562-F640 HydrophobicContact CG2-CD2 3.63Å; I562-F640 HydrophobicContact CG2-CE1 4.15Å; I562-F640 HydrophobicContact CG2-CE2 3.92Å; I562-F640 HydrophobicContact CG2-CG 3.59Å; I562-F640 HydrophobicContact CG2-CZ 4.17Å
563	L	91.4	Very high	92.3	Very high	27 Å²	27	24.1 Å²	24.1	14%	0.141	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-47.1	179.3	-176.9	67.6	0	0	0	111.5	L306 L310 E559 T560 Y566 F567	L306-L563 HydrophobicContact CD2-CD2 4.3Å; L310-L563 HydrophobicContact CD1-CD1 3.97Å; E559-L563 WeakPolarHBondContact O-CB 3.11Å; E559-L563 PolarHBondContact O-N 2.62Å; T560-L563 PolarHBondContact O-N 3.47Å; L563-Y566 PolarHBondContact O-N 3.28Å; L563-F567 HydrophobicContact CD1-CD2 4.1Å; L563-F567 HydrophobicContact CD1-CE2 3.44Å; L563-F567 VanDerWaalsContact CD1-CE2 3.44Å; L563-F567 HydrophobicContact CD1-CZ 3.85Å; L563-F567 HydrophobicContact CD2-CE2 4.12Å; L563-F567 HydrophobicContact CG-CD2 3.95Å; L563-F567 HydrophobicContact CG-CE2 3.55Å; L563-F567 HydrophobicContact CG-CZ 4.44Å; L563-F567 VanDerWaalsContact O-CD2 3.29Å; L563-F567 WeakPolarHBondContact O-CD2 3.07Å; L563-F567 PolarHBondContact O-N 3.3Å
564	M	91	Very high	92.2	Very high	38 Å²	38	24.9 Å²	24.9	19%	0.187	13%	0.134	C	C	.	.	H	α-helix	trans	-65.5	-41.2	177.5	-70.2	-62.2	173.3	0	0	112.3	I514 T560 S561 I562 Y566 F567 Q568 T583	I514-M564 HydrophobicContact CB-CE 3.77Å; I514-M564 HydrophobicContact CG2-CE 3.27Å; T560-M564 WeakPolarHBondContact O-CB 3.39Å; T560-M564 VanDerWaalsContact O-CG 3.27Å; T560-M564 WeakPolarHBondContact O-CG 3.29Å; T560-M564 PolarHBondContact O-N 3.29Å; S561-M564 PolarHBondContact O-N 2.03Å; I562-M564 PolarHBondContact O-N 3.33Å; M564-Y566 VanDerWaalsContact C-N 3.33Å; M564-Y566 PolarHBondContact O-N 2.99Å; M564-F567 PolarHBondContact O-N 3.19Å; M564-Q568 WeakPolarHBondContact O-CB 3.37Å; M564-Q568 PolarHBondContact O-N 3.06Å; M564-T583 HydrophobicContact CB-CG2 3.86Å; M564-T583 HydrophobicContact CG-CG2 3.7Å
565	C	93.1	Very high	92.1	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.027	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-42.4	175.5	-177.8	0	0	0	0	111.2	S561 I562 Q568 L569 C637	S561-C565 VanDerWaalsContact O-CB 3.24Å; S561-C565 WeakPolarHBondContact O-CB 3.34Å; S561-C565 PolarHBondContact O-N 3.11Å; I562-C565 PolarHBondContact O-N 2.71Å; C565-Q568 WeakPolarHBondContact O-CB 3.16Å; C565-Q568 PolarHBondContact O-N 3.48Å; C565-L569 VanDerWaalsContact O-CG 3.32Å; C565-L569 WeakPolarHBondContact O-CG 3.37Å; C565-L569 PolarHBondContact O-N 3.3Å; C565-C637 HydrophobicContact CB-CB 4.18Å; C565-C637 WeakPolarHBondContact CB-SG 3.22Å
566	Y	91	Very high	92	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-48	177.3	177.9	-116.7	0	0	0	112.4	L310 L314 D317 W336 I562 L563 M564 Q568 L569 C570 F640	L310-Y566 HydrophobicContact CD1-CD1 4.48Å; L314-Y566 HydrophobicContact CD2-CD1 4.42Å; L314-Y566 HydrophobicContact CD2-CD2 3.65Å; L314-Y566 HydrophobicContact CD2-CE1 4.13Å; L314-Y566 HydrophobicContact CD2-CE2 3.32Å; L314-Y566 HydrophobicContact CD2-CG 4.18Å; D317-Y566 PolarHBondContact OD2-OH 3.26Å; W336-Y566 AromaticContact CD1-CE2 3.87Å; W336-Y566 HydrophobicContact CG-CE2 4.4Å; I562-Y566 WeakPolarHBondContact O-CB 3.24Å; I562-Y566 PolarHBondContact O-N 3.39Å; L563-Y566 PolarHBondContact O-N 3.28Å; M564-Y566 VanDerWaalsContact C-N 3.33Å; M564-Y566 PolarHBondContact O-N 2.99Å; Y566-Q568 VanDerWaalsContact C-N 3.27Å; Y566-Q568 PolarHBondContact O-N 2.88Å; Y566-L569 PolarHBondContact O-N 3.32Å; Y566-C570 VanDerWaalsContact CE2-SG 3.56Å; Y566-C570 VanDerWaalsContact CZ-SG 3.55Å; Y566-C570 PolarHBondContact O-N 2.74Å; Y566-C570 PolarHBondContact O-SG 3.1Å; Y566-F640 HydrophobicContact CD2-CE1 4.28Å; Y566-F640 AromaticContact CD2-CZ 3.78Å; Y566-F640 HydrophobicContact CD2-CZ 3.78Å; Y566-F640 HydrophobicContact CG-CE1 4.48Å; Y566-F640 HydrophobicContact CG-CZ 4.09Å
567	F	89.1	Confident	92.2	Very high	112 Å²	112	26.7 Å²	26.7	49%	0.491	13%	0.133	S	C	.	.	H	α-helix	trans	-62.1	-36.6	176.2	-73.7	-47.6	0	0	0	112.5	L563 M564 C570 G571	L563-F567 HydrophobicContact CD1-CD2 4.1Å; L563-F567 HydrophobicContact CD1-CE2 3.44Å; L563-F567 VanDerWaalsContact CD1-CE2 3.44Å; L563-F567 HydrophobicContact CD1-CZ 3.85Å; L563-F567 HydrophobicContact CD2-CE2 4.12Å; L563-F567 HydrophobicContact CG-CD2 3.95Å; L563-F567 HydrophobicContact CG-CE2 3.55Å; L563-F567 HydrophobicContact CG-CZ 4.44Å; L563-F567 VanDerWaalsContact O-CD2 3.29Å; L563-F567 WeakPolarHBondContact O-CD2 3.07Å; L563-F567 PolarHBondContact O-N 3.3Å; M564-F567 PolarHBondContact O-N 3.19Å; F567-C570 PolarHBondContact O-N 3.36Å; F567-G571 PolarHBondContact O-N 3.15Å
568	Q	90.8	Very high	92.1	Very high	11 Å²	11	30.2 Å²	30.2	5%	0.051	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-46.8	173.9	-179.1	-170.7	-26	0	0	111.8	M564 C565 Y566 C570 G571 E572 D573 R575 R579	M564-Q568 WeakPolarHBondContact O-CB 3.37Å; M564-Q568 PolarHBondContact O-N 3.06Å; C565-Q568 WeakPolarHBondContact O-CB 3.16Å; C565-Q568 PolarHBondContact O-N 3.48Å; Y566-Q568 VanDerWaalsContact C-N 3.27Å; Y566-Q568 PolarHBondContact O-N 2.88Å; Q568-C570 VanDerWaalsContact C-N 3.3Å; Q568-C570 PolarHBondContact O-N 3.44Å; Q568-G571 CarbonylContact O-C 3.53Å; Q568-G571 WeakPolarHBondContact O-CA 3.3Å; Q568-G571 PolarHBondContact O-N 3.09Å; Q568-G571 VanDerWaalsContact O-N 3.09Å; Q568-E572 PolarHBondContact O-N 3.46Å; Q568-D573 HydrophobicContact CG-CB 3.94Å; Q568-D573 WeakPolarHBondContact CG-O 3.28Å; Q568-D573 PolarHBondContact NE2-O 2.88Å; Q568-D573 PolarHBondContact O-N 3.19Å; Q568-R575 PolarHBondContact NE2-O 2.74Å; Q568-R575 VanDerWaalsContact NE2-O 3.1Å; Q568-R579 VanDerWaalsContact NE2-CD 3.33Å
569	L	91.2	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-35.9	178.4	-68.2	173.3	0	0	0	111.5	W336 V339 V343 C565 Y566 G571 E572 V641 I644 Y645	W336-L569 VanDerWaalsContact CA-O 3.25Å; W336-L569 WeakPolarHBondContact CA-O 3.37Å; W336-L569 HydrophobicContact CB-CB 3.75Å; W336-L569 PolarHBondContact N-O 2.96Å; V339-L569 HydrophobicContact CG2-CD2 4.15Å; V343-L569 HydrophobicContact CG2-CD2 3.88Å; C565-L569 VanDerWaalsContact O-CG 3.32Å; C565-L569 WeakPolarHBondContact O-CG 3.37Å; C565-L569 PolarHBondContact O-N 3.3Å; Y566-L569 PolarHBondContact O-N 3.32Å; L569-G571 PolarHBondContact O-N 2.82Å; L569-E572 WeakPolarHBondContact O-CA 3.31Å; L569-E572 PolarHBondContact O-N 2.8Å; L569-V641 HydrophobicContact CD1-CG2 4.04Å; L569-I644 HydrophobicContact CD1-CD1 3.95Å; L569-Y645 HydrophobicContact CD1-CE2 4.16Å
570	C	88	Confident	92.1	Very high	42 Å²	42	28.8 Å²	28.8	28%	0.284	14%	0.135	S	C	.	.	H	α-helix	trans	-63.5	-29.8	172.5	-66.1	0	0	0	0	112.5	Y566 F567 Q568 E572	Y566-C570 VanDerWaalsContact CE2-SG 3.56Å; Y566-C570 VanDerWaalsContact CZ-SG 3.55Å; Y566-C570 PolarHBondContact O-N 2.74Å; Y566-C570 PolarHBondContact O-SG 3.1Å; F567-C570 PolarHBondContact O-N 3.36Å; Q568-C570 VanDerWaalsContact C-N 3.3Å; Q568-C570 PolarHBondContact O-N 3.44Å; C570-E572 PolarHBondContact O-N 2.86Å
571	G	88.3	Confident	92.2	Very high	24 Å²	24	28.6 Å²	28.6	25%	0.247	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	10	170.2	0	0	0	0	0	114.5	Q502 F567 Q568 L569 D573	Q502-G571 PolarHBondContact NE2-O 3.15Å; F567-G571 PolarHBondContact O-N 3.15Å; Q568-G571 CarbonylContact O-C 3.53Å; Q568-G571 WeakPolarHBondContact O-CA 3.3Å; Q568-G571 PolarHBondContact O-N 3.09Å; Q568-G571 VanDerWaalsContact O-N 3.09Å; L569-G571 PolarHBondContact O-N 2.82Å; G571-D573 PolarHBondContact O-N 2.97Å; G571-D573 VanDerWaalsContact O-N 3.17Å
572	E	89.8	Confident	92.1	Very high	41 Å²	41	30.9 Å²	30.9	19%	0.192	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	18.6	179.5	-50.5	-176.3	-174.4	0	0	114.7	G335 V339 R497 P500 Q568 L569 C570	G335-E572 PolarHBondContact N-OE1 3.28Å; V339-E572 HydrophobicContact CG1-CB 4Å; R497-E572 IonicContact CZ-OE2 3.49Å; R497-E572 IonicContact NH1-OE2 2.59Å; R497-E572 PolarHBondContact NH1-OE2 3.35Å; R497-E572 IonicContact NH2-OE2 3.52Å; P500-E572 HydrophobicContact CG-CB 3.94Å; Q568-E572 PolarHBondContact O-N 3.46Å; L569-E572 WeakPolarHBondContact O-CA 3.31Å; L569-E572 PolarHBondContact O-N 2.8Å; C570-E572 PolarHBondContact O-N 2.86Å
573	D	91.7	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.145	C	C	.	.			trans	-94.4	98.2	172.2	-170.4	-15.3	0	0	0	110.3	I499 Q568 G571 R575 R579	I499-D573 HydrophobicContact CG2-CB 3.8Å; Q568-D573 HydrophobicContact CG-CB 3.94Å; Q568-D573 WeakPolarHBondContact CG-O 3.28Å; Q568-D573 PolarHBondContact NE2-O 2.88Å; Q568-D573 PolarHBondContact O-N 3.19Å; G571-D573 PolarHBondContact O-N 2.97Å; G571-D573 VanDerWaalsContact O-N 3.17Å; D573-R575 PolarHBondContact O-N 3.25Å; D573-R575 VanDerWaalsContact OD1-CB 3.27Å; D573-R575 WeakPolarHBondContact OD1-CB 3.38Å; D573-R575 IonicContact OD1-CZ 3.24Å; D573-R575 PolarHBondContact OD1-N 2.98Å; D573-R575 IonicContact OD1-NE 3.62Å; D573-R575 PolarHBondContact OD1-NE 2.81Å; D573-R575 VanDerWaalsContact OD1-NE 3.13Å; D573-R575 IonicContact OD1-NH2 3.85Å; D573-R575 IonicContact OD2-CZ 3.93Å; D573-R575 IonicContact OD2-NE 2.76Å; D573-R575 IonicContact OD2-NH2 2.79Å; D573-R575 PolarHBondContact OD2-NH2 2.8Å; D573-R575 VanDerWaalsContact OD2-NH2 3.15Å; D573-R579 IonicContact OD2-CZ 2.76Å; D573-R579 IonicContact OD2-NE 3.45Å; D573-R579 IonicContact OD2-NH2 3.16Å; D573-R579 PolarHBondContact OD2-NH2 2.85Å
574	Y	92.2	Very high	92	Very high	28 Å²	28	28.8 Å²	28.8	11%	0.11	14%	0.138	C	C	.	.			trans	-71.4	-4.3	179	64	-96.4	0	0	0	114.6	D342 P496 I499 W576	D342-Y574 HydrophobicContact CB-CD1 3.68Å; D342-Y574 HydrophobicContact CB-CD2 3.83Å; D342-Y574 HydrophobicContact CB-CE1 4.03Å; D342-Y574 HydrophobicContact CB-CE2 4.18Å; D342-Y574 HydrophobicContact CB-CG 3.58Å; D342-Y574 WeakPolarHBondContact O-CD2 3.32Å; P496-Y574 WeakPolarHBondContact CB-OH 3.45Å; I499-Y574 HydrophobicContact CD1-CD1 4.32Å; I499-Y574 HydrophobicContact CD1-CE1 3.86Å; I499-Y574 HydrophobicContact CG1-CD1 4.18Å; I499-Y574 HydrophobicContact CG1-CE1 3.78Å; Y574-W576 PolarHBondContact O-N 2.81Å
