A0A077Z7Y8_TRITR Loading...

Ion trans and BTB 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7Y8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 529 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	50.6	Low	55.9	Low	112 Å²	112	87.4 Å²	87.4	55%	0.552	48%	0.475	S	S	*	.				0	132.6	0	-75.4	-176.3	-177	0	0	108.2	S3 Y6 F41 L45	M1-S3 PolarHBondContact O-N 2.8Å; M1-Y6 HydrophobicContact CB-CE2 4.46Å; M1-F41 HydrophobicContact CE-CE1 3.99Å; M1-F41 HydrophobicContact CE-CZ 3.99Å; M1-L45 HydrophobicContact CE-CD1 3.54Å; M1-L45 HydrophobicContact CE-CD2 3.6Å; M1-L45 HydrophobicContact CE-CG 4.21Å; M1-L45 HydrophobicContact SD-CD1 4.07Å
2	N	51.3	Low	56.7	Low	114 Å²	114	85.7 Å²	85.7	61%	0.61	48%	0.481	S	S	*	.			trans	-76	103.4	172.9	-78	6.4	0	0	0	109.8	S4 K5 Y6	N2-S4 PolarHBondContact O-N 2.91Å; N2-K5 PolarHBondContact O-N 3.17Å; N2-K5 VanDerWaalsContact O-N 3.15Å; N2-Y6 WeakPolarHBondContact O-CD2 3.3Å
3	S	52	Low	58.2	Low	46 Å²	46	79.5 Å²	79.5	32%	0.322	45%	0.447	S	S	.	.	H	α-helix	trans	-55.5	-33.4	179.8	63.6	0	0	0	0	112.5	M1 K5 Y6 S7	M1-S3 PolarHBondContact O-N 2.8Å; S3-K5 VanDerWaalsContact C-N 3.28Å; S3-K5 PolarHBondContact O-N 3.35Å; S3-Y6 PolarHBondContact O-N 2.9Å; S3-Y6 VanDerWaalsContact O-N 3.15Å; S3-S7 PolarHBondContact O-N 3.36Å; S3-S7 VanDerWaalsContact O-N 3.09Å
4	S	51.6	Low	59.5	Low	77 Å²	77	81.9 Å²	81.9	54%	0.538	45%	0.445	S	S	.	.	H	α-helix	trans	-60.8	-28.8	178.9	60.8	0	0	0	0	114.7	N2 S7	N2-S4 PolarHBondContact O-N 2.91Å; S4-S7 PolarHBondContact O-OG 3.27Å
5	K	54.4	Low	60.5	Low	154 Å²	154	77.1 Å²	77.1	67%	0.67	42%	0.419	S	S	*	.	H	α-helix	trans	-74.9	-26.4	177.9	-90.2	-171.3	177.6	-179.1	0	113.1	N2 S3	N2-K5 PolarHBondContact O-N 3.17Å; N2-K5 VanDerWaalsContact O-N 3.15Å; S3-K5 VanDerWaalsContact C-N 3.28Å; S3-K5 PolarHBondContact O-N 3.35Å
6	Y	53.2	Low	61	Low	46 Å²	46	73.6 Å²	73.6	18%	0.18	40%	0.402	C	S	.	.	H	α-helix	trans	-101.5	-25.8	-173	-61.2	-70.4	0	0	0	112.8	M1 N2 S3 T8 K9 R49	M1-Y6 HydrophobicContact CB-CE2 4.46Å; N2-Y6 WeakPolarHBondContact O-CD2 3.3Å; S3-Y6 PolarHBondContact O-N 2.9Å; S3-Y6 VanDerWaalsContact O-N 3.15Å; Y6-T8 PolarHBondContact O-N 3.42Å; Y6-K9 PolarHBondContact O-N 3.3Å; Y6-R49 HydrophobicContact CE1-CG 3.88Å
7	S	54.5	Low	61.6	Low	47 Å²	47	78.6 Å²	78.6	33%	0.329	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.6	178.2	64	0	0	0	0	113.5	S3 S4	S3-S7 PolarHBondContact O-N 3.36Å; S3-S7 VanDerWaalsContact O-N 3.09Å; S4-S7 PolarHBondContact O-OG 3.27Å
8	T	55.3	Low	62.1	Low	112 Å²	112	74.8 Å²	74.8	69%	0.687	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-27	-178.9	61.1	0	0	0	0	113.9	Y6	Y6-T8 PolarHBondContact O-N 3.42Å
9	K	61.2	Low	62.4	Low	126 Å²	126	75 Å²	75	55%	0.548	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-42.2	-173.9	-76.1	-169.3	176.2	-164.4	0	113	Y6 Y48 R49	Y6-K9 PolarHBondContact O-N 3.3Å; K9-Y48 WeakPolarHBondContact CD-O 3.42Å; K9-R49 PolarHBondContact NZ-O 2.85Å
10	I	66.4	Low	62.5	Low	29 Å²	29	78.6 Å²	78.6	15%	0.149	41%	0.412	C	S	.	.	S	Bend	trans	-137.3	88.1	-177.1	-48.7	171.3	0	0	0	109	T13 Y47 Y48	I10-T13 HydrophobicContact CB-CG2 4.39Å; I10-T13 HydrophobicContact CG2-CG2 3.56Å; I10-T13 PolarHBondContact O-OG1 3.15Å; I10-Y47 HydrophobicContact CD1-CD1 3.64Å; I10-Y47 HydrophobicContact CD1-CD2 4.49Å; I10-Y47 HydrophobicContact CD1-CE1 3.36Å; I10-Y47 HydrophobicContact CD1-CE2 4.29Å; I10-Y47 HydrophobicContact CD1-CG 4.23Å; I10-Y48 HydrophobicContact CB-CD1 4.38Å; I10-Y48 HydrophobicContact CB-CE1 4.14Å; I10-Y48 HydrophobicContact CD1-CD1 4.04Å; I10-Y48 HydrophobicContact CD1-CE1 4.24Å; I10-Y48 HydrophobicContact CD1-CG 4.39Å; I10-Y48 HydrophobicContact CG1-CD1 4.5Å
11	P	64.7	Low	62.5	Low	98 Å²	98	79.5 Å²	79.5	64%	0.636	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	156.2	179.8	27.4	-32.9	0	0	0	111.4	T13	P11-T13 PolarHBondContact O-N 3.26Å
12	A	65.4	Low	63.2	Low	67 Å²	67	77.2 Å²	77.2	55%	0.554	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	9.9	174.6	0	0	0	0	0	118	S16 R17	A12-S16 PolarHBondContact N-OG 3.08Å; A12-R17 PolarHBondContact O-NH2 3.29Å
13	T	76.1	Confident	64	Low	5 Å²	5	76.8 Å²	76.8	3%	0.031	43%	0.433	C	S	.	.	S	Bend	trans	-94.6	164.3	175.8	59.9	0	0	0	0	113.2	I10 P11 L15 S16 R17 Y48 L73	I10-T13 HydrophobicContact CB-CG2 4.39Å; I10-T13 HydrophobicContact CG2-CG2 3.56Å; I10-T13 PolarHBondContact O-OG1 3.15Å; P11-T13 PolarHBondContact O-N 3.26Å; T13-L15 PolarHBondContact O-N 3.09Å; T13-S16 PolarHBondContact N-OG 3.23Å; T13-S16 PolarHBondContact O-N 3.15Å; T13-S16 PolarHBondContact O-OG 2.88Å; T13-S16 VanDerWaalsContact OG1-CB 3.3Å; T13-S16 WeakPolarHBondContact OG1-CB 3.47Å; T13-S16 PolarHBondContact OG1-N 3.13Å; T13-S16 PolarHBondContact OG1-OG 3.03Å; T13-R17 WeakPolarHBondContact O-CG 3.25Å; T13-R17 PolarHBondContact O-N 2.88Å; T13-Y48 WeakPolarHBondContact CB-OH 3.17Å; T13-Y48 HydrophobicContact CG2-CE1 4.4Å; T13-Y48 WeakPolarHBondContact CG2-OH 3.5Å; T13-Y48 VanDerWaalsContact OG1-CE1 3.31Å; T13-Y48 WeakPolarHBondContact OG1-CE1 3.49Å; T13-Y48 PolarHBondContact OG1-OH 2.86Å; T13-L73 HydrophobicContact CG2-CD2 3.67Å
14	R	76.2	Confident	65	Low	114 Å²	114	77.6 Å²	77.6	43%	0.43	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-38.4	-177.2	-162.2	-179.1	-67.7	-100.1	2.5	112.8	R17 F70 W71	R14-R17 PolarHBondContact O-N 3.23Å; R14-F70 VanDerWaalsContact CD-CE1 3.41Å; R14-F70 PolarHBondContact NE-O 3.31Å; R14-F70 PolarHBondContact NH2-O 3.19Å; R14-W71 HydrophobicContact CB-CE3 4.37Å; R14-W71 PolarHBondContact N-O 2.88Å
15	L	73.9	Confident	66.2	Low	10 Å²	10	75.9 Å²	75.9	5%	0.052	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-68.6	-32.6	175.9	-80.9	151.1	0	0	0	112.5	T13 R17 L18 F41 I44 Y48 W71	T13-L15 PolarHBondContact O-N 3.09Å; L15-R17 PolarHBondContact O-N 3.18Å; L15-L18 HydrophobicContact CD2-CD1 3.85Å; L15-L18 WeakPolarHBondContact O-CG 3.4Å; L15-F41 HydrophobicContact CD1-CE2 4.09Å; L15-F41 HydrophobicContact CD2-CE2 4.16Å; L15-F41 HydrophobicContact CD2-CZ 4.21Å; L15-I44 HydrophobicContact CD1-CG2 3.65Å; L15-Y48 HydrophobicContact CB-CE1 3.97Å; L15-Y48 HydrophobicContact CB-CE2 4.06Å; L15-Y48 HydrophobicContact CD1-CD2 3.74Å; L15-Y48 HydrophobicContact CD1-CE2 3.25Å; L15-Y48 HydrophobicContact CG-CE2 4.27Å; L15-W71 HydrophobicContact CD1-CD2 4.3Å; L15-W71 HydrophobicContact CD1-CE3 3.69Å; L15-W71 HydrophobicContact CD1-CZ3 4.03Å; L15-W71 HydrophobicContact CD2-CZ3 4.13Å; L15-W71 HydrophobicContact CG-CE3 3.73Å; L15-W71 HydrophobicContact CG-CZ3 3.76Å
16	S	68.9	Low	67.4	Low	20 Å²	20	71.3 Å²	71.3	14%	0.14	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-68.7	-23.5	174.9	74.2	0	0	0	0	113.4	A12 T13	A12-S16 PolarHBondContact N-OG 3.08Å; T13-S16 PolarHBondContact N-OG 3.23Å; T13-S16 PolarHBondContact O-N 3.15Å; T13-S16 PolarHBondContact O-OG 2.88Å; T13-S16 VanDerWaalsContact OG1-CB 3.3Å; T13-S16 WeakPolarHBondContact OG1-CB 3.47Å; T13-S16 PolarHBondContact OG1-N 3.13Å; T13-S16 PolarHBondContact OG1-OG 3.03Å
17	R	71.6	Confident	68.6	Low	160 Å²	160	73.8 Å²	73.8	60%	0.604	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-97.6	9.8	-177.2	-66.6	179.8	-176.1	148.7	4.3	113.8	A12 T13 R14 L15 T19	A12-R17 PolarHBondContact O-NH2 3.29Å; T13-R17 WeakPolarHBondContact O-CG 3.25Å; T13-R17 PolarHBondContact O-N 2.88Å; R14-R17 PolarHBondContact O-N 3.23Å; L15-R17 PolarHBondContact O-N 3.18Å; R17-T19 PolarHBondContact O-N 3.4Å; R17-T19 VanDerWaalsContact O-N 3.13Å
18	L	69.8	Low	69.8	Low	9 Å²	9	77.7 Å²	77.7	5%	0.047	44%	0.442	C	S	.	.			trans	-63.5	117	178.4	-66.8	178.6	0	0	0	110.3	L15 L22 Y32 F34	L15-L18 HydrophobicContact CD2-CD1 3.85Å; L15-L18 WeakPolarHBondContact O-CG 3.4Å; L18-L22 HydrophobicContact CD2-CD2 3.74Å; L18-Y32 HydrophobicContact CB-CE1 4.32Å; L18-Y32 HydrophobicContact CD1-CD2 4.49Å; L18-Y32 HydrophobicContact CD2-CD1 4.22Å; L18-Y32 HydrophobicContact CD2-CE1 4.22Å; L18-F34 HydrophobicContact CD2-CZ 3.88Å
19	T	68.1	Low	71	Confident	79 Å²	79	77.4 Å²	77.4	49%	0.485	44%	0.435	S	S	.	.			trans	-122	158.7	173.6	54.3	0	0	0	0	108.5	R17 A21 L22 Y32	R17-T19 PolarHBondContact O-N 3.4Å; R17-T19 VanDerWaalsContact O-N 3.13Å; T19-A21 PolarHBondContact O-N 2.73Å; T19-L22 WeakPolarHBondContact O-CB 3.43Å; T19-L22 PolarHBondContact O-N 3.21Å; T19-Y32 VanDerWaalsContact C-OH 3.26Å; T19-Y32 PolarHBondContact O-OH 3.46Å; T19-Y32 VanDerWaalsContact O-OH 3.08Å
20	E	65.2	Low	71.9	Confident	147 Å²	147	76.8 Å²	76.8	69%	0.687	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.5	175.8	-66.3	174.5	-173.1	0	0	112.2	L22 Y25	E20-L22 PolarHBondContact O-N 3.28Å; E20-Y25 HydrophobicContact CB-CD1 4.07Å; E20-Y25 HydrophobicContact CB-CE1 4Å; E20-Y25 HydrophobicContact CG-CD1 4.42Å; E20-Y25 HydrophobicContact CG-CE1 3.97Å; E20-Y25 WeakPolarHBondContact O-CD1 3.42Å
21	A	61	Low	72.7	Confident	97 Å²	97	80 Å²	80	80%	0.802	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-3	177	0	0	0	0	0	114.1	T19	T19-A21 PolarHBondContact O-N 2.73Å
22	L	66.4	Low	73.4	Confident	65 Å²	65	77.7 Å²	77.7	34%	0.34	43%	0.432	S	S	.	.	S	Bend	trans	-78.6	137.1	-179.1	-155	74	0	0	0	110.5	L18 T19 E20 N24 Y25	L18-L22 HydrophobicContact CD2-CD2 3.74Å; T19-L22 WeakPolarHBondContact O-CB 3.43Å; T19-L22 PolarHBondContact O-N 3.21Å; E20-L22 PolarHBondContact O-N 3.28Å; L22-N24 PolarHBondContact O-N 3.37Å; L22-Y25 WeakPolarHBondContact O-CB 3.44Å; L22-Y25 PolarHBondContact O-N 3.07Å
23	A	67.4	Low	74.1	Confident	104 Å²	104	81.2 Å²	81.2	86%	0.86	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-13.6	-175.1	0	0	0	0	0	115.8
24	N	74	Confident	74.4	Confident	64 Å²	64	83 Å²	83	34%	0.342	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	1	-177.7	-68.9	20.1	0	0	0	113.1	L22 Y32 F33 F34	L22-N24 PolarHBondContact O-N 3.37Å; N24-Y32 CarbonylContact O-C 3.58Å; N24-Y32 WeakPolarHBondContact O-CA 3.39Å; N24-F33 WeakPolarHBondContact CB-O 3.36Å; N24-F33 PolarHBondContact ND2-O 3Å; N24-F33 PolarHBondContact O-N 3.31Å; N24-F34 HydrophobicContact CB-CE1 4.35Å; N24-F34 WeakPolarHBondContact ND2-CD1 3.46Å; N24-F34 VanDerWaalsContact ND2-CE1 3.31Å; N24-F34 WeakPolarHBondContact ND2-CE1 3.48Å
25	Y	77.2	Confident	74.7	Confident	41 Å²	41	84.5 Å²	84.5	16%	0.161	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.8	179.9	-178.3	-116.2	0	0	0	110.7	E20 L22 P27 N30 E31 Y32	E20-Y25 HydrophobicContact CB-CD1 4.07Å; E20-Y25 HydrophobicContact CB-CE1 4Å; E20-Y25 HydrophobicContact CG-CD1 4.42Å; E20-Y25 HydrophobicContact CG-CE1 3.97Å; E20-Y25 WeakPolarHBondContact O-CD1 3.42Å; L22-Y25 WeakPolarHBondContact O-CB 3.44Å; L22-Y25 PolarHBondContact O-N 3.07Å; Y25-P27 HydrophobicContact CE1-CB 4.14Å; Y25-P27 WeakPolarHBondContact O-CD 3.37Å; Y25-N30 PolarHBondContact OH-OD1 3.29Å; Y25-E31 WeakPolarHBondContact CD2-O 3.35Å; Y25-Y32 HydrophobicContact CD2-CD1 4.03Å; Y25-Y32 HydrophobicContact CD2-CD2 4.12Å; Y25-Y32 AromaticContact CD2-CE1 3.71Å; Y25-Y32 HydrophobicContact CD2-CE1 3.71Å; Y25-Y32 AromaticContact CD2-CE2 3.8Å; Y25-Y32 HydrophobicContact CD2-CE2 3.8Å; Y25-Y32 HydrophobicContact CD2-CG 4.23Å; Y25-Y32 AromaticContact CD2-CZ 3.58Å; Y25-Y32 HydrophobicContact CE2-CE2 4.23Å; Y25-Y32 HydrophobicContact CG-CD1 4.43Å; Y25-Y32 AromaticContact CG-CE1 3.99Å; Y25-Y32 HydrophobicContact CG-CE1 3.99Å
26	D	78.3	Confident	75.4	Confident	57 Å²	57	87.1 Å²	87.1	31%	0.305	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	109.8	170.2	-174.8	-11.6	0	0	0	109.3	V28 N30 E31	D26-V28 VanDerWaalsContact C-N 3.26Å; D26-V28 PolarHBondContact O-N 3.47Å; D26-V28 WeakPolarHBondContact OD1-CB 3.35Å; D26-V28 PolarHBondContact OD1-N 3.27Å; D26-N30 VanDerWaalsContact O-CA 3.3Å; D26-N30 WeakPolarHBondContact O-CA 3.49Å; D26-N30 PolarHBondContact O-N 3.06Å; D26-E31 HydrophobicContact CB-CG 4.4Å; D26-E31 PolarHBondContact N-O 3.42Å; D26-E31 PolarHBondContact O-N 3.46Å
27	P	78	Confident	76.2	Confident	98 Å²	98	89.2 Å²	89.2	64%	0.636	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.1	-178.6	29.6	-35.2	0	0	0	113.4	Y25	Y25-P27 HydrophobicContact CE1-CB 4.14Å; Y25-P27 WeakPolarHBondContact O-CD 3.37Å
28	V	81.3	Confident	76.9	Confident	129 Å²	129	86.4 Å²	86.4	78%	0.782	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-44.9	-178.4	-177.9	0	0	0	0	110.4	D26	D26-V28 VanDerWaalsContact C-N 3.26Å; D26-V28 PolarHBondContact O-N 3.47Å; D26-V28 WeakPolarHBondContact OD1-CB 3.35Å; D26-V28 PolarHBondContact OD1-N 3.27Å
29	L	80.4	Confident	77.8	Confident	106 Å²	106	87.7 Å²	87.7	56%	0.555	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.2	179.3	-63.5	178.8	0	0	0	112.9	E31	L29-E31 VanDerWaalsContact C-N 3.27Å; L29-E31 HydrophobicContact CB-CG 3.76Å; L29-E31 VanDerWaalsContact CD1-OE1 3.25Å; L29-E31 WeakPolarHBondContact CD1-OE1 3.3Å; L29-E31 PolarHBondContact O-N 3.04Å
30	N	79.9	Confident	78.8	Confident	113 Å²	113	84 Å²	84	60%	0.604	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	44.7	-174.8	-171.6	8.5	0	0	0	111.8	Y25 D26	Y25-N30 PolarHBondContact OH-OD1 3.29Å; D26-N30 VanDerWaalsContact O-CA 3.3Å; D26-N30 WeakPolarHBondContact O-CA 3.49Å; D26-N30 PolarHBondContact O-N 3.06Å
31	E	82.3	Confident	79.9	Confident	96 Å²	96	79.2 Å²	79.2	45%	0.449	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	163.9	-177.1	73.1	-177.4	-176.7	0	0	112.4	Y25 D26 L29	Y25-E31 WeakPolarHBondContact CD2-O 3.35Å; D26-E31 HydrophobicContact CB-CG 4.4Å; D26-E31 PolarHBondContact N-O 3.42Å; D26-E31 PolarHBondContact O-N 3.46Å; L29-E31 VanDerWaalsContact C-N 3.27Å; L29-E31 HydrophobicContact CB-CG 3.76Å; L29-E31 VanDerWaalsContact CD1-OE1 3.25Å; L29-E31 WeakPolarHBondContact CD1-OE1 3.3Å; L29-E31 PolarHBondContact O-N 3.04Å
32	Y	79.1	Confident	81.2	Confident	51 Å²	51	76.8 Å²	76.8	20%	0.2	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.8	175.8	-69.9	-88.1	0	0	0	109.3	L18 T19 N24 Y25	L18-Y32 HydrophobicContact CB-CE1 4.32Å; L18-Y32 HydrophobicContact CD1-CD2 4.49Å; L18-Y32 HydrophobicContact CD2-CD1 4.22Å; L18-Y32 HydrophobicContact CD2-CE1 4.22Å; T19-Y32 VanDerWaalsContact C-OH 3.26Å; T19-Y32 PolarHBondContact O-OH 3.46Å; T19-Y32 VanDerWaalsContact O-OH 3.08Å; N24-Y32 CarbonylContact O-C 3.58Å; N24-Y32 WeakPolarHBondContact O-CA 3.39Å; Y25-Y32 HydrophobicContact CD2-CD1 4.03Å; Y25-Y32 HydrophobicContact CD2-CD2 4.12Å; Y25-Y32 AromaticContact CD2-CE1 3.71Å; Y25-Y32 HydrophobicContact CD2-CE1 3.71Å; Y25-Y32 AromaticContact CD2-CE2 3.8Å; Y25-Y32 HydrophobicContact CD2-CE2 3.8Å; Y25-Y32 HydrophobicContact CD2-CG 4.23Å; Y25-Y32 AromaticContact CD2-CZ 3.58Å; Y25-Y32 HydrophobicContact CE2-CE2 4.23Å; Y25-Y32 HydrophobicContact CG-CD1 4.43Å; Y25-Y32 AromaticContact CG-CE1 3.99Å; Y25-Y32 HydrophobicContact CG-CE1 3.99Å
33	F	80.4	Confident	82.3	Confident	140 Å²	140	76.1 Å²	76.1	61%	0.614	42%	0.419	S	S	*	.			trans	-100.2	129	178	-174.9	-99.5	0	0	0	111.6	N24 D35	N24-F33 WeakPolarHBondContact CB-O 3.36Å; N24-F33 PolarHBondContact ND2-O 3Å; N24-F33 PolarHBondContact O-N 3.31Å; F33-D35 HydrophobicContact CE1-CB 4.01Å; F33-D35 HydrophobicContact CZ-CB 4.43Å
34	F	82.3	Confident	83.3	Confident	42 Å²	42	71.2 Å²	71.2	18%	0.184	38%	0.378	C	S	.	.			trans	-132.1	117.9	173.4	-62.6	-80.4	0	0	0	109.5	L18 N24 R36 W71	L18-F34 HydrophobicContact CD2-CZ 3.88Å; N24-F34 HydrophobicContact CB-CE1 4.35Å; N24-F34 WeakPolarHBondContact ND2-CD1 3.46Å; N24-F34 VanDerWaalsContact ND2-CE1 3.31Å; N24-F34 WeakPolarHBondContact ND2-CE1 3.48Å; F34-R36 VanDerWaalsContact C-N 3.32Å; F34-R36 HydrophobicContact CB-CG 4.29Å; F34-R36 PolarHBondContact O-N 3.19Å; F34-W71 HydrophobicContact CB-CH2 4.27Å; F34-W71 AromaticContact CD1-CH2 3.75Å; F34-W71 HydrophobicContact CD1-CH2 3.75Å; F34-W71 HydrophobicContact CD1-CZ3 4.34Å; F34-W71 AromaticContact CD2-CH2 3.85Å; F34-W71 HydrophobicContact CD2-CH2 3.85Å; F34-W71 HydrophobicContact CE1-CH2 4.01Å; F34-W71 HydrophobicContact CE1-CZ3 4.15Å; F34-W71 HydrophobicContact CE2-CH2 4.09Å; F34-W71 HydrophobicContact CE2-CZ3 4.39Å; F34-W71 AromaticContact CG-CH2 3.69Å; F34-W71 HydrophobicContact CG-CH2 3.69Å; F34-W71 HydrophobicContact CG-CZ2 4.45Å; F34-W71 HydrophobicContact CZ-CH2 4.19Å; F34-W71 HydrophobicContact CZ-CZ3 4.19Å
35	D	84.3	Confident	83.9	Confident	147 Å²	147	69 Å²	69	79%	0.786	37%	0.366	S	S	*	.			trans	-81.7	76.6	175.8	-171.4	17.8	0	0	0	110.7	F33	F33-D35 HydrophobicContact CE1-CB 4.01Å; F33-D35 HydrophobicContact CZ-CB 4.43Å