575	R	92.7	Very high	92.2	Very high	132 Å²	132	27 Å²	27	50%	0.498	13%	0.129	S	C	.	.			trans	-83.5	57	-176	-58.6	174.5	-62.4	-176.6	-2.9	112.2	I499 Q568 D573 R579	I499-R575 HydrophobicContact CD1-CG 4.05Å; I499-R575 VanDerWaalsContact CD1-CZ 3.47Å; Q568-R575 PolarHBondContact NE2-O 2.74Å; Q568-R575 VanDerWaalsContact NE2-O 3.1Å; D573-R575 PolarHBondContact O-N 3.25Å; D573-R575 VanDerWaalsContact OD1-CB 3.27Å; D573-R575 WeakPolarHBondContact OD1-CB 3.38Å; D573-R575 IonicContact OD1-CZ 3.24Å; D573-R575 PolarHBondContact OD1-N 2.98Å; D573-R575 IonicContact OD1-NE 3.62Å; D573-R575 PolarHBondContact OD1-NE 2.81Å; D573-R575 VanDerWaalsContact OD1-NE 3.13Å; D573-R575 IonicContact OD1-NH2 3.85Å; D573-R575 IonicContact OD2-CZ 3.93Å; D573-R575 IonicContact OD2-NE 2.76Å; D573-R575 IonicContact OD2-NH2 2.79Å; D573-R575 PolarHBondContact OD2-NH2 2.8Å; D573-R575 VanDerWaalsContact OD2-NH2 3.15Å; R575-R579 WeakPolarHBondContact O-CD 3.36Å
576	W	93.8	Very high	92.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-83.6	-19.1	-172.2	65.4	-90.9	0	0	0	113.6	V343 Y574 R579 S580 F634 C637 F638 V641	V343-W576 PolarHBondContact O-NE1 2.92Å; Y574-W576 PolarHBondContact O-N 2.81Å; W576-R579 PolarHBondContact O-N 3.24Å; W576-S580 WeakPolarHBondContact O-CB 2.99Å; W576-S580 PolarHBondContact O-N 3.24Å; W576-F634 HydrophobicContact CH2-CE2 4.26Å; W576-F634 HydrophobicContact CZ3-CD2 4.25Å; W576-F634 HydrophobicContact CZ3-CE2 4.26Å; W576-C637 HydrophobicContact CE3-CB 3.88Å; W576-C637 HydrophobicContact CZ3-CB 3.72Å; W576-F638 HydrophobicContact CH2-CB 3.91Å; W576-F638 AromaticContact CH2-CD2 3.91Å; W576-F638 HydrophobicContact CH2-CD2 3.91Å; W576-F638 HydrophobicContact CH2-CG 4.42Å; W576-F638 HydrophobicContact CZ2-CD2 4.45Å; W576-F638 HydrophobicContact CZ3-CB 4.34Å; W576-V641 HydrophobicContact CD2-CG2 4.1Å; W576-V641 HydrophobicContact CE3-CG2 4.41Å; W576-V641 HydrophobicContact CH2-CG2 4.45Å; W576-V641 HydrophobicContact CZ2-CB 4.14Å; W576-V641 HydrophobicContact CZ2-CG1 4Å; W576-V641 HydrophobicContact CZ2-CG2 4.12Å
577	W	95.3	Very high	92.4	Very high	6 Å²	6	26.6 Å²	26.6	2%	0.023	13%	0.127	C	C	.	.	H	α-helix	trans	-49.3	-69.7	-176.8	-61.1	106.5	0	0	0	113.4	F344 R345 P347 F353 F412 F413 R579 S580 F634 F638	F344-W577 HydrophobicContact CD1-CZ2 4.4Å; R345-W577 PolarHBondContact O-NE1 2.78Å; P347-W577 HydrophobicContact CB-CB 3.67Å; P347-W577 HydrophobicContact CB-CG 3.83Å; P347-W577 HydrophobicContact CG-CB 3.98Å; P347-W577 HydrophobicContact CG-CD2 4.4Å; P347-W577 HydrophobicContact CG-CG 3.92Å; F353-W577 HydrophobicContact CE1-CE3 4.39Å; F353-W577 VanDerWaalsContact CE2-C 3.47Å; F353-W577 HydrophobicContact CE2-CB 3.94Å; F353-W577 WeakPolarHBondContact CE2-O 3.5Å; F353-W577 HydrophobicContact CZ-CB 4.24Å; F353-W577 HydrophobicContact CZ-CE3 4.21Å; F412-W577 HydrophobicContact CD1-CH2 4.34Å; F412-W577 AromaticContact CE1-CH2 3.52Å; F412-W577 HydrophobicContact CE1-CH2 3.52Å; F412-W577 HydrophobicContact CE1-CZ2 4.05Å; F412-W577 HydrophobicContact CE1-CZ3 4.37Å; F412-W577 HydrophobicContact CZ-CH2 4.35Å; F413-W577 HydrophobicContact CE1-CD2 4.16Å; F413-W577 AromaticContact CE1-CE3 3.91Å; F413-W577 HydrophobicContact CE1-CE3 3.91Å; F413-W577 AromaticContact CE1-CH2 3.92Å; F413-W577 HydrophobicContact CE1-CH2 3.92Å; F413-W577 HydrophobicContact CE1-CZ2 4.09Å; F413-W577 AromaticContact CE1-CZ3 3.78Å; F413-W577 HydrophobicContact CE1-CZ3 3.78Å; F413-W577 HydrophobicContact CZ-CD2 4.28Å; F413-W577 AromaticContact CZ-CE3 3.84Å; F413-W577 HydrophobicContact CZ-CE3 3.84Å; F413-W577 HydrophobicContact CZ-CZ3 4Å; W577-R579 VanDerWaalsContact C-N 3.28Å; W577-R579 PolarHBondContact O-N 3.08Å; W577-S580 PolarHBondContact O-N 2.95Å; W577-S580 PolarHBondContact O-OG 2.91Å; W577-F634 HydrophobicContact CE3-CD2 4.49Å; W577-F634 AromaticContact CE3-CE2 3.68Å; W577-F634 HydrophobicContact CE3-CE2 3.68Å; W577-F634 AromaticContact CZ3-CE2 3.64Å; W577-F634 HydrophobicContact CZ3-CE2 3.64Å; W577-F634 HydrophobicContact CZ3-CZ 4.18Å; W577-F638 AromaticContact CH2-CD2 3.84Å; W577-F638 HydrophobicContact CH2-CD2 3.84Å; W577-F638 AromaticContact CH2-CE2 3.91Å; W577-F638 HydrophobicContact CH2-CE2 3.91Å; W577-F638 AromaticContact CZ3-CD2 3.79Å; W577-F638 HydrophobicContact CZ3-CD2 3.79Å; W577-F638 HydrophobicContact CZ3-CE2 4.17Å
578	W	94.9	Very high	92.8	Very high	74 Å²	74	21.7 Å²	21.7	28%	0.28	11%	0.107	S	C	.	.	H	α-helix	trans	-63.2	-35.2	-179	-76.5	106.2	0	0	0	113	N348 W349 L352 F353 S580 L581 C582	N348-W578 PolarHBondContact O-NE1 2.86Å; W349-W578 HydrophobicContact CB-CZ2 3.97Å; L352-W578 HydrophobicContact CB-CH2 4.08Å; L352-W578 HydrophobicContact CD2-CH2 4.05Å; L352-W578 HydrophobicContact CG-CH2 3.96Å; F353-W578 HydrophobicContact CB-CH2 3.85Å; F353-W578 HydrophobicContact CB-CZ2 3.67Å; F353-W578 AromaticContact CD2-CD2 3.84Å; F353-W578 HydrophobicContact CD2-CD2 3.84Å; F353-W578 AromaticContact CD2-CE2 3.88Å; F353-W578 AromaticContact CD2-CE3 3.98Å; F353-W578 HydrophobicContact CD2-CE3 3.98Å; F353-W578 HydrophobicContact CD2-CG 4.38Å; F353-W578 HydrophobicContact CD2-CH2 4.2Å; F353-W578 HydrophobicContact CD2-CZ2 4.07Å; F353-W578 HydrophobicContact CD2-CZ3 4.16Å; F353-W578 HydrophobicContact CG-CZ2 4.4Å; W578-S580 VanDerWaalsContact C-N 3.31Å; W578-S580 PolarHBondContact O-N 2.84Å; W578-L581 HydrophobicContact CE3-CD1 3.93Å; W578-L581 HydrophobicContact CZ3-CD1 3.98Å; W578-L581 WeakPolarHBondContact O-CB 3.35Å; W578-L581 PolarHBondContact O-N 3.29Å; W578-C582 PolarHBondContact O-N 3.16Å; W578-C582 PolarHBondContact O-SG 3.35Å; W578-C582 VanDerWaalsContact O-SG 3.32Å
579	R	92.6	Very high	93	Very high	28 Å²	28	24.7 Å²	24.7	11%	0.106	12%	0.12	C	C	.	.	H	α-helix	trans	-65.3	-35.2	178.9	-70.8	174.5	173	-133.1	12.4	112.1	S506 P508 Q568 D573 R575 W576 W577 L581 C582 T583	S506-R579 PolarHBondContact O-NH1 3.15Å; S506-R579 PolarHBondContact O-NH2 2.76Å; P508-R579 HydrophobicContact CB-CG 4.43Å; Q568-R579 VanDerWaalsContact NE2-CD 3.33Å; D573-R579 IonicContact OD2-CZ 2.76Å; D573-R579 IonicContact OD2-NE 3.45Å; D573-R579 IonicContact OD2-NH2 3.16Å; D573-R579 PolarHBondContact OD2-NH2 2.85Å; R575-R579 WeakPolarHBondContact O-CD 3.36Å; W576-R579 PolarHBondContact O-N 3.24Å; W577-R579 VanDerWaalsContact C-N 3.28Å; W577-R579 PolarHBondContact O-N 3.08Å; R579-L581 VanDerWaalsContact C-N 3.32Å; R579-L581 PolarHBondContact O-N 3.24Å; R579-C582 PolarHBondContact O-N 2.94Å; R579-T583 WeakPolarHBondContact O-CB 3.45Å; R579-T583 PolarHBondContact O-N 2.87Å; R579-T583 PolarHBondContact O-OG1 2.81Å
580	S	95	Very high	93.2	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-38.8	175.2	71	0	0	0	0	112.1	W576 W577 W578 G584	W576-S580 WeakPolarHBondContact O-CB 2.99Å; W576-S580 PolarHBondContact O-N 3.24Å; W577-S580 PolarHBondContact O-N 2.95Å; W577-S580 PolarHBondContact O-OG 2.91Å; W578-S580 VanDerWaalsContact C-N 3.31Å; W578-S580 PolarHBondContact O-N 2.84Å; S580-G584 PolarHBondContact O-N 2.89Å
581	L	94.9	Very high	93.6	Very high	6 Å²	6	25 Å²	25	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-64.9	-51.3	171.7	-66.5	179	0	0	0	110.5	F353 V356 V357 W578 R579 T583 G584 A585 S630 F634	F353-L581 HydrophobicContact CD2-CD1 3.41Å; F353-L581 VanDerWaalsContact CD2-CD1 3.41Å; F353-L581 HydrophobicContact CD2-CG 4.28Å; F353-L581 HydrophobicContact CE2-CD1 3.23Å; F353-L581 HydrophobicContact CE2-CD2 4.46Å; F353-L581 HydrophobicContact CE2-CG 3.59Å; F353-L581 HydrophobicContact CG-CD1 4.2Å; F353-L581 HydrophobicContact CZ-CD1 3.92Å; F353-L581 HydrophobicContact CZ-CD2 4.44Å; F353-L581 HydrophobicContact CZ-CG 3.99Å; V356-L581 HydrophobicContact CG1-CD1 4.22Å; V357-L581 HydrophobicContact CG2-CD1 4.5Å; V357-L581 HydrophobicContact CG2-CD2 3.8Å; W578-L581 HydrophobicContact CE3-CD1 3.93Å; W578-L581 HydrophobicContact CZ3-CD1 3.98Å; W578-L581 WeakPolarHBondContact O-CB 3.35Å; W578-L581 PolarHBondContact O-N 3.29Å; R579-L581 VanDerWaalsContact C-N 3.32Å; R579-L581 PolarHBondContact O-N 3.24Å; L581-T583 VanDerWaalsContact C-N 3.28Å; L581-T583 PolarHBondContact O-N 2.97Å; L581-G584 PolarHBondContact O-N 2.78Å; L581-A585 VanDerWaalsContact O-CB 3.29Å; L581-A585 WeakPolarHBondContact O-CB 3.44Å; L581-A585 PolarHBondContact O-N 3.32Å; L581-S630 WeakPolarHBondContact CD2-O 3.04Å; L581-S630 PolarHBondContact O-OG 2.02Å; L581-F634 HydrophobicContact CD2-CB 3.53Å; L581-F634 HydrophobicContact CD2-CG 4.29Å; L581-F634 HydrophobicContact CG-CB 4.3Å
582	C	93.3	Very high	94	Very high	47 Å²	47	28.2 Å²	28.2	32%	0.318	12%	0.123	S	C	.	.	H	α-helix	trans	-59.9	-36.7	-178.4	-66.6	0	0	0	0	113	F512 W578 R579 A585 G586	F512-C582 HydrophobicContact CD2-CB 4.28Å; F512-C582 WeakPolarHBondContact CD2-O 3.39Å; W578-C582 PolarHBondContact O-N 3.16Å; W578-C582 PolarHBondContact O-SG 3.35Å; W578-C582 VanDerWaalsContact O-SG 3.32Å; R579-C582 PolarHBondContact O-N 2.94Å; C582-A585 WeakPolarHBondContact O-CB 3.19Å; C582-A585 PolarHBondContact O-N 3.3Å; C582-G586 PolarHBondContact O-N 3.3Å
583	T	92.2	Very high	94.3	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.025	14%	0.135	C	C	.	.	H	α-helix	trans	-63.4	-47.5	-178.9	-55.2	0	0	0	0	110.8	G515 M564 R579 L581 G586	G515-T583 CarbonylContact C-O 3.56Å; M564-T583 HydrophobicContact CB-CG2 3.86Å; M564-T583 HydrophobicContact CG-CG2 3.7Å; R579-T583 WeakPolarHBondContact O-CB 3.45Å; R579-T583 PolarHBondContact O-N 2.87Å; R579-T583 PolarHBondContact O-OG1 2.81Å; L581-T583 VanDerWaalsContact C-N 3.28Å; L581-T583 PolarHBondContact O-N 2.97Å; T583-G586 PolarHBondContact O-N 3Å