36	R	86.7	Confident	84.3	Confident	65 Å²	65	69.9 Å²	69.9	25%	0.245	37%	0.374	C	S	.	.	S	Bend	trans	-147.2	168.4	-167.8	-64.9	-67.5	-80.1	-73	-29.8	112.3	F34 P38 E67	F34-R36 VanDerWaalsContact C-N 3.32Å; F34-R36 HydrophobicContact CB-CG 4.29Å; F34-R36 PolarHBondContact O-N 3.19Å; R36-P38 WeakPolarHBondContact O-CD 3.3Å; R36-P38 VanDerWaalsContact O-N 3.07Å; R36-E67 IonicContact CZ-OE1 3.38Å; R36-E67 IonicContact CZ-OE2 3.61Å; R36-E67 VanDerWaalsContact NE-CD 3.34Å; R36-E67 IonicContact NE-OE1 3.19Å; R36-E67 PolarHBondContact NE-OE1 2.67Å; R36-E67 IonicContact NE-OE2 2.75Å; R36-E67 PolarHBondContact NE-OE2 3.4Å; R36-E67 IonicContact NH2-OE1 2.7Å; R36-E67 IonicContact NH2-OE2 3.22Å; R36-E67 PolarHBondContact NH2-OE2 3.22Å
37	H	87.1	Confident	84.8	Confident	63 Å²	63	68.2 Å²	68.2	29%	0.292	36%	0.364	S	S	.	.			trans	-64.7	110.4	-174.2	-161.7	-68.2	0	0	0	111.7	A39 V40 F41	H37-A39 PolarHBondContact ND1-N 3.46Å; H37-A39 PolarHBondContact O-N 3.04Å; H37-V40 HydrophobicContact CB-CB 4.28Å; H37-V40 HydrophobicContact CB-CG2 4.16Å; H37-V40 PolarHBondContact O-N 3.23Å; H37-F41 PolarHBondContact O-N 3.28Å; H37-F41 VanDerWaalsContact O-N 3.15Å
38	P	86.6	Confident	85	Confident	102 Å²	102	63.6 Å²	63.6	66%	0.662	33%	0.334	S	S	*	.	H	α-helix	trans	-67.4	-35.7	-169.2	25.5	-33.7	0	0	0	112.5	R36 F41 A42	R36-P38 WeakPolarHBondContact O-CD 3.3Å; R36-P38 VanDerWaalsContact O-N 3.07Å; P38-F41 PolarHBondContact O-N 2.9Å; P38-A42 PolarHBondContact O-N 3.06Å
39	A	87.1	Confident	85.2	Confident	36 Å²	36	63.2 Å²	63.2	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-67	-37.8	179.7	0	0	0	0	0	113	H37 A42	H37-A39 PolarHBondContact ND1-N 3.46Å; H37-A39 PolarHBondContact O-N 3.04Å; A39-A42 WeakPolarHBondContact O-CB 3.36Å; A39-A42 PolarHBondContact O-N 3.41Å
40	V	89.8	Confident	85.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-70.7	-40.2	178.1	176.5	0	0	0	0	109.7	H37 A42 Q43 I44 P56 V59 F64 E67	H37-V40 HydrophobicContact CB-CB 4.28Å; H37-V40 HydrophobicContact CB-CG2 4.16Å; H37-V40 PolarHBondContact O-N 3.23Å; V40-A42 PolarHBondContact O-N 3.3Å; V40-Q43 WeakPolarHBondContact O-CB 3.31Å; V40-Q43 PolarHBondContact O-N 2.81Å; V40-I44 HydrophobicContact CG1-CD1 3.78Å; V40-I44 PolarHBondContact O-N 3.39Å; V40-I44 VanDerWaalsContact O-N 3.1Å; V40-P56 HydrophobicContact CG2-CG 4.39Å; V40-V59 HydrophobicContact CG2-CB 4.35Å; V40-V59 HydrophobicContact CG2-CG1 3.96Å; V40-V59 HydrophobicContact CG2-CG2 3.88Å; V40-F64 HydrophobicContact CG1-CD2 3.54Å; V40-F64 HydrophobicContact CG1-CE2 3.85Å; V40-F64 HydrophobicContact CG2-CD2 4.43Å; V40-E67 HydrophobicContact CB-CG 4.16Å; V40-E67 HydrophobicContact CG1-CB 3.57Å; V40-E67 HydrophobicContact CG1-CG 3.74Å
41	F	89.5	Confident	85.7	Confident	47 Å²	47	58.9 Å²	58.9	21%	0.206	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-34.6	176.6	-175.2	-107.5	0	0	0	113	M1 L15 H37 P38 Q43 I44 L45 W71	M1-F41 HydrophobicContact CE-CE1 3.99Å; M1-F41 HydrophobicContact CE-CZ 3.99Å; L15-F41 HydrophobicContact CD1-CE2 4.09Å; L15-F41 HydrophobicContact CD2-CE2 4.16Å; L15-F41 HydrophobicContact CD2-CZ 4.21Å; H37-F41 PolarHBondContact O-N 3.28Å; H37-F41 VanDerWaalsContact O-N 3.15Å; P38-F41 PolarHBondContact O-N 2.9Å; F41-Q43 VanDerWaalsContact C-N 3.27Å; F41-Q43 PolarHBondContact O-N 3.31Å; F41-I44 PolarHBondContact O-N 3.08Å; F41-L45 WeakPolarHBondContact O-CB 3.39Å; F41-L45 PolarHBondContact O-N 2.78Å; F41-W71 AromaticContact CD2-CE2 3.84Å; F41-W71 AromaticContact CD2-CH2 3.8Å; F41-W71 HydrophobicContact CD2-CH2 3.8Å; F41-W71 AromaticContact CD2-CZ2 3.39Å; F41-W71 HydrophobicContact CD2-CZ2 3.39Å; F41-W71 AromaticContact CE2-CH2 3.49Å; F41-W71 HydrophobicContact CE2-CH2 3.49Å; F41-W71 VanDerWaalsContact CE2-CH2 3.49Å; F41-W71 AromaticContact CE2-CZ2 3.61Å; F41-W71 HydrophobicContact CE2-CZ2 3.61Å; F41-W71 AromaticContact CE2-CZ3 3.99Å; F41-W71 HydrophobicContact CE2-CZ3 3.99Å; F41-W71 HydrophobicContact CG-CZ2 4.49Å
42	A	88.4	Confident	85.9	Confident	46 Å²	46	59.5 Å²	59.5	38%	0.38	31%	0.31	S	S	.	.	H	α-helix	trans	-58.3	-39.5	174.1	0	0	0	0	0	112.3	P38 A39 V40 N46	P38-A42 PolarHBondContact O-N 3.06Å; A39-A42 WeakPolarHBondContact O-CB 3.36Å; A39-A42 PolarHBondContact O-N 3.41Å; V40-A42 PolarHBondContact O-N 3.3Å; A42-N46 WeakPolarHBondContact O-CB 3.14Å; A42-N46 VanDerWaalsContact O-CG 3.24Å; A42-N46 PolarHBondContact O-N 2.9Å; A42-N46 PolarHBondContact O-ND2 3.4Å
43	Q	88.6	Confident	86.4	Confident	52 Å²	52	57.1 Å²	57.1	24%	0.243	30%	0.3	C	S	.	.	H	α-helix	trans	-72.6	-39.4	177.2	-59	-58	-1.5	0	0	112.8	V40 F41 L45 N46 Y47 P56	V40-Q43 WeakPolarHBondContact O-CB 3.31Å; V40-Q43 PolarHBondContact O-N 2.81Å; F41-Q43 VanDerWaalsContact C-N 3.27Å; F41-Q43 PolarHBondContact O-N 3.31Å; Q43-L45 VanDerWaalsContact C-N 3.32Å; Q43-L45 PolarHBondContact O-N 2.76Å; Q43-N46 WeakPolarHBondContact O-CB 3.37Å; Q43-N46 PolarHBondContact O-N 3.07Å; Q43-Y47 PolarHBondContact O-N 3.34Å; Q43-P56 HydrophobicContact CG-CB 4.15Å; Q43-P56 HydrophobicContact CG-CG 4.39Å
44	I	88.6	Confident	86.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-48.4	172.9	-68.8	150.6	0	0	0	109.6	L15 V40 F41 N46 Y47 Y48 E67 W71 L73	L15-I44 HydrophobicContact CD1-CG2 3.65Å; V40-I44 HydrophobicContact CG1-CD1 3.78Å; V40-I44 PolarHBondContact O-N 3.39Å; V40-I44 VanDerWaalsContact O-N 3.1Å; F41-I44 PolarHBondContact O-N 3.08Å; I44-N46 VanDerWaalsContact C-N 3.32Å; I44-N46 PolarHBondContact O-N 2.89Å; I44-Y47 WeakPolarHBondContact O-CA 2.9Å; I44-Y47 VanDerWaalsContact O-CB 3.29Å; I44-Y47 WeakPolarHBondContact O-CB 3.31Å; I44-Y47 PolarHBondContact O-N 3.25Å; I44-Y47 VanDerWaalsContact O-N 3.07Å; I44-Y48 HydrophobicContact CG2-CD2 4.14Å; I44-Y48 HydrophobicContact CG2-CE2 3.73Å; I44-Y48 WeakPolarHBondContact O-CD2 3.29Å; I44-Y48 PolarHBondContact O-N 2.98Å; I44-Y48 VanDerWaalsContact O-N 3.13Å; I44-E67 HydrophobicContact CD1-CB 4.4Å; I44-W71 HydrophobicContact CD1-CG 3.97Å; I44-W71 VanDerWaalsContact CD1-NE1 3.32Å; I44-W71 HydrophobicContact CG2-CB 4.36Å; I44-W71 HydrophobicContact CG2-CD2 4.42Å; I44-W71 HydrophobicContact CG2-CG 4.1Å; I44-L73 HydrophobicContact CG1-CD1 4.28Å; I44-L73 HydrophobicContact CG2-CD1 4.02Å
45	L	85.7	Confident	87.2	Confident	18 Å²	18	52.5 Å²	52.5	9%	0.094	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-39.3	178.7	-174.8	60.1	0	0	0	112.2	M1 F41 Q43 Y47 Y48 R49	M1-L45 HydrophobicContact CE-CD1 3.54Å; M1-L45 HydrophobicContact CE-CD2 3.6Å; M1-L45 HydrophobicContact CE-CG 4.21Å; M1-L45 HydrophobicContact SD-CD1 4.07Å; F41-L45 WeakPolarHBondContact O-CB 3.39Å; F41-L45 PolarHBondContact O-N 2.78Å; Q43-L45 VanDerWaalsContact C-N 3.32Å; Q43-L45 PolarHBondContact O-N 2.76Å; L45-Y47 VanDerWaalsContact C-N 3.3Å; L45-Y47 PolarHBondContact O-N 3.42Å; L45-Y48 PolarHBondContact O-N 3.13Å; L45-R49 VanDerWaalsContact CD2-CZ 3.49Å; L45-R49 VanDerWaalsContact CD2-NH2 3.34Å; L45-R49 VanDerWaalsContact O-CG 3.3Å; L45-R49 WeakPolarHBondContact O-CG 3.46Å; L45-R49 PolarHBondContact O-N 3.27Å
46	N	86.2	Confident	87.4	Confident	60 Å²	60	45.7 Å²	45.7	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-41.3	172.5	-75.4	-21.3	0	0	0	111.4	A42 Q43 I44 Y48 R49 T50	A42-N46 WeakPolarHBondContact O-CB 3.14Å; A42-N46 VanDerWaalsContact O-CG 3.24Å; A42-N46 PolarHBondContact O-N 2.9Å; A42-N46 PolarHBondContact O-ND2 3.4Å; Q43-N46 WeakPolarHBondContact O-CB 3.37Å; Q43-N46 PolarHBondContact O-N 3.07Å; I44-N46 VanDerWaalsContact C-N 3.32Å; I44-N46 PolarHBondContact O-N 2.89Å; N46-Y48 PolarHBondContact O-N 3.46Å; N46-R49 CarbonylContact O-C 3.49Å; N46-R49 WeakPolarHBondContact O-CA 3.48Å; N46-R49 WeakPolarHBondContact O-CB 3.48Å; N46-R49 PolarHBondContact O-N 3.1Å; N46-T50 PolarHBondContact O-N 2.97Å; N46-T50 PolarHBondContact O-OG1 3.24Å
47	Y	87.8	Confident	87.2	Confident	21 Å²	21	48.9 Å²	48.9	8%	0.082	27%	0.271	C	S	.	.	H	α-helix	trans	-58.8	-44.2	174.8	178.3	-127.6	0	0	0	112.6	I10 Q43 I44 L45 R49 G51 K52 L53 L73	I10-Y47 HydrophobicContact CD1-CD1 3.64Å; I10-Y47 HydrophobicContact CD1-CD2 4.49Å; I10-Y47 HydrophobicContact CD1-CE1 3.36Å; I10-Y47 HydrophobicContact CD1-CE2 4.29Å; I10-Y47 HydrophobicContact CD1-CG 4.23Å; Q43-Y47 PolarHBondContact O-N 3.34Å; I44-Y47 WeakPolarHBondContact O-CA 2.9Å; I44-Y47 VanDerWaalsContact O-CB 3.29Å; I44-Y47 WeakPolarHBondContact O-CB 3.31Å; I44-Y47 PolarHBondContact O-N 3.25Å; I44-Y47 VanDerWaalsContact O-N 3.07Å; L45-Y47 VanDerWaalsContact C-N 3.3Å; L45-Y47 PolarHBondContact O-N 3.42Å; Y47-R49 PolarHBondContact O-N 3.35Å; Y47-G51 VanDerWaalsContact CD2-C 3.47Å; Y47-G51 VanDerWaalsContact CE2-O 3.3Å; Y47-G51 WeakPolarHBondContact CE2-O 3.3Å; Y47-G51 WeakPolarHBondContact O-CA 3.19Å; Y47-G51 PolarHBondContact O-N 3.41Å; Y47-K52 VanDerWaalsContact CD2-C 3.41Å; Y47-L53 HydrophobicContact CD1-CB 4.44Å; Y47-L53 HydrophobicContact CD1-CD1 4.28Å; Y47-L53 HydrophobicContact CD2-CB 3.56Å; Y47-L53 VanDerWaalsContact CD2-N 3.35Å; Y47-L53 HydrophobicContact CE2-CB 3.89Å; Y47-L53 HydrophobicContact CG-CB 3.83Å; Y47-L53 HydrophobicContact CG-CD1 3.97Å; Y47-L53 HydrophobicContact CG-CG 4.44Å; Y47-L73 HydrophobicContact CD1-CD1 3.68Å; Y47-L73 HydrophobicContact CD1-CD2 3.99Å; Y47-L73 HydrophobicContact CD1-CG 4.44Å; Y47-L73 HydrophobicContact CE1-CD1 4.14Å; Y47-L73 HydrophobicContact CE1-CD2 3.75Å; Y47-L73 HydrophobicContact CE1-CG 4.47Å
48	Y	83.2	Confident	87.1	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-30.1	173.6	-75.2	-88.8	0	0	0	113.3	K9 I10 T13 L15 I44 L45 N46 L73	K9-Y48 WeakPolarHBondContact CD-O 3.42Å; I10-Y48 HydrophobicContact CB-CD1 4.38Å; I10-Y48 HydrophobicContact CB-CE1 4.14Å; I10-Y48 HydrophobicContact CD1-CD1 4.04Å; I10-Y48 HydrophobicContact CD1-CE1 4.24Å; I10-Y48 HydrophobicContact CD1-CG 4.39Å; I10-Y48 HydrophobicContact CG1-CD1 4.5Å; T13-Y48 WeakPolarHBondContact CB-OH 3.17Å; T13-Y48 HydrophobicContact CG2-CE1 4.4Å; T13-Y48 WeakPolarHBondContact CG2-OH 3.5Å; T13-Y48 VanDerWaalsContact OG1-CE1 3.31Å; T13-Y48 WeakPolarHBondContact OG1-CE1 3.49Å; T13-Y48 PolarHBondContact OG1-OH 2.86Å; L15-Y48 HydrophobicContact CB-CE1 3.97Å; L15-Y48 HydrophobicContact CB-CE2 4.06Å; L15-Y48 HydrophobicContact CD1-CD2 3.74Å; L15-Y48 HydrophobicContact CD1-CE2 3.25Å; L15-Y48 HydrophobicContact CG-CE2 4.27Å; I44-Y48 HydrophobicContact CG2-CD2 4.14Å; I44-Y48 HydrophobicContact CG2-CE2 3.73Å; I44-Y48 WeakPolarHBondContact O-CD2 3.29Å; I44-Y48 PolarHBondContact O-N 2.98Å; I44-Y48 VanDerWaalsContact O-N 3.13Å; L45-Y48 PolarHBondContact O-N 3.13Å; N46-Y48 PolarHBondContact O-N 3.46Å; Y48-L73 HydrophobicContact CE2-CD1 4.4Å; Y48-L73 HydrophobicContact CE2-CD2 4.3Å
49	R	84.8	Confident	87	Confident	120 Å²	120	47.3 Å²	47.3	45%	0.453	26%	0.26	S	S	.	.	H	α-helix	trans	-78.8	-48.2	-179.4	-72	169	175.3	169.9	-4.1	112.1	Y6 K9 L45 N46 Y47	Y6-R49 HydrophobicContact CE1-CG 3.88Å; K9-R49 PolarHBondContact NZ-O 2.85Å; L45-R49 VanDerWaalsContact CD2-CZ 3.49Å; L45-R49 VanDerWaalsContact CD2-NH2 3.34Å; L45-R49 VanDerWaalsContact O-CG 3.3Å; L45-R49 WeakPolarHBondContact O-CG 3.46Å; L45-R49 PolarHBondContact O-N 3.27Å; N46-R49 CarbonylContact O-C 3.49Å; N46-R49 WeakPolarHBondContact O-CA 3.48Å; N46-R49 WeakPolarHBondContact O-CB 3.48Å; N46-R49 PolarHBondContact O-N 3.1Å; Y47-R49 PolarHBondContact O-N 3.35Å
50	T	86	Confident	86.9	Confident	87 Å²	87	49.2 Å²	49.2	53%	0.534	27%	0.27	S	S	.	.	H	α-helix	trans	-98.5	-22.9	-170.9	64.7	0	0	0	0	112.9	N46 K52	N46-T50 PolarHBondContact O-N 2.97Å; N46-T50 PolarHBondContact O-OG1 3.24Å; T50-K52 VanDerWaalsContact C-N 3.26Å; T50-K52 PolarHBondContact OG1-N 3.42Å; T50-K52 VanDerWaalsContact OG1-N 3.08Å; T50-K52 PolarHBondContact OG1-O 3.25Å
51	G	84.2	Confident	86.6	Confident	41 Å²	41	49.4 Å²	49.4	42%	0.423	27%	0.272	S	S	.	.	S	Bend	trans	77.8	7.4	-168.6	0	0	0	0	0	113.8	Y47	Y47-G51 VanDerWaalsContact CD2-C 3.47Å; Y47-G51 VanDerWaalsContact CE2-O 3.3Å; Y47-G51 WeakPolarHBondContact CE2-O 3.3Å; Y47-G51 WeakPolarHBondContact O-CA 3.19Å; Y47-G51 PolarHBondContact O-N 3.41Å
52	K	88	Confident	86.3	Confident	110 Å²	110	49.9 Å²	49.9	48%	0.478	28%	0.28	S	S	.	.			trans	-119.8	121.5	-177.6	-61.5	-167.1	175.5	-170	0	111.7	Y47 T50 E79	Y47-K52 VanDerWaalsContact CD2-C 3.41Å; T50-K52 VanDerWaalsContact C-N 3.26Å; T50-K52 PolarHBondContact OG1-N 3.42Å; T50-K52 VanDerWaalsContact OG1-N 3.08Å; T50-K52 PolarHBondContact OG1-O 3.25Å; K52-E79 HydrophobicContact CB-CG 3.92Å; K52-E79 HydrophobicContact CG-CG 4.46Å; K52-E79 WeakPolarHBondContact CG-OE1 3.46Å
53	L	89.6	Confident	86.3	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-98.1	116.9	-176	-176.7	66	0	0	0	110	Y47 F64 L68 V78 E79	Y47-L53 HydrophobicContact CD1-CB 4.44Å; Y47-L53 HydrophobicContact CD1-CD1 4.28Å; Y47-L53 HydrophobicContact CD2-CB 3.56Å; Y47-L53 VanDerWaalsContact CD2-N 3.35Å; Y47-L53 HydrophobicContact CE2-CB 3.89Å; Y47-L53 HydrophobicContact CG-CB 3.83Å; Y47-L53 HydrophobicContact CG-CD1 3.97Å; Y47-L53 HydrophobicContact CG-CG 4.44Å; L53-F64 HydrophobicContact CD1-CZ 4.19Å; L53-F64 HydrophobicContact CG-CZ 4.41Å; L53-L68 HydrophobicContact CD1-CD2 4.12Å; L53-L68 HydrophobicContact CD2-CD1 4.15Å; L53-L68 HydrophobicContact CD2-CD2 3.84Å; L53-V78 HydrophobicContact CD2-CG2 3.73Å; L53-V78 HydrophobicContact CG-CG2 4.15Å; L53-V78 WeakPolarHBondContact O-CA 3.36Å; L53-E79 PolarHBondContact O-N 2.97Å
54	H	90.4	Very high	86.3	Confident	65 Å²	65	47.7 Å²	47.7	30%	0.301	26%	0.263	S	S	.	.			trans	-111.5	143	179.5	-66.7	-75.2	0	0	0	111.2	C81	H54-C81 PolarHBondContact ND1-SG 3.15Å; H54-C81 VanDerWaalsContact ND1-SG 3.42Å
55	Y	88.6	Confident	86.2	Confident	19 Å²	19	50.1 Å²	50.1	8%	0.075	28%	0.275	C	S	.	.			trans	-81.9	128.1	178.5	-176.5	-92.3	0	0	0	111.1	V59 G61 F64 C82 T85 Y86	Y55-V59 PolarHBondContact OH-O 2.7Å; Y55-G61 VanDerWaalsContact OH-CA 3.23Å; Y55-G61 WeakPolarHBondContact OH-CA 3.36Å; Y55-G61 PolarHBondContact OH-N 3.19Å; Y55-F64 HydrophobicContact CD2-CB 4.35Å; Y55-F64 AromaticContact CD2-CD1 3.47Å; Y55-F64 HydrophobicContact CD2-CD1 3.47Å; Y55-F64 VanDerWaalsContact CD2-CD1 3.47Å; Y55-F64 AromaticContact CD2-CE1 3.82Å; Y55-F64 HydrophobicContact CD2-CE1 3.82Å; Y55-F64 AromaticContact CD2-CG 3.94Å; Y55-F64 HydrophobicContact CD2-CG 3.94Å; Y55-F64 HydrophobicContact CE2-CB 3.79Å; Y55-F64 AromaticContact CE2-CD1 3.75Å; Y55-F64 HydrophobicContact CE2-CD1 3.75Å; Y55-F64 AromaticContact CE2-CG 3.89Å; Y55-F64 HydrophobicContact CE2-CG 3.89Å; Y55-C82 PolarHBondContact N-SG 2.98Å; Y55-T85 HydrophobicContact CD1-CG2 3.8Å; Y55-T85 HydrophobicContact CE1-CG2 3.69Å; Y55-Y86 AromaticContact CD2-CD2 3.69Å; Y55-Y86 HydrophobicContact CD2-CD2 3.69Å; Y55-Y86 HydrophobicContact CD2-CG 4.19Å; Y55-Y86 AromaticContact CE2-CD2 3.81Å; Y55-Y86 HydrophobicContact CE2-CD2 3.81Å
56	P	88.1	Confident	86.4	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.026	30%	0.299	C	S	.	.			trans	-74.3	130.8	175.7	27.9	-31.3	0	0	0	112.3	V40 Q43 D58 V59 F64	V40-P56 HydrophobicContact CG2-CG 4.39Å; Q43-P56 HydrophobicContact CG-CB 4.15Å; Q43-P56 HydrophobicContact CG-CG 4.39Å; P56-D58 VanDerWaalsContact C-N 3.34Å; P56-D58 WeakPolarHBondContact CB-OD1 3.44Å; P56-D58 PolarHBondContact O-N 2.78Å; P56-V59 HydrophobicContact CB-CG2 4.38Å; P56-V59 HydrophobicContact CG-CB 4.11Å; P56-V59 HydrophobicContact CG-CG2 4.25Å; P56-F64 VanDerWaalsContact CD-CE2 3.44Å; P56-F64 HydrophobicContact CG-CD2 3.79Å; P56-F64 HydrophobicContact CG-CE2 4.02Å
57	T	82.5	Confident	86.5	Confident	132 Å²	132	53 Å²	53	81%	0.81	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.5	-175.4	52.7	0	0	0	0	114.8
58	D	84.5	Confident	86.6	Confident	116 Å²	116	52.1 Å²	52.1	62%	0.62	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-3.2	-177.4	59.7	-40.9	0	0	0	113.6	P56	P56-D58 VanDerWaalsContact C-N 3.34Å; P56-D58 WeakPolarHBondContact CB-OD1 3.44Å; P56-D58 PolarHBondContact O-N 2.78Å
59	V	86.1	Confident	86.8	Confident	16 Å²	16	59.5 Å²	59.5	10%	0.097	32%	0.317	C	S	.	.	S	Bend	trans	-119.8	150.7	-174.7	-178.4	0	0	0	0	110.3	V40 Y55 P56 L63	V40-V59 HydrophobicContact CG2-CB 4.35Å; V40-V59 HydrophobicContact CG2-CG1 3.96Å; V40-V59 HydrophobicContact CG2-CG2 3.88Å; Y55-V59 PolarHBondContact OH-O 2.7Å; P56-V59 HydrophobicContact CB-CG2 4.38Å; P56-V59 HydrophobicContact CG-CB 4.11Å; P56-V59 HydrophobicContact CG-CG2 4.25Å; V59-L63 HydrophobicContact CG1-CB 3.85Å; V59-L63 HydrophobicContact CG1-CD2 3.45Å; V59-L63 VanDerWaalsContact CG1-CD2 3.45Å; V59-L63 HydrophobicContact CG1-CG 3.78Å
60	C	84.5	Confident	86.9	Confident	76 Å²	76	56.4 Å²	56.4	51%	0.514	31%	0.307	S	S	.	.			trans	-81.1	150.4	174.6	68.3	0	0	0	0	111.9	L63 F64	C60-L63 PolarHBondContact O-N 3.43Å; C60-L63 VanDerWaalsContact SG-CB 3.54Å; C60-F64 PolarHBondContact O-N 2.98Å
61	G	83.7	Confident	87	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	28%	0.282	C	S	.	.	H	α-helix	trans	-53.8	-50	-175	0	0	0	0	0	114.9	Y55 L63 F64 E65 H89	Y55-G61 VanDerWaalsContact OH-CA 3.23Å; Y55-G61 WeakPolarHBondContact OH-CA 3.36Å; Y55-G61 PolarHBondContact OH-N 3.19Å; G61-L63 VanDerWaalsContact C-N 3.33Å; G61-L63 PolarHBondContact O-N 3.33Å; G61-F64 WeakPolarHBondContact O-CB 3.5Å; G61-F64 PolarHBondContact O-N 3.1Å; G61-E65 PolarHBondContact O-N 2.83Å; G61-H89 WeakPolarHBondContact CA-CD2 3.4Å
62	P	83.5	Confident	86.9	Confident	56 Å²	56	52.5 Å²	52.5	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-39.9	179.4	-26.8	35.7	0	0	0	113.7	F64 E65 E66	P62-F64 VanDerWaalsContact C-N 3.28Å; P62-F64 PolarHBondContact O-N 3.3Å; P62-E65 PolarHBondContact O-N 2.87Å; P62-E66 WeakPolarHBondContact O-CG 3.39Å; P62-E66 PolarHBondContact O-N 3.24Å
63	L	87	Confident	86.8	Confident	52 Å²	52	47.9 Å²	47.9	27%	0.272	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-37.1	177.3	178.1	61.7	0	0	0	111.1	V59 C60 G61 E67	V59-L63 HydrophobicContact CG1-CB 3.85Å; V59-L63 HydrophobicContact CG1-CD2 3.45Å; V59-L63 VanDerWaalsContact CG1-CD2 3.45Å; V59-L63 HydrophobicContact CG1-CG 3.78Å; C60-L63 PolarHBondContact O-N 3.43Å; C60-L63 VanDerWaalsContact SG-CB 3.54Å; G61-L63 VanDerWaalsContact C-N 3.33Å; G61-L63 PolarHBondContact O-N 3.33Å; L63-E67 WeakPolarHBondContact O-CG 3.43Å; L63-E67 PolarHBondContact O-N 3.11Å
64	F	90	Very high	86.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-67.7	-41.3	175.2	-171.8	-113.6	0	0	0	112	V40 L53 Y55 P56 C60 G61 P62 E67 L68 V78 Y86	V40-F64 HydrophobicContact CG1-CD2 3.54Å; V40-F64 HydrophobicContact CG1-CE2 3.85Å; V40-F64 HydrophobicContact CG2-CD2 4.43Å; L53-F64 HydrophobicContact CD1-CZ 4.19Å; L53-F64 HydrophobicContact CG-CZ 4.41Å; Y55-F64 HydrophobicContact CD2-CB 4.35Å; Y55-F64 AromaticContact CD2-CD1 3.47Å; Y55-F64 HydrophobicContact CD2-CD1 3.47Å; Y55-F64 VanDerWaalsContact CD2-CD1 3.47Å; Y55-F64 AromaticContact CD2-CE1 3.82Å; Y55-F64 HydrophobicContact CD2-CE1 3.82Å; Y55-F64 AromaticContact CD2-CG 3.94Å; Y55-F64 HydrophobicContact CD2-CG 3.94Å; Y55-F64 HydrophobicContact CE2-CB 3.79Å; Y55-F64 AromaticContact CE2-CD1 3.75Å; Y55-F64 HydrophobicContact CE2-CD1 3.75Å; Y55-F64 AromaticContact CE2-CG 3.89Å; Y55-F64 HydrophobicContact CE2-CG 3.89Å; P56-F64 VanDerWaalsContact CD-CE2 3.44Å; P56-F64 HydrophobicContact CG-CD2 3.79Å; P56-F64 HydrophobicContact CG-CE2 4.02Å; C60-F64 PolarHBondContact O-N 2.98Å; G61-F64 WeakPolarHBondContact O-CB 3.5Å; G61-F64 PolarHBondContact O-N 3.1Å; P62-F64 VanDerWaalsContact C-N 3.28Å; P62-F64 PolarHBondContact O-N 3.3Å; F64-E67 PolarHBondContact O-N 3.21Å; F64-L68 HydrophobicContact CD1-CD1 3.87Å; F64-L68 HydrophobicContact CD1-CG 4.21Å; F64-L68 HydrophobicContact CE1-CD1 3.55Å; F64-L68 HydrophobicContact CE1-CD2 4.25Å; F64-L68 HydrophobicContact CE1-CG 3.98Å; F64-L68 HydrophobicContact CE2-CD2 4.39Å; F64-L68 HydrophobicContact CZ-CD1 4.14Å; F64-L68 HydrophobicContact CZ-CD2 3.98Å; F64-L68 HydrophobicContact CZ-CG 4.16Å; F64-L68 WeakPolarHBondContact O-CG 3.41Å; F64-L68 PolarHBondContact O-N 2.92Å; F64-V78 HydrophobicContact CE1-CG2 4.25Å; F64-Y86 HydrophobicContact CD1-CD2 4.31Å; F64-Y86 HydrophobicContact CD1-CE2 4.32Å
65	E	86.8	Confident	86.1	Confident	52 Å²	52	49.6 Å²	49.6	24%	0.243	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-45	175.9	-68.9	-171.3	152.3	0	0	112.5	G61 P62 E67 L68 E69 Y86 H89	G61-E65 PolarHBondContact O-N 2.83Å; P62-E65 PolarHBondContact O-N 2.87Å; E65-E67 VanDerWaalsContact C-N 3.27Å; E65-E67 PolarHBondContact O-N 3Å; E65-L68 PolarHBondContact O-N 3.38Å; E65-E69 WeakPolarHBondContact O-CB 3.37Å; E65-E69 PolarHBondContact O-N 3.14Å; E65-Y86 HydrophobicContact CG-CE2 3.76Å; E65-Y86 WeakPolarHBondContact CG-OH 3.4Å; E65-Y86 PolarHBondContact OE1-OH 3.39Å; E65-H89 IonicContact OE1-CE1 3.82Å; E65-H89 PolarHBondContact OE1-CE1 3.19Å; E65-H89 IonicContact OE1-NE2 3.66Å; E65-H89 PolarHBondContact OE1-NE2 2.6Å; E65-H89 VanDerWaalsContact OE1-NE2 3.16Å; E65-H89 IonicContact OE2-CE1 2.78Å; E65-H89 PolarHBondContact OE2-CE1 3.34Å; E65-H89 VanDerWaalsContact OE2-CE1 3.3Å; E65-H89 IonicContact OE2-NE2 3.64Å
66	E	88	Confident	85.8	Confident	128 Å²	128	54.2 Å²	54.2	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-58.7	-40.4	176	-73.9	177.2	-173.4	0	0	111.6	P62 F70	P62-E66 WeakPolarHBondContact O-CG 3.39Å; P62-E66 PolarHBondContact O-N 3.24Å; E66-F70 PolarHBondContact O-N 3.42Å; E66-F70 VanDerWaalsContact O-N 3.14Å
67	E	90	Very high	85.6	Confident	11 Å²	11	58.8 Å²	58.8	5%	0.051	33%	0.325	C	S	.	.	H	α-helix	trans	-65.6	-50.6	174.8	-73.9	-66.2	151.2	0	0	111.3	R36 V40 I44 L63 F64 E65 E69 F70 W71	R36-E67 IonicContact CZ-OE1 3.38Å; R36-E67 IonicContact CZ-OE2 3.61Å; R36-E67 VanDerWaalsContact NE-CD 3.34Å; R36-E67 IonicContact NE-OE1 3.19Å; R36-E67 PolarHBondContact NE-OE1 2.67Å; R36-E67 IonicContact NE-OE2 2.75Å; R36-E67 PolarHBondContact NE-OE2 3.4Å; R36-E67 IonicContact NH2-OE1 2.7Å; R36-E67 IonicContact NH2-OE2 3.22Å; R36-E67 PolarHBondContact NH2-OE2 3.22Å; V40-E67 HydrophobicContact CB-CG 4.16Å; V40-E67 HydrophobicContact CG1-CB 3.57Å; V40-E67 HydrophobicContact CG1-CG 3.74Å; I44-E67 HydrophobicContact CD1-CB 4.4Å; L63-E67 WeakPolarHBondContact O-CG 3.43Å; L63-E67 PolarHBondContact O-N 3.11Å; F64-E67 PolarHBondContact O-N 3.21Å; E65-E67 VanDerWaalsContact C-N 3.27Å; E65-E67 PolarHBondContact O-N 3Å; E67-E69 VanDerWaalsContact C-N 3.33Å; E67-E69 PolarHBondContact O-N 3Å; E67-F70 PolarHBondContact O-N 3.45Å; E67-W71 PolarHBondContact O-N 3.3Å; E67-W71 PolarHBondContact OE2-NE1 3.34Å
68	L	89.3	Confident	85.9	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-56.2	-47	178.3	-70.2	-176.5	0	0	0	111.9	L53 F64 E65 F70 W71 G72 L73 A75	L53-L68 HydrophobicContact CD1-CD2 4.12Å; L53-L68 HydrophobicContact CD2-CD1 4.15Å; L53-L68 HydrophobicContact CD2-CD2 3.84Å; F64-L68 HydrophobicContact CD1-CD1 3.87Å; F64-L68 HydrophobicContact CD1-CG 4.21Å; F64-L68 HydrophobicContact CE1-CD1 3.55Å; F64-L68 HydrophobicContact CE1-CD2 4.25Å; F64-L68 HydrophobicContact CE1-CG 3.98Å; F64-L68 HydrophobicContact CE2-CD2 4.39Å; F64-L68 HydrophobicContact CZ-CD1 4.14Å; F64-L68 HydrophobicContact CZ-CD2 3.98Å; F64-L68 HydrophobicContact CZ-CG 4.16Å; F64-L68 WeakPolarHBondContact O-CG 3.41Å; F64-L68 PolarHBondContact O-N 2.92Å; E65-L68 PolarHBondContact O-N 3.38Å; L68-F70 VanDerWaalsContact C-N 3.33Å; L68-F70 PolarHBondContact O-N 3.18Å; L68-W71 PolarHBondContact O-N 3.18Å; L68-G72 PolarHBondContact O-N 2.89Å; L68-L73 HydrophobicContact CB-CB 4.28Å; L68-L73 HydrophobicContact CD2-CB 3.87Å; L68-L73 HydrophobicContact CD2-CD1 3.81Å; L68-L73 HydrophobicContact CD2-CG 4.44Å; L68-L73 PolarHBondContact O-N 3.22Å; L68-A75 HydrophobicContact CD1-CB 4.25Å
69	E	87.9	Confident	86.1	Confident	156 Å²	156	49.9 Å²	49.9	73%	0.729	27%	0.271	S	S	*	.	H	α-helix	trans	-57.2	-46.6	178	-176	178.7	-176	0	0	110.9	E65 E67 W71 G72	E65-E69 WeakPolarHBondContact O-CB 3.37Å; E65-E69 PolarHBondContact O-N 3.14Å; E67-E69 VanDerWaalsContact C-N 3.33Å; E67-E69 PolarHBondContact O-N 3Å; E69-W71 PolarHBondContact O-N 3.31Å; E69-G72 PolarHBondContact O-N 2.74Å; E69-G72 VanDerWaalsContact O-N 3.11Å
70	F	87.2	Confident	86.2	Confident	56 Å²	56	52.9 Å²	52.9	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-43.4	178.1	171.2	-89	0	0	0	113	R14 E66 E67 L68 G72	R14-F70 VanDerWaalsContact CD-CE1 3.41Å; R14-F70 PolarHBondContact NE-O 3.31Å; R14-F70 PolarHBondContact NH2-O 3.19Å; E66-F70 PolarHBondContact O-N 3.42Å; E66-F70 VanDerWaalsContact O-N 3.14Å; E67-F70 PolarHBondContact O-N 3.45Å; L68-F70 VanDerWaalsContact C-N 3.33Å; L68-F70 PolarHBondContact O-N 3.18Å; F70-G72 PolarHBondContact O-N 3.46Å
71	W	86.9	Confident	86.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-71.4	-8.7	179.8	-65.5	108.4	0	0	0	112	R14 L15 F34 F41 I44 E67 L68 E69 L73	R14-W71 HydrophobicContact CB-CE3 4.37Å; R14-W71 PolarHBondContact N-O 2.88Å; L15-W71 HydrophobicContact CD1-CD2 4.3Å; L15-W71 HydrophobicContact CD1-CE3 3.69Å; L15-W71 HydrophobicContact CD1-CZ3 4.03Å; L15-W71 HydrophobicContact CD2-CZ3 4.13Å; L15-W71 HydrophobicContact CG-CE3 3.73Å; L15-W71 HydrophobicContact CG-CZ3 3.76Å; F34-W71 HydrophobicContact CB-CH2 4.27Å; F34-W71 AromaticContact CD1-CH2 3.75Å; F34-W71 HydrophobicContact CD1-CH2 3.75Å; F34-W71 HydrophobicContact CD1-CZ3 4.34Å; F34-W71 AromaticContact CD2-CH2 3.85Å; F34-W71 HydrophobicContact CD2-CH2 3.85Å; F34-W71 HydrophobicContact CE1-CH2 4.01Å; F34-W71 HydrophobicContact CE1-CZ3 4.15Å; F34-W71 HydrophobicContact CE2-CH2 4.09Å; F34-W71 HydrophobicContact CE2-CZ3 4.39Å; F34-W71 AromaticContact CG-CH2 3.69Å; F34-W71 HydrophobicContact CG-CH2 3.69Å; F34-W71 HydrophobicContact CG-CZ2 4.45Å; F34-W71 HydrophobicContact CZ-CH2 4.19Å; F34-W71 HydrophobicContact CZ-CZ3 4.19Å; F41-W71 AromaticContact CD2-CE2 3.84Å; F41-W71 AromaticContact CD2-CH2 3.8Å; F41-W71 HydrophobicContact CD2-CH2 3.8Å; F41-W71 AromaticContact CD2-CZ2 3.39Å; F41-W71 HydrophobicContact CD2-CZ2 3.39Å; F41-W71 AromaticContact CE2-CH2 3.49Å; F41-W71 HydrophobicContact CE2-CH2 3.49Å; F41-W71 VanDerWaalsContact CE2-CH2 3.49Å; F41-W71 AromaticContact CE2-CZ2 3.61Å; F41-W71 HydrophobicContact CE2-CZ2 3.61Å; F41-W71 AromaticContact CE2-CZ3 3.99Å; F41-W71 HydrophobicContact CE2-CZ3 3.99Å; F41-W71 HydrophobicContact CG-CZ2 4.49Å; I44-W71 HydrophobicContact CD1-CG 3.97Å; I44-W71 VanDerWaalsContact CD1-NE1 3.32Å; I44-W71 HydrophobicContact CG2-CB 4.36Å; I44-W71 HydrophobicContact CG2-CD2 4.42Å; I44-W71 HydrophobicContact CG2-CG 4.1Å; E67-W71 PolarHBondContact O-N 3.3Å; E67-W71 PolarHBondContact OE2-NE1 3.34Å; L68-W71 PolarHBondContact O-N 3.18Å; E69-W71 PolarHBondContact O-N 3.31Å; W71-L73 HydrophobicContact CB-CG 4.19Å
72	G	83.3	Confident	86.6	Confident	45 Å²	45	54.4 Å²	54.4	46%	0.464	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	31.5	-179.5	0	0	0	0	0	111.8	L68 E69 F70	L68-G72 PolarHBondContact O-N 2.89Å; E69-G72 PolarHBondContact O-N 2.74Å; E69-G72 VanDerWaalsContact O-N 3.11Å; F70-G72 PolarHBondContact O-N 3.46Å
73	L	86	Confident	86.8	Confident	14 Å²	14	58.1 Å²	58.1	7%	0.073	31%	0.308	C	S	.	.			trans	-97.6	136.9	176.8	-62.1	-173.2	0	0	0	109.8	T13 I44 Y47 Y48 L68 W71	T13-L73 HydrophobicContact CG2-CD2 3.67Å; I44-L73 HydrophobicContact CG1-CD1 4.28Å; I44-L73 HydrophobicContact CG2-CD1 4.02Å; Y47-L73 HydrophobicContact CD1-CD1 3.68Å; Y47-L73 HydrophobicContact CD1-CD2 3.99Å; Y47-L73 HydrophobicContact CD1-CG 4.44Å; Y47-L73 HydrophobicContact CE1-CD1 4.14Å; Y47-L73 HydrophobicContact CE1-CD2 3.75Å; Y47-L73 HydrophobicContact CE1-CG 4.47Å; Y48-L73 HydrophobicContact CE2-CD1 4.4Å; Y48-L73 HydrophobicContact CE2-CD2 4.3Å; L68-L73 HydrophobicContact CB-CB 4.28Å; L68-L73 HydrophobicContact CD2-CB 3.87Å; L68-L73 HydrophobicContact CD2-CD1 3.81Å; L68-L73 HydrophobicContact CD2-CG 4.44Å; L68-L73 PolarHBondContact O-N 3.22Å; W71-L73 HydrophobicContact CB-CG 4.19Å
74	D	84	Confident	86.6	Confident	81 Å²	81	63.1 Å²	63.1	43%	0.433	33%	0.331	S	S	.	.			trans	-78.9	124.7	173.4	-176.9	4.3	0	0	0	109.8	N76 Q77	D74-N76 PolarHBondContact O-N 3.08Å; D74-N76 VanDerWaalsContact O-N 3.17Å; D74-N76 PolarHBondContact OD1-N 3.17Å; D74-N76 PolarHBondContact OD1-ND2 3.37Å; D74-N76 PolarHBondContact OD2-ND2 2.87Å; D74-Q77 HydrophobicContact CB-CG 4.11Å; D74-Q77 WeakPolarHBondContact O-CB 3.23Å; D74-Q77 PolarHBondContact O-N 2.93Å; D74-Q77 VanDerWaalsContact O-N 3.08Å
75	A	80.3	Confident	86.3	Confident	21 Å²	21	65.9 Å²	65.9	17%	0.174	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-55.1	-26.3	174.4	0	0	0	0	0	113.7	L68 Q77 V78 Y86	L68-A75 HydrophobicContact CD1-CB 4.25Å; A75-Q77 PolarHBondContact O-N 3.16Å; A75-V78 VanDerWaalsContact O-CG2 3.32Å; A75-V78 WeakPolarHBondContact O-CG2 3.44Å; A75-V78 PolarHBondContact O-N 3.07Å; A75-Y86 HydrophobicContact CB-CE1 4.39Å; A75-Y86 WeakPolarHBondContact CB-OH 3.4Å
76	N	81.5	Confident	86.1	Confident	115 Å²	115	63.9 Å²	63.9	62%	0.615	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-71.7	-8.9	178.8	-57	-44.5	0	0	0	113.6	D74 V78	D74-N76 PolarHBondContact O-N 3.08Å; D74-N76 VanDerWaalsContact O-N 3.17Å; D74-N76 PolarHBondContact OD1-N 3.17Å; D74-N76 PolarHBondContact OD1-ND2 3.37Å; D74-N76 PolarHBondContact OD2-ND2 2.87Å; N76-V78 VanDerWaalsContact C-N 3.3Å
77	Q	84.4	Confident	85.9	Confident	100 Å²	100	60.3 Å²	60.3	47%	0.467	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-85.9	2.4	179.5	-58.8	-63.7	-40.6	0	0	113.6	D74 A75	D74-Q77 HydrophobicContact CB-CG 4.11Å; D74-Q77 WeakPolarHBondContact O-CB 3.23Å; D74-Q77 PolarHBondContact O-N 2.93Å; D74-Q77 VanDerWaalsContact O-N 3.08Å; A75-Q77 PolarHBondContact O-N 3.16Å
78	V	88.9	Confident	85.5	Confident	5 Å²	5	65.6 Å²	65.6	3%	0.03	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-63	139.9	175.8	176.4	0	0	0	0	109.9	L53 F64 A75 N76 C82 W83 Y86	L53-V78 HydrophobicContact CD2-CG2 3.73Å; L53-V78 HydrophobicContact CG-CG2 4.15Å; L53-V78 WeakPolarHBondContact O-CA 3.36Å; F64-V78 HydrophobicContact CE1-CG2 4.25Å; A75-V78 VanDerWaalsContact O-CG2 3.32Å; A75-V78 WeakPolarHBondContact O-CG2 3.44Å; A75-V78 PolarHBondContact O-N 3.07Å; N76-V78 VanDerWaalsContact C-N 3.3Å; V78-C82 HydrophobicContact CG1-CB 3.61Å; V78-W83 PolarHBondContact O-NE1 3.3Å; V78-Y86 HydrophobicContact CG2-CD1 4.3Å; V78-Y86 HydrophobicContact CG2-CE1 4.45Å
79	E	89.9	Confident	85.1	Confident	56 Å²	56	66.5 Å²	66.5	26%	0.262	35%	0.354	S	S	.	.			trans	-68.5	147.9	179.6	-73.1	-71.4	151.7	0	0	112.6	K52 L53 C81 C82 W83	K52-E79 HydrophobicContact CB-CG 3.92Å; K52-E79 HydrophobicContact CG-CG 4.46Å; K52-E79 WeakPolarHBondContact CG-OE1 3.46Å; L53-E79 PolarHBondContact O-N 2.97Å; E79-C81 PolarHBondContact O-N 3.25Å; E79-C82 PolarHBondContact O-N 2.99Å; E79-W83 VanDerWaalsContact O-CD1 3.28Å
80	P	88.3	Confident	84.7	Confident	79 Å²	79	64.2 Å²	64.2	51%	0.513	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-55.9	-30.8	-176.3	-27.3	34.7	0	0	0	115.1	C82 W83	P80-C82 PolarHBondContact O-N 3.41Å; P80-C82 VanDerWaalsContact O-N 3.16Å; P80-W83 HydrophobicContact CB-CD2 4.28Å; P80-W83 HydrophobicContact CB-CE3 4.39Å; P80-W83 HydrophobicContact CB-CZ2 4.45Å; P80-W83 HydrophobicContact CG-CH2 4.29Å; P80-W83 HydrophobicContact CG-CZ2 4.04Å; P80-W83 PolarHBondContact O-N 3.44Å
81	C	88	Confident	84.3	Confident	97 Å²	97	65.4 Å²	65.4	66%	0.655	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-62.6	-21.2	177.9	64.2	0	0	0	0	113.4	H54 E79	H54-C81 PolarHBondContact ND1-SG 3.15Å; H54-C81 VanDerWaalsContact ND1-SG 3.42Å; E79-C81 PolarHBondContact O-N 3.25Å
82	C	88.7	Confident	83.9	Confident	17 Å²	17	67.1 Å²	67.1	12%	0.115	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-104.9	-8.7	-177.3	-69.7	0	0	0	0	113.1	Y55 V78 E79 P80 M84 T85 Y86	Y55-C82 PolarHBondContact N-SG 2.98Å; V78-C82 HydrophobicContact CG1-CB 3.61Å; E79-C82 PolarHBondContact O-N 2.99Å; P80-C82 PolarHBondContact O-N 3.41Å; P80-C82 VanDerWaalsContact O-N 3.16Å; C82-M84 PolarHBondContact O-N 3.22Å; C82-T85 PolarHBondContact O-N 3.21Å; C82-Y86 WeakPolarHBondContact O-CB 3.36Å; C82-Y86 PolarHBondContact O-N 3.4Å
83	W	86.4	Confident	83.7	Confident	134 Å²	134	70.4 Å²	70.4	51%	0.508	36%	0.362	S	S	.	.	H	α-helix	trans	-56.6	-46.1	-174.5	-74	-1.7	0	0	0	112.6	V78 E79 P80 T85 Y86 T87	V78-W83 PolarHBondContact O-NE1 3.3Å; E79-W83 VanDerWaalsContact O-CD1 3.28Å; P80-W83 HydrophobicContact CB-CD2 4.28Å; P80-W83 HydrophobicContact CB-CE3 4.39Å; P80-W83 HydrophobicContact CB-CZ2 4.45Å; P80-W83 HydrophobicContact CG-CH2 4.29Å; P80-W83 HydrophobicContact CG-CZ2 4.04Å; P80-W83 PolarHBondContact O-N 3.44Å; W83-T85 PolarHBondContact O-N 2.69Å; W83-Y86 PolarHBondContact O-N 2.9Å; W83-T87 WeakPolarHBondContact O-CB 3.32Å; W83-T87 WeakPolarHBondContact O-CG2 3.22Å; W83-T87 PolarHBondContact O-N 3.48Å; W83-T87 PolarHBondContact O-OG1 3.06Å
84	M	83.7	Confident	83.4	Confident	156 Å²	156	75.7 Å²	75.7	77%	0.768	39%	0.386	S	S	*	.	H	α-helix	trans	-58.5	-44.7	-177.1	-172.4	175	68.1	0	0	112.7	C82 Q88	C82-M84 PolarHBondContact O-N 3.22Å; M84-Q88 WeakPolarHBondContact O-CB 3.48Å; M84-Q88 PolarHBondContact O-N 3.33Å