584	G	90.6	Very high	94.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-41.8	174.3	0	0	0	0	0	112.4	S580 L581 G586 T587 T629	S580-G584 PolarHBondContact O-N 2.89Å; L581-G584 PolarHBondContact O-N 2.78Å; G584-G586 PolarHBondContact O-N 2.64Å; G584-T587 PolarHBondContact O-N 2.94Å; G584-T587 PolarHBondContact O-OG1 3.05Å; G584-T629 WeakPolarHBondContact O-CB 3.38Å; G584-T629 PolarHBondContact O-OG1 3.12Å
585	A	94.9	Very high	94.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-23.9	179.7	0	0	0	0	0	114.7	F512 L581 C582 T587 S588 F626 S630	F512-A585 HydrophobicContact CE2-CB 4.06Å; L581-A585 VanDerWaalsContact O-CB 3.29Å; L581-A585 WeakPolarHBondContact O-CB 3.44Å; L581-A585 PolarHBondContact O-N 3.32Å; C582-A585 WeakPolarHBondContact O-CB 3.19Å; C582-A585 PolarHBondContact O-N 3.3Å; A585-T587 PolarHBondContact O-N 2.92Å; A585-T587 VanDerWaalsContact O-N 3.08Å; A585-S588 WeakPolarHBondContact O-CB 3.42Å; A585-S588 PolarHBondContact O-N 3.26Å; A585-F626 HydrophobicContact CB-CD2 3.68Å; A585-F626 HydrophobicContact CB-CE1 4.46Å; A585-F626 HydrophobicContact CB-CE2 3.45Å; A585-F626 VanDerWaalsContact CB-CE2 3.45Å; A585-F626 HydrophobicContact CB-CG 4.3Å; A585-F626 HydrophobicContact CB-CZ 3.86Å; A585-S630 VanDerWaalsContact CB-OG 3.3Å; A585-S630 WeakPolarHBondContact CB-OG 3.43Å
586	G	95	Very high	94.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-53.3	-29.2	177.7	0	0	0	0	0	113.5	F512 G516 C582 T583 G584 S588 F589 Y590	F512-G586 VanDerWaalsContact O-CA 3.3Å; F512-G586 WeakPolarHBondContact O-CA 3.42Å; G516-G586 VanDerWaalsContact CA-C 3.46Å; C582-G586 PolarHBondContact O-N 3.3Å; T583-G586 PolarHBondContact O-N 3Å; G584-G586 PolarHBondContact O-N 2.64Å; G586-S588 PolarHBondContact O-N 2.98Å; G586-F589 WeakPolarHBondContact O-CB 3.47Å; G586-F589 PolarHBondContact O-N 2.9Å; G586-F589 VanDerWaalsContact O-N 3.12Å; G586-Y590 WeakPolarHBondContact O-CD2 3.39Å
587	T	94.8	Very high	94.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.6	-37.3	177	-47	0	0	0	0	111.9	P519 F520 I523 G584 A585 F589 Y590 L591	P519-T587 HydrophobicContact CB-CG2 4.12Å; F520-T587 HydrophobicContact CB-CG2 4.33Å; I523-T587 HydrophobicContact CD1-CG2 4.29Å; G584-T587 PolarHBondContact O-N 2.94Å; G584-T587 PolarHBondContact O-OG1 3.05Å; A585-T587 PolarHBondContact O-N 2.92Å; A585-T587 VanDerWaalsContact O-N 3.08Å; T587-F589 VanDerWaalsContact C-N 3.32Å; T587-F589 PolarHBondContact O-N 3.17Å; T587-Y590 PolarHBondContact O-N 3.06Å; T587-L591 PolarHBondContact O-N 3.04Å; T587-L591 VanDerWaalsContact O-N 3.11Å
588	S	96.1	Very high	94.8	Very high	9 Å²	9	30.7 Å²	30.7	6%	0.063	15%	0.147	C	C	.	.	H	α-helix	trans	-70.5	-27.3	-178.8	-50.1	0	0	0	0	112.8	A585 G586 L591 F592 L622 N625 F626	A585-S588 WeakPolarHBondContact O-CB 3.42Å; A585-S588 PolarHBondContact O-N 3.26Å; G586-S588 PolarHBondContact O-N 2.98Å; S588-L591 PolarHBondContact O-N 3.12Å; S588-F592 PolarHBondContact O-N 3.21Å; S588-L622 WeakPolarHBondContact O-CD2 3.48Å; S588-N625 PolarHBondContact OG-OD1 3.25Å; S588-F626 WeakPolarHBondContact OG-CA 3.48Å; S588-F626 PolarHBondContact OG-N 3.42Å
589	F	95.9	Very high	94.8	Very high	74 Å²	74	29.3 Å²	29.3	33%	0.325	14%	0.143	S	C	.	.	H	α-helix	trans	-64.7	-45.2	173.5	169.7	-97.1	0	0	0	111.5	F512 F513 G586 T587 L591 F592 V593	F512-F589 HydrophobicContact CE1-CB 3.57Å; F512-F589 HydrophobicContact CE1-CD2 4.45Å; F512-F589 HydrophobicContact CE1-CG 4.01Å; F512-F589 HydrophobicContact CZ-CB 3.73Å; F513-F589 AromaticContact CD1-CD1 3.67Å; F513-F589 HydrophobicContact CD1-CD1 3.67Å; F513-F589 AromaticContact CD1-CE1 3.67Å; F513-F589 HydrophobicContact CD1-CE1 3.67Å; F513-F589 HydrophobicContact CD1-CG 4.24Å; F513-F589 HydrophobicContact CD1-CZ 4.24Å; F513-F589 AromaticContact CE1-CD1 3.64Å; F513-F589 HydrophobicContact CE1-CD1 3.64Å; F513-F589 AromaticContact CE1-CD2 3.98Å; F513-F589 HydrophobicContact CE1-CD2 3.98Å; F513-F589 AromaticContact CE1-CE1 3.48Å; F513-F589 HydrophobicContact CE1-CE1 3.48Å; F513-F589 VanDerWaalsContact CE1-CE1 3.48Å; F513-F589 AromaticContact CE1-CE2 3.83Å; F513-F589 HydrophobicContact CE1-CE2 3.83Å; F513-F589 AromaticContact CE1-CG 3.88Å; F513-F589 HydrophobicContact CE1-CG 3.88Å; F513-F589 AromaticContact CE1-CZ 3.58Å; F513-F589 HydrophobicContact CE1-CZ 3.58Å; F513-F589 HydrophobicContact CZ-CZ 4.48Å; G586-F589 WeakPolarHBondContact O-CB 3.47Å; G586-F589 PolarHBondContact O-N 2.9Å; G586-F589 VanDerWaalsContact O-N 3.12Å; T587-F589 VanDerWaalsContact C-N 3.32Å; T587-F589 PolarHBondContact O-N 3.17Å; F589-L591 VanDerWaalsContact C-N 3.33Å; F589-L591 PolarHBondContact O-N 2.85Å; F589-F592 WeakPolarHBondContact O-CB 3.49Å; F589-F592 PolarHBondContact O-N 2.96Å; F589-F592 VanDerWaalsContact O-N 3.16Å; F589-V593 HydrophobicContact CE1-CG2 4.01Å; F589-V593 HydrophobicContact CE2-CG2 4.26Å; F589-V593 HydrophobicContact CZ-CG2 3.87Å; F589-V593 PolarHBondContact O-N 3.12Å
590	Y	96.2	Very high	94.8	Very high	45 Å²	45	33.1 Å²	33.1	18%	0.176	17%	0.169	C	C	.	.	H	α-helix	trans	-67	-36	176.5	-67.4	-79.6	0	0	0	112.2	F513 G516 L517 F520 G586 T587 F592 V593 Y594	F513-Y590 WeakPolarHBondContact O-CE2 3.04Å; F513-Y590 PolarHBondContact O-OH 2.84Å; G516-Y590 VanDerWaalsContact C-CE2 3.47Å; L517-Y590 HydrophobicContact CB-CE2 4.12Å; L517-Y590 HydrophobicContact CD1-CE1 3.81Å; F520-Y590 HydrophobicContact CB-CD2 4.24Å; F520-Y590 HydrophobicContact CB-CG 4.1Å; F520-Y590 HydrophobicContact CD1-CD1 4.27Å; F520-Y590 HydrophobicContact CD1-CG 4.05Å; F520-Y590 VanDerWaalsContact CD2-CB 3.41Å; F520-Y590 AromaticContact CG-CG 3.99Å; F520-Y590 HydrophobicContact CG-CG 3.99Å; G586-Y590 WeakPolarHBondContact O-CD2 3.39Å; T587-Y590 PolarHBondContact O-N 3.06Å; Y590-F592 VanDerWaalsContact C-N 3.26Å; Y590-F592 PolarHBondContact O-N 3.12Å; Y590-V593 PolarHBondContact O-N 3.14Å; Y590-Y594 WeakPolarHBondContact O-CB 3.23Å; Y590-Y594 PolarHBondContact O-N 3.34Å
591	L	95.7	Very high	94.6	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-35.8	172.2	-177.9	59	0	0	0	112.1	L527 F531 T587 S588 F589 Y594 S595 I621 L622 N625	L527-L591 HydrophobicContact CD1-CD1 3.55Å; L527-L591 HydrophobicContact CD2-CD1 3.59Å; L527-L591 HydrophobicContact CG-CD1 4.14Å; F531-L591 HydrophobicContact CE2-CD1 3.95Å; F531-L591 HydrophobicContact CZ-CD1 4.04Å; T587-L591 PolarHBondContact O-N 3.04Å; T587-L591 VanDerWaalsContact O-N 3.11Å; S588-L591 PolarHBondContact O-N 3.12Å; F589-L591 VanDerWaalsContact C-N 3.33Å; F589-L591 PolarHBondContact O-N 2.85Å; L591-Y594 PolarHBondContact O-N 2.91Å; L591-S595 PolarHBondContact O-N 3.01Å; L591-I621 HydrophobicContact CD2-CG2 4.47Å; L591-L622 HydrophobicContact CB-CD2 3.68Å; L591-L622 HydrophobicContact CD2-CD2 3.81Å; L591-L622 HydrophobicContact CG-CD2 3.51Å; L591-N625 HydrophobicContact CD2-CB 4.11Å
592	F	96.6	Very high	94.2	Very high	91 Å²	91	42.6 Å²	42.6	40%	0.399	21%	0.212	S	C	.	.	H	α-helix	trans	-69.2	-43.8	174.8	171.6	-109.5	0	0	0	112.3	S588 F589 Y590 Y594 S595 I596 L622	S588-F592 PolarHBondContact O-N 3.21Å; F589-F592 WeakPolarHBondContact O-CB 3.49Å; F589-F592 PolarHBondContact O-N 2.96Å; F589-F592 VanDerWaalsContact O-N 3.16Å; Y590-F592 VanDerWaalsContact C-N 3.26Å; Y590-F592 PolarHBondContact O-N 3.12Å; F592-Y594 VanDerWaalsContact C-N 3.26Å; F592-Y594 PolarHBondContact O-N 2.85Å; F592-S595 PolarHBondContact O-N 2.7Å; F592-S595 PolarHBondContact O-OG 2.74Å; F592-I596 HydrophobicContact CD1-CD1 4.23Å; F592-I596 HydrophobicContact CE1-CD1 3.68Å; F592-I596 HydrophobicContact CE2-CD1 4.09Å; F592-I596 HydrophobicContact CE2-CG1 4.43Å; F592-I596 HydrophobicContact CZ-CD1 3.62Å; F592-I596 HydrophobicContact CZ-CG1 4.42Å; F592-I596 PolarHBondContact O-N 3.26Å; F592-I596 VanDerWaalsContact O-N 3.16Å; F592-L622 HydrophobicContact CB-CD1 3.78Å; F592-L622 HydrophobicContact CB-CD2 3.88Å; F592-L622 HydrophobicContact CD2-CD1 3.61Å; F592-L622 HydrophobicContact CG-CD1 4.16Å
593	V	96.9	Very high	94	Very high	70 Å²	70	41.5 Å²	41.5	42%	0.424	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-40.9	173.9	175	0	0	0	0	110.5	F589 Y590 I596 H597	F589-V593 HydrophobicContact CE1-CG2 4.01Å; F589-V593 HydrophobicContact CE2-CG2 4.26Å; F589-V593 HydrophobicContact CZ-CG2 3.87Å; F589-V593 PolarHBondContact O-N 3.12Å; Y590-V593 PolarHBondContact O-N 3.14Å; V593-I596 PolarHBondContact O-N 2.78Å; V593-H597 PolarHBondContact O-N 3.08Å
594	Y	96.1	Very high	93.6	Very high	13 Å²	13	46.3 Å²	46.3	5%	0.051	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-40	176.5	-179.2	-103.4	0	0	0	112.7	F520 F524 L527 F528 F531 Y590 L591 F592 I596 H597 Y598	F520-Y594 HydrophobicContact CE2-CG 4.47Å; F520-Y594 HydrophobicContact CZ-CG 4.41Å; F524-Y594 HydrophobicContact CD2-CD2 4.09Å; F524-Y594 HydrophobicContact CD2-CE2 4.21Å; F524-Y594 AromaticContact CE2-CD2 3.59Å; F524-Y594 HydrophobicContact CE2-CD2 3.59Å; F524-Y594 AromaticContact CE2-CE2 3.59Å; F524-Y594 HydrophobicContact CE2-CE2 3.59Å; F524-Y594 HydrophobicContact CZ-CE2 4.32Å; L527-Y594 HydrophobicContact CB-CD1 4.22Å; L527-Y594 HydrophobicContact CB-CE1 3.93Å; F528-Y594 WeakPolarHBondContact CA-OH 3.27Å; F528-Y594 WeakPolarHBondContact CB-OH 3.36Å; F531-Y594 HydrophobicContact CD1-CE1 4.33Å; F531-Y594 HydrophobicContact CD2-CE1 4.1Å; F531-Y594 HydrophobicContact CE2-CD1 4.36Å; F531-Y594 HydrophobicContact CE2-CE1 4.33Å; F531-Y594 HydrophobicContact CG-CE1 4.09Å; F531-Y594 HydrophobicContact CZ-CD1 4.33Å; Y590-Y594 WeakPolarHBondContact O-CB 3.23Å; Y590-Y594 PolarHBondContact O-N 3.34Å; L591-Y594 PolarHBondContact O-N 2.91Å; F592-Y594 VanDerWaalsContact C-N 3.26Å; F592-Y594 PolarHBondContact O-N 2.85Å; Y594-I596 VanDerWaalsContact C-N 3.33Å; Y594-I596 PolarHBondContact O-N 3.26Å; Y594-H597 WeakPolarHBondContact O-CB 3.43Å; Y594-H597 PolarHBondContact O-N 2.9Å; Y594-Y598 WeakPolarHBondContact O-CB 3.48Å; Y594-Y598 PolarHBondContact O-N 3.25Å