85	T	83.5	Confident	83	Confident	59 Å²	59	72.2 Å²	72.2	36%	0.362	37%	0.368	S	S	.	.	H	α-helix	trans	-72.1	-37.9	178.7	-49.1	0	0	0	0	111.5	Y55 C82 W83	Y55-T85 HydrophobicContact CD1-CG2 3.8Å; Y55-T85 HydrophobicContact CE1-CG2 3.69Å; C82-T85 PolarHBondContact O-N 3.21Å; W83-T85 PolarHBondContact O-N 2.69Å
86	Y	82.6	Confident	82.7	Confident	10 Å²	10	73.6 Å²	73.6	4%	0.039	37%	0.372	C	S	.	.	H	α-helix	trans	-70.4	-46.7	179.7	176.1	-121	0	0	0	112	Y55 F64 E65 A75 V78 C82 W83 Q88 H89	Y55-Y86 AromaticContact CD2-CD2 3.69Å; Y55-Y86 HydrophobicContact CD2-CD2 3.69Å; Y55-Y86 HydrophobicContact CD2-CG 4.19Å; Y55-Y86 AromaticContact CE2-CD2 3.81Å; Y55-Y86 HydrophobicContact CE2-CD2 3.81Å; F64-Y86 HydrophobicContact CD1-CD2 4.31Å; F64-Y86 HydrophobicContact CD1-CE2 4.32Å; E65-Y86 HydrophobicContact CG-CE2 3.76Å; E65-Y86 WeakPolarHBondContact CG-OH 3.4Å; E65-Y86 PolarHBondContact OE1-OH 3.39Å; A75-Y86 HydrophobicContact CB-CE1 4.39Å; A75-Y86 WeakPolarHBondContact CB-OH 3.4Å; V78-Y86 HydrophobicContact CG2-CD1 4.3Å; V78-Y86 HydrophobicContact CG2-CE1 4.45Å; C82-Y86 WeakPolarHBondContact O-CB 3.36Å; C82-Y86 PolarHBondContact O-N 3.4Å; W83-Y86 PolarHBondContact O-N 2.9Å; Y86-Q88 VanDerWaalsContact C-N 3.29Å; Y86-Q88 PolarHBondContact O-N 3.29Å; Y86-H89 AromaticContact CE2-NE2 3.63Å; Y86-H89 PolarHBondContact O-CD2 2.99Å; Y86-H89 PolarHBondContact O-NE2 3.16Å
87	T	82.6	Confident	82.5	Confident	53 Å²	53	70.1 Å²	70.1	33%	0.325	36%	0.359	S	S	.	.	H	α-helix	trans	-73.1	-21.9	-178.8	61	0	0	0	0	113.1	W83 H89 R90 D91	W83-T87 WeakPolarHBondContact O-CB 3.32Å; W83-T87 WeakPolarHBondContact O-CG2 3.22Å; W83-T87 PolarHBondContact O-N 3.48Å; W83-T87 PolarHBondContact O-OG1 3.06Å; T87-H89 PolarHBondContact O-N 3.02Å; T87-H89 VanDerWaalsContact O-N 3.14Å; T87-R90 WeakPolarHBondContact O-CA 3.34Å; T87-R90 WeakPolarHBondContact O-CB 3.49Å; T87-R90 PolarHBondContact O-N 3.49Å; T87-D91 PolarHBondContact O-N 2.99Å
88	Q	82.5	Confident	82	Confident	121 Å²	121	67.3 Å²	67.3	57%	0.565	35%	0.349	S	S	*	.	H	α-helix	trans	-51.1	-41.6	178.9	-173.9	178.5	9.6	0	0	112	M84 Y86 R90 D91 T92	M84-Q88 WeakPolarHBondContact O-CB 3.48Å; M84-Q88 PolarHBondContact O-N 3.33Å; Y86-Q88 VanDerWaalsContact C-N 3.29Å; Y86-Q88 PolarHBondContact O-N 3.29Å; Q88-R90 VanDerWaalsContact C-N 3.33Å; Q88-R90 PolarHBondContact O-N 3.3Å; Q88-D91 PolarHBondContact O-N 2.95Å; Q88-T92 WeakPolarHBondContact O-CG2 3.49Å; Q88-T92 PolarHBondContact O-N 3.26Å; Q88-T92 PolarHBondContact O-OG1 3.03Å
89	H	79.9	Confident	81.3	Confident	21 Å²	21	67.3 Å²	67.3	10%	0.097	35%	0.349	C	S	.	.	H	α-helix	trans	-65.8	-37.2	178.4	85	78.1	0	0	0	112	G61 E65 Y86 T87 T92 Q93	G61-H89 WeakPolarHBondContact CA-CD2 3.4Å; E65-H89 IonicContact OE1-CE1 3.82Å; E65-H89 PolarHBondContact OE1-CE1 3.19Å; E65-H89 IonicContact OE1-NE2 3.66Å; E65-H89 PolarHBondContact OE1-NE2 2.6Å; E65-H89 VanDerWaalsContact OE1-NE2 3.16Å; E65-H89 IonicContact OE2-CE1 2.78Å; E65-H89 PolarHBondContact OE2-CE1 3.34Å; E65-H89 VanDerWaalsContact OE2-CE1 3.3Å; E65-H89 IonicContact OE2-NE2 3.64Å; Y86-H89 AromaticContact CE2-NE2 3.63Å; Y86-H89 PolarHBondContact O-CD2 2.99Å; Y86-H89 PolarHBondContact O-NE2 3.16Å; T87-H89 PolarHBondContact O-N 3.02Å; T87-H89 VanDerWaalsContact O-N 3.14Å; H89-T92 WeakPolarHBondContact CA-OG1 3.42Å; H89-T92 PolarHBondContact O-N 3.28Å; H89-T92 PolarHBondContact O-OG1 3.48Å; H89-Q93 WeakPolarHBondContact O-CB 3.42Å; H89-Q93 PolarHBondContact O-N 2.76Å
90	R	79.7	Confident	80.3	Confident	108 Å²	108	68 Å²	68	41%	0.408	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-45.3	179.9	-63.6	-178.1	59.1	153	-3.4	110.4	T87 Q88 T92 Q93 E94	T87-R90 WeakPolarHBondContact O-CA 3.34Å; T87-R90 WeakPolarHBondContact O-CB 3.49Å; T87-R90 PolarHBondContact O-N 3.49Å; Q88-R90 VanDerWaalsContact C-N 3.33Å; Q88-R90 PolarHBondContact O-N 3.3Å; R90-T92 VanDerWaalsContact C-N 3.3Å; R90-T92 PolarHBondContact O-N 3.2Å; R90-Q93 WeakPolarHBondContact O-CB 3.34Å; R90-Q93 PolarHBondContact O-N 2.82Å; R90-E94 WeakPolarHBondContact O-CG 3.32Å; R90-E94 PolarHBondContact O-N 3.43Å
91	D	79.4	Confident	79.4	Confident	81 Å²	81	73 Å²	73	43%	0.433	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-41.2	176.4	-61.2	-22.8	0	0	0	111.3	T87 Q88 E94 T95	T87-D91 PolarHBondContact O-N 2.99Å; Q88-D91 PolarHBondContact O-N 2.95Å; D91-E94 PolarHBondContact O-N 3.41Å; D91-T95 WeakPolarHBondContact O-CB 3.42Å; D91-T95 PolarHBondContact O-N 2.9Å; D91-T95 PolarHBondContact O-OG1 3.33Å
92	T	77.7	Confident	78.4	Confident	37 Å²	37	70.1 Å²	70.1	23%	0.227	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-38.9	174.1	66.4	0	0	0	0	111.5	Q88 H89 R90 T95 L96	Q88-T92 WeakPolarHBondContact O-CG2 3.49Å; Q88-T92 PolarHBondContact O-N 3.26Å; Q88-T92 PolarHBondContact O-OG1 3.03Å; H89-T92 WeakPolarHBondContact CA-OG1 3.42Å; H89-T92 PolarHBondContact O-N 3.28Å; H89-T92 PolarHBondContact O-OG1 3.48Å; R90-T92 VanDerWaalsContact C-N 3.3Å; R90-T92 PolarHBondContact O-N 3.2Å; T92-T95 WeakPolarHBondContact O-CB 3.39Å; T92-T95 PolarHBondContact O-N 3.25Å; T92-L96 WeakPolarHBondContact O-CB 3.44Å; T92-L96 WeakPolarHBondContact O-CG 3.33Å; T92-L96 PolarHBondContact O-N 2.89Å
93	Q	79.4	Confident	77.1	Confident	114 Å²	114	71.2 Å²	71.2	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-38.7	178.4	-174.7	176.8	-10.9	0	0	112.2	H89 R90 L96 A97	H89-Q93 WeakPolarHBondContact O-CB 3.42Å; H89-Q93 PolarHBondContact O-N 2.76Å; R90-Q93 WeakPolarHBondContact O-CB 3.34Å; R90-Q93 PolarHBondContact O-N 2.82Å; Q93-L96 PolarHBondContact O-N 3.01Å; Q93-A97 WeakPolarHBondContact O-CB 3.46Å; Q93-A97 PolarHBondContact O-N 3.34Å
94	E	79.5	Confident	75.6	Confident	124 Å²	124	68.6 Å²	68.6	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-63.1	-44.4	173.2	-72.4	-175.1	-175.8	0	0	111.2	R90 D91 L96 A97 V98	R90-E94 WeakPolarHBondContact O-CG 3.32Å; R90-E94 PolarHBondContact O-N 3.43Å; D91-E94 PolarHBondContact O-N 3.41Å; E94-L96 PolarHBondContact O-N 3.32Å; E94-A97 PolarHBondContact O-N 2.83Å; E94-V98 WeakPolarHBondContact O-CG2 3.41Å; E94-V98 PolarHBondContact O-N 2.94Å; E94-V98 VanDerWaalsContact O-N 3.09Å
95	T	77	Confident	74.1	Confident	8 Å²	8	64.4 Å²	64.4	5%	0.049	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-47	173.6	-60.9	0	0	0	0	110.9	D91 T92 A97 V98 L99 M402 F403 H406	D91-T95 WeakPolarHBondContact O-CB 3.42Å; D91-T95 PolarHBondContact O-N 2.9Å; D91-T95 PolarHBondContact O-OG1 3.33Å; T92-T95 WeakPolarHBondContact O-CB 3.39Å; T92-T95 PolarHBondContact O-N 3.25Å; T95-A97 VanDerWaalsContact C-N 3.31Å; T95-A97 PolarHBondContact O-N 3.37Å; T95-V98 PolarHBondContact O-N 3.33Å; T95-L99 HydrophobicContact CG2-CD1 4.33Å; T95-L99 WeakPolarHBondContact O-CG 3.33Å; T95-L99 PolarHBondContact O-N 3.42Å; T95-M402 HydrophobicContact CG2-SD 3.77Å; T95-M402 WeakPolarHBondContact OG1-CE 3.44Å; T95-F403 HydrophobicContact CG2-CD1 3.69Å; T95-F403 HydrophobicContact CG2-CD2 4.22Å; T95-F403 HydrophobicContact CG2-CE1 3.66Å; T95-F403 HydrophobicContact CG2-CE2 4.2Å; T95-F403 HydrophobicContact CG2-CG 3.98Å; T95-F403 HydrophobicContact CG2-CZ 3.92Å; T95-H406 HydrophobicContact CG2-CB 4.44Å
96	L	73.2	Confident	72.7	Confident	51 Å²	51	63.2 Å²	63.2	27%	0.267	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-37.9	176.6	-72.7	170.6	0	0	0	112	T92 Q93 E94 V98 L99 D100	T92-L96 WeakPolarHBondContact O-CB 3.44Å; T92-L96 WeakPolarHBondContact O-CG 3.33Å; T92-L96 PolarHBondContact O-N 2.89Å; Q93-L96 PolarHBondContact O-N 3.01Å; E94-L96 PolarHBondContact O-N 3.32Å; L96-V98 VanDerWaalsContact C-N 3.33Å; L96-V98 PolarHBondContact O-N 2.98Å; L96-L99 CarbonylContact O-C 3.58Å; L96-L99 PolarHBondContact O-N 2.92Å; L96-D100 WeakPolarHBondContact O-CB 3.4Å; L96-D100 PolarHBondContact O-N 3.15Å
97	A	76.6	Confident	71.2	Confident	41 Å²	41	65 Å²	65	34%	0.339	33%	0.329	S	S	.	.	H	α-helix	trans	-66.1	-35	176.6	0	0	0	0	0	112.3	Q93 E94 T95 R101	Q93-A97 WeakPolarHBondContact O-CB 3.46Å; Q93-A97 PolarHBondContact O-N 3.34Å; E94-A97 PolarHBondContact O-N 2.83Å; T95-A97 VanDerWaalsContact C-N 3.31Å; T95-A97 PolarHBondContact O-N 3.37Å; A97-R101 VanDerWaalsContact O-CG 3.32Å; A97-R101 WeakPolarHBondContact O-CG 3.41Å; A97-R101 PolarHBondContact O-N 3.16Å
98	V	75.2	Confident	69.8	Low	42 Å²	42	64.4 Å²	64.4	26%	0.255	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-43.2	172.1	175.6	0	0	0	0	110.7	E94 T95 L96 R101 L102 H304 F403	E94-V98 WeakPolarHBondContact O-CG2 3.41Å; E94-V98 PolarHBondContact O-N 2.94Å; E94-V98 VanDerWaalsContact O-N 3.09Å; T95-V98 PolarHBondContact O-N 3.33Å; L96-V98 VanDerWaalsContact C-N 3.33Å; L96-V98 PolarHBondContact O-N 2.98Å; V98-R101 WeakPolarHBondContact O-CB 3.42Å; V98-R101 PolarHBondContact O-N 3.25Å; V98-L102 PolarHBondContact O-N 2.95Å; V98-H304 HydrophobicContact CG1-CB 4.39Å; V98-F403 HydrophobicContact CG1-CE1 4.47Å
99	L	72.6	Confident	68.4	Low	4 Å²	4	65.1 Å²	65.1	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-67.2	-38.7	177.5	-63.9	179.8	0	0	0	112.5	T95 L96 R101 L102 D103 H406 T407	T95-L99 HydrophobicContact CG2-CD1 4.33Å; T95-L99 WeakPolarHBondContact O-CG 3.33Å; T95-L99 PolarHBondContact O-N 3.42Å; L96-L99 CarbonylContact O-C 3.58Å; L96-L99 PolarHBondContact O-N 2.92Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 3.47Å; L99-L102 HydrophobicContact CD2-CD1 4.13Å; L99-L102 WeakPolarHBondContact O-CB 3.16Å; L99-L102 PolarHBondContact O-N 2.99Å; L99-L102 VanDerWaalsContact O-N 3.11Å; L99-D103 PolarHBondContact O-N 3.01Å; L99-H406 HydrophobicContact CD1-CB 3.72Å; L99-T407 HydrophobicContact CD1-CG2 3.62Å; L99-T407 HydrophobicContact CD2-CG2 3.3Å; L99-T407 HydrophobicContact CG-CG2 4.07Å
100	D	70.7	Confident	67.6	Low	70 Å²	70	67.6 Å²	67.6	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-36	174.9	-79	-20.1	0	0	0	110.8	L96 L102 D103 V104 R410	L96-D100 WeakPolarHBondContact O-CB 3.4Å; L96-D100 PolarHBondContact O-N 3.15Å; D100-L102 VanDerWaalsContact C-N 3.33Å; D100-L102 PolarHBondContact O-N 3.11Å; D100-D103 PolarHBondContact O-N 3.4Å; D100-V104 VanDerWaalsContact O-CB 3.25Å; D100-V104 WeakPolarHBondContact O-CB 3.38Å; D100-V104 WeakPolarHBondContact O-CG2 3.45Å; D100-V104 PolarHBondContact O-N 3.21Å; D100-R410 IonicContact OD1-CZ 2.58Å; D100-R410 IonicContact OD1-NH1 3.3Å; D100-R410 PolarHBondContact OD1-NH1 3.37Å; D100-R410 IonicContact OD1-NH2 3.39Å; D100-R410 PolarHBondContact OD1-NH2 2.67Å
101	R	69.3	Low	66.9	Low	185 Å²	185	68.7 Å²	68.7	70%	0.698	35%	0.35	S	S	*	.	H	α-helix	trans	-62.7	-39.9	172.9	-70.6	169.3	-172.7	175.7	4.4	112	A97 V98 L99	A97-R101 VanDerWaalsContact O-CG 3.32Å; A97-R101 WeakPolarHBondContact O-CG 3.41Å; A97-R101 PolarHBondContact O-N 3.16Å; V98-R101 WeakPolarHBondContact O-CB 3.42Å; V98-R101 PolarHBondContact O-N 3.25Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 3.47Å
102	L	65.5	Low	66.2	Low	36 Å²	36	68.7 Å²	68.7	19%	0.188	35%	0.347	C	S	.	.	H	α-helix	trans	-67.1	-39.1	176	-70.1	172.6	0	0	0	112.5	V98 L99 D100 K300 I301 H304	V98-L102 PolarHBondContact O-N 2.95Å; L99-L102 HydrophobicContact CD2-CD1 4.13Å; L99-L102 WeakPolarHBondContact O-CB 3.16Å; L99-L102 PolarHBondContact O-N 2.99Å; L99-L102 VanDerWaalsContact O-N 3.11Å; D100-L102 VanDerWaalsContact C-N 3.33Å; D100-L102 PolarHBondContact O-N 3.11Å; L102-K300 HydrophobicContact CD2-CB 4.27Å; L102-K300 HydrophobicContact CD2-CD 4.43Å; L102-I301 HydrophobicContact CD1-CG1 4.42Å; L102-H304 WeakPolarHBondContact CD2-NE2 3.33Å
103	D	61.9	Low	65.7	Low	41 Å²	41	68.6 Å²	68.6	22%	0.219	35%	0.35	C	S	.	.	H	α-helix	trans	-77.4	-34.5	-179.9	-78.1	-58.5	0	0	0	112.8	L99 D100 D105 S106 D107 R410 R418	L99-D103 PolarHBondContact O-N 3.01Å; D100-D103 PolarHBondContact O-N 3.4Å; D103-D105 PolarHBondContact O-N 2.93Å; D103-S106 CarbonylContact O-C 3.59Å; D103-S106 WeakPolarHBondContact O-CA 3.46Å; D103-S106 WeakPolarHBondContact O-CB 3.47Å; D103-S106 PolarHBondContact O-N 3.44Å; D103-D107 PolarHBondContact O-N 3.07Å; D103-R410 IonicContact OD2-CZ 3.57Å; D103-R410 IonicContact OD2-NE 3.2Å; D103-R410 PolarHBondContact OD2-NE 2.73Å; D103-R410 IonicContact OD2-NH2 2.87Å; D103-R410 PolarHBondContact OD2-NH2 3.09Å; D103-R418 VanDerWaalsContact CG-CZ 3.42Å; D103-R418 IonicContact OD1-CZ 2.85Å; D103-R418 IonicContact OD1-NH1 3.03Å; D103-R418 PolarHBondContact OD1-NH1 3.06Å; D103-R418 VanDerWaalsContact OD1-NH1 3.12Å; D103-R418 IonicContact OD1-NH2 3.84Å; D103-R418 PolarHBondContact OD1-NH2 3.46Å; D103-R418 IonicContact OD2-CZ 3.77Å; D103-R418 IonicContact OD2-NH1 3.32Å; D103-R418 IonicContact OD2-NH2 2.67Å; D103-R418 PolarHBondContact OD2-NH2 3.26Å
104	V	54.3	Low	65.5	Low	79 Å²	79	64.8 Å²	64.8	48%	0.479	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-21.8	173.9	167.7	0	0	0	0	110.5	D100 S106 M108 R117	D100-V104 VanDerWaalsContact O-CB 3.25Å; D100-V104 WeakPolarHBondContact O-CB 3.38Å; D100-V104 WeakPolarHBondContact O-CG2 3.45Å; D100-V104 PolarHBondContact O-N 3.21Å; V104-S106 VanDerWaalsContact C-N 3.31Å; V104-M108 HydrophobicContact CG1-SD 4.33Å; V104-M108 WeakPolarHBondContact O-CG 3.46Å; V104-R117 PolarHBondContact O-NH2 2.95Å
105	D	52.1	Low	65	Low	67 Å²	67	59.1 Å²	59.1	36%	0.358	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-26	167.9	-69.8	-29.2	0	0	0	112.6	D103 R117	D103-D105 PolarHBondContact O-N 2.93Å; D105-R117 IonicContact OD1-CZ 3.41Å; D105-R117 IonicContact OD1-NH1 2.76Å; D105-R117 IonicContact OD1-NH2 2.63Å; D105-R117 PolarHBondContact OD1-NH2 3.15Å
106	S	54.6	Low	64.8	Low	34 Å²	34	65.8 Å²	65.8	24%	0.238	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-37.9	-175.6	-150	0	0	0	0	115.5	D103 V104 M108 E145	D103-S106 CarbonylContact O-C 3.59Å; D103-S106 WeakPolarHBondContact O-CA 3.46Å; D103-S106 WeakPolarHBondContact O-CB 3.47Å; D103-S106 PolarHBondContact O-N 3.44Å; V104-S106 VanDerWaalsContact C-N 3.31Å; S106-M108 VanDerWaalsContact C-N 3.33Å; S106-M108 PolarHBondContact O-N 3.26Å; S106-E145 VanDerWaalsContact CA-OE1 3.32Å; S106-E145 WeakPolarHBondContact CA-OE1 3.42Å; S106-E145 PolarHBondContact OG-OE1 3.48Å; S106-E145 VanDerWaalsContact OG-OE1 3.07Å
107	D	51.9	Low	64.8	Low	47 Å²	47	67.2 Å²	67.2	25%	0.251	34%	0.339	S	S	.	.			trans	-91	23.5	-173.8	-84.5	-30.3	0	0	0	113.9	D103 H109 R418 R419	D103-D107 PolarHBondContact O-N 3.07Å; D107-H109 PolarHBondContact O-N 3.19Å; D107-R418 IonicContact OD2-CZ 3.22Å; D107-R418 IonicContact OD2-NH1 3.07Å; D107-R418 PolarHBondContact OD2-NH1 3.4Å; D107-R419 PolarHBondContact O-NH2 2.98Å; D107-R419 VanDerWaalsContact O-NH2 3.16Å
108	M	52.2	Low	64.9	Low	42 Å²	42	66.2 Å²	66.2	21%	0.207	33%	0.327	C	S	.	.			trans	-72.1	50.9	-174.3	-70	-72.1	-60.7	0	0	115	V104 S106 A113 V114 R117	V104-M108 HydrophobicContact CG1-SD 4.33Å; V104-M108 WeakPolarHBondContact O-CG 3.46Å; S106-M108 VanDerWaalsContact C-N 3.33Å; S106-M108 PolarHBondContact O-N 3.26Å; M108-A113 HydrophobicContact CE-CB 3.86Å; M108-A113 HydrophobicContact SD-CB 4.24Å; M108-V114 HydrophobicContact CE-CG2 4.17Å; M108-R117 VanDerWaalsContact CE-CD 3.47Å; M108-R117 HydrophobicContact CE-CG 4.11Å; M108-R117 VanDerWaalsContact CE-NE 3.25Å; M108-R117 VanDerWaalsContact SD-CZ 3.58Å
109	H	53.5	Low	64.8	Low	136 Å²	136	67.2 Å²	67.2	63%	0.63	35%	0.346	S	S	*	.			trans	-88	-5.9	175	-80.2	-76.1	0	0	0	114.5	D107 E111	D107-H109 PolarHBondContact O-N 3.19Å; H109-E111 PolarHBondContact O-N 3.3Å
110	D	62.7	Low	64.9	Low	73 Å²	73	69.1 Å²	69.1	39%	0.39	35%	0.353	S	S	.	.			trans	-83.1	116	177.1	-67.1	-17.6	0	0	0	110.6	E112 A113 V114 R419	D110-E112 PolarHBondContact O-N 3.48Å; D110-E112 VanDerWaalsContact O-N 3.17Å; D110-A113 HydrophobicContact CB-CB 4.08Å; D110-A113 PolarHBondContact O-N 3.27Å; D110-V114 PolarHBondContact O-N 3.22Å; D110-V114 VanDerWaalsContact O-N 3.1Å; D110-R419 IonicContact OD2-CZ 3.45Å; D110-R419 IonicContact OD2-NH1 3.16Å; D110-R419 PolarHBondContact OD2-NH1 2.85Å; D110-R419 IonicContact OD2-NH2 3.54Å
111	E	65.2	Low	64.9	Low	130 Å²	130	69.2 Å²	69.2	61%	0.607	35%	0.351	S	S	*	.	H	α-helix	trans	-54.8	-33.7	177.8	-63.9	-174.7	160.8	0	0	112.6	H109 V114 A115 Y124	H109-E111 PolarHBondContact O-N 3.3Å; E111-V114 PolarHBondContact O-N 3.49Å; E111-A115 WeakPolarHBondContact O-CB 3.12Å; E111-A115 PolarHBondContact O-N 3.44Å; E111-Y124 HydrophobicContact CB-CE2 3.65Å; E111-Y124 WeakPolarHBondContact CB-OH 3.22Å; E111-Y124 PolarHBondContact OE2-OH 3.45Å
112	E	64.9	Low	65	Low	81 Å²	81	66.7 Å²	66.7	38%	0.379	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-42.7	175.7	-171.5	177.7	-173.2	0	0	112	D110 V114 A115 K116 Y124	D110-E112 PolarHBondContact O-N 3.48Å; D110-E112 VanDerWaalsContact O-N 3.17Å; E112-V114 VanDerWaalsContact C-N 3.31Å; E112-V114 PolarHBondContact O-N 3.33Å; E112-A115 PolarHBondContact O-N 3.41Å; E112-K116 PolarHBondContact O-N 3.43Å; E112-Y124 HydrophobicContact CB-CE1 4.22Å
113	A	68.5	Low	65.4	Low	35 Å²	35	67.9 Å²	67.9	29%	0.289	36%	0.358	S	S	.	.	H	α-helix	trans	-67.2	-36.1	177.5	0	0	0	0	0	111.5	M108 D110 R117	M108-A113 HydrophobicContact CE-CB 3.86Å; M108-A113 HydrophobicContact SD-CB 4.24Å; D110-A113 HydrophobicContact CB-CB 4.08Å; D110-A113 PolarHBondContact O-N 3.27Å; A113-R117 PolarHBondContact O-N 2.71Å; A113-R117 VanDerWaalsContact O-N 3.17Å
114	V	73.2	Confident	65.8	Low	35 Å²	35	69.5 Å²	69.5	21%	0.212	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-50.3	172.1	176.5	0	0	0	0	110	M108 D110 E111 E112 K116 R117 F118 P137	M108-V114 HydrophobicContact CE-CG2 4.17Å; D110-V114 PolarHBondContact O-N 3.22Å; D110-V114 VanDerWaalsContact O-N 3.1Å; E111-V114 PolarHBondContact O-N 3.49Å; E112-V114 VanDerWaalsContact C-N 3.31Å; E112-V114 PolarHBondContact O-N 3.33Å; V114-K116 VanDerWaalsContact C-N 3.28Å; V114-K116 PolarHBondContact O-N 3.14Å; V114-R117 PolarHBondContact O-N 2.87Å; V114-R117 VanDerWaalsContact O-N 3.12Å; V114-F118 HydrophobicContact CG1-CD2 4.09Å; V114-F118 HydrophobicContact CG1-CE2 4.2Å; V114-F118 WeakPolarHBondContact O-CD2 3.42Å; V114-F118 PolarHBondContact O-N 3.02Å; V114-P137 HydrophobicContact CG1-CB 3.34Å; V114-P137 HydrophobicContact CG1-CG 3.98Å
115	A	70.3	Confident	66.6	Low	5 Å²	5	71 Å²	71	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-56	-43	178.6	0	0	0	0	0	111.9	E111 E112 R117 F118 G119 W120 Y124	E111-A115 WeakPolarHBondContact O-CB 3.12Å; E111-A115 PolarHBondContact O-N 3.44Å; E112-A115 PolarHBondContact O-N 3.41Å; A115-R117 PolarHBondContact O-N 3.37Å; A115-F118 PolarHBondContact O-N 2.88Å; A115-G119 PolarHBondContact O-N 3.27Å; A115-W120 PolarHBondContact O-N 3.29Å; A115-Y124 HydrophobicContact CB-CD1 4.5Å; A115-Y124 HydrophobicContact CB-CD2 4.31Å; A115-Y124 HydrophobicContact CB-CG 3.92Å
116	K	73.4	Confident	67.8	Low	147 Å²	147	71 Å²	71	64%	0.639	37%	0.371	S	S	*	.	H	α-helix	trans	-62.1	-41.5	176.5	-170.9	172.5	-175.8	170.4	0	113.4	E112 V114 F118 G119	E112-K116 PolarHBondContact O-N 3.43Å; V114-K116 VanDerWaalsContact C-N 3.28Å; V114-K116 PolarHBondContact O-N 3.14Å; K116-F118 VanDerWaalsContact C-N 3.29Å; K116-F118 PolarHBondContact O-N 3.01Å; K116-G119 PolarHBondContact O-N 3.39Å
117	R	72.7	Confident	68.6	Low	82 Å²	82	71.6 Å²	71.6	31%	0.309	38%	0.383	S	S	.	.	H	α-helix	trans	-63	-35	177.1	-78.9	-169.6	-179.4	-169.1	-7.9	112.8	V104 D105 M108 A113 V114 A115 P239	V104-R117 PolarHBondContact O-NH2 2.95Å; D105-R117 IonicContact OD1-CZ 3.41Å; D105-R117 IonicContact OD1-NH1 2.76Å; D105-R117 IonicContact OD1-NH2 2.63Å; D105-R117 PolarHBondContact OD1-NH2 3.15Å; M108-R117 VanDerWaalsContact CE-CD 3.47Å; M108-R117 HydrophobicContact CE-CG 4.11Å; M108-R117 VanDerWaalsContact CE-NE 3.25Å; M108-R117 VanDerWaalsContact SD-CZ 3.58Å; A113-R117 PolarHBondContact O-N 2.71Å; A113-R117 VanDerWaalsContact O-N 3.17Å; V114-R117 PolarHBondContact O-N 2.87Å; V114-R117 VanDerWaalsContact O-N 3.12Å; A115-R117 PolarHBondContact O-N 3.37Å; R117-P239 WeakPolarHBondContact O-CB 3.43Å
118	F	79	Confident	69.7	Low	20 Å²	20	75.4 Å²	75.4	9%	0.088	40%	0.403	C	S	.	.	H	α-helix	trans	-86.2	-8.2	178.3	-76.6	-90.9	0	0	0	113.5	V114 A115 K116 W120 K136 P137 W140 F237 P239	V114-F118 HydrophobicContact CG1-CD2 4.09Å; V114-F118 HydrophobicContact CG1-CE2 4.2Å; V114-F118 WeakPolarHBondContact O-CD2 3.42Å; V114-F118 PolarHBondContact O-N 3.02Å; A115-F118 PolarHBondContact O-N 2.88Å; K116-F118 VanDerWaalsContact C-N 3.29Å; K116-F118 PolarHBondContact O-N 3.01Å; F118-W120 HydrophobicContact CB-CD2 3.59Å; F118-W120 HydrophobicContact CB-CE3 3.46Å; F118-W120 VanDerWaalsContact CB-CE3 3.46Å; F118-W120 HydrophobicContact CB-CG 4.19Å; F118-W120 HydrophobicContact CB-CH2 4.22Å; F118-W120 HydrophobicContact CB-CZ2 4.31Å; F118-W120 HydrophobicContact CB-CZ3 3.77Å; F118-W120 HydrophobicContact CD1-CE3 4.46Å; F118-W120 AromaticContact CD1-CH2 3.82Å; F118-W120 HydrophobicContact CD1-CH2 3.82Å; F118-W120 HydrophobicContact CD1-CZ2 4.24Å; F118-W120 AromaticContact CD1-CZ3 3.9Å; F118-W120 HydrophobicContact CD1-CZ3 3.9Å; F118-W120 HydrophobicContact CG-CE3 4.02Å; F118-W120 HydrophobicContact CG-CH2 4.2Å; F118-W120 AromaticContact CG-CZ3 3.82Å; F118-W120 HydrophobicContact CG-CZ3 3.82Å; F118-K136 HydrophobicContact CD1-CD 3.84Å; F118-K136 HydrophobicContact CD1-CG 4.47Å; F118-K136 HydrophobicContact CE1-CD 3.61Å; F118-K136 HydrophobicContact CE1-CG 3.82Å; F118-P137 HydrophobicContact CD2-CB 4.16Å; F118-P137 HydrophobicContact CE2-CB 3.57Å; F118-P137 HydrophobicContact CZ-CB 3.95Å; F118-W140 HydrophobicContact CE2-CE3 4.35Å; F118-W140 HydrophobicContact CZ-CB 4.36Å; F118-W140 HydrophobicContact CZ-CD2 4.34Å; F118-W140 HydrophobicContact CZ-CE3 4.22Å; F118-W140 HydrophobicContact CZ-CG 4.42Å; F118-F237 WeakPolarHBondContact CE1-O 3.34Å; F118-P239 HydrophobicContact CD1-CB 3.83Å; F118-P239 HydrophobicContact CE1-CB 3.93Å; F118-P239 HydrophobicContact CG-CB 4.18Å; F118-P239 HydrophobicContact CZ-CB 4.35Å
119	G	73.3	Confident	70.8	Confident	63 Å²	63	75.1 Å²	75.1	65%	0.649	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	26.4	-176.6	0	0	0	0	0	113.5	A115 K116	A115-G119 PolarHBondContact O-N 3.27Å; K116-G119 PolarHBondContact O-N 3.39Å
120	W	74.5	Confident	72.1	Confident	43 Å²	43	71.3 Å²	71.3	16%	0.163	39%	0.391	C	S	.	.			trans	-109.7	30	-178.2	-58.9	-31.8	0	0	0	112.4	A115 F118 D122 D123 Y124 Q133 K136	A115-W120 PolarHBondContact O-N 3.29Å; F118-W120 HydrophobicContact CB-CD2 3.59Å; F118-W120 HydrophobicContact CB-CE3 3.46Å; F118-W120 VanDerWaalsContact CB-CE3 3.46Å; F118-W120 HydrophobicContact CB-CG 4.19Å; F118-W120 HydrophobicContact CB-CH2 4.22Å; F118-W120 HydrophobicContact CB-CZ2 4.31Å; F118-W120 HydrophobicContact CB-CZ3 3.77Å; F118-W120 HydrophobicContact CD1-CE3 4.46Å; F118-W120 AromaticContact CD1-CH2 3.82Å; F118-W120 HydrophobicContact CD1-CH2 3.82Å; F118-W120 HydrophobicContact CD1-CZ2 4.24Å; F118-W120 AromaticContact CD1-CZ3 3.9Å; F118-W120 HydrophobicContact CD1-CZ3 3.9Å; F118-W120 HydrophobicContact CG-CE3 4.02Å; F118-W120 HydrophobicContact CG-CH2 4.2Å; F118-W120 AromaticContact CG-CZ3 3.82Å; F118-W120 HydrophobicContact CG-CZ3 3.82Å; W120-D122 VanDerWaalsContact C-N 3.33Å; W120-D122 PolarHBondContact O-N 2.99Å; W120-D123 HydrophobicContact CB-CB 4.31Å; W120-D123 PolarHBondContact O-N 2.92Å; W120-Y124 VanDerWaalsContact O-CB 3.3Å; W120-Y124 WeakPolarHBondContact O-CB 3.27Å; W120-Y124 PolarHBondContact O-N 3.33Å; W120-Q133 HydrophobicContact CD2-CB 4.3Å; W120-Q133 HydrophobicContact CD2-CG 3.83Å; W120-Q133 HydrophobicContact CE3-CB 3.86Å; W120-Q133 HydrophobicContact CE3-CG 3.9Å; W120-Q133 HydrophobicContact CH2-CB 3.92Å; W120-Q133 HydrophobicContact CH2-CG 3.67Å; W120-Q133 HydrophobicContact CZ2-CB 4.39Å; W120-Q133 HydrophobicContact CZ2-CG 3.64Å; W120-Q133 VanDerWaalsContact CZ3-CA 3.49Å; W120-Q133 HydrophobicContact CZ3-CB 3.68Å; W120-Q133 HydrophobicContact CZ3-CG 3.85Å; W120-Q133 WeakPolarHBondContact CZ3-O 3.29Å; W120-K136 HydrophobicContact CH2-CB 4.08Å; W120-K136 HydrophobicContact CH2-CD 3.5Å; W120-K136 HydrophobicContact CH2-CG 4.32Å; W120-K136 HydrophobicContact CZ2-CD 4.01Å
121	E	71.1	Confident	73	Confident	72 Å²	72	77.2 Å²	77.2	34%	0.336	41%	0.408	S	S	.	.	H	α-helix	trans	-60	-43.9	-179.7	-170.5	169.2	174.8	0	0	111	Y124 I125	E121-Y124 PolarHBondContact O-N 3.31Å; E121-I125 HydrophobicContact CG-CD1 3.92Å; E121-I125 WeakPolarHBondContact O-CB 3.41Å; E121-I125 WeakPolarHBondContact O-CD1 3.47Å; E121-I125 WeakPolarHBondContact O-CG1 3.38Å; E121-I125 PolarHBondContact O-N 3.02Å
122	D	71.3	Confident	73.8	Confident	132 Å²	132	76.5 Å²	76.5	71%	0.706	40%	0.4	S	S	*	.	H	α-helix	trans	-67	-41.6	178.3	-62.1	-35.8	0	0	0	112.8	W120 Y124 I125 S126	W120-D122 VanDerWaalsContact C-N 3.33Å; W120-D122 PolarHBondContact O-N 2.99Å; D122-Y124 VanDerWaalsContact C-N 3.32Å; D122-Y124 PolarHBondContact O-N 3.35Å; D122-I125 PolarHBondContact O-N 3.03Å; D122-S126 WeakPolarHBondContact O-CB 3.45Å; D122-S126 PolarHBondContact O-N 2.85Å; D122-S126 PolarHBondContact O-OG 3.03Å
123	D	73.9	Confident	74.6	Confident	62 Å²	62	73.9 Å²	73.9	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-67.7	-34.4	177.4	-69.2	-16.4	0	0	0	111.6	W120 S126 G127 N128 Q133	W120-D123 HydrophobicContact CB-CB 4.31Å; W120-D123 PolarHBondContact O-N 2.92Å; D123-S126 WeakPolarHBondContact CA-OG 3.2Å; D123-S126 PolarHBondContact O-OG 3.36Å; D123-S126 VanDerWaalsContact O-OG 3.12Å; D123-G127 PolarHBondContact O-N 2.8Å; D123-N128 PolarHBondContact O-N 3.37Å; D123-N128 VanDerWaalsContact O-N 3.15Å; D123-Q133 PolarHBondContact OD2-NE2 3.5Å
124	Y	69.1	Low	75.1	Confident	74 Å²	74	78.9 Å²	78.9	29%	0.29	40%	0.399	S	S	.	.	H	α-helix	trans	-68.4	-47.7	174.7	-177.5	-99.6	0	0	0	111.8	E111 E112 A115 W120 E121 D122 S126 G127 L129	E111-Y124 HydrophobicContact CB-CE2 3.65Å; E111-Y124 WeakPolarHBondContact CB-OH 3.22Å; E111-Y124 PolarHBondContact OE2-OH 3.45Å; E112-Y124 HydrophobicContact CB-CE1 4.22Å; A115-Y124 HydrophobicContact CB-CD1 4.5Å; A115-Y124 HydrophobicContact CB-CD2 4.31Å; A115-Y124 HydrophobicContact CB-CG 3.92Å; W120-Y124 VanDerWaalsContact O-CB 3.3Å; W120-Y124 WeakPolarHBondContact O-CB 3.27Å; W120-Y124 PolarHBondContact O-N 3.33Å; E121-Y124 PolarHBondContact O-N 3.31Å; D122-Y124 VanDerWaalsContact C-N 3.32Å; D122-Y124 PolarHBondContact O-N 3.35Å; Y124-S126 VanDerWaalsContact C-N 3.31Å; Y124-S126 PolarHBondContact O-N 3.06Å; Y124-G127 PolarHBondContact O-N 3.5Å; Y124-G127 VanDerWaalsContact O-N 3.12Å; Y124-L129 HydrophobicContact CD2-CD1 4Å; Y124-L129 HydrophobicContact CD2-CD2 4.19Å
125	I	71.5	Confident	75.7	Confident	112 Å²	112	79.7 Å²	79.7	57%	0.574	40%	0.402	S	S	*	.	H	α-helix	trans	-63.8	-37.6	178.7	-67.4	165.6	0	0	0	111.3	E121 D122 G127	E121-I125 HydrophobicContact CG-CD1 3.92Å; E121-I125 WeakPolarHBondContact O-CB 3.41Å; E121-I125 WeakPolarHBondContact O-CD1 3.47Å; E121-I125 WeakPolarHBondContact O-CG1 3.38Å; E121-I125 PolarHBondContact O-N 3.02Å; D122-I125 PolarHBondContact O-N 3.03Å; I125-G127 PolarHBondContact O-N 3.33Å
126	S	76.3	Confident	76.5	Confident	66 Å²	66	80.8 Å²	80.8	46%	0.462	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-7	177	61.5	0	0	0	0	114.3	D122 D123 Y124 N128	D122-S126 WeakPolarHBondContact O-CB 3.45Å; D122-S126 PolarHBondContact O-N 2.85Å; D122-S126 PolarHBondContact O-OG 3.03Å; D123-S126 WeakPolarHBondContact CA-OG 3.2Å; D123-S126 PolarHBondContact O-OG 3.36Å; D123-S126 VanDerWaalsContact O-OG 3.12Å; Y124-S126 VanDerWaalsContact C-N 3.31Å; Y124-S126 PolarHBondContact O-N 3.06Å; S126-N128 PolarHBondContact O-N 3.39Å
127	G	73.3	Confident	76.9	Confident	47 Å²	47	74.6 Å²	74.6	49%	0.485	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	2.1	-178.7	0	0	0	0	0	114.9	D123 Y124 I125 L129	D123-G127 PolarHBondContact O-N 2.8Å; Y124-G127 PolarHBondContact O-N 3.5Å; Y124-G127 VanDerWaalsContact O-N 3.12Å; I125-G127 PolarHBondContact O-N 3.33Å; G127-L129 PolarHBondContact O-N 3.48Å
128	N	74.3	Confident	77.4	Confident	127 Å²	127	78 Å²	78	68%	0.679	40%	0.398	S	S	*	.			trans	-93.5	43.1	-172.5	-75.5	-27.7	0	0	0	113.3	D123 S126 S130	D123-N128 PolarHBondContact O-N 3.37Å; D123-N128 VanDerWaalsContact O-N 3.15Å; S126-N128 PolarHBondContact O-N 3.39Å; N128-S130 PolarHBondContact O-N 3.01Å
129	L	74.6	Confident	77.7	Confident	36 Å²	36	78.4 Å²	78.4	19%	0.188	40%	0.402	C	S	.	.			trans	-74.8	121.8	176.2	-63.1	87	0	0	0	111.5	Y124 G127 Q133 R134	Y124-L129 HydrophobicContact CD2-CD1 4Å; Y124-L129 HydrophobicContact CD2-CD2 4.19Å; G127-L129 PolarHBondContact O-N 3.48Å; L129-Q133 HydrophobicContact CB-CB 4.4Å; L129-R134 HydrophobicContact CB-CG 4.02Å; L129-R134 HydrophobicContact CD2-CG 4.39Å; L129-R134 PolarHBondContact O-NE 2.9Å
130	S	80.8	Confident	78.3	Confident	56 Å²	56	77.2 Å²	77.2	39%	0.392	38%	0.377	S	S	.	.			trans	-59.8	157.9	167.7	65.8	0	0	0	0	112	N128 W132 Q133 R134	N128-S130 PolarHBondContact O-N 3.01Å; S130-W132 VanDerWaalsContact C-N 3.26Å; S130-W132 PolarHBondContact O-N 2.83Å; S130-Q133 PolarHBondContact O-N 3.4Å; S130-Q133 VanDerWaalsContact O-N 3.15Å; S130-Q133 WeakPolarHBondContact OG-CB 3.48Å; S130-Q133 VanDerWaalsContact OG-CD 3.27Å; S130-Q133 WeakPolarHBondContact OG-CG 3.34Å; S130-Q133 PolarHBondContact OG-N 2.58Å; S130-Q133 PolarHBondContact OG-OE1 3.16Å; S130-R134 PolarHBondContact O-N 3.22Å; S130-R134 VanDerWaalsContact O-N 3.12Å
131	W	82.6	Confident	78.7	Confident	196 Å²	196	76.3 Å²	76.3	74%	0.742	38%	0.379	S	S	*	.	H	α-helix	trans	-57.2	-40.1	175	174.3	73.7	0	0	0	112.4	R134 L135	W131-R134 PolarHBondContact O-N 2.87Å; W131-R134 VanDerWaalsContact O-N 3.16Å; W131-L135 HydrophobicContact CH2-CD2 3.84Å; W131-L135 HydrophobicContact CZ2-CD2 3.81Å; W131-L135 HydrophobicContact CZ3-CD2 4.44Å; W131-L135 PolarHBondContact O-N 2.63Å
132	W	82.4	Confident	79.4	Confident	116 Å²	116	74.7 Å²	74.7	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-41.3	176.4	-176.4	-107.7	0	0	0	112.4	S130 R134 L135 K136 V236 F237	S130-W132 VanDerWaalsContact C-N 3.26Å; S130-W132 PolarHBondContact O-N 2.83Å; W132-R134 PolarHBondContact O-N 3.22Å; W132-L135 PolarHBondContact O-N 2.76Å; W132-K136 VanDerWaalsContact O-CB 3.26Å; W132-K136 WeakPolarHBondContact O-CB 3.46Å; W132-K136 PolarHBondContact O-N 3.31Å; W132-V236 HydrophobicContact CZ2-CG1 4.46Å; W132-F237 HydrophobicContact CH2-CD1 4.01Å; W132-F237 AromaticContact CH2-CE1 3.21Å; W132-F237 HydrophobicContact CH2-CE1 3.21Å; W132-F237 AromaticContact CH2-CZ 3.77Å; W132-F237 HydrophobicContact CH2-CZ 3.77Å; W132-F237 HydrophobicContact CZ2-CD1 4.06Å; W132-F237 AromaticContact CZ2-CE1 3.73Å; W132-F237 HydrophobicContact CZ2-CE1 3.73Å; W132-F237 AromaticContact CZ3-CE1 3.74Å; W132-F237 HydrophobicContact CZ3-CE1 3.74Å; W132-F237 HydrophobicContact CZ3-CZ 4.29Å
133	Q	81.3	Confident	80.1	Confident	26 Å²	26	69.7 Å²	69.7	12%	0.121	35%	0.345	C	S	.	.	H	α-helix	trans	-63.7	-28.4	175.3	-74.4	167.7	-44.2	0	0	112.5	W120 D123 L129 S130 P137	W120-Q133 HydrophobicContact CD2-CB 4.3Å; W120-Q133 HydrophobicContact CD2-CG 3.83Å; W120-Q133 HydrophobicContact CE3-CB 3.86Å; W120-Q133 HydrophobicContact CE3-CG 3.9Å; W120-Q133 HydrophobicContact CH2-CB 3.92Å; W120-Q133 HydrophobicContact CH2-CG 3.67Å; W120-Q133 HydrophobicContact CZ2-CB 4.39Å; W120-Q133 HydrophobicContact CZ2-CG 3.64Å; W120-Q133 VanDerWaalsContact CZ3-CA 3.49Å; W120-Q133 HydrophobicContact CZ3-CB 3.68Å; W120-Q133 HydrophobicContact CZ3-CG 3.85Å; W120-Q133 WeakPolarHBondContact CZ3-O 3.29Å; D123-Q133 PolarHBondContact OD2-NE2 3.5Å; L129-Q133 HydrophobicContact CB-CB 4.4Å; S130-Q133 PolarHBondContact O-N 3.4Å; S130-Q133 VanDerWaalsContact O-N 3.15Å; S130-Q133 WeakPolarHBondContact OG-CB 3.48Å; S130-Q133 VanDerWaalsContact OG-CD 3.27Å; S130-Q133 WeakPolarHBondContact OG-CG 3.34Å; S130-Q133 PolarHBondContact OG-N 2.58Å; S130-Q133 PolarHBondContact OG-OE1 3.16Å; Q133-P137 WeakPolarHBondContact O-CD 3.39Å; Q133-P137 VanDerWaalsContact O-CG 3.31Å; Q133-P137 WeakPolarHBondContact O-CG 3.47Å
134	R	79.5	Confident	80.4	Confident	139 Å²	139	68.6 Å²	68.6	53%	0.525	34%	0.339	S	S	.	.	H	α-helix	trans	-79.5	-33.9	173.8	-64.7	175.5	-177.1	-115.5	1.2	112.9	L129 S130 W131 W132 K138	L129-R134 HydrophobicContact CB-CG 4.02Å; L129-R134 HydrophobicContact CD2-CG 4.39Å; L129-R134 PolarHBondContact O-NE 2.9Å; S130-R134 PolarHBondContact O-N 3.22Å; S130-R134 VanDerWaalsContact O-N 3.12Å; W131-R134 PolarHBondContact O-N 2.87Å; W131-R134 VanDerWaalsContact O-N 3.16Å; W132-R134 PolarHBondContact O-N 3.22Å; R134-K138 WeakPolarHBondContact O-CG 3.32Å