595	S	95.3	Very high	93.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.5	-36.8	177.5	67.9	0	0	0	0	112.5	L591 F592 Y598 F599 Y614	L591-S595 PolarHBondContact O-N 3.01Å; F592-S595 PolarHBondContact O-N 2.7Å; F592-S595 PolarHBondContact O-OG 2.74Å; S595-Y598 PolarHBondContact O-N 2.87Å; S595-F599 WeakPolarHBondContact O-CB 3.02Å; S595-F599 PolarHBondContact O-N 2.8Å; S595-Y614 PolarHBondContact O-OH 3.42Å
596	I	96	Very high	92.9	Very high	67 Å²	67	54.3 Å²	54.3	34%	0.344	26%	0.262	S	S	.	.	H	α-helix	trans	-61.9	-46.9	171.4	-64.4	168.6	0	0	0	110.4	F592 V593 Y594 Y598 F599 V600 F615	F592-I596 HydrophobicContact CD1-CD1 4.23Å; F592-I596 HydrophobicContact CE1-CD1 3.68Å; F592-I596 HydrophobicContact CE2-CD1 4.09Å; F592-I596 HydrophobicContact CE2-CG1 4.43Å; F592-I596 HydrophobicContact CZ-CD1 3.62Å; F592-I596 HydrophobicContact CZ-CG1 4.42Å; F592-I596 PolarHBondContact O-N 3.26Å; F592-I596 VanDerWaalsContact O-N 3.16Å; V593-I596 PolarHBondContact O-N 2.78Å; Y594-I596 VanDerWaalsContact C-N 3.33Å; Y594-I596 PolarHBondContact O-N 3.26Å; I596-Y598 VanDerWaalsContact C-N 3.33Å; I596-Y598 PolarHBondContact O-N 2.85Å; I596-F599 PolarHBondContact O-N 3.29Å; I596-V600 WeakPolarHBondContact O-CG2 3.28Å; I596-V600 PolarHBondContact O-N 3.37Å; I596-F615 HydrophobicContact CG1-CE1 3.96Å; I596-F615 HydrophobicContact CG1-CZ 4.41Å
597	H	95.1	Very high	92.4	Very high	103 Å²	103	56.2 Å²	56.2	48%	0.477	27%	0.273	S	S	.	.	H	α-helix	trans	-59	-44.9	177.2	172.6	76	0	0	0	112	V593 Y594 F599 V600 T601	V593-H597 PolarHBondContact O-N 3.08Å; Y594-H597 WeakPolarHBondContact O-CB 3.43Å; Y594-H597 PolarHBondContact O-N 2.9Å; H597-F599 VanDerWaalsContact C-N 3.35Å; H597-F599 PolarHBondContact O-N 2.94Å; H597-V600 PolarHBondContact O-N 3.45Å; H597-T601 WeakPolarHBondContact O-CB 3.23Å; H597-T601 WeakPolarHBondContact O-CG2 3.19Å; H597-T601 PolarHBondContact O-N 3.35Å; H597-T601 PolarHBondContact O-OG1 3.11Å
598	Y	93.6	Very high	92.2	Very high	6 Å²	6	60.3 Å²	60.3	2%	0.024	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-42.7	178.1	-173.4	-89	0	0	0	111.5	F531 N532 W535 Y594 S595 I596 V600 T601 R602 L603	F531-Y598 HydrophobicContact CB-CD1 4.3Å; F531-Y598 HydrophobicContact CB-CD2 3.87Å; F531-Y598 HydrophobicContact CB-CE1 4.1Å; F531-Y598 HydrophobicContact CB-CE2 3.66Å; F531-Y598 HydrophobicContact CB-CG 4.19Å; F531-Y598 AromaticContact CD1-CD1 3.82Å; F531-Y598 HydrophobicContact CD1-CD1 3.82Å; F531-Y598 HydrophobicContact CD1-CD2 4.34Å; F531-Y598 HydrophobicContact CD1-CE1 4.3Å; F531-Y598 AromaticContact CD1-CG 3.84Å; F531-Y598 HydrophobicContact CD1-CG 3.84Å; F531-Y598 HydrophobicContact CG-CD2 4.48Å; F531-Y598 HydrophobicContact CG-CG 4.42Å; F531-Y598 PolarHBondContact O-OH 2.93Å; N532-Y598 WeakPolarHBondContact CA-OH 3.41Å; N532-Y598 PolarHBondContact N-OH 2.94Å; N532-Y598 WeakPolarHBondContact OD1-CE2 3.01Å; N532-Y598 PolarHBondContact OD1-OH 3.23Å; W535-Y598 HydrophobicContact CB-CE1 4.13Å; W535-Y598 AromaticContact CD1-CE1 3.99Å; W535-Y598 HydrophobicContact CG-CE1 4.32Å; Y594-Y598 WeakPolarHBondContact O-CB 3.48Å; Y594-Y598 PolarHBondContact O-N 3.25Å; S595-Y598 PolarHBondContact O-N 2.87Å; I596-Y598 VanDerWaalsContact C-N 3.33Å; I596-Y598 PolarHBondContact O-N 2.85Å; Y598-V600 PolarHBondContact O-N 3.15Å; Y598-T601 PolarHBondContact O-N 3.46Å; Y598-R602 HydrophobicContact CD2-CB 4.15Å; Y598-R602 HydrophobicContact CD2-CG 4.09Å; Y598-R602 HydrophobicContact CE1-CB 4.29Å; Y598-R602 HydrophobicContact CE2-CB 3.9Å; Y598-R602 HydrophobicContact CE2-CG 3.98Å; Y598-R602 HydrophobicContact CG-CB 4.44Å; Y598-R602 WeakPolarHBondContact O-CB 3.5Å; Y598-R602 PolarHBondContact O-N 3.22Å; Y598-L603 HydrophobicContact CD1-CD1 4.03Å; Y598-L603 HydrophobicContact CD1-CG 3.98Å; Y598-L603 HydrophobicContact CE1-CD1 4.05Å; Y598-L603 HydrophobicContact CE1-CD2 3.81Å; Y598-L603 HydrophobicContact CE1-CG 3.76Å; Y598-L603 PolarHBondContact O-N 2.81Å
599	F	93.4	Very high	91.9	Very high	44 Å²	44	62.4 Å²	62.4	19%	0.193	32%	0.319	C	S	.	.	H	α-helix	trans	-58.3	-46.1	175.4	177.7	-96.1	0	0	0	112.5	S595 I596 H597 L603 F605 A611 Y614 F615	S595-F599 WeakPolarHBondContact O-CB 3.02Å; S595-F599 PolarHBondContact O-N 2.8Å; I596-F599 PolarHBondContact O-N 3.29Å; H597-F599 VanDerWaalsContact C-N 3.35Å; H597-F599 PolarHBondContact O-N 2.94Å; F599-L603 HydrophobicContact CB-CD1 4.48Å; F599-L603 HydrophobicContact CD2-CB 4.49Å; F599-L603 HydrophobicContact CD2-CD1 4.02Å; F599-F605 HydrophobicContact CD2-CD2 4.49Å; F599-F605 HydrophobicContact CE2-CD2 4.08Å; F599-A611 HydrophobicContact CE2-CB 3.76Å; F599-A611 HydrophobicContact CZ-CB 3.55Å; F599-Y614 HydrophobicContact CB-CD1 4.25Å; F599-Y614 HydrophobicContact CB-CE1 3.69Å; F599-Y614 AromaticContact CD2-CD1 3.59Å; F599-Y614 HydrophobicContact CD2-CD1 3.59Å; F599-Y614 AromaticContact CD2-CE1 3.93Å; F599-Y614 HydrophobicContact CD2-CE1 3.93Å; F599-Y614 HydrophobicContact CD2-CG 4.08Å; F599-Y614 HydrophobicContact CE2-CD1 4.38Å; F599-Y614 HydrophobicContact CG-CD1 4.22Å; F599-Y614 HydrophobicContact CG-CE1 4.16Å; F599-F615 HydrophobicContact CB-CZ 4.09Å; F599-F615 AromaticContact CD1-CE2 3.98Å; F599-F615 HydrophobicContact CD1-CE2 3.98Å; F599-F615 AromaticContact CD1-CZ 3.93Å; F599-F615 HydrophobicContact CD1-CZ 3.93Å; F599-F615 HydrophobicContact CD2-CE2 4.09Å; F599-F615 HydrophobicContact CD2-CZ 4.33Å; F599-F615 HydrophobicContact CE1-CE2 4.12Å; F599-F615 HydrophobicContact CE2-CE2 4.23Å; F599-F615 AromaticContact CG-CE2 3.98Å; F599-F615 HydrophobicContact CG-CE2 3.98Å; F599-F615 AromaticContact CG-CZ 3.85Å; F599-F615 HydrophobicContact CG-CZ 3.85Å; F599-F615 HydrophobicContact CZ-CE2 4.25Å
600	V	93	Very high	91.7	Very high	108 Å²	108	58.9 Å²	58.9	66%	0.655	30%	0.303	S	S	*	.	H	α-helix	trans	-74.4	-32.1	-177.1	175.6	0	0	0	0	112.8	I596 H597 Y598	I596-V600 WeakPolarHBondContact O-CG2 3.28Å; I596-V600 PolarHBondContact O-N 3.37Å; H597-V600 PolarHBondContact O-N 3.45Å; Y598-V600 PolarHBondContact O-N 3.15Å
601	T	91	Very high	91.6	Very high	73 Å²	73	57.7 Å²	57.7	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-101.2	-25	-170.1	58.9	0	0	0	0	115.1	H597 Y598	H597-T601 WeakPolarHBondContact O-CB 3.23Å; H597-T601 WeakPolarHBondContact O-CG2 3.19Å; H597-T601 PolarHBondContact O-N 3.35Å; H597-T601 PolarHBondContact O-OG1 3.11Å; Y598-T601 PolarHBondContact O-N 3.46Å
602	R	86.3	Confident	91.5	Very high	136 Å²	136	62.2 Å²	62.2	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-123.9	-22.6	-171.5	-65.1	-62.6	-170.8	135.4	-0.9	114.4	Y598	Y598-R602 HydrophobicContact CD2-CB 4.15Å; Y598-R602 HydrophobicContact CD2-CG 4.09Å; Y598-R602 HydrophobicContact CE1-CB 4.29Å; Y598-R602 HydrophobicContact CE2-CB 3.9Å; Y598-R602 HydrophobicContact CE2-CG 3.98Å; Y598-R602 HydrophobicContact CG-CB 4.44Å; Y598-R602 WeakPolarHBondContact O-CB 3.5Å; Y598-R602 PolarHBondContact O-N 3.22Å
603	L	88.9	Confident	91.4	Very high	24 Å²	24	57.9 Å²	57.9	13%	0.126	30%	0.303	C	S	.	.			trans	-94.6	133.1	178.9	-63.7	179.1	0	0	0	110.1	W535 Y598 F599 F605 Y614	W535-L603 HydrophobicContact CB-CD2 3.98Å; Y598-L603 HydrophobicContact CD1-CD1 4.03Å; Y598-L603 HydrophobicContact CD1-CG 3.98Å; Y598-L603 HydrophobicContact CE1-CD1 4.05Å; Y598-L603 HydrophobicContact CE1-CD2 3.81Å; Y598-L603 HydrophobicContact CE1-CG 3.76Å; Y598-L603 PolarHBondContact O-N 2.81Å; F599-L603 HydrophobicContact CB-CD1 4.48Å; F599-L603 HydrophobicContact CD2-CB 4.49Å; F599-L603 HydrophobicContact CD2-CD1 4.02Å; L603-F605 VanDerWaalsContact C-N 3.35Å; L603-F605 HydrophobicContact CB-CD2 4.2Å; L603-F605 HydrophobicContact CB-CE2 4.37Å; L603-F605 HydrophobicContact CB-CG 4.43Å; L603-F605 HydrophobicContact CD1-CD2 4.12Å; L603-F605 HydrophobicContact CD1-CE2 3.69Å; L603-F605 HydrophobicContact CD1-CZ 4.32Å; L603-F605 HydrophobicContact CD2-CE2 4.28Å; L603-F605 HydrophobicContact CD2-CZ 4.11Å; L603-F605 HydrophobicContact CG-CE2 4.35Å; L603-Y614 HydrophobicContact CD1-CD2 3.5Å; L603-Y614 VanDerWaalsContact CD1-CD2 3.5Å; L603-Y614 HydrophobicContact CD1-CE2 3.36Å; L603-Y614 HydrophobicContact CD1-CG 4.14Å
604	E	84.5	Confident	91.3	Very high	104 Å²	104	54.6 Å²	54.6	49%	0.486	28%	0.283	S	S	.	.			trans	-101.5	24.2	-178.6	-61.7	-179.8	178.6	0	0	111.7	K58 Q606	K58-E604 WeakPolarHBondContact CA-O 3.21Å; E604-Q606 PolarHBondContact O-N 3.16Å
605	F	86.6	Confident	91.3	Very high	32 Å²	32	57.2 Å²	57.2	14%	0.14	30%	0.295	C	S	.	.			trans	-63.1	122	-178	-63.5	-24.2	0	0	0	110.9	K58 F60 F599 L603 Y614	K58-F605 WeakPolarHBondContact O-CA 3.47Å; F60-F605 HydrophobicContact CB-CE1 4.4Å; F60-F605 HydrophobicContact CB-CE2 4.44Å; F60-F605 HydrophobicContact CB-CZ 4.16Å; F60-F605 HydrophobicContact CD2-CZ 4.28Å; F599-F605 HydrophobicContact CD2-CD2 4.49Å; F599-F605 HydrophobicContact CE2-CD2 4.08Å; L603-F605 VanDerWaalsContact C-N 3.35Å; L603-F605 HydrophobicContact CB-CD2 4.2Å; L603-F605 HydrophobicContact CB-CE2 4.37Å; L603-F605 HydrophobicContact CB-CG 4.43Å; L603-F605 HydrophobicContact CD1-CD2 4.12Å; L603-F605 HydrophobicContact CD1-CE2 3.69Å; L603-F605 HydrophobicContact CD1-CZ 4.32Å; L603-F605 HydrophobicContact CD2-CE2 4.28Å; L603-F605 HydrophobicContact CD2-CZ 4.11Å; L603-F605 HydrophobicContact CG-CE2 4.35Å; F605-Y614 HydrophobicContact CE2-CD2 4.36Å; F605-Y614 HydrophobicContact CE2-CG 4.5Å
606	Q	83	Confident	91.4	Very high	136 Å²	136	57.8 Å²	57.8	64%	0.636	30%	0.3	S	S	*	.			trans	-92.3	-24.9	-177.9	-62.3	-173.1	-12.7	0	0	112.7	K58 E604	K58-Q606 HydrophobicContact CB-CG 4.46Å; K58-Q606 PolarHBondContact O-N 2.92Å; E604-Q606 PolarHBondContact O-N 3.16Å