135	L	85.1	Confident	80.9	Confident	53 Å²	53	66.2 Å²	66.2	28%	0.277	33%	0.331	S	S	.	.	H	α-helix	trans	-80.1	-45.2	-178	-177.6	64.1	0	0	0	112.5	W131 W132 K138 V139	W131-L135 HydrophobicContact CH2-CD2 3.84Å; W131-L135 HydrophobicContact CZ2-CD2 3.81Å; W131-L135 HydrophobicContact CZ3-CD2 4.44Å; W131-L135 PolarHBondContact O-N 2.63Å; W132-L135 PolarHBondContact O-N 2.76Å; L135-K138 WeakPolarHBondContact O-CB 3.5Å; L135-K138 PolarHBondContact O-N 3.07Å; L135-V139 HydrophobicContact CD1-CG2 3.67Å; L135-V139 HydrophobicContact CG-CG2 3.86Å; L135-V139 PolarHBondContact O-N 2.78Å
136	K	86.4	Confident	81	Confident	27 Å²	27	61.3 Å²	61.3	12%	0.117	31%	0.306	C	S	.	.	H	α-helix	trans	-48.7	-52.1	-176.4	-173.7	-170	-172	-167.8	0	113.9	F118 W120 W132 K138 V139 W140 F237 C238	F118-K136 HydrophobicContact CD1-CD 3.84Å; F118-K136 HydrophobicContact CD1-CG 4.47Å; F118-K136 HydrophobicContact CE1-CD 3.61Å; F118-K136 HydrophobicContact CE1-CG 3.82Å; W120-K136 HydrophobicContact CH2-CB 4.08Å; W120-K136 HydrophobicContact CH2-CD 3.5Å; W120-K136 HydrophobicContact CH2-CG 4.32Å; W120-K136 HydrophobicContact CZ2-CD 4.01Å; W132-K136 VanDerWaalsContact O-CB 3.26Å; W132-K136 WeakPolarHBondContact O-CB 3.46Å; W132-K136 PolarHBondContact O-N 3.31Å; K136-K138 VanDerWaalsContact C-N 3.35Å; K136-K138 PolarHBondContact O-N 3.38Å; K136-V139 PolarHBondContact O-N 3.44Å; K136-W140 WeakPolarHBondContact O-CB 3.1Å; K136-W140 PolarHBondContact O-N 2.84Å; K136-F237 HydrophobicContact CB-CD1 4.18Å; K136-F237 WeakPolarHBondContact CE-O 3.23Å; K136-F237 HydrophobicContact CG-CB 4.19Å; K136-F237 HydrophobicContact CG-CD1 3.93Å; K136-F237 WeakPolarHBondContact CG-O 3.49Å; K136-C238 WeakPolarHBondContact CE-O 3.28Å; K136-C238 PolarHBondContact NZ-O 3.43Å
137	P	81.8	Confident	80.8	Confident	18 Å²	18	63.2 Å²	63.2	12%	0.117	30%	0.303	C	S	.	.	H	α-helix	trans	-66	-36	179.2	24.3	-34	0	0	0	112.8	V114 F118 Q133 A141	V114-P137 HydrophobicContact CG1-CB 3.34Å; V114-P137 HydrophobicContact CG1-CG 3.98Å; F118-P137 HydrophobicContact CD2-CB 4.16Å; F118-P137 HydrophobicContact CE2-CB 3.57Å; F118-P137 HydrophobicContact CZ-CB 3.95Å; Q133-P137 WeakPolarHBondContact O-CD 3.39Å; Q133-P137 VanDerWaalsContact O-CG 3.31Å; Q133-P137 WeakPolarHBondContact O-CG 3.47Å; P137-A141 VanDerWaalsContact O-CB 3.24Å; P137-A141 WeakPolarHBondContact O-CB 3.36Å; P137-A141 PolarHBondContact O-N 3.45Å
138	K	82.9	Confident	80.9	Confident	153 Å²	153	62.4 Å²	62.4	67%	0.665	29%	0.29	S	S	*	.	H	α-helix	trans	-65.3	-45.3	179	-67.8	-177.9	179.4	-175.1	0	111.5	R134 L135 K136 L142	R134-K138 WeakPolarHBondContact O-CG 3.32Å; L135-K138 WeakPolarHBondContact O-CB 3.5Å; L135-K138 PolarHBondContact O-N 3.07Å; K136-K138 VanDerWaalsContact C-N 3.35Å; K136-K138 PolarHBondContact O-N 3.38Å; K138-L142 WeakPolarHBondContact O-CB 3.41Å; K138-L142 PolarHBondContact O-N 3.4Å
139	V	86.9	Confident	81.3	Confident	29 Å²	29	58.1 Å²	58.1	18%	0.176	27%	0.27	C	S	.	.	H	α-helix	trans	-69.7	-40.4	178.4	179.8	0	0	0	0	111	L135 K136 L142 F143 I233 F237	L135-V139 HydrophobicContact CD1-CG2 3.67Å; L135-V139 HydrophobicContact CG-CG2 3.86Å; L135-V139 PolarHBondContact O-N 2.78Å; K136-V139 PolarHBondContact O-N 3.44Å; V139-L142 WeakPolarHBondContact O-CB 3.3Å; V139-L142 PolarHBondContact O-N 3.46Å; V139-F143 HydrophobicContact CG1-CD2 4.47Å; V139-F143 PolarHBondContact O-N 3.2Å; V139-I233 HydrophobicContact CG1-CG2 3.84Å; V139-F237 HydrophobicContact CB-CD1 4.15Å; V139-F237 HydrophobicContact CB-CD2 4.21Å; V139-F237 HydrophobicContact CB-CE1 4.25Å; V139-F237 HydrophobicContact CB-CE2 4.37Å; V139-F237 HydrophobicContact CB-CG 4.12Å; V139-F237 HydrophobicContact CB-CZ 4.38Å; V139-F237 HydrophobicContact CG1-CD1 4.33Å; V139-F237 HydrophobicContact CG1-CD2 3.53Å; V139-F237 HydrophobicContact CG1-CE1 4.33Å; V139-F237 HydrophobicContact CG1-CE2 3.59Å; V139-F237 HydrophobicContact CG1-CG 3.94Å; V139-F237 HydrophobicContact CG1-CZ 4Å; V139-F237 HydrophobicContact CG2-CE1 4.45Å
140	W	85.9	Confident	81.7	Confident	37 Å²	37	61.9 Å²	61.9	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-48.5	174.6	177.7	72.4	0	0	0	111.6	F118 K136 L142 F143 D144 F237	F118-W140 HydrophobicContact CE2-CE3 4.35Å; F118-W140 HydrophobicContact CZ-CB 4.36Å; F118-W140 HydrophobicContact CZ-CD2 4.34Å; F118-W140 HydrophobicContact CZ-CE3 4.22Å; F118-W140 HydrophobicContact CZ-CG 4.42Å; K136-W140 WeakPolarHBondContact O-CB 3.1Å; K136-W140 PolarHBondContact O-N 2.84Å; W140-L142 VanDerWaalsContact C-N 3.25Å; W140-L142 PolarHBondContact O-N 3.07Å; W140-F143 PolarHBondContact O-N 3.03Å; W140-D144 HydrophobicContact CD2-CB 4.47Å; W140-D144 HydrophobicContact CZ2-CB 4.18Å; W140-D144 WeakPolarHBondContact CZ2-OD2 3.25Å; W140-D144 PolarHBondContact NE1-OD2 3.47Å; W140-D144 WeakPolarHBondContact O-CB 3.49Å; W140-D144 PolarHBondContact O-N 3.27Å; W140-F237 HydrophobicContact CB-CB 3.96Å
141	A	81.6	Confident	82	Confident	24 Å²	24	62.1 Å²	62.1	20%	0.198	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-32.8	177.5	0	0	0	0	0	112.9	P137 F143 E145 S148	P137-A141 VanDerWaalsContact O-CB 3.24Å; P137-A141 WeakPolarHBondContact O-CB 3.36Å; P137-A141 PolarHBondContact O-N 3.45Å; A141-F143 VanDerWaalsContact C-N 3.29Å; A141-F143 PolarHBondContact O-N 3.24Å; A141-E145 CarbonylContact O-C 3.4Å; A141-E145 WeakPolarHBondContact O-CA 3.37Å; A141-E145 PolarHBondContact O-N 3.02Å; A141-S148 PolarHBondContact O-OG 3Å; A141-S148 VanDerWaalsContact O-OG 3.05Å
142	L	85.6	Confident	82.3	Confident	38 Å²	38	52.8 Å²	52.8	20%	0.199	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-36.2	177.9	-175.5	69.6	0	0	0	113	K138 V139 W140 S151 A152 I155	K138-L142 WeakPolarHBondContact O-CB 3.41Å; K138-L142 PolarHBondContact O-N 3.4Å; V139-L142 WeakPolarHBondContact O-CB 3.3Å; V139-L142 PolarHBondContact O-N 3.46Å; W140-L142 VanDerWaalsContact C-N 3.25Å; W140-L142 PolarHBondContact O-N 3.07Å; L142-S151 WeakPolarHBondContact CD1-OG 3.5Å; L142-A152 HydrophobicContact CD1-CB 3.95Å; L142-A152 VanDerWaalsContact CD1-N 3.3Å; L142-A152 WeakPolarHBondContact O-CB 3.44Å; L142-I155 HydrophobicContact CD1-CD1 3.84Å; L142-I155 HydrophobicContact CD2-CD1 3.56Å; L142-I155 HydrophobicContact CG-CD1 3.47Å; L142-I155 VanDerWaalsContact CG-CD1 3.47Å
143	F	85.9	Confident	82.5	Confident	28 Å²	28	52.7 Å²	52.7	12%	0.123	26%	0.264	C	S	.	.	H	α-helix	trans	-97.2	-36.8	-177.9	-79.8	-92.9	0	0	0	113	V139 W140 A141 I155 E230 I233 R234	V139-F143 HydrophobicContact CG1-CD2 4.47Å; V139-F143 PolarHBondContact O-N 3.2Å; W140-F143 PolarHBondContact O-N 3.03Å; A141-F143 VanDerWaalsContact C-N 3.29Å; A141-F143 PolarHBondContact O-N 3.24Å; F143-I155 HydrophobicContact CD1-CG2 4.07Å; F143-I155 HydrophobicContact CE1-CG2 4.01Å; F143-I155 HydrophobicContact CE2-CD1 4.38Å; F143-I155 HydrophobicContact CZ-CD1 4.34Å; F143-E230 HydrophobicContact CD1-CG 3.68Å; F143-E230 HydrophobicContact CE1-CG 4.07Å; F143-I233 HydrophobicContact CD2-CG2 3.6Å; F143-I233 HydrophobicContact CE1-CD1 4.13Å; F143-I233 HydrophobicContact CE2-CD1 4.03Å; F143-I233 HydrophobicContact CE2-CG2 3.67Å; F143-I233 HydrophobicContact CG-CG2 4.1Å; F143-I233 HydrophobicContact CZ-CD1 3.6Å; F143-I233 HydrophobicContact CZ-CG2 4.21Å; F143-R234 HydrophobicContact CB-CG 3.93Å; F143-R234 PolarHBondContact O-NE 3.27Å; F143-R234 PolarHBondContact O-NH2 3.41Å
144	D	81.6	Confident	83	Confident	39 Å²	39	56 Å²	56	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-85.6	-35.5	-175.8	-136.5	30.2	0	0	0	112.4	W140 P146 R234	W140-D144 HydrophobicContact CD2-CB 4.47Å; W140-D144 HydrophobicContact CZ2-CB 4.18Å; W140-D144 WeakPolarHBondContact CZ2-OD2 3.25Å; W140-D144 PolarHBondContact NE1-OD2 3.47Å; W140-D144 WeakPolarHBondContact O-CB 3.49Å; W140-D144 PolarHBondContact O-N 3.27Å; D144-P146 WeakPolarHBondContact O-CD 3.5Å; D144-R234 IonicContact OD1-NE 3.07Å; D144-R234 PolarHBondContact OD1-NE 3.33Å
145	E	77.9	Confident	83.5	Confident	24 Å²	24	50.7 Å²	50.7	11%	0.112	27%	0.268	C	S	.	.			trans	-115.7	95.5	-173.5	-167.8	56.5	-143.6	0	0	111.4	S106 A141 Y147 S148	S106-E145 VanDerWaalsContact CA-OE1 3.32Å; S106-E145 WeakPolarHBondContact CA-OE1 3.42Å; S106-E145 PolarHBondContact OG-OE1 3.48Å; S106-E145 VanDerWaalsContact OG-OE1 3.07Å; A141-E145 CarbonylContact O-C 3.4Å; A141-E145 WeakPolarHBondContact O-CA 3.37Å; A141-E145 PolarHBondContact O-N 3.02Å; E145-Y147 PolarHBondContact O-N 3.01Å; E145-S148 WeakPolarHBondContact O-CB 3.38Å; E145-S148 PolarHBondContact O-N 3.41Å; E145-S148 VanDerWaalsContact O-N 3.11Å; E145-S148 PolarHBondContact O-OG 3.14Å
146	P	74.2	Confident	83.8	Confident	8 Å²	8	48.7 Å²	48.7	5%	0.052	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.6	-170.3	28	-36.2	0	0	0	113.5	D144 A152 K153 A156	D144-P146 WeakPolarHBondContact O-CD 3.5Å; P146-A152 CarbonylContact O-C 3.6Å; P146-K153 VanDerWaalsContact O-CG 3.22Å; P146-K153 WeakPolarHBondContact O-CG 3.5Å; P146-K153 PolarHBondContact O-N 2.76Å; P146-A156 HydrophobicContact CB-CB 3.6Å
147	Y	73.2	Confident	84	Confident	106 Å²	106	52.4 Å²	52.4	42%	0.416	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-3.8	-179	-56.2	-69.7	0	0	0	113.8	E145 H295	E145-Y147 PolarHBondContact O-N 3.01Å; Y147-H295 PolarHBondContact OH-O 3.08Å
148	S	74.8	Confident	84.5	Confident	30 Å²	30	54 Å²	54	21%	0.21	29%	0.293	C	S	.	.	S	Bend	trans	-67.9	-38.3	-173.9	63.2	0	0	0	0	114.1	A141 E145 A152	A141-S148 PolarHBondContact O-OG 3Å; A141-S148 VanDerWaalsContact O-OG 3.05Å; E145-S148 WeakPolarHBondContact O-CB 3.38Å; E145-S148 PolarHBondContact O-N 3.41Å; E145-S148 VanDerWaalsContact O-N 3.11Å; E145-S148 PolarHBondContact O-OG 3.14Å; S148-A152 WeakPolarHBondContact OG-CB 3.45Å
149	S	82.4	Confident	85	Confident	37 Å²	37	46.8 Å²	46.8	26%	0.259	26%	0.262	S	S	.	.			trans	-145.7	165.4	179.8	74.4	0	0	0	0	112.2	S151 A152 K153	S149-S151 VanDerWaalsContact C-N 3.27Å; S149-S151 PolarHBondContact O-N 3.33Å; S149-S151 PolarHBondContact OG-N 3.39Å; S149-S151 PolarHBondContact OG-OG 3.02Å; S149-A152 WeakPolarHBondContact O-CB 3.35Å; S149-A152 PolarHBondContact O-N 2.95Å; S149-A152 WeakPolarHBondContact OG-CB 3.22Å; S149-A152 PolarHBondContact OG-N 3.46Å; S149-K153 WeakPolarHBondContact O-CG 3.46Å; S149-K153 PolarHBondContact O-N 3.07Å; S149-K153 VanDerWaalsContact O-N 3.13Å
150	T	83.2	Confident	85.3	Confident	116 Å²	116	47.7 Å²	47.7	71%	0.712	27%	0.267	S	S	*	.	H	α-helix	trans	-61.1	-38.8	171.6	47.9	0	0	0	0	111.7	A152 K153 V154	T150-A152 VanDerWaalsContact C-N 3.34Å; T150-K153 WeakPolarHBondContact O-CB 3.47Å; T150-K153 PolarHBondContact O-N 3.5Å; T150-V154 PolarHBondContact O-N 2.96Å
151	S	87.9	Confident	85.7	Confident	61 Å²	61	52.4 Å²	52.4	43%	0.427	29%	0.289	S	S	.	.	H	α-helix	trans	-64.8	-35.9	173.8	47.6	0	0	0	0	112.6	L142 S149 K153 V154 I155	L142-S151 WeakPolarHBondContact CD1-OG 3.5Å; S149-S151 VanDerWaalsContact C-N 3.27Å; S149-S151 PolarHBondContact O-N 3.33Å; S149-S151 PolarHBondContact OG-N 3.39Å; S149-S151 PolarHBondContact OG-OG 3.02Å; S151-K153 VanDerWaalsContact C-N 3.32Å; S151-K153 PolarHBondContact O-N 3.45Å; S151-V154 PolarHBondContact O-N 3.3Å; S151-I155 PolarHBondContact O-N 3.38Å
152	A	86.9	Confident	86.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-40.5	175.3	0	0	0	0	0	110.9	L142 P146 S148 S149 T150 V154 I155 A156	L142-A152 HydrophobicContact CD1-CB 3.95Å; L142-A152 VanDerWaalsContact CD1-N 3.3Å; L142-A152 WeakPolarHBondContact O-CB 3.44Å; P146-A152 CarbonylContact O-C 3.6Å; S148-A152 WeakPolarHBondContact OG-CB 3.45Å; S149-A152 WeakPolarHBondContact O-CB 3.35Å; S149-A152 PolarHBondContact O-N 2.95Å; S149-A152 WeakPolarHBondContact OG-CB 3.22Å; S149-A152 PolarHBondContact OG-N 3.46Å; T150-A152 VanDerWaalsContact C-N 3.34Å; A152-V154 PolarHBondContact O-N 2.93Å; A152-I155 PolarHBondContact O-N 3.43Å; A152-A156 VanDerWaalsContact O-CB 3.32Å; A152-A156 WeakPolarHBondContact O-CB 3.3Å; A152-A156 PolarHBondContact O-N 2.89Å
153	K	87.8	Confident	86.7	Confident	113 Å²	113	50.4 Å²	50.4	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-61.7	-42.1	174.9	-65.9	176.7	-176.2	-179.4	0	112.2	P146 S149 T150 S151 A156 V157	P146-K153 VanDerWaalsContact O-CG 3.22Å; P146-K153 WeakPolarHBondContact O-CG 3.5Å; P146-K153 PolarHBondContact O-N 2.76Å; S149-K153 WeakPolarHBondContact O-CG 3.46Å; S149-K153 PolarHBondContact O-N 3.07Å; S149-K153 VanDerWaalsContact O-N 3.13Å; T150-K153 WeakPolarHBondContact O-CB 3.47Å; T150-K153 PolarHBondContact O-N 3.5Å; S151-K153 VanDerWaalsContact C-N 3.32Å; S151-K153 PolarHBondContact O-N 3.45Å; K153-A156 PolarHBondContact O-N 3.12Å; K153-V157 WeakPolarHBondContact O-CG2 3.11Å; K153-V157 PolarHBondContact O-N 3.25Å
154	V	91.8	Very high	87.2	Confident	95 Å²	95	52.5 Å²	52.5	58%	0.576	29%	0.293	S	S	*	.	H	α-helix	trans	-61.9	-48.9	176.5	175.7	0	0	0	0	110.3	T150 S151 A152 A156 V157 T158	T150-V154 PolarHBondContact O-N 2.96Å; S151-V154 PolarHBondContact O-N 3.3Å; A152-V154 PolarHBondContact O-N 2.93Å; V154-A156 VanDerWaalsContact C-N 3.29Å; V154-A156 PolarHBondContact O-N 3.27Å; V154-V157 PolarHBondContact O-N 3.35Å; V154-T158 PolarHBondContact O-N 3.17Å; V154-T158 PolarHBondContact O-OG1 2.75Å; V154-T158 VanDerWaalsContact O-OG1 3.06Å
155	I	90.7	Very high	87.9	Confident	28 Å²	28	52.8 Å²	52.8	14%	0.144	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-39.3	177.6	-71.5	163.9	0	0	0	111.5	L142 F143 S151 A152 T158 S159 W226	L142-I155 HydrophobicContact CD1-CD1 3.84Å; L142-I155 HydrophobicContact CD2-CD1 3.56Å; L142-I155 HydrophobicContact CG-CD1 3.47Å; L142-I155 VanDerWaalsContact CG-CD1 3.47Å; F143-I155 HydrophobicContact CD1-CG2 4.07Å; F143-I155 HydrophobicContact CE1-CG2 4.01Å; F143-I155 HydrophobicContact CE2-CD1 4.38Å; F143-I155 HydrophobicContact CZ-CD1 4.34Å; S151-I155 PolarHBondContact O-N 3.38Å; A152-I155 PolarHBondContact O-N 3.43Å; I155-T158 PolarHBondContact O-N 3.47Å; I155-S159 WeakPolarHBondContact O-CB 3.27Å; I155-S159 PolarHBondContact O-N 3.39Å; I155-S159 PolarHBondContact O-OG 3.47Å; I155-W226 HydrophobicContact CG2-CZ2 4.4Å
156	A	90.1	Very high	88.6	Confident	12 Å²	12	52 Å²	52	10%	0.099	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-46.9	175.7	0	0	0	0	0	111.8	P146 A152 K153 V154 T158 S159 V160	P146-A156 HydrophobicContact CB-CB 3.6Å; A152-A156 VanDerWaalsContact O-CB 3.32Å; A152-A156 WeakPolarHBondContact O-CB 3.3Å; A152-A156 PolarHBondContact O-N 2.89Å; K153-A156 PolarHBondContact O-N 3.12Å; V154-A156 VanDerWaalsContact C-N 3.29Å; V154-A156 PolarHBondContact O-N 3.27Å; A156-T158 VanDerWaalsContact C-N 3.35Å; A156-T158 PolarHBondContact O-N 3.09Å; A156-S159 PolarHBondContact O-N 3.23Å; A156-V160 WeakPolarHBondContact O-CG2 3.43Å; A156-V160 PolarHBondContact O-N 3.4Å
157	V	91.8	Very high	89.5	Confident	104 Å²	104	53.1 Å²	53.1	63%	0.63	30%	0.299	S	S	*	.	H	α-helix	trans	-61	-44.6	175.6	171.2	0	0	0	0	110.8	K153 V154 S159 V160 F161	K153-V157 WeakPolarHBondContact O-CG2 3.11Å; K153-V157 PolarHBondContact O-N 3.25Å; V154-V157 PolarHBondContact O-N 3.35Å; V157-S159 VanDerWaalsContact C-N 3.32Å; V157-S159 PolarHBondContact O-N 3.26Å; V157-V160 PolarHBondContact O-N 3.46Å; V157-F161 WeakPolarHBondContact O-CB 3.36Å; V157-F161 PolarHBondContact O-N 3Å
158	T	92.2	Very high	90.4	Very high	52 Å²	52	53 Å²	53	32%	0.319	31%	0.305	S	S	.	.	H	α-helix	trans	-59.8	-42.1	174.9	-56.8	0	0	0	0	111.6	V154 I155 A156 F161 T162 W226	V154-T158 PolarHBondContact O-N 3.17Å; V154-T158 PolarHBondContact O-OG1 2.75Å; V154-T158 VanDerWaalsContact O-OG1 3.06Å; I155-T158 PolarHBondContact O-N 3.47Å; A156-T158 VanDerWaalsContact C-N 3.35Å; A156-T158 PolarHBondContact O-N 3.09Å; T158-F161 PolarHBondContact O-N 3.33Å; T158-T162 WeakPolarHBondContact O-CG2 2.94Å; T158-T162 PolarHBondContact O-N 3.01Å; T158-T162 PolarHBondContact O-OG1 3.44Å; T158-W226 HydrophobicContact CG2-CH2 4.1Å; T158-W226 HydrophobicContact CG2-CZ2 3.87Å
159	S	92.4	Very high	91.2	Very high	1 Å²	1	52 Å²	52	1%	0.007	30%	0.297	C	S	.	.	H	α-helix	trans	-68.4	-38.9	179.8	-55.7	0	0	0	0	112.3	I155 A156 V157 T162 I163 W226	I155-S159 WeakPolarHBondContact O-CB 3.27Å; I155-S159 PolarHBondContact O-N 3.39Å; I155-S159 PolarHBondContact O-OG 3.47Å; A156-S159 PolarHBondContact O-N 3.23Å; V157-S159 VanDerWaalsContact C-N 3.32Å; V157-S159 PolarHBondContact O-N 3.26Å; S159-T162 WeakPolarHBondContact CA-OG1 3.42Å; S159-T162 PolarHBondContact O-OG1 3.3Å; S159-I163 WeakPolarHBondContact O-CD1 3.48Å; S159-I163 WeakPolarHBondContact O-CG1 3.44Å; S159-I163 PolarHBondContact O-N 3.1Å; S159-W226 PolarHBondContact OG-NE1 3.19Å