607	D	85.7	Confident	91.4	Very high	41 Å²	41	56.6 Å²	56.6	22%	0.219	29%	0.292	C	S	.	.	S	Bend	trans	-100.4	139.7	-173.9	62.6	-66.3	0	0	0	112.9	S59 V609 S610 A611	S59-D607 PolarHBondContact OG-OD1 3.37Å; D607-V609 PolarHBondContact O-N 3.02Å; D607-S610 PolarHBondContact O-N 2.94Å; D607-S610 VanDerWaalsContact OD1-CB 3.28Å; D607-S610 WeakPolarHBondContact OD1-CB 3.33Å; D607-S610 PolarHBondContact OD1-OG 3.15Å; D607-S610 VanDerWaalsContact OD2-CB 3.24Å; D607-S610 WeakPolarHBondContact OD2-CB 3.37Å; D607-S610 PolarHBondContact OD2-N 3.3Å; D607-S610 PolarHBondContact OD2-OG 2.9Å; D607-A611 PolarHBondContact O-N 3.46Å
608	A	89.4	Confident	91.4	Very high	85 Å²	85	51.8 Å²	51.8	70%	0.702	27%	0.269	S	S	*	.	H	α-helix	trans	-61.6	-26.1	178.3	0	0	0	0	0	112.8	A611 F612	A608-A611 WeakPolarHBondContact O-CB 3.41Å; A608-A611 PolarHBondContact O-N 2.97Å; A608-F612 PolarHBondContact O-N 3.25Å
609	V	91.1	Very high	91.6	Very high	54 Å²	54	53.7 Å²	53.7	33%	0.327	29%	0.287	S	S	.	.	H	α-helix	trans	-72.7	-42.5	-179.9	-175.5	0	0	0	0	111.3	L447 D607 A611 F612 L613	L447-V609 HydrophobicContact CD1-CG1 3.41Å; L447-V609 VanDerWaalsContact CD1-CG1 3.41Å; D607-V609 PolarHBondContact O-N 3.02Å; V609-A611 VanDerWaalsContact C-N 3.28Å; V609-A611 PolarHBondContact O-N 3.03Å; V609-F612 WeakPolarHBondContact O-CB 3.36Å; V609-F612 PolarHBondContact O-N 3.39Å; V609-F612 VanDerWaalsContact O-N 3.16Å; V609-L613 HydrophobicContact CG1-CD1 4.22Å; V609-L613 WeakPolarHBondContact O-CG 3.47Å; V609-L613 PolarHBondContact O-N 2.88Å
610	S	91.5	Very high	91.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-37.8	171.7	-67	0	0	0	0	112.2	S59 F60 D607 L613 Y614	S59-S610 PolarHBondContact OG-OG 2.85Å; S59-S610 VanDerWaalsContact OG-OG 3.14Å; F60-S610 WeakPolarHBondContact CB-OG 3.17Å; F60-S610 PolarHBondContact N-OG 2.68Å; D607-S610 PolarHBondContact O-N 2.94Å; D607-S610 VanDerWaalsContact OD1-CB 3.28Å; D607-S610 WeakPolarHBondContact OD1-CB 3.33Å; D607-S610 PolarHBondContact OD1-OG 3.15Å; D607-S610 VanDerWaalsContact OD2-CB 3.24Å; D607-S610 WeakPolarHBondContact OD2-CB 3.37Å; D607-S610 PolarHBondContact OD2-N 3.3Å; D607-S610 PolarHBondContact OD2-OG 2.9Å; S610-L613 PolarHBondContact O-N 3.36Å; S610-Y614 WeakPolarHBondContact O-CB 3.37Å; S610-Y614 PolarHBondContact O-N 3.41Å
611	A	93.4	Very high	91.9	Very high	19 Å²	19	50.5 Å²	50.5	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-46.9	171.7	0	0	0	0	0	111.6	F599 D607 A608 V609 L613 Y614 F615	F599-A611 HydrophobicContact CE2-CB 3.76Å; F599-A611 HydrophobicContact CZ-CB 3.55Å; D607-A611 PolarHBondContact O-N 3.46Å; A608-A611 WeakPolarHBondContact O-CB 3.41Å; A608-A611 PolarHBondContact O-N 2.97Å; V609-A611 VanDerWaalsContact C-N 3.28Å; V609-A611 PolarHBondContact O-N 3.03Å; A611-L613 PolarHBondContact O-N 3.31Å; A611-Y614 PolarHBondContact O-N 3.35Å; A611-F615 WeakPolarHBondContact O-CD2 3.42Å; A611-F615 PolarHBondContact O-N 3.28Å
612	F	95.3	Very high	92.2	Very high	101 Å²	101	48 Å²	48	44%	0.443	25%	0.251	S	S	.	.	H	α-helix	trans	-57.6	-45.5	175.5	170.2	-103.2	0	0	0	112.4	I439 L440 A443 A608 V609 F615 G616	I439-F612 HydrophobicContact CG2-CZ 4.07Å; L440-F612 HydrophobicContact CD2-CD1 4.25Å; L440-F612 HydrophobicContact CD2-CE1 3.7Å; L440-F612 HydrophobicContact CD2-CZ 4.01Å; A443-F612 HydrophobicContact CB-CE1 4.21Å; A608-F612 PolarHBondContact O-N 3.25Å; V609-F612 WeakPolarHBondContact O-CB 3.36Å; V609-F612 PolarHBondContact O-N 3.39Å; V609-F612 VanDerWaalsContact O-N 3.16Å; F612-F615 PolarHBondContact O-N 3.19Å; F612-G616 PolarHBondContact O-N 3.29Å
613	L	94	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-45.7	178.5	-68.2	167.5	0	0	0	111.7	F60 L440 L444 V609 S610 A611 G616 Y617	F60-L613 HydrophobicContact CD1-CB 3.8Å; F60-L613 HydrophobicContact CD1-CD1 3.56Å; F60-L613 HydrophobicContact CD1-CG 4.28Å; F60-L613 HydrophobicContact CE1-CB 4.05Å; F60-L613 HydrophobicContact CE1-CD1 4.1Å; F60-L613 HydrophobicContact CG-CB 4.32Å; F60-L613 HydrophobicContact CG-CD1 4.49Å; L440-L613 HydrophobicContact CB-CD2 4.21Å; L440-L613 HydrophobicContact CD2-CD2 4Å; L444-L613 HydrophobicContact CD1-CD2 4.47Å; L444-L613 HydrophobicContact CD2-CD1 3.68Å; L444-L613 HydrophobicContact CD2-CD2 4.14Å; L444-L613 HydrophobicContact CG-CD1 4.38Å; L444-L613 HydrophobicContact CG-CD2 3.94Å; V609-L613 HydrophobicContact CG1-CD1 4.22Å; V609-L613 WeakPolarHBondContact O-CG 3.47Å; V609-L613 PolarHBondContact O-N 2.88Å; S610-L613 PolarHBondContact O-N 3.36Å; A611-L613 PolarHBondContact O-N 3.31Å; L613-G616 PolarHBondContact O-N 2.78Å; L613-Y617 WeakPolarHBondContact O-CD2 3.35Å; L613-Y617 PolarHBondContact O-N 3.3Å
614	Y	95.1	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-55.4	-53.5	175.4	171.2	-96.1	0	0	0	112	W535 S595 F599 L603 F605 S610 A611 G616 T618	W535-Y614 AromaticContact CD1-CE2 3.94Å; W535-Y614 AromaticContact CD2-CD2 3.7Å; W535-Y614 HydrophobicContact CD2-CD2 3.7Å; W535-Y614 AromaticContact CD2-CE2 3.74Å; W535-Y614 HydrophobicContact CD2-CE2 3.74Å; W535-Y614 AromaticContact CE2-CD2 3.59Å; W535-Y614 AromaticContact CE2-CE2 3.41Å; W535-Y614 VanDerWaalsContact CE2-CE2 3.41Å; W535-Y614 AromaticContact CE3-CD2 3.76Å; W535-Y614 HydrophobicContact CE3-CD2 3.76Å; W535-Y614 HydrophobicContact CE3-CE2 4.29Å; W535-Y614 HydrophobicContact CG-CD2 4.41Å; W535-Y614 HydrophobicContact CG-CE2 4.08Å; W535-Y614 AromaticContact CH2-CD2 3.65Å; W535-Y614 HydrophobicContact CH2-CD2 3.65Å; W535-Y614 HydrophobicContact CH2-CE2 4.27Å; W535-Y614 HydrophobicContact CH2-CG 4.39Å; W535-Y614 AromaticContact CZ2-CD2 3.6Å; W535-Y614 HydrophobicContact CZ2-CD2 3.6Å; W535-Y614 AromaticContact CZ2-CE2 3.74Å; W535-Y614 HydrophobicContact CZ2-CE2 3.74Å; W535-Y614 AromaticContact CZ3-CD2 3.71Å; W535-Y614 HydrophobicContact CZ3-CD2 3.71Å; W535-Y614 AromaticContact NE1-CE2 3.55Å; S595-Y614 PolarHBondContact O-OH 3.42Å; F599-Y614 HydrophobicContact CB-CD1 4.25Å; F599-Y614 HydrophobicContact CB-CE1 3.69Å; F599-Y614 AromaticContact CD2-CD1 3.59Å; F599-Y614 HydrophobicContact CD2-CD1 3.59Å; F599-Y614 AromaticContact CD2-CE1 3.93Å; F599-Y614 HydrophobicContact CD2-CE1 3.93Å; F599-Y614 HydrophobicContact CD2-CG 4.08Å; F599-Y614 HydrophobicContact CE2-CD1 4.38Å; F599-Y614 HydrophobicContact CG-CD1 4.22Å; F599-Y614 HydrophobicContact CG-CE1 4.16Å; L603-Y614 HydrophobicContact CD1-CD2 3.5Å; L603-Y614 VanDerWaalsContact CD1-CD2 3.5Å; L603-Y614 HydrophobicContact CD1-CE2 3.36Å; L603-Y614 HydrophobicContact CD1-CG 4.14Å; F605-Y614 HydrophobicContact CE2-CD2 4.36Å; F605-Y614 HydrophobicContact CE2-CG 4.5Å; S610-Y614 WeakPolarHBondContact O-CB 3.37Å; S610-Y614 PolarHBondContact O-N 3.41Å; A611-Y614 PolarHBondContact O-N 3.35Å; Y614-G616 VanDerWaalsContact C-N 3.31Å; Y614-G616 PolarHBondContact O-N 3.43Å; Y614-T618 VanDerWaalsContact O-CB 3.25Å; Y614-T618 WeakPolarHBondContact O-CB 3.14Å; Y614-T618 PolarHBondContact O-N 3.15Å; Y614-T618 PolarHBondContact O-OG1 2.81Å
615	F	96.3	Very high	93.6	Very high	69 Å²	69	42.2 Å²	42.2	30%	0.303	23%	0.228	S	C	.	.	H	α-helix	trans	-67.9	-32.2	-179.1	-77.3	-65.6	0	0	0	112.1	I596 F599 A611 F612 A619	I596-F615 HydrophobicContact CG1-CE1 3.96Å; I596-F615 HydrophobicContact CG1-CZ 4.41Å; F599-F615 HydrophobicContact CB-CZ 4.09Å; F599-F615 AromaticContact CD1-CE2 3.98Å; F599-F615 HydrophobicContact CD1-CE2 3.98Å; F599-F615 AromaticContact CD1-CZ 3.93Å; F599-F615 HydrophobicContact CD1-CZ 3.93Å; F599-F615 HydrophobicContact CD2-CE2 4.09Å; F599-F615 HydrophobicContact CD2-CZ 4.33Å; F599-F615 HydrophobicContact CE1-CE2 4.12Å; F599-F615 HydrophobicContact CE2-CE2 4.23Å; F599-F615 AromaticContact CG-CE2 3.98Å; F599-F615 HydrophobicContact CG-CE2 3.98Å; F599-F615 AromaticContact CG-CZ 3.85Å; F599-F615 HydrophobicContact CG-CZ 3.85Å; F599-F615 HydrophobicContact CZ-CE2 4.25Å; A611-F615 WeakPolarHBondContact O-CD2 3.42Å; A611-F615 PolarHBondContact O-N 3.28Å; F612-F615 PolarHBondContact O-N 3.19Å; F615-A619 VanDerWaalsContact O-CB 3.27Å; F615-A619 WeakPolarHBondContact O-CB 3.37Å; F615-A619 PolarHBondContact O-N 3.34Å
616	G	96.6	Very high	94.1	Very high	11 Å²	11	43.9 Å²	43.9	11%	0.113	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-52.8	174.7	0	0	0	0	0	113.3	F612 L613 Y614 T618 A619 I620	F612-G616 PolarHBondContact O-N 3.29Å; L613-G616 PolarHBondContact O-N 2.78Å; Y614-G616 VanDerWaalsContact C-N 3.31Å; Y614-G616 PolarHBondContact O-N 3.43Å; G616-T618 VanDerWaalsContact C-N 3.32Å; G616-T618 PolarHBondContact O-N 3.34Å; G616-A619 WeakPolarHBondContact O-CB 3.5Å; G616-A619 PolarHBondContact O-N 2.86Å; G616-I620 PolarHBondContact O-N 3.35Å
617	Y	95.3	Very high	94.7	Very high	43 Å²	43	37.5 Å²	37.5	17%	0.169	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-37.3	176.8	-74.3	-65.4	0	0	0	111.9	F60 F437 L440 L444 L613 A619 I620 I621	F60-Y617 AromaticContact CE1-CE2 3.98Å; F60-Y617 HydrophobicContact CE1-CE2 3.98Å; F60-Y617 HydrophobicContact CZ-CD2 4.04Å; F60-Y617 AromaticContact CZ-CE2 3.77Å; F60-Y617 HydrophobicContact CZ-CE2 3.77Å; F437-Y617 HydrophobicContact CD2-CE1 4.25Å; F437-Y617 HydrophobicContact CE2-CE1 4.47Å; L440-Y617 HydrophobicContact CD1-CD1 3.89Å; L440-Y617 HydrophobicContact CD1-CD2 4.12Å; L440-Y617 HydrophobicContact CD1-CE1 3.96Å; L440-Y617 HydrophobicContact CD1-CE2 4.17Å; L440-Y617 HydrophobicContact CD1-CG 3.96Å; L444-Y617 WeakPolarHBondContact CD1-OH 3.34Å; L613-Y617 WeakPolarHBondContact O-CD2 3.35Å; L613-Y617 PolarHBondContact O-N 3.3Å; Y617-A619 VanDerWaalsContact C-N 3.31Å; Y617-A619 PolarHBondContact O-N 3.01Å; Y617-I620 HydrophobicContact CD1-CD1 4.43Å; Y617-I620 WeakPolarHBondContact O-CB 3.47Å; Y617-I620 PolarHBondContact O-N 3.38Å; Y617-I621 PolarHBondContact O-N 3.18Å; Y617-I621 VanDerWaalsContact O-N 3.15Å