160	V	93	Very high	91.6	Very high	48 Å²	48	52 Å²	52	29%	0.291	29%	0.293	S	S	.	.	H	α-helix	trans	-64.4	-43.3	172.4	172.7	0	0	0	0	110.5	A156 V157 I163 C164 L292 H295	A156-V160 WeakPolarHBondContact O-CG2 3.43Å; A156-V160 PolarHBondContact O-N 3.4Å; V157-V160 PolarHBondContact O-N 3.46Å; V160-I163 WeakPolarHBondContact O-CB 3.49Å; V160-I163 PolarHBondContact O-N 3.01Å; V160-C164 PolarHBondContact O-N 3.41Å; V160-C164 PolarHBondContact O-SG 3.26Å; V160-C164 VanDerWaalsContact O-SG 3.34Å; V160-L292 HydrophobicContact CB-CD2 4.42Å; V160-L292 HydrophobicContact CG1-CD2 4.08Å; V160-L292 HydrophobicContact CG2-CD2 3.98Å; V160-H295 HydrophobicContact CG2-CB 4.13Å
161	F	95.1	Very high	91.9	Very high	136 Å²	136	49.7 Å²	49.7	60%	0.596	28%	0.281	S	S	*	.	H	α-helix	trans	-61.4	-45.1	177	178.6	-99.5	0	0	0	112.2	V157 T158 I163 C164 V165	V157-F161 WeakPolarHBondContact O-CB 3.36Å; V157-F161 PolarHBondContact O-N 3Å; T158-F161 PolarHBondContact O-N 3.33Å; F161-I163 VanDerWaalsContact C-N 3.31Å; F161-I163 PolarHBondContact O-N 3.46Å; F161-C164 PolarHBondContact O-N 2.91Å; F161-V165 HydrophobicContact CD1-CG2 4.28Å; F161-V165 HydrophobicContact CE1-CG2 3.82Å; F161-V165 HydrophobicContact CE2-CG2 4.21Å; F161-V165 HydrophobicContact CZ-CG2 3.78Å; F161-V165 WeakPolarHBondContact O-CG2 3.36Å; F161-V165 PolarHBondContact O-N 2.78Å
162	T	95	Very high	92.1	Very high	20 Å²	20	49.7 Å²	49.7	12%	0.123	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-33.4	176.8	54.7	0	0	0	0	112.4	T158 S159 S166 W226 F227	T158-T162 WeakPolarHBondContact O-CG2 2.94Å; T158-T162 PolarHBondContact O-N 3.01Å; T158-T162 PolarHBondContact O-OG1 3.44Å; S159-T162 WeakPolarHBondContact CA-OG1 3.42Å; S159-T162 PolarHBondContact O-OG1 3.3Å; T162-S166 VanDerWaalsContact O-CB 3.29Å; T162-S166 WeakPolarHBondContact O-CB 3.08Å; T162-S166 PolarHBondContact O-N 3.17Å; T162-W226 HydrophobicContact CG2-CG 4.19Å; T162-F227 WeakPolarHBondContact OG1-CE1 3.22Å
163	I	93.8	Very high	92.1	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-49.7	170.2	-69.7	163.3	0	0	0	110.4	S159 V160 F161 V165 S166 I167 F227 R288 L289 K291 L292	S159-I163 WeakPolarHBondContact O-CD1 3.48Å; S159-I163 WeakPolarHBondContact O-CG1 3.44Å; S159-I163 PolarHBondContact O-N 3.1Å; V160-I163 WeakPolarHBondContact O-CB 3.49Å; V160-I163 PolarHBondContact O-N 3.01Å; F161-I163 VanDerWaalsContact C-N 3.31Å; F161-I163 PolarHBondContact O-N 3.46Å; I163-V165 PolarHBondContact O-N 2.85Å; I163-S166 WeakPolarHBondContact O-CB 3.44Å; I163-S166 PolarHBondContact O-N 3Å; I163-I167 HydrophobicContact CG2-CG1 4.38Å; I163-I167 WeakPolarHBondContact O-CG1 3.37Å; I163-I167 PolarHBondContact O-N 3.39Å; I163-F227 HydrophobicContact CG1-CE1 3.92Å; I163-F227 HydrophobicContact CG1-CZ 3.94Å; I163-R288 HydrophobicContact CG2-CG 4.4Å; I163-L289 HydrophobicContact CG2-CD2 4.02Å; I163-K291 HydrophobicContact CD1-CB 4.04Å; I163-K291 HydrophobicContact CD1-CD 4.17Å; I163-K291 HydrophobicContact CD1-CG 4.18Å; I163-L292 HydrophobicContact CD1-CD2 3.89Å; I163-L292 HydrophobicContact CD1-CG 4.38Å; I163-L292 HydrophobicContact CG2-CD2 4.3Å; I163-L292 HydrophobicContact CG2-CG 4.4Å
164	C	95.3	Very high	92	Very high	72 Å²	72	49.9 Å²	49.9	49%	0.486	28%	0.283	S	S	.	.	H	α-helix	trans	-59	-46.8	179.5	-68	0	0	0	0	112.2	V160 F161 S166 I167 L168	V160-C164 PolarHBondContact O-N 3.41Å; V160-C164 PolarHBondContact O-SG 3.26Å; V160-C164 VanDerWaalsContact O-SG 3.34Å; F161-C164 PolarHBondContact O-N 2.91Å; C164-S166 VanDerWaalsContact C-N 3.33Å; C164-S166 PolarHBondContact O-N 3.24Å; C164-I167 PolarHBondContact O-N 3.34Å; C164-L168 WeakPolarHBondContact O-CB 3.18Å; C164-L168 PolarHBondContact O-N 2.9Å
165	V	95.7	Very high	91.8	Very high	44 Å²	44	49 Å²	49	27%	0.267	27%	0.273	S	S	.	.	H	α-helix	trans	-61.2	-41.8	176.5	173.2	0	0	0	0	111.1	F161 I163 I167 S169 V219	F161-V165 HydrophobicContact CD1-CG2 4.28Å; F161-V165 HydrophobicContact CE1-CG2 3.82Å; F161-V165 HydrophobicContact CE2-CG2 4.21Å; F161-V165 HydrophobicContact CZ-CG2 3.78Å; F161-V165 WeakPolarHBondContact O-CG2 3.36Å; F161-V165 PolarHBondContact O-N 2.78Å; I163-V165 PolarHBondContact O-N 2.85Å; V165-I167 PolarHBondContact O-N 3.31Å; V165-S169 WeakPolarHBondContact O-CB 2.97Å; V165-S169 PolarHBondContact O-N 3.46Å; V165-V219 HydrophobicContact CG1-CG1 3.72Å
166	S	93	Very high	91.4	Very high	9 Å²	9	52.1 Å²	52.1	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-42	177.8	178.5	0	0	0	0	112.7	T162 I163 C164 F170 R288	T162-S166 VanDerWaalsContact O-CB 3.29Å; T162-S166 WeakPolarHBondContact O-CB 3.08Å; T162-S166 PolarHBondContact O-N 3.17Å; I163-S166 WeakPolarHBondContact O-CB 3.44Å; I163-S166 PolarHBondContact O-N 3Å; C164-S166 VanDerWaalsContact C-N 3.33Å; C164-S166 PolarHBondContact O-N 3.24Å; S166-F170 WeakPolarHBondContact O-CB 2.97Å; S166-F170 PolarHBondContact O-N 3.03Å; S166-R288 WeakPolarHBondContact OG-CD 3.4Å; S166-R288 PolarHBondContact OG-NE 3.33Å
167	I	92.8	Very high	91.2	Very high	30 Å²	30	57.8 Å²	57.8	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-73.5	-41.3	179.8	-62.6	-65.5	0	0	0	111	I163 C164 V165 S169 F170 C171 R288 L289	I163-I167 HydrophobicContact CG2-CG1 4.38Å; I163-I167 WeakPolarHBondContact O-CG1 3.37Å; I163-I167 PolarHBondContact O-N 3.39Å; C164-I167 PolarHBondContact O-N 3.34Å; V165-I167 PolarHBondContact O-N 3.31Å; I167-S169 PolarHBondContact O-N 2.66Å; I167-F170 WeakPolarHBondContact O-CB 3.45Å; I167-F170 PolarHBondContact O-N 2.99Å; I167-C171 PolarHBondContact O-N 3.12Å; I167-C171 PolarHBondContact O-SG 3.19Å; I167-C171 VanDerWaalsContact O-SG 3.35Å; I167-R288 HydrophobicContact CD1-CG 4.24Å; I167-L289 HydrophobicContact CD1-CD1 4.29Å; I167-L289 HydrophobicContact CD1-CD2 4.17Å; I167-L289 HydrophobicContact CD1-CG 3.88Å; I167-L289 HydrophobicContact CG1-CD2 3.76Å; I167-L289 HydrophobicContact CG1-CG 4.06Å
168	L	93.1	Very high	90.8	Very high	105 Å²	105	57.3 Å²	57.3	55%	0.55	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-45	174.8	-177.8	61.4	0	0	0	111.2	C164 F170 C171 L172	C164-L168 WeakPolarHBondContact O-CB 3.18Å; C164-L168 PolarHBondContact O-N 2.9Å; L168-F170 VanDerWaalsContact C-N 3.29Å; L168-F170 PolarHBondContact O-N 2.81Å; L168-C171 PolarHBondContact O-N 3.33Å; L168-L172 HydrophobicContact CD1-CD1 4.1Å; L168-L172 HydrophobicContact CD1-CG 4.09Å; L168-L172 HydrophobicContact CG-CD1 3.95Å; L168-L172 HydrophobicContact CG-CG 4.33Å; L168-L172 WeakPolarHBondContact O-CB 3.36Å; L168-L172 VanDerWaalsContact O-CG 3.32Å; L168-L172 WeakPolarHBondContact O-CG 3.32Å; L168-L172 PolarHBondContact O-N 3.38Å
169	S	91.4	Very high	90.3	Very high	7 Å²	7	58.4 Å²	58.4	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-56.5	-44.2	173.2	-178.7	0	0	0	0	111.4	V165 I167 L172 K173 F216	V165-S169 WeakPolarHBondContact O-CB 2.97Å; V165-S169 PolarHBondContact O-N 3.46Å; I167-S169 PolarHBondContact O-N 2.66Å; S169-L172 PolarHBondContact O-N 2.83Å; S169-K173 VanDerWaalsContact O-CB 3.24Å; S169-K173 WeakPolarHBondContact O-CB 3.38Å; S169-K173 PolarHBondContact O-N 3.16Å; S169-F216 WeakPolarHBondContact OG-CD1 3.24Å
170	F	89.7	Confident	89.6	Confident	38 Å²	38	62.4 Å²	62.4	17%	0.167	33%	0.332	C	S	.	.	H	α-helix	trans	-62.8	-44.3	177.5	176.1	-96.9	0	0	0	112.5	S166 I167 L168 I283 I286	S166-F170 WeakPolarHBondContact O-CB 2.97Å; S166-F170 PolarHBondContact O-N 3.03Å; I167-F170 WeakPolarHBondContact O-CB 3.45Å; I167-F170 PolarHBondContact O-N 2.99Å; L168-F170 VanDerWaalsContact C-N 3.29Å; L168-F170 PolarHBondContact O-N 2.81Å; F170-I283 HydrophobicContact CZ-CG1 4.31Å; F170-I286 HydrophobicContact CD1-CD1 4.29Å; F170-I286 HydrophobicContact CD1-CG1 4.09Å; F170-I286 HydrophobicContact CE1-CD1 3.53Å; F170-I286 HydrophobicContact CE1-CG1 3.76Å; F170-I286 HydrophobicContact CZ-CD1 3.96Å; F170-I286 HydrophobicContact CZ-CG1 4.18Å
171	C	90.9	Very high	88.6	Confident	67 Å²	67	62.5 Å²	62.5	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-50.8	175.6	-65.7	0	0	0	0	111.4	I167 L168 K173 T174	I167-C171 PolarHBondContact O-N 3.12Å; I167-C171 PolarHBondContact O-SG 3.19Å; I167-C171 VanDerWaalsContact O-SG 3.35Å; L168-C171 PolarHBondContact O-N 3.33Å; C171-K173 VanDerWaalsContact C-N 3.27Å; C171-K173 PolarHBondContact O-N 3.49Å; C171-T174 PolarHBondContact O-N 2.83Å; C171-T174 PolarHBondContact O-OG1 2.9Å
172	L	90.9	Very high	87.4	Confident	62 Å²	62	57.5 Å²	57.5	33%	0.325	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-33	-178	-68.6	177.8	0	0	0	112.9	L168 S169 T174 H175 F178 F216	L168-L172 HydrophobicContact CD1-CD1 4.1Å; L168-L172 HydrophobicContact CD1-CG 4.09Å; L168-L172 HydrophobicContact CG-CD1 3.95Å; L168-L172 HydrophobicContact CG-CG 4.33Å; L168-L172 WeakPolarHBondContact O-CB 3.36Å; L168-L172 VanDerWaalsContact O-CG 3.32Å; L168-L172 WeakPolarHBondContact O-CG 3.32Å; L168-L172 PolarHBondContact O-N 3.38Å; S169-L172 PolarHBondContact O-N 2.83Å; L172-T174 PolarHBondContact O-N 2.85Å; L172-H175 WeakPolarHBondContact O-CB 3.32Å; L172-H175 PolarHBondContact O-N 2.8Å; L172-H175 VanDerWaalsContact O-N 3.08Å; L172-F178 HydrophobicContact CB-CD2 4.31Å; L172-F178 HydrophobicContact CD2-CD2 4.31Å; L172-F178 HydrophobicContact CD2-CE2 3.92Å; L172-F216 HydrophobicContact CB-CE1 3.68Å; L172-F216 HydrophobicContact CB-CZ 3.94Å
173	K	87.1	Confident	86	Confident	36 Å²	36	61.6 Å²	61.6	16%	0.157	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-26.1	173.3	-173.2	-175.2	-170.8	169.9	0	113.6	S169 C171 R179 P212 F216 E220	S169-K173 VanDerWaalsContact O-CB 3.24Å; S169-K173 WeakPolarHBondContact O-CB 3.38Å; S169-K173 PolarHBondContact O-N 3.16Å; C171-K173 VanDerWaalsContact C-N 3.27Å; C171-K173 PolarHBondContact O-N 3.49Å; K173-R179 PolarHBondContact O-NE 3.11Å; K173-R179 VanDerWaalsContact O-NE 3.08Å; K173-P212 HydrophobicContact CD-CB 4.38Å; K173-P212 HydrophobicContact CG-CB 3.58Å; K173-P212 HydrophobicContact CG-CG 4.29Å; K173-F216 HydrophobicContact CB-CG 4.37Å; K173-E220 WeakPolarHBondContact CD-OE1 3.48Å; K173-E220 IonicContact NZ-OE1 3.09Å; K173-E220 PolarHBondContact NZ-OE1 3.2Å; K173-E220 IonicContact NZ-OE2 3.94Å; K173-E220 PolarHBondContact NZ-OE2 3.13Å
174	T	85.9	Confident	84.6	Confident	80 Å²	80	66.2 Å²	66.2	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-87.5	-14.1	178.4	63.3	0	0	0	0	113.9	C171 L172	C171-T174 PolarHBondContact O-N 2.83Å; C171-T174 PolarHBondContact O-OG1 2.9Å; L172-T174 PolarHBondContact O-N 2.85Å
175	H	88.2	Confident	83.1	Confident	77 Å²	77	66.1 Å²	66.1	36%	0.356	36%	0.357	S	S	.	.	S	Bend	trans	-71.4	138.2	-177.8	-164.9	-89	0	0	0	111.6	L172 D177 F178 R179	L172-H175 WeakPolarHBondContact O-CB 3.32Å; L172-H175 PolarHBondContact O-N 2.8Å; L172-H175 VanDerWaalsContact O-N 3.08Å; H175-D177 VanDerWaalsContact C-N 3.33Å; H175-D177 VanDerWaalsContact CE1-CG 3.42Å; H175-D177 IonicContact CE1-OD1 3.39Å; H175-D177 IonicContact CE1-OD2 3.07Å; H175-D177 PolarHBondContact CE1-OD2 2.92Å; H175-D177 WeakPolarHBondContact ND1-CB 3.48Å; H175-D177 PolarHBondContact ND1-N 3.08Å; H175-D177 IonicContact ND1-OD2 2.63Å; H175-D177 PolarHBondContact O-N 3.34Å; H175-F178 HydrophobicContact CB-CD2 3.92Å; H175-F178 PolarHBondContact O-N 3.25Å; H175-R179 WeakPolarHBondContact O-CG 3.3Å
176	P	83.1	Confident	81.7	Confident	93 Å²	93	69.4 Å²	69.4	60%	0.604	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-58.9	-39.5	-178	22.7	-34.2	0	0	0	113.3	F178 R179	P176-F178 PolarHBondContact O-N 2.8Å; P176-R179 WeakPolarHBondContact O-CB 3.34Å; P176-R179 PolarHBondContact O-N 3.09Å; P176-R179 VanDerWaalsContact O-N 3.09Å
177	D	85	Confident	80.4	Confident	132 Å²	132	73 Å²	73	71%	0.706	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-65.1	-23.4	-178.6	-59.8	-8.2	0	0	0	113.8	H175	H175-D177 VanDerWaalsContact C-N 3.33Å; H175-D177 VanDerWaalsContact CE1-CG 3.42Å; H175-D177 IonicContact CE1-OD1 3.39Å; H175-D177 IonicContact CE1-OD2 3.07Å; H175-D177 PolarHBondContact CE1-OD2 2.92Å; H175-D177 WeakPolarHBondContact ND1-CB 3.48Å; H175-D177 PolarHBondContact ND1-N 3.08Å; H175-D177 IonicContact ND1-OD2 2.63Å; H175-D177 PolarHBondContact O-N 3.34Å
178	F	83.5	Confident	79	Confident	94 Å²	94	76.7 Å²	76.7	41%	0.412	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-98	5.7	179.9	-69.8	-60.2	0	0	0	113	L172 H175 P176 H213 F216	L172-F178 HydrophobicContact CB-CD2 4.31Å; L172-F178 HydrophobicContact CD2-CD2 4.31Å; L172-F178 HydrophobicContact CD2-CE2 3.92Å; H175-F178 HydrophobicContact CB-CD2 3.92Å; H175-F178 PolarHBondContact O-N 3.25Å; P176-F178 PolarHBondContact O-N 2.8Å; F178-H213 PolarHBondContact O-N 3.35Å; F178-F216 HydrophobicContact CB-CE2 3.82Å; F178-F216 HydrophobicContact CB-CZ 3.91Å; F178-F216 HydrophobicContact CD1-CE2 4.47Å; F178-F216 HydrophobicContact CD1-CZ 4.16Å; F178-F216 HydrophobicContact CG-CE2 4.29Å; F178-F216 AromaticContact CG-CZ 3.95Å; F178-F216 HydrophobicContact CG-CZ 3.95Å
179	R	81.1	Confident	77.5	Confident	75 Å²	75	76.7 Å²	76.7	28%	0.283	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116	-179.1	-81.6	-175.5	171.2	-146.8	0.9	109.7	K173 H175 P176 T210 Q211	K173-R179 PolarHBondContact O-NE 3.11Å; K173-R179 VanDerWaalsContact O-NE 3.08Å; H175-R179 WeakPolarHBondContact O-CG 3.3Å; P176-R179 WeakPolarHBondContact O-CB 3.34Å; P176-R179 PolarHBondContact O-N 3.09Å; P176-R179 VanDerWaalsContact O-N 3.09Å; R179-T210 HydrophobicContact CB-CG2 4.33Å; R179-Q211 CarbonylContact C-O 3.57Å
180	I	78.3	Confident	75.9	Confident	84 Å²	84	78.9 Å²	78.9	43%	0.431	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	128.9	-178.5	-53.9	154.7	0	0	0	108	V182 T210 Q211 H213	I180-V182 PolarHBondContact O-N 3.45Å; I180-T210 CarbonylContact O-C 3.49Å; I180-T210 VanDerWaalsContact O-CA 3.24Å; I180-T210 WeakPolarHBondContact O-CA 3.17Å; I180-Q211 PolarHBondContact N-O 3.27Å; I180-Q211 PolarHBondContact O-N 3.21Å; I180-H213 HydrophobicContact CD1-CB 4.19Å
181	P	71.7	Confident	74.5	Confident	50 Å²	50	82 Å²	82	33%	0.325	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	129.1	173.9	27.6	-33.3	0	0	0	110.3	K207	P181-K207 HydrophobicContact CB-CG 3.9Å
182	V	69.6	Low	72.8	Confident	31 Å²	31	85.5 Å²	85.5	19%	0.188	46%	0.456	C	S	.	.			trans	-88.4	115	170.5	-176.4	0	0	0	0	106.9	I180 E184 R209 Q211	I180-V182 PolarHBondContact O-N 3.45Å; V182-E184 HydrophobicContact CG1-CG 4.27Å; V182-E184 PolarHBondContact O-N 3.28Å; V182-R209 HydrophobicContact CB-CB 4.39Å; V182-R209 WeakPolarHBondContact CB-O 3.38Å; V182-R209 PolarHBondContact N-O 3.29Å; V182-Q211 HydrophobicContact CG2-CB 3.79Å; V182-Q211 VanDerWaalsContact CG2-CD 3.44Å; V182-Q211 HydrophobicContact CG2-CG 3.39Å
183	L	65.5	Low	70.8	Confident	107 Å²	107	86.3 Å²	86.3	56%	0.56	48%	0.478	S	S	*	.			trans	-85.4	105.8	172.4	-72.4	89.6	0	0	0	108.3	F205	L183-F205 HydrophobicContact CB-CD1 4.01Å; L183-F205 HydrophobicContact CD2-CB 4.17Å; L183-F205 HydrophobicContact CD2-CD1 3.67Å; L183-F205 HydrophobicContact CD2-CE1 4.21Å; L183-F205 HydrophobicContact CD2-CG 4.02Å; L183-F205 HydrophobicContact CG-CD1 4.38Å
184	E	64.2	Low	69.2	Low	97 Å²	97	92.4 Å²	92.4	45%	0.453	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	117.7	166.3	-74.1	179.3	-158.4	0	0	108.2	V182 D206 R209	V182-E184 HydrophobicContact CG1-CG 4.27Å; V182-E184 PolarHBondContact O-N 3.28Å; E184-D206 PolarHBondContact O-N 3.48Å; E184-R209 IonicContact OE1-CZ 2.68Å; E184-R209 IonicContact OE1-NH1 2.87Å; E184-R209 PolarHBondContact OE1-NH1 3.27Å; E184-R209 IonicContact OE2-NH1 2.9Å; E184-R209 PolarHBondContact OE2-NH1 2.87Å; E184-R209 VanDerWaalsContact OE2-NH1 3.09Å
185	S	64.8	Low	67.4	Low	71 Å²	71	94.7 Å²	94.7	50%	0.497	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.6	171.7	57.4	0	0	0	0	109.4
186	Y	65.3	Low	65.6	Low	112 Å²	112	103.4 Å²	103.4	44%	0.439	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127	168	60.4	-84.7	0	0	0	109.3	Y188 V204 D206	Y186-Y188 HydrophobicContact CE2-CD1 4.41Å; Y186-Y188 PolarHBondContact O-N 3.39Å; Y186-V204 HydrophobicContact CE1-CB 3.78Å; Y186-V204 HydrophobicContact CE1-CG1 4.02Å; Y186-V204 HydrophobicContact CE2-CB 3.91Å; Y186-V204 HydrophobicContact CE2-CG2 4.14Å; Y186-V204 VanDerWaalsContact CZ-CB 3.44Å; Y186-V204 PolarHBondContact N-O 3.11Å; Y186-V204 WeakPolarHBondContact OH-CB 3.4Å; Y186-V204 VanDerWaalsContact OH-CG1 3.23Å; Y186-V204 WeakPolarHBondContact OH-CG1 3.5Å; Y186-D206 HydrophobicContact CE1-CB 4.04Å