618	T	96.1	Very high	95.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-36.4	175.5	-57.7	0	0	0	0	111.6	Y614 G616 I620 I621 L622	Y614-T618 VanDerWaalsContact O-CB 3.25Å; Y614-T618 WeakPolarHBondContact O-CB 3.14Å; Y614-T618 PolarHBondContact O-N 3.15Å; Y614-T618 PolarHBondContact O-OG1 2.81Å; G616-T618 VanDerWaalsContact C-N 3.32Å; G616-T618 PolarHBondContact O-N 3.34Å; T618-I620 VanDerWaalsContact C-N 3.28Å; T618-I620 PolarHBondContact O-N 3.23Å; T618-I621 WeakPolarHBondContact O-CB 3.23Å; T618-I621 PolarHBondContact O-N 3.01Å; T618-I621 VanDerWaalsContact O-N 3.14Å; T618-L622 HydrophobicContact CG2-CD1 3.99Å; T618-L622 HydrophobicContact CG2-CG 4.26Å; T618-L622 WeakPolarHBondContact O-CB 3.37Å; T618-L622 VanDerWaalsContact O-CG 3.23Å; T618-L622 WeakPolarHBondContact O-CG 3.45Å; T618-L622 PolarHBondContact O-N 2.98Å
619	A	97	Very high	95.6	Very high	47 Å²	47	31.7 Å²	31.7	39%	0.388	16%	0.162	S	C	.	.	H	α-helix	trans	-61.3	-36.4	174.2	0	0	0	0	0	112.2	F615 G616 Y617 L622 W623	F615-A619 VanDerWaalsContact O-CB 3.27Å; F615-A619 WeakPolarHBondContact O-CB 3.37Å; F615-A619 PolarHBondContact O-N 3.34Å; G616-A619 WeakPolarHBondContact O-CB 3.5Å; G616-A619 PolarHBondContact O-N 2.86Å; Y617-A619 VanDerWaalsContact C-N 3.31Å; Y617-A619 PolarHBondContact O-N 3.01Å; A619-L622 PolarHBondContact O-N 2.77Å; A619-W623 WeakPolarHBondContact O-CB 3.2Å; A619-W623 PolarHBondContact O-N 3.37Å
620	I	97	Very high	95.8	Very high	23 Å²	23	29.1 Å²	29.1	12%	0.118	15%	0.147	C	C	.	.	H	α-helix	trans	-62.2	-49.3	172.1	-63	171.6	0	0	0	110.1	V433 V436 F437 L440 G616 Y617 T618 L622 W623 L624	V433-I620 HydrophobicContact CG1-CG2 3.83Å; V433-I620 HydrophobicContact CG2-CG2 4.39Å; V436-I620 HydrophobicContact CB-CD1 4.27Å; V436-I620 HydrophobicContact CB-CG1 4.14Å; V436-I620 HydrophobicContact CG1-CD1 3.94Å; V436-I620 HydrophobicContact CG1-CG1 3.83Å; F437-I620 HydrophobicContact CB-CD1 4.36Å; L440-I620 HydrophobicContact CD1-CD1 4.45Å; G616-I620 PolarHBondContact O-N 3.35Å; Y617-I620 HydrophobicContact CD1-CD1 4.43Å; Y617-I620 WeakPolarHBondContact O-CB 3.47Å; Y617-I620 PolarHBondContact O-N 3.38Å; T618-I620 VanDerWaalsContact C-N 3.28Å; T618-I620 PolarHBondContact O-N 3.23Å; I620-L622 VanDerWaalsContact C-N 3.29Å; I620-L622 PolarHBondContact O-N 3.15Å; I620-W623 PolarHBondContact O-N 3.27Å; I620-L624 HydrophobicContact CG2-CD1 4.13Å; I620-L624 HydrophobicContact CG2-CG 4.39Å; I620-L624 WeakPolarHBondContact O-CG 3.39Å; I620-L624 PolarHBondContact O-N 3.36Å
621	I	95.8	Very high	96.1	Very high	62 Å²	62	29.2 Å²	29.2	32%	0.318	15%	0.148	S	C	.	.	H	α-helix	trans	-57.6	-44.3	178.3	-64.3	171.1	0	0	0	110.8	I534 L591 Y617 T618 L624 N625	I534-I621 HydrophobicContact CD1-CD1 4.5Å; L591-I621 HydrophobicContact CD2-CG2 4.47Å; Y617-I621 PolarHBondContact O-N 3.18Å; Y617-I621 VanDerWaalsContact O-N 3.15Å; T618-I621 WeakPolarHBondContact O-CB 3.23Å; T618-I621 PolarHBondContact O-N 3.01Å; T618-I621 VanDerWaalsContact O-N 3.14Å; I621-L624 PolarHBondContact O-N 3.15Å; I621-N625 VanDerWaalsContact O-CB 3.32Å; I621-N625 WeakPolarHBondContact O-CB 3.23Å; I621-N625 PolarHBondContact O-N 3.01Å
622	L	97.2	Very high	96.4	Very high	21 Å²	21	28.9 Å²	28.9	11%	0.11	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-43.4	178.7	-71	167.1	0	0	0	112.3	S588 L591 F592 T618 A619 I620 N625 F626	S588-L622 WeakPolarHBondContact O-CD2 3.48Å; L591-L622 HydrophobicContact CB-CD2 3.68Å; L591-L622 HydrophobicContact CD2-CD2 3.81Å; L591-L622 HydrophobicContact CG-CD2 3.51Å; F592-L622 HydrophobicContact CB-CD1 3.78Å; F592-L622 HydrophobicContact CB-CD2 3.88Å; F592-L622 HydrophobicContact CD2-CD1 3.61Å; F592-L622 HydrophobicContact CG-CD1 4.16Å; T618-L622 HydrophobicContact CG2-CD1 3.99Å; T618-L622 HydrophobicContact CG2-CG 4.26Å; T618-L622 WeakPolarHBondContact O-CB 3.37Å; T618-L622 VanDerWaalsContact O-CG 3.23Å; T618-L622 WeakPolarHBondContact O-CG 3.45Å; T618-L622 PolarHBondContact O-N 2.98Å; A619-L622 PolarHBondContact O-N 2.77Å; I620-L622 VanDerWaalsContact C-N 3.29Å; I620-L622 PolarHBondContact O-N 3.15Å; L622-N625 PolarHBondContact O-N 3.44Å; L622-F626 WeakPolarHBondContact O-CB 3.44Å; L622-F626 PolarHBondContact O-N 3.45Å
623	W	96.8	Very high	96.4	Very high	71 Å²	71	24 Å²	24	27%	0.269	12%	0.122	S	C	.	.	H	α-helix	trans	-64.5	-43.1	177.6	177	-116.8	0	0	0	112.3	L432 A619 I620 F626 L627	L432-W623 HydrophobicContact CD1-CH2 4.45Å; L432-W623 HydrophobicContact CD1-CZ2 3.77Å; A619-W623 WeakPolarHBondContact O-CB 3.2Å; A619-W623 PolarHBondContact O-N 3.37Å; I620-W623 PolarHBondContact O-N 3.27Å; W623-F626 HydrophobicContact CE3-CB 4.47Å; W623-F626 HydrophobicContact CE3-CD1 4.24Å; W623-F626 HydrophobicContact CE3-CG 4.47Å; W623-F626 AromaticContact CZ3-CD1 3.87Å; W623-F626 HydrophobicContact CZ3-CD1 3.87Å; W623-F626 HydrophobicContact CZ3-CE1 4.19Å; W623-F626 HydrophobicContact CZ3-CG 4.46Å; W623-F626 WeakPolarHBondContact O-CB 3.45Å; W623-F626 PolarHBondContact O-N 3.33Å; W623-L627 HydrophobicContact CD2-CD1 4.38Å; W623-L627 HydrophobicContact CD2-CG 4.39Å; W623-L627 HydrophobicContact CH2-CD2 3.93Å; W623-L627 HydrophobicContact CH2-CG 4.39Å; W623-L627 HydrophobicContact CZ2-CD1 3.88Å; W623-L627 HydrophobicContact CZ2-CD2 3.83Å; W623-L627 HydrophobicContact CZ2-CG 4.03Å; W623-L627 WeakPolarHBondContact O-CG 2.96Å; W623-L627 PolarHBondContact O-N 3.19Å; W623-L627 VanDerWaalsContact O-N 3.1Å
624	L	96.4	Very high	96.6	Very high	47 Å²	47	24 Å²	24	25%	0.246	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-41.8	175.8	-65.2	-178.4	0	0	0	111.5	I363 V433 I620 I621 F626 L627 F628	I363-L624 HydrophobicContact CD1-CD2 3.71Å; I363-L624 HydrophobicContact CG1-CD2 4.21Å; V433-L624 HydrophobicContact CG2-CD2 4.05Å; I620-L624 HydrophobicContact CG2-CD1 4.13Å; I620-L624 HydrophobicContact CG2-CG 4.39Å; I620-L624 WeakPolarHBondContact O-CG 3.39Å; I620-L624 PolarHBondContact O-N 3.36Å; I621-L624 PolarHBondContact O-N 3.15Å; L624-F626 VanDerWaalsContact C-N 3.33Å; L624-F626 PolarHBondContact O-N 3.4Å; L624-L627 PolarHBondContact O-N 3.33Å; L624-F628 WeakPolarHBondContact O-CB 3.23Å; L624-F628 PolarHBondContact O-N 3.08Å; L624-F628 VanDerWaalsContact O-N 3.09Å
625	N	95.8	Very high	96.7	Very high	23 Å²	23	27.9 Å²	27.9	12%	0.123	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-41.2	174	-176.8	-98.6	0	0	0	111.6	S588 L591 I621 L622 L627 F628 T629	S588-N625 PolarHBondContact OG-OD1 3.25Å; L591-N625 HydrophobicContact CD2-CB 4.11Å; I621-N625 VanDerWaalsContact O-CB 3.32Å; I621-N625 WeakPolarHBondContact O-CB 3.23Å; I621-N625 PolarHBondContact O-N 3.01Å; L622-N625 PolarHBondContact O-N 3.44Å; N625-L627 PolarHBondContact O-N 2.56Å; N625-F628 PolarHBondContact O-N 2.86Å; N625-T629 WeakPolarHBondContact O-CB 3.27Å; N625-T629 VanDerWaalsContact O-CG2 3.28Å; N625-T629 WeakPolarHBondContact O-CG2 3.02Å; N625-T629 PolarHBondContact O-N 3.32Å; N625-T629 PolarHBondContact O-OG1 3.4Å
626	F	96.8	Very high	96.8	Very high	67 Å²	67	25.1 Å²	25.1	29%	0.294	13%	0.127	S	C	.	.	H	α-helix	trans	-58.5	-51	178.1	178.9	-79.4	0	0	0	111	A585 S588 L622 W623 L624 T629 S630	A585-F626 HydrophobicContact CB-CD2 3.68Å; A585-F626 HydrophobicContact CB-CE1 4.46Å; A585-F626 HydrophobicContact CB-CE2 3.45Å; A585-F626 VanDerWaalsContact CB-CE2 3.45Å; A585-F626 HydrophobicContact CB-CG 4.3Å; A585-F626 HydrophobicContact CB-CZ 3.86Å; S588-F626 WeakPolarHBondContact OG-CA 3.48Å; S588-F626 PolarHBondContact OG-N 3.42Å; L622-F626 WeakPolarHBondContact O-CB 3.44Å; L622-F626 PolarHBondContact O-N 3.45Å; W623-F626 HydrophobicContact CE3-CB 4.47Å; W623-F626 HydrophobicContact CE3-CD1 4.24Å; W623-F626 HydrophobicContact CE3-CG 4.47Å; W623-F626 AromaticContact CZ3-CD1 3.87Å; W623-F626 HydrophobicContact CZ3-CD1 3.87Å; W623-F626 HydrophobicContact CZ3-CE1 4.19Å; W623-F626 HydrophobicContact CZ3-CG 4.46Å; W623-F626 WeakPolarHBondContact O-CB 3.45Å; W623-F626 PolarHBondContact O-N 3.33Å; L624-F626 VanDerWaalsContact C-N 3.33Å; L624-F626 PolarHBondContact O-N 3.4Å; F626-T629 PolarHBondContact O-OG1 2.83Å; F626-S630 WeakPolarHBondContact O-CB 3.32Å; F626-S630 PolarHBondContact O-N 3.05Å; F626-S630 PolarHBondContact O-OG 3.14Å
627	L	97.4	Very high	96.8	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-45.9	-178.7	-67.1	175.2	0	0	0	112.2	V356 G360 C429 W623 L624 N625 S631	V356-L627 HydrophobicContact CB-CD2 4.49Å; V356-L627 HydrophobicContact CG1-CD2 3.86Å; G360-L627 VanDerWaalsContact CA-O 3.29Å; G360-L627 WeakPolarHBondContact CA-O 3.3Å; C429-L627 HydrophobicContact CB-CD1 3.85Å; C429-L627 WeakPolarHBondContact SG-CD1 3.01Å; W623-L627 HydrophobicContact CD2-CD1 4.38Å; W623-L627 HydrophobicContact CD2-CG 4.39Å; W623-L627 HydrophobicContact CH2-CD2 3.93Å; W623-L627 HydrophobicContact CH2-CG 4.39Å; W623-L627 HydrophobicContact CZ2-CD1 3.88Å; W623-L627 HydrophobicContact CZ2-CD2 3.83Å; W623-L627 HydrophobicContact CZ2-CG 4.03Å; W623-L627 WeakPolarHBondContact O-CG 2.96Å; W623-L627 PolarHBondContact O-N 3.19Å; W623-L627 VanDerWaalsContact O-N 3.1Å; L624-L627 PolarHBondContact O-N 3.33Å; N625-L627 PolarHBondContact O-N 2.56Å; L627-S631 PolarHBondContact O-N 2.66Å; L627-S631 VanDerWaalsContact O-N 3.08Å; L627-S631 PolarHBondContact O-OG 3.26Å
628	F	95.9	Very high	96.9	Very high	4 Å²	4	23 Å²	23	2%	0.018	12%	0.116	C	C	.	.	H	α-helix	trans	-57.8	-58.2	177.4	153.2	-121.4	0	0	0	111.1	I363 F364 L367 F550 L553 V554 L624 N625 S630 S631 V632	I363-F628 HydrophobicContact CB-CB 4.34Å; I363-F628 HydrophobicContact CG2-CB 3.85Å; F364-F628 HydrophobicContact CB-CD2 3.95Å; F364-F628 HydrophobicContact CB-CE2 4.45Å; F364-F628 AromaticContact CD2-CD2 3.96Å; F364-F628 HydrophobicContact CD2-CD2 3.96Å; F364-F628 AromaticContact CD2-CE2 3.59Å; F364-F628 HydrophobicContact CD2-CE2 3.59Å; F364-F628 HydrophobicContact CE2-CE2 4.36Å; F364-F628 HydrophobicContact CG-CD2 4.44Å; F364-F628 HydrophobicContact CG-CE2 4.47Å; L367-F628 HydrophobicContact CD1-CD1 4.2Å; L367-F628 HydrophobicContact CD1-CG 4.21Å; F550-F628 HydrophobicContact CD2-CZ 4.22Å; F550-F628 HydrophobicContact CE2-CE1 4.32Å; F550-F628 AromaticContact CE2-CE2 3.87Å; F550-F628 HydrophobicContact CE2-CE2 3.87Å; F550-F628 AromaticContact CE2-CZ 3.63Å; F550-F628 HydrophobicContact CE2-CZ 3.63Å; F550-F628 HydrophobicContact CZ-CE2 4.31Å; F550-F628 HydrophobicContact CZ-CZ 4.44Å; L553-F628 HydrophobicContact CD2-CE1 3.69Å; L553-F628 HydrophobicContact CD2-CZ 4.1Å; L553-F628 HydrophobicContact CG-CE1 4.48Å; V554-F628 HydrophobicContact CG2-CE2 4.19Å; V554-F628 HydrophobicContact CG2-CZ 4.12Å; L624-F628 WeakPolarHBondContact O-CB 3.23Å; L624-F628 PolarHBondContact O-N 3.08Å; L624-F628 VanDerWaalsContact O-N 3.09Å; N625-F628 PolarHBondContact O-N 2.86Å; F628-S630 VanDerWaalsContact C-N 3.33Å; F628-S630 PolarHBondContact O-N 2.86Å; F628-S631 PolarHBondContact O-N 2.83Å; F628-S631 PolarHBondContact O-OG 3.04Å; F628-V632 HydrophobicContact CD2-CG2 3.92Å; F628-V632 HydrophobicContact CE2-CG2 3.56Å; F628-V632 HydrophobicContact CZ-CG2 4.46Å; F628-V632 PolarHBondContact O-N 3.13Å
629	T	96.6	Very high	96.8	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.4	-37.2	-175.8	56.7	0	0	0	0	112.3	I557 G584 N625 F626 G633	I557-T629 HydrophobicContact CD1-CG2 3.52Å; G584-T629 WeakPolarHBondContact O-CB 3.38Å; G584-T629 PolarHBondContact O-OG1 3.12Å; N625-T629 WeakPolarHBondContact O-CB 3.27Å; N625-T629 VanDerWaalsContact O-CG2 3.28Å; N625-T629 WeakPolarHBondContact O-CG2 3.02Å; N625-T629 PolarHBondContact O-N 3.32Å; N625-T629 PolarHBondContact O-OG1 3.4Å; F626-T629 PolarHBondContact O-OG1 2.83Å; T629-G633 PolarHBondContact O-N 2.89Å; T629-G633 VanDerWaalsContact O-N 3.1Å
630	S	96.3	Very high	96.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.8	-50.4	173.4	-61.7	0	0	0	0	111.8	L581 A585 F626 F628 V632 G633 F634	L581-S630 WeakPolarHBondContact CD2-O 3.04Å; L581-S630 PolarHBondContact O-OG 2.02Å; A585-S630 VanDerWaalsContact CB-OG 3.3Å; A585-S630 WeakPolarHBondContact CB-OG 3.43Å; F626-S630 WeakPolarHBondContact O-CB 3.32Å; F626-S630 PolarHBondContact O-N 3.05Å; F626-S630 PolarHBondContact O-OG 3.14Å; F628-S630 VanDerWaalsContact C-N 3.33Å; F628-S630 PolarHBondContact O-N 2.86Å; S630-V632 PolarHBondContact O-N 3.14Å; S630-G633 PolarHBondContact O-N 2.77Å; S630-F634 PolarHBondContact O-N 3.06Å
631	S	97.6	Very high	96.6	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.014	12%	0.124	C	C	.	.	H	α-helix	trans	-64.9	-39.2	-176.2	66.2	0	0	0	0	112.9	G360 L627 F628 F634 Y635	G360-S631 WeakPolarHBondContact CA-OG 3.21Å; G360-S631 PolarHBondContact O-OG 2.02Å; L627-S631 PolarHBondContact O-N 2.66Å; L627-S631 VanDerWaalsContact O-N 3.08Å; L627-S631 PolarHBondContact O-OG 3.26Å; F628-S631 PolarHBondContact O-N 2.83Å; F628-S631 PolarHBondContact O-OG 3.04Å; S631-F634 PolarHBondContact O-N 3.46Å; S631-Y635 VanDerWaalsContact O-CD2 3.26Å; S631-Y635 WeakPolarHBondContact O-CD2 2.94Å; S631-Y635 PolarHBondContact O-N 2.86Å
632	V	98.2	Very high	96.5	Very high	12 Å²	12	29.2 Å²	29.2	7%	0.073	12%	0.124	C	C	.	.	H	α-helix	trans	-60.5	-49.6	174.5	173.9	0	0	0	0	110.3	F364 V554 I557 F628 S630 F634 Y635 A636	F364-V632 HydrophobicContact CD2-CG2 4.23Å; V554-V632 HydrophobicContact CG1-CG1 4Å; I557-V632 HydrophobicContact CB-CG1 4.08Å; I557-V632 HydrophobicContact CG2-CB 4.05Å; I557-V632 HydrophobicContact CG2-CG1 3.79Å; F628-V632 HydrophobicContact CD2-CG2 3.92Å; F628-V632 HydrophobicContact CE2-CG2 3.56Å; F628-V632 HydrophobicContact CZ-CG2 4.46Å; F628-V632 PolarHBondContact O-N 3.13Å; S630-V632 PolarHBondContact O-N 3.14Å; V632-F634 VanDerWaalsContact C-N 3.32Å; V632-F634 PolarHBondContact O-N 2.85Å; V632-Y635 PolarHBondContact O-N 3.44Å; V632-A636 WeakPolarHBondContact O-CB 3.18Å; V632-A636 PolarHBondContact O-N 3.48Å
633	G	97	Very high	96.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59	-42.4	178.3	0	0	0	0	0	112.7	S561 T629 S630 C637	S561-G633 WeakPolarHBondContact OG-CA 3.22Å; T629-G633 PolarHBondContact O-N 2.89Å; T629-G633 VanDerWaalsContact O-N 3.1Å; S630-G633 PolarHBondContact O-N 2.77Å; G633-C637 PolarHBondContact O-N 2.02Å; G633-C637 PolarHBondContact O-SG 3.44Å
634	F	97.5	Very high	95.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-51.9	174.3	162.1	-109	0	0	0	113.1	F353 V357 I409 W576 W577 L581 S630 S631 V632 A636 C637 F638	F353-F634 HydrophobicContact CE1-CD1 4.49Å; F353-F634 AromaticContact CE1-CD2 3.89Å; F353-F634 HydrophobicContact CE1-CD2 3.89Å; F353-F634 HydrophobicContact CE1-CE1 4.32Å; F353-F634 AromaticContact CE1-CE2 3.7Å; F353-F634 HydrophobicContact CE1-CE2 3.7Å; F353-F634 HydrophobicContact CE1-CG 4.27Å; F353-F634 AromaticContact CE1-CZ 3.92Å; F353-F634 HydrophobicContact CE1-CZ 3.92Å; F353-F634 AromaticContact CZ-CD2 3.46Å; F353-F634 HydrophobicContact CZ-CD2 3.46Å; F353-F634 VanDerWaalsContact CZ-CD2 3.46Å; F353-F634 AromaticContact CZ-CE2 3.65Å; F353-F634 HydrophobicContact CZ-CE2 3.65Å; F353-F634 AromaticContact CZ-CG 3.98Å; F353-F634 HydrophobicContact CZ-CG 3.98Å; F353-F634 HydrophobicContact CZ-CZ 4.32Å; V357-F634 HydrophobicContact CB-CD1 4.37Å; V357-F634 HydrophobicContact CG1-CD1 3.71Å; V357-F634 HydrophobicContact CG1-CE1 3.81Å; V357-F634 HydrophobicContact CG2-CD1 3.61Å; V357-F634 HydrophobicContact CG2-CE1 4.05Å; V357-F634 HydrophobicContact CG2-CG 4.08Å; I409-F634 HydrophobicContact CD1-CE1 3.85Å; I409-F634 HydrophobicContact CD1-CZ 3.81Å; I409-F634 HydrophobicContact CG1-CE1 4.22Å; I409-F634 HydrophobicContact CG1-CZ 4.47Å; W576-F634 HydrophobicContact CH2-CE2 4.26Å; W576-F634 HydrophobicContact CZ3-CD2 4.25Å; W576-F634 HydrophobicContact CZ3-CE2 4.26Å; W577-F634 HydrophobicContact CE3-CD2 4.49Å; W577-F634 AromaticContact CE3-CE2 3.68Å; W577-F634 HydrophobicContact CE3-CE2 3.68Å; W577-F634 AromaticContact CZ3-CE2 3.64Å; W577-F634 HydrophobicContact CZ3-CE2 3.64Å; W577-F634 HydrophobicContact CZ3-CZ 4.18Å; L581-F634 HydrophobicContact CD2-CB 3.53Å; L581-F634 HydrophobicContact CD2-CG 4.29Å; L581-F634 HydrophobicContact CG-CB 4.3Å; S630-F634 PolarHBondContact O-N 3.06Å; S631-F634 PolarHBondContact O-N 3.46Å; V632-F634 VanDerWaalsContact C-N 3.32Å; V632-F634 PolarHBondContact O-N 2.85Å; F634-A636 VanDerWaalsContact C-N 3.27Å; F634-A636 PolarHBondContact O-N 2.88Å; F634-C637 PolarHBondContact O-N 2.9Å; F634-F638 HydrophobicContact CD2-CB 4.4Å; F634-F638 HydrophobicContact CE2-CB 3.84Å; F634-F638 HydrophobicContact CE2-CD2 4.49Å; F634-F638 HydrophobicContact CE2-CG 4.3Å; F634-F638 HydrophobicContact CZ-CB 3.98Å; F634-F638 HydrophobicContact CZ-CD2 4.44Å; F634-F638 HydrophobicContact CZ-CG 4.11Å; F634-F638 WeakPolarHBondContact O-CB 3.13Å; F634-F638 PolarHBondContact O-N 3.36Å
635	Y	98	Very high	95.5	Very high	80 Å²	80	29.3 Å²	29.3	31%	0.314	12%	0.124	S	C	.	.	H	α-helix	trans	-63.8	-35.4	-177.4	-85.5	-70.6	0	0	0	112.1	V357 V361 S631 V632 W639	V357-Y635 HydrophobicContact CG1-CD2 4.48Å; V357-Y635 HydrophobicContact CG1-CE2 3.57Å; V361-Y635 HydrophobicContact CG2-CD2 4.21Å; V361-Y635 HydrophobicContact CG2-CE2 3.32Å; S631-Y635 VanDerWaalsContact O-CD2 3.26Å; S631-Y635 WeakPolarHBondContact O-CD2 2.94Å; S631-Y635 PolarHBondContact O-N 2.86Å; V632-Y635 PolarHBondContact O-N 3.44Å; Y635-W639 WeakPolarHBondContact O-CB 3.49Å; Y635-W639 PolarHBondContact O-N 3.42Å
636	A	97.5	Very high	95	Very high	11 Å²	11	30.7 Å²	30.7	9%	0.091	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-50.3	173.1	0	0	0	0	0	111.4	I562 V632 F634 W639 F640	I562-A636 HydrophobicContact CD1-CB 4.12Å; I562-A636 HydrophobicContact CG1-CB 4.05Å; V632-A636 WeakPolarHBondContact O-CB 3.18Å; V632-A636 PolarHBondContact O-N 3.48Å; F634-A636 VanDerWaalsContact C-N 3.27Å; F634-A636 PolarHBondContact O-N 2.88Å; A636-W639 PolarHBondContact O-N 3.46Å; A636-F640 WeakPolarHBondContact O-CB 3.38Å; A636-F640 PolarHBondContact O-N 3.19Å
637	C	96.8	Very high	94.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-44.3	176.4	-67.4	0	0	0	0	112.4	S561 C565 W576 G633 F634 W639 F640 V641	S561-C637 PolarHBondContact O-SG 3.43Å; C565-C637 HydrophobicContact CB-CB 4.18Å; C565-C637 WeakPolarHBondContact CB-SG 3.22Å; W576-C637 HydrophobicContact CE3-CB 3.88Å; W576-C637 HydrophobicContact CZ3-CB 3.72Å; G633-C637 PolarHBondContact O-N 2.02Å; G633-C637 PolarHBondContact O-SG 3.44Å; F634-C637 PolarHBondContact O-N 2.9Å; C637-W639 VanDerWaalsContact C-N 3.34Å; C637-W639 PolarHBondContact O-N 2.6Å; C637-F640 PolarHBondContact O-N 3.38Å; C637-V641 WeakPolarHBondContact O-CB 3.26Å; C637-V641 VanDerWaalsContact O-CG2 3.23Å; C637-V641 WeakPolarHBondContact O-CG2 3.42Å; C637-V641 PolarHBondContact O-N 3.05Å
638	F	97	Very high	93.2	Very high	11 Å²	11	32.6 Å²	32.6	5%	0.048	16%	0.161	C	C	.	.	H	α-helix	trans	-62.2	-42.3	179.8	179.4	-114.1	0	0	0	112	F412 F486 W576 W577 F634 R642	F412-F638 HydrophobicContact CE1-CE2 4.01Å; F412-F638 HydrophobicContact CZ-CE2 4.12Å; F486-F638 HydrophobicContact CB-CZ 4.41Å; F486-F638 HydrophobicContact CD2-CE1 4.45Å; F486-F638 HydrophobicContact CD2-CZ 4.11Å; F486-F638 HydrophobicContact CG-CZ 4.23Å; W576-F638 HydrophobicContact CH2-CB 3.91Å; W576-F638 AromaticContact CH2-CD2 3.91Å; W576-F638 HydrophobicContact CH2-CD2 3.91Å; W576-F638 HydrophobicContact CH2-CG 4.42Å; W576-F638 HydrophobicContact CZ2-CD2 4.45Å; W576-F638 HydrophobicContact CZ3-CB 4.34Å; W577-F638 AromaticContact CH2-CD2 3.84Å; W577-F638 HydrophobicContact CH2-CD2 3.84Å; W577-F638 AromaticContact CH2-CE2 3.91Å; W577-F638 HydrophobicContact CH2-CE2 3.91Å; W577-F638 AromaticContact CZ3-CD2 3.79Å; W577-F638 HydrophobicContact CZ3-CD2 3.79Å; W577-F638 HydrophobicContact CZ3-CE2 4.17Å; F634-F638 HydrophobicContact CD2-CB 4.4Å; F634-F638 HydrophobicContact CE2-CB 3.84Å; F634-F638 HydrophobicContact CE2-CD2 4.49Å; F634-F638 HydrophobicContact CE2-CG 4.3Å; F634-F638 HydrophobicContact CZ-CB 3.98Å; F634-F638 HydrophobicContact CZ-CD2 4.44Å; F634-F638 HydrophobicContact CZ-CG 4.11Å; F634-F638 WeakPolarHBondContact O-CB 3.13Å; F634-F638 PolarHBondContact O-N 3.36Å; F638-R642 HydrophobicContact CE2-CG 4.27Å; F638-R642 HydrophobicContact CZ-CG 4.46Å; F638-R642 WeakPolarHBondContact O-CB 3.36Å; F638-R642 WeakPolarHBondContact O-CG 3.44Å; F638-R642 PolarHBondContact O-N 3.24Å; F638-R642 VanDerWaalsContact O-N 3.11Å
639	W	95.2	Very high	91.7	Very high	169 Å²	169	41.3 Å²	41.3	64%	0.64	20%	0.199	S	C	*	.	H	α-helix	trans	-63.3	-46.8	174	179.8	87.2	0	0	0	111.5	Y635 A636 C637 R642 K643	Y635-W639 WeakPolarHBondContact O-CB 3.49Å; Y635-W639 PolarHBondContact O-N 3.42Å; A636-W639 PolarHBondContact O-N 3.46Å; C637-W639 VanDerWaalsContact C-N 3.34Å; C637-W639 PolarHBondContact O-N 2.6Å; W639-R642 PolarHBondContact O-N 3.45Å; W639-K643 WeakPolarHBondContact O-CB 3.4Å; W639-K643 PolarHBondContact O-N 3.05Å
640	F	94.8	Very high	90	Very high	10 Å²	10	43.5 Å²	43.5	4%	0.044	21%	0.212	C	C	.	.	H	α-helix	trans	-59.9	-50.5	178.7	169	-109.7	0	0	0	112.6	L314 I562 Y566 A636 C637 R642 K643 I644	L314-F640 HydrophobicContact CD1-CE2 3.77Å; L314-F640 HydrophobicContact CD1-CZ 4.37Å; L314-F640 HydrophobicContact CD2-CE2 4.11Å; L314-F640 HydrophobicContact CD2-CZ 4.03Å; I562-F640 HydrophobicContact CB-CG 4.48Å; I562-F640 HydrophobicContact CD1-CB 4.2Å; I562-F640 HydrophobicContact CG1-CB 3.88Å; I562-F640 HydrophobicContact CG1-CG 4.28Å; I562-F640 HydrophobicContact CG2-CB 4.13Å; I562-F640 HydrophobicContact CG2-CD1 3.87Å; I562-F640 HydrophobicContact CG2-CD2 3.63Å; I562-F640 HydrophobicContact CG2-CE1 4.15Å; I562-F640 HydrophobicContact CG2-CE2 3.92Å; I562-F640 HydrophobicContact CG2-CG 3.59Å; I562-F640 HydrophobicContact CG2-CZ 4.17Å; Y566-F640 HydrophobicContact CD2-CE1 4.28Å; Y566-F640 AromaticContact CD2-CZ 3.78Å; Y566-F640 HydrophobicContact CD2-CZ 3.78Å; Y566-F640 HydrophobicContact CG-CE1 4.48Å; Y566-F640 HydrophobicContact CG-CZ 4.09Å; A636-F640 WeakPolarHBondContact O-CB 3.38Å; A636-F640 PolarHBondContact O-N 3.19Å; C637-F640 PolarHBondContact O-N 3.38Å; F640-R642 PolarHBondContact O-N 2.68Å; F640-K643 WeakPolarHBondContact O-CA 3.49Å; F640-K643 WeakPolarHBondContact O-CB 3.31Å; F640-K643 PolarHBondContact O-N 2.73Å; F640-I644 HydrophobicContact CD1-CD1 4.35Å; F640-I644 HydrophobicContact CD2-CG2 3.83Å; F640-I644 HydrophobicContact CE1-CD1 3.74Å; F640-I644 HydrophobicContact CE1-CG2 4.42Å; F640-I644 HydrophobicContact CE2-CG2 3.34Å; F640-I644 HydrophobicContact CZ-CD1 3.85Å; F640-I644 HydrophobicContact CZ-CG2 3.69Å; F640-I644 PolarHBondContact O-N 3.46Å
641	V	94.5	Very high	87.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-48.6	179	171.2	0	0	0	0	110.4	V343 F344 L569 W576 C637 K643 I644 Y645	V343-V641 HydrophobicContact CG1-CG1 4.42Å; V343-V641 HydrophobicContact CG2-CG1 3.6Å; F344-V641 HydrophobicContact CE1-CG1 3.96Å; F344-V641 HydrophobicContact CZ-CG1 3.79Å; L569-V641 HydrophobicContact CD1-CG2 4.04Å; W576-V641 HydrophobicContact CD2-CG2 4.1Å; W576-V641 HydrophobicContact CE3-CG2 4.41Å; W576-V641 HydrophobicContact CH2-CG2 4.45Å; W576-V641 HydrophobicContact CZ2-CB 4.14Å; W576-V641 HydrophobicContact CZ2-CG1 4Å; W576-V641 HydrophobicContact CZ2-CG2 4.12Å; C637-V641 WeakPolarHBondContact O-CB 3.26Å; C637-V641 VanDerWaalsContact O-CG2 3.23Å; C637-V641 WeakPolarHBondContact O-CG2 3.42Å; C637-V641 PolarHBondContact O-N 3.05Å; V641-K643 PolarHBondContact O-N 3.38Å; V641-I644 WeakPolarHBondContact O-CG1 3.43Å; V641-I644 PolarHBondContact O-N 2.82Å; V641-Y645 HydrophobicContact CG1-CD2 3.82Å; V641-Y645 HydrophobicContact CG1-CE2 4.02Å; V641-Y645 VanDerWaalsContact O-CD2 3.27Å; V641-Y645 WeakPolarHBondContact O-CD2 3.46Å; V641-Y645 PolarHBondContact O-N 2.83Å; V641-Y645 VanDerWaalsContact O-N 3.13Å
642	R	93.1	Very high	87.2	Confident	83 Å²	83	57.2 Å²	57.2	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-59.3	-35.5	175.5	-72	-174.9	75.1	-147.4	0.9	112.4	F344 E487 F638 W639 F640 G646	F344-R642 HydrophobicContact CE1-CG 3.72Å; F344-R642 HydrophobicContact CZ-CG 3.84Å; E487-R642 PolarHBondContact O-NE 2.78Å; E487-R642 PolarHBondContact O-NH2 3.38Å; F638-R642 HydrophobicContact CE2-CG 4.27Å; F638-R642 HydrophobicContact CZ-CG 4.46Å; F638-R642 WeakPolarHBondContact O-CB 3.36Å; F638-R642 WeakPolarHBondContact O-CG 3.44Å; F638-R642 PolarHBondContact O-N 3.24Å; F638-R642 VanDerWaalsContact O-N 3.11Å; W639-R642 PolarHBondContact O-N 3.45Å; F640-R642 PolarHBondContact O-N 2.68Å; R642-G646 PolarHBondContact O-N 2.98Å; R642-G646 VanDerWaalsContact O-N 3.08Å
643	K	91	Very high	86.7	Confident	129 Å²	129	59.5 Å²	59.5	56%	0.561	30%	0.295	S	S	*	.	H	α-helix	trans	-72.4	-46	-179.5	-168.1	63.7	179.6	174.6	0	112.7	W639 F640 V641 G646	W639-K643 WeakPolarHBondContact O-CB 3.4Å; W639-K643 PolarHBondContact O-N 3.05Å; F640-K643 WeakPolarHBondContact O-CA 3.49Å; F640-K643 WeakPolarHBondContact O-CB 3.31Å; F640-K643 PolarHBondContact O-N 2.73Å; V641-K643 PolarHBondContact O-N 3.38Å; K643-G646 PolarHBondContact O-N 2.99Å
644	I	88.7	Confident	86.1	Confident	13 Å²	13	62.8 Å²	62.8	7%	0.067	31%	0.311	C	S	.	.	H	α-helix	trans	-68.6	-40.4	-178.3	64.8	178.5	0	0	0	112	W336 L569 F640 V641 G646 V647	W336-I644 HydrophobicContact CE3-CD1 3.95Å; W336-I644 HydrophobicContact CE3-CG1 4.34Å; W336-I644 HydrophobicContact CH2-CB 4.08Å; W336-I644 HydrophobicContact CZ3-CB 3.98Å; W336-I644 HydrophobicContact CZ3-CD1 4.09Å; W336-I644 HydrophobicContact CZ3-CG1 3.98Å; L569-I644 HydrophobicContact CD1-CD1 3.95Å; F640-I644 HydrophobicContact CD1-CD1 4.35Å; F640-I644 HydrophobicContact CD2-CG2 3.83Å; F640-I644 HydrophobicContact CE1-CD1 3.74Å; F640-I644 HydrophobicContact CE1-CG2 4.42Å; F640-I644 HydrophobicContact CE2-CG2 3.34Å; F640-I644 HydrophobicContact CZ-CD1 3.85Å; F640-I644 HydrophobicContact CZ-CG2 3.69Å; F640-I644 PolarHBondContact O-N 3.46Å; V641-I644 WeakPolarHBondContact O-CG1 3.43Å; V641-I644 PolarHBondContact O-N 2.82Å; I644-G646 VanDerWaalsContact C-N 3.35Å; I644-V647 PolarHBondContact O-N 2.98Å
645	Y	89.3	Confident	85.4	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-78	-20.4	178.1	-71.7	-78.9	0	0	0	113	W336 V339 H340 V343 L569 V641 V647 V648	W336-Y645 HydrophobicContact CE3-CD1 4.45Å; W336-Y645 AromaticContact CE3-CE1 3.86Å; W336-Y645 HydrophobicContact CE3-CE1 3.86Å; W336-Y645 HydrophobicContact CE3-CE2 4.29Å; W336-Y645 AromaticContact CE3-CZ 3.79Å; W336-Y645 HydrophobicContact CZ3-CD1 4.15Å; W336-Y645 HydrophobicContact CZ3-CE1 4.02Å; W336-Y645 PolarHBondContact O-OH 3.07Å; V339-Y645 WeakPolarHBondContact CG2-OH 3.47Å; H340-Y645 VanDerWaalsContact CA-CE1 3.42Å; H340-Y645 HydrophobicContact CB-CD1 3.72Å; H340-Y645 HydrophobicContact CB-CE1 3.65Å; V343-Y645 HydrophobicContact CB-CE2 4.02Å; V343-Y645 HydrophobicContact CG1-CD1 4.39Å; V343-Y645 HydrophobicContact CG1-CD2 3.86Å; V343-Y645 HydrophobicContact CG1-CE1 4.32Å; V343-Y645 HydrophobicContact CG1-CE2 3.82Å; V343-Y645 HydrophobicContact CG1-CG 4.16Å; V343-Y645 HydrophobicContact CG2-CD2 4.3Å; V343-Y645 HydrophobicContact CG2-CE2 3.63Å; L569-Y645 HydrophobicContact CD1-CE2 4.16Å; V641-Y645 HydrophobicContact CG1-CD2 3.82Å; V641-Y645 HydrophobicContact CG1-CE2 4.02Å; V641-Y645 VanDerWaalsContact O-CD2 3.27Å; V641-Y645 WeakPolarHBondContact O-CD2 3.46Å; V641-Y645 PolarHBondContact O-N 2.83Å; V641-Y645 VanDerWaalsContact O-N 3.13Å; Y645-V647 PolarHBondContact O-N 2.81Å; Y645-V648 HydrophobicContact CD1-CG2 4.29Å; Y645-V648 PolarHBondContact O-N 3.33Å
646	G	86.4	Confident	84.6	Confident	52 Å²	52	65.7 Å²	65.7	54%	0.536	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-12	168.4	0	0	0	0	0	114.2	R642 K643 I644	R642-G646 PolarHBondContact O-N 2.98Å; R642-G646 VanDerWaalsContact O-N 3.08Å; K643-G646 PolarHBondContact O-N 2.99Å; I644-G646 VanDerWaalsContact C-N 3.35Å
647	V	82.3	Confident	83.8	Confident	90 Å²	90	69.3 Å²	69.3	55%	0.545	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-21.8	174.4	177.7	0	0	0	0	111.5	I644 Y645 K649	I644-V647 PolarHBondContact O-N 2.98Å; Y645-V647 PolarHBondContact O-N 2.81Å; V647-K649 PolarHBondContact O-N 2.83Å
648	V	73.9	Confident	82.8	Confident	19 Å²	19	74.3 Å²	74.3	12%	0.115	37%	0.371	C	S	.	.	S	Bend	trans	-75.5	120.4	177.8	-166.6	0	0	0	0	108.3	W336 K337 Y645 V650	W336-V648 HydrophobicContact CH2-CG2 3.6Å; W336-V648 HydrophobicContact CZ3-CG2 3.58Å; K337-V648 HydrophobicContact CG-CG2 4.42Å; Y645-V648 HydrophobicContact CD1-CG2 4.29Å; Y645-V648 PolarHBondContact O-N 3.33Å; V648-V650 HydrophobicContact CB-CG2 4.23Å; V648-V650 HydrophobicContact CG1-CG2 3.34Å; V648-V650 PolarHBondContact O-N 3.25Å; V648-V650 VanDerWaalsContact O-N 3.17Å
649	K	65	Low	81.8	Confident	187 Å²	187	79.2 Å²	79.2	81%	0.813	40%	0.396	S	S	*	.			trans	-81.5	86.7	172.1	-62.6	-179.4	-177.4	178.5	0	108.1	V647	V647-K649 PolarHBondContact O-N 2.83Å
650	V	60.5	Low	80.6	Confident	45 Å²	45	71.7 Å²	71.7	27%	0.273	38%	0.376	S	S	.	.			trans	-119	111.5	166.7	-161.5	0	0	0	0	105.9	V648	V648-V650 HydrophobicContact CB-CG2 4.23Å; V648-V650 HydrophobicContact CG1-CG2 3.34Å; V648-V650 PolarHBondContact O-N 3.25Å; V648-V650 VanDerWaalsContact O-N 3.17Å
651	D	48	Very low	79.3	Confident	232 Å²	232	77.3 Å²	77.3	100%	1.241	41%	0.406	S	S	*	.			trans	-74.1	0	174.3	-75.2	-28.9	0	0	0	111.5

Retrieved 651 of 651 residues in 947.2 ms (Link to these results)

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