187	V	66.3	Low	64.2	Low	84 Å²	84	107.4 Å²	107.4	51%	0.509	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.8	106.3	173.1	179.4	0	0	0	0	106.9	K201	V187-K201 HydrophobicContact CG1-CB 4.01Å; V187-K201 HydrophobicContact CG1-CD 4.01Å; V187-K201 HydrophobicContact CG1-CG 3.91Å
188	Y	63.8	Low	62.7	Low	109 Å²	109	106.3 Å²	106.3	43%	0.427	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.2	132.1	166.9	69.3	-79.1	0	0	0	108.9	Y186 S190 G202 V204	Y186-Y188 HydrophobicContact CE2-CD1 4.41Å; Y186-Y188 PolarHBondContact O-N 3.39Å; Y188-S190 PolarHBondContact O-N 3.19Å; Y188-G202 WeakPolarHBondContact CD1-O 3.49Å; Y188-G202 WeakPolarHBondContact CE1-O 3.48Å; Y188-V204 HydrophobicContact CD1-CG2 4.01Å; Y188-V204 HydrophobicContact CE1-CG2 3.5Å
189	N	60.7	Low	61	Low	104 Å²	104	106.7 Å²	106.7	56%	0.556	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.5	109.1	164.8	-69.7	-31.1	0	0	0	106.7	S191	N189-S191 VanDerWaalsContact C-N 3.26Å; N189-S191 PolarHBondContact O-N 2.85Å
190	S	59.3	Low	59.8	Low	54 Å²	54	107 Å²	107	38%	0.378	59%	0.585	S	S	.	*			trans	-72	89	167.6	-170.4	0	0	0	0	108.5	Y188 N192	Y188-S190 PolarHBondContact O-N 3.19Å; S190-N192 VanDerWaalsContact C-N 3.3Å; S190-N192 PolarHBondContact O-N 3.4Å
191	S	58.9	Low	58.4	Low	102 Å²	102	110.2 Å²	110.2	71%	0.713	60%	0.595	S	S	*	*			trans	-94.4	62.4	166.7	64.5	0	0	0	0	108.8	N189 G193	N189-S191 VanDerWaalsContact C-N 3.26Å; N189-S191 PolarHBondContact O-N 2.85Å; S191-G193 VanDerWaalsContact C-N 3.34Å; S191-G193 PolarHBondContact O-N 3.02Å
192	N	55.5	Low	57.6	Low	142 Å²	142	108.6 Å²	108.6	76%	0.759	59%	0.587	S	S	*	*			trans	-62.2	105.6	163.3	-83.5	-4	0	0	0	106.8	S190 L194	S190-N192 VanDerWaalsContact C-N 3.3Å; S190-N192 PolarHBondContact O-N 3.4Å; N192-L194 PolarHBondContact O-N 2.9Å
193	G	50.2	Low	56.7	Low	78 Å²	78	112.2 Å²	112.2	80%	0.804	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	37.4	-159.1	0	0	0	0	0	116.9	S191	S191-G193 VanDerWaalsContact C-N 3.34Å; S191-G193 PolarHBondContact O-N 3.02Å
194	L	52.5	Low	56.4	Low	164 Å²	164	109.8 Å²	109.8	86%	0.859	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.7	-12.1	177.4	-141.3	74.3	0	0	0	116.7	N192	N192-L194 PolarHBondContact O-N 2.9Å
195	I	49	Very low	56.1	Low	129 Å²	129	110.6 Å²	110.6	66%	0.662	60%	0.595	S	S	*	*			trans	-141.7	112.4	-180	-53.9	-177.7	0	0	0	109.8	F197	I195-F197 HydrophobicContact CG2-CB 3.98Å; I195-F197 HydrophobicContact CG2-CD2 3.7Å; I195-F197 HydrophobicContact CG2-CG 4.27Å; I195-F197 PolarHBondContact O-N 3.12Å
196	R	50	Low	55.7	Low	260 Å²	260	110.4 Å²	110.4	98%	0.981	59%	0.589	S	S	*	*			trans	-71	34	178.7	-68.4	-168.5	179.6	-127.2	3.6	113.9
197	F	52.8	Low	55.4	Low	177 Å²	177	112.5 Å²	112.5	78%	0.776	60%	0.6	S	S	*	*	S	Bend	trans	-106.2	116.7	178.9	-84.5	-95.7	0	0	0	109.9	I195	I195-F197 HydrophobicContact CG2-CB 3.98Å; I195-F197 HydrophobicContact CG2-CD2 3.7Å; I195-F197 HydrophobicContact CG2-CG 4.27Å; I195-F197 PolarHBondContact O-N 3.12Å
198	S	54	Low	55.1	Low	109 Å²	109	116.2 Å²	116.2	76%	0.762	61%	0.612	S	S	*	*			trans	49.6	107.4	176.2	69.7	0	0	0	0	116.4	S200	S198-S200 VanDerWaalsContact C-N 3.26Å; S198-S200 PolarHBondContact O-N 3.38Å
199	T	48.2	Very low	55.2	Low	102 Å²	102	118 Å²	118	63%	0.626	62%	0.618	S	S	*	*			trans	-63.6	88.6	162.4	-45.7	0	0	0	0	108.7	K201	T199-K201 PolarHBondContact O-N 3.34Å; T199-K201 VanDerWaalsContact O-N 3.12Å
200	S	54.6	Low	55.8	Low	82 Å²	82	115.2 Å²	115.2	57%	0.573	61%	0.605	S	S	*	*			trans	-70.5	108.2	170.3	-171.8	0	0	0	0	107.6	S198 G202	S198-S200 VanDerWaalsContact C-N 3.26Å; S198-S200 PolarHBondContact O-N 3.38Å; S200-G202 VanDerWaalsContact C-N 3.35Å; S200-G202 PolarHBondContact O-N 3.45Å; S200-G202 VanDerWaalsContact O-N 3.11Å
201	K	49	Very low	56.6	Low	151 Å²	151	117.3 Å²	117.3	66%	0.657	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.1	92.5	169.3	-71.6	-177.3	179	-178.2	0	107	V187 T199 M203	V187-K201 HydrophobicContact CG1-CB 4.01Å; V187-K201 HydrophobicContact CG1-CD 4.01Å; V187-K201 HydrophobicContact CG1-CG 3.91Å; T199-K201 PolarHBondContact O-N 3.34Å; T199-K201 VanDerWaalsContact O-N 3.12Å; K201-M203 PolarHBondContact O-N 3.17Å
202	G	55.6	Low	57.7	Low	15 Å²	15	114.6 Å²	114.6	16%	0.155	59%	0.588	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.7	123.2	166.5	0	0	0	0	0	108.5	Y188 S200	Y188-G202 WeakPolarHBondContact CD1-O 3.49Å; Y188-G202 WeakPolarHBondContact CE1-O 3.48Å; S200-G202 VanDerWaalsContact C-N 3.35Å; S200-G202 PolarHBondContact O-N 3.45Å; S200-G202 VanDerWaalsContact O-N 3.11Å
203	M	50.1	Low	59.1	Low	108 Å²	108	112 Å²	112	53%	0.532	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.3	112.8	167.9	-173.2	159.5	61.9	0	0	107	K201 F205	K201-M203 PolarHBondContact O-N 3.17Å; M203-F205 HydrophobicContact CE-CE2 4.18Å; M203-F205 HydrophobicContact CE-CZ 3.7Å; M203-F205 HydrophobicContact CG-CE2 4.45Å; M203-F205 HydrophobicContact CG-CZ 4.32Å; M203-F205 HydrophobicContact SD-CZ 4.26Å
204	V	59.4	Low	60.8	Low	55 Å²	55	112.3 Å²	112.3	33%	0.333	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.8	139.9	169	-173	0	0	0	0	107.6	Y186 Y188	Y186-V204 HydrophobicContact CE1-CB 3.78Å; Y186-V204 HydrophobicContact CE1-CG1 4.02Å; Y186-V204 HydrophobicContact CE2-CB 3.91Å; Y186-V204 HydrophobicContact CE2-CG2 4.14Å; Y186-V204 VanDerWaalsContact CZ-CB 3.44Å; Y186-V204 PolarHBondContact N-O 3.11Å; Y186-V204 WeakPolarHBondContact OH-CB 3.4Å; Y186-V204 VanDerWaalsContact OH-CG1 3.23Å; Y186-V204 WeakPolarHBondContact OH-CG1 3.5Å; Y188-V204 HydrophobicContact CD1-CG2 4.01Å; Y188-V204 HydrophobicContact CE1-CG2 3.5Å
205	F	58.7	Low	62.5	Low	114 Å²	114	106.7 Å²	106.7	50%	0.5	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.5	170.2	-65.4	-79.6	0	0	0	107.9	L183 M203	L183-F205 HydrophobicContact CB-CD1 4.01Å; L183-F205 HydrophobicContact CD2-CB 4.17Å; L183-F205 HydrophobicContact CD2-CD1 3.67Å; L183-F205 HydrophobicContact CD2-CE1 4.21Å; L183-F205 HydrophobicContact CD2-CG 4.02Å; L183-F205 HydrophobicContact CG-CD1 4.38Å; M203-F205 HydrophobicContact CE-CE2 4.18Å; M203-F205 HydrophobicContact CE-CZ 3.7Å; M203-F205 HydrophobicContact CG-CE2 4.45Å; M203-F205 HydrophobicContact CG-CZ 4.32Å; M203-F205 HydrophobicContact SD-CZ 4.26Å
206	D	55.6	Low	64.5	Low	68 Å²	68	101.7 Å²	101.7	36%	0.364	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.9	167.6	-154.9	-16.2	0	0	0	109.3	E184 Y186 E208	E184-D206 PolarHBondContact O-N 3.48Å; Y186-D206 HydrophobicContact CE1-CB 4.04Å; D206-E208 WeakPolarHBondContact OD1-CG 3.16Å; D206-E208 PolarHBondContact OD1-N 3.12Å
207	K	59.3	Low	66.3	Low	156 Å²	156	94.2 Å²	94.2	68%	0.678	49%	0.487	S	S	*	.			trans	-107.2	34.3	-179	-162.9	-157.1	171.8	179.2	0	110.9	P181	P181-K207 HydrophobicContact CB-CG 3.9Å
208	E	60.9	Low	68.2	Low	161 Å²	161	89.6 Å²	89.6	75%	0.752	47%	0.473	S	S	*	.			trans	-87.1	-31.6	-176.9	-81.2	-166.6	-179.8	0	0	113.9	D206	D206-E208 WeakPolarHBondContact OD1-CG 3.16Å; D206-E208 PolarHBondContact OD1-N 3.12Å
209	R	65.3	Low	70	Confident	146 Å²	146	86.9 Å²	86.9	55%	0.551	45%	0.452	S	S	*	.			trans	-96.3	129.8	-175.3	-65.8	-174	-177.3	142.7	4.7	111.1	V182 E184	V182-R209 HydrophobicContact CB-CB 4.39Å; V182-R209 WeakPolarHBondContact CB-O 3.38Å; V182-R209 PolarHBondContact N-O 3.29Å; E184-R209 IonicContact OE1-CZ 2.68Å; E184-R209 IonicContact OE1-NH1 2.87Å; E184-R209 PolarHBondContact OE1-NH1 3.27Å; E184-R209 IonicContact OE2-NH1 2.9Å; E184-R209 PolarHBondContact OE2-NH1 2.87Å; E184-R209 VanDerWaalsContact OE2-NH1 3.09Å
210	T	74.2	Confident	72	Confident	47 Å²	47	82.5 Å²	82.5	29%	0.288	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	153.3	169.4	57.6	0	0	0	0	111	R179 I180 K275	R179-T210 HydrophobicContact CB-CG2 4.33Å; I180-T210 CarbonylContact O-C 3.49Å; I180-T210 VanDerWaalsContact O-CA 3.24Å; I180-T210 WeakPolarHBondContact O-CA 3.17Å; T210-K275 PolarHBondContact O-NZ 3.48Å; T210-K275 VanDerWaalsContact O-NZ 3.08Å
211	Q	75.3	Confident	73.8	Confident	98 Å²	98	79.8 Å²	79.8	46%	0.458	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.3	174.2	-82.5	178.1	22.9	0	0	110.2	R179 I180 V182	R179-Q211 CarbonylContact C-O 3.57Å; I180-Q211 PolarHBondContact N-O 3.27Å; I180-Q211 PolarHBondContact O-N 3.21Å; V182-Q211 HydrophobicContact CG2-CB 3.79Å; V182-Q211 VanDerWaalsContact CG2-CD 3.44Å; V182-Q211 HydrophobicContact CG2-CG 3.39Å
212	P	81.3	Confident	76	Confident	44 Å²	44	78.1 Å²	78.1	29%	0.286	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	148.4	177.2	30.4	-35.1	0	0	0	111	K173 F216	K173-P212 HydrophobicContact CD-CB 4.38Å; K173-P212 HydrophobicContact CG-CB 3.58Å; K173-P212 HydrophobicContact CG-CG 4.29Å; P212-F216 HydrophobicContact CB-CD2 4.48Å
213	H	85.6	Confident	77.9	Confident	88 Å²	88	77.8 Å²	77.8	41%	0.407	40%	0.399	S	S	.	.			trans	-56.7	140.8	173.6	-169.6	-87	0	0	0	111.8	F178 I180 A215 F216	F178-H213 PolarHBondContact O-N 3.35Å; I180-H213 HydrophobicContact CD1-CB 4.19Å; H213-A215 WeakPolarHBondContact ND1-CB 3.3Å; H213-A215 PolarHBondContact ND1-N 3.15Å; H213-A215 PolarHBondContact O-N 3.33Å; H213-A215 VanDerWaalsContact O-N 3.12Å; H213-F216 HydrophobicContact CB-CD2 3.93Å; H213-F216 HydrophobicContact CB-CE2 3.94Å; H213-F216 WeakPolarHBondContact O-CD2 3.44Å; H213-F216 PolarHBondContact O-N 2.98Å; H213-F216 VanDerWaalsContact O-N 3.09Å
214	S	85	Confident	80	Confident	85 Å²	85	72.9 Å²	72.9	59%	0.594	38%	0.375	S	S	*	.	H	α-helix	trans	-59.1	-27.8	-176.3	58.6	0	0	0	0	113.5	F216 F217 V218	S214-F216 VanDerWaalsContact C-N 3.29Å; S214-F216 PolarHBondContact O-N 2.84Å; S214-F217 WeakPolarHBondContact O-CB 3.5Å; S214-F217 PolarHBondContact O-N 3.28Å; S214-F217 VanDerWaalsContact O-N 3.15Å; S214-V218 PolarHBondContact O-N 3.47Å
215	A	89.7	Confident	81.6	Confident	46 Å²	46	73.9 Å²	73.9	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-57	-37.7	175.4	0	0	0	0	0	113.3	H213 F217 V218 V219	H213-A215 WeakPolarHBondContact ND1-CB 3.3Å; H213-A215 PolarHBondContact ND1-N 3.15Å; H213-A215 PolarHBondContact O-N 3.33Å; H213-A215 VanDerWaalsContact O-N 3.12Å; A215-F217 VanDerWaalsContact C-N 3.28Å; A215-F217 PolarHBondContact O-N 2.85Å; A215-V218 PolarHBondContact O-N 2.84Å; A215-V218 VanDerWaalsContact O-N 3.15Å; A215-V219 WeakPolarHBondContact O-CG2 2.97Å; A215-V219 PolarHBondContact O-N 3.23Å
216	F	89.9	Confident	83.4	Confident	24 Å²	24	72 Å²	72	11%	0.105	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-37.7	178.5	-66.1	-67.8	0	0	0	111.5	S169 L172 K173 F178 P212 H213 S214 V218 V219 E220	S169-F216 WeakPolarHBondContact OG-CD1 3.24Å; L172-F216 HydrophobicContact CB-CE1 3.68Å; L172-F216 HydrophobicContact CB-CZ 3.94Å; K173-F216 HydrophobicContact CB-CG 4.37Å; F178-F216 HydrophobicContact CB-CE2 3.82Å; F178-F216 HydrophobicContact CB-CZ 3.91Å; F178-F216 HydrophobicContact CD1-CE2 4.47Å; F178-F216 HydrophobicContact CD1-CZ 4.16Å; F178-F216 HydrophobicContact CG-CE2 4.29Å; F178-F216 AromaticContact CG-CZ 3.95Å; F178-F216 HydrophobicContact CG-CZ 3.95Å; P212-F216 HydrophobicContact CB-CD2 4.48Å; H213-F216 HydrophobicContact CB-CD2 3.93Å; H213-F216 HydrophobicContact CB-CE2 3.94Å; H213-F216 WeakPolarHBondContact O-CD2 3.44Å; H213-F216 PolarHBondContact O-N 2.98Å; H213-F216 VanDerWaalsContact O-N 3.09Å; S214-F216 VanDerWaalsContact C-N 3.29Å; S214-F216 PolarHBondContact O-N 2.84Å; F216-V218 VanDerWaalsContact C-N 3.33Å; F216-V218 PolarHBondContact O-N 3.29Å; F216-V219 PolarHBondContact O-N 3.35Å; F216-E220 WeakPolarHBondContact O-CB 3.31Å; F216-E220 VanDerWaalsContact O-CG 3.28Å; F216-E220 WeakPolarHBondContact O-CG 3.24Å; F216-E220 PolarHBondContact O-N 3.24Å
217	F	87.7	Confident	85.3	Confident	103 Å²	103	68.8 Å²	68.8	45%	0.452	35%	0.354	S	S	.	.	H	α-helix	trans	-63.5	-40	175.4	175.4	-96.9	0	0	0	111.9	S214 A215 E220 A221 F260 F264	S214-F217 WeakPolarHBondContact O-CB 3.5Å; S214-F217 PolarHBondContact O-N 3.28Å; S214-F217 VanDerWaalsContact O-N 3.15Å; A215-F217 VanDerWaalsContact C-N 3.28Å; A215-F217 PolarHBondContact O-N 2.85Å; F217-E220 PolarHBondContact O-N 3.41Å; F217-A221 VanDerWaalsContact O-CB 3.31Å; F217-A221 WeakPolarHBondContact O-CB 3.41Å; F217-A221 PolarHBondContact O-N 3.31Å; F217-F260 HydrophobicContact CE2-CE2 4.42Å; F217-F260 HydrophobicContact CE2-CZ 4.37Å; F217-F264 HydrophobicContact CE2-CE1 4Å; F217-F264 HydrophobicContact CE2-CE2 4.19Å; F217-F264 AromaticContact CE2-CZ 3.44Å; F217-F264 HydrophobicContact CE2-CZ 3.44Å; F217-F264 VanDerWaalsContact CE2-CZ 3.44Å; F217-F264 AromaticContact CZ-CE1 3.61Å; F217-F264 HydrophobicContact CZ-CE1 3.61Å; F217-F264 HydrophobicContact CZ-CE2 4.45Å; F217-F264 AromaticContact CZ-CZ 3.33Å; F217-F264 HydrophobicContact CZ-CZ 3.33Å
218	V	92.4	Very high	86.9	Confident	80 Å²	80	62.4 Å²	62.4	49%	0.485	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-46.9	175.9	178.6	0	0	0	0	111	S214 A215 F216 A221 I222	S214-V218 PolarHBondContact O-N 3.47Å; A215-V218 PolarHBondContact O-N 2.84Å; A215-V218 VanDerWaalsContact O-N 3.15Å; F216-V218 VanDerWaalsContact C-N 3.33Å; F216-V218 PolarHBondContact O-N 3.29Å; V218-A221 PolarHBondContact O-N 3.15Å; V218-I222 HydrophobicContact CG1-CD1 3.98Å; V218-I222 WeakPolarHBondContact O-CG1 3.08Å; V218-I222 PolarHBondContact O-N 2.91Å
219	V	93	Very high	88.6	Confident	51 Å²	51	59 Å²	59	31%	0.309	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-45.2	177.6	174.3	0	0	0	0	111.1	V165 A215 F216 A221 I222 C223	V165-V219 HydrophobicContact CG1-CG1 3.72Å; A215-V219 WeakPolarHBondContact O-CG2 2.97Å; A215-V219 PolarHBondContact O-N 3.23Å; F216-V219 PolarHBondContact O-N 3.35Å; V219-A221 VanDerWaalsContact C-N 3.34Å; V219-A221 PolarHBondContact O-N 3.11Å; V219-I222 PolarHBondContact O-N 2.73Å; V219-C223 PolarHBondContact O-N 3.39Å; V219-C223 PolarHBondContact O-SG 3.3Å
220	E	90.6	Very high	89.9	Confident	11 Å²	11	52.1 Å²	52.1	5%	0.051	29%	0.289	C	S	.	.	H	α-helix	trans	-59.2	-44	175.1	-77.1	-179.4	-146.4	0	0	111.4	K173 F216 F217 C223 N224 F260 R285	K173-E220 WeakPolarHBondContact CD-OE1 3.48Å; K173-E220 IonicContact NZ-OE1 3.09Å; K173-E220 PolarHBondContact NZ-OE1 3.2Å; K173-E220 IonicContact NZ-OE2 3.94Å; K173-E220 PolarHBondContact NZ-OE2 3.13Å; F216-E220 WeakPolarHBondContact O-CB 3.31Å; F216-E220 VanDerWaalsContact O-CG 3.28Å; F216-E220 WeakPolarHBondContact O-CG 3.24Å; F216-E220 PolarHBondContact O-N 3.24Å; F217-E220 PolarHBondContact O-N 3.41Å; E220-C223 PolarHBondContact O-N 3.29Å; E220-N224 WeakPolarHBondContact O-CB 3.32Å; E220-N224 PolarHBondContact O-N 2.96Å; E220-F260 HydrophobicContact CB-CD2 4.39Å; E220-F260 HydrophobicContact CB-CE2 3.99Å; E220-R285 IonicContact OE2-CZ 3.12Å; E220-R285 IonicContact OE2-NH1 3.56Å; E220-R285 PolarHBondContact OE2-NH1 2.92Å
221	A	92	Very high	90.8	Very high	25 Å²	25	50.6 Å²	50.6	21%	0.207	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-42.6	178.4	0	0	0	0	0	112.3	F217 V218 V219 T225 F260	F217-A221 VanDerWaalsContact O-CB 3.31Å; F217-A221 WeakPolarHBondContact O-CB 3.41Å; F217-A221 PolarHBondContact O-N 3.31Å; V218-A221 PolarHBondContact O-N 3.15Å; V219-A221 VanDerWaalsContact C-N 3.34Å; V219-A221 PolarHBondContact O-N 3.11Å; A221-T225 WeakPolarHBondContact O-CB 3.22Å; A221-T225 PolarHBondContact O-N 2.89Å; A221-T225 PolarHBondContact O-OG1 3.25Å; A221-F260 HydrophobicContact CB-CE2 4.49Å; A221-F260 HydrophobicContact CB-CZ 3.75Å
222	I	95.1	Very high	91.7	Very high	115 Å²	115	50.7 Å²	50.7	59%	0.59	28%	0.281	S	S	*	.	H	α-helix	trans	-63.2	-49.7	176.6	-67	165.5	0	0	0	110.3	V218 V219 N224 T225 W226	V218-I222 HydrophobicContact CG1-CD1 3.98Å; V218-I222 WeakPolarHBondContact O-CG1 3.08Å; V218-I222 PolarHBondContact O-N 2.91Å; V219-I222 PolarHBondContact O-N 2.73Å; I222-N224 PolarHBondContact O-N 3.27Å; I222-T225 WeakPolarHBondContact O-CB 3.5Å; I222-T225 PolarHBondContact O-N 3.34Å; I222-W226 PolarHBondContact O-N 3.36Å; I222-W226 VanDerWaalsContact O-N 3.08Å
223	C	95.2	Very high	92.2	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-45.3	179.2	-64.5	0	0	0	0	111.2	V219 E220 T225 W226 F227	V219-C223 PolarHBondContact O-N 3.39Å; V219-C223 PolarHBondContact O-SG 3.3Å; E220-C223 PolarHBondContact O-N 3.29Å; C223-T225 VanDerWaalsContact C-N 3.3Å; C223-T225 PolarHBondContact O-N 2.79Å; C223-W226 WeakPolarHBondContact O-CB 3.18Å; C223-W226 PolarHBondContact O-N 3.38Å; C223-W226 VanDerWaalsContact O-N 3.14Å; C223-F227 HydrophobicContact CB-CE2 3.97Å; C223-F227 WeakPolarHBondContact O-CD2 3.44Å; C223-F227 WeakPolarHBondContact O-CE2 3.43Å; C223-F227 WeakPolarHBondContact O-CG 3.23Å; C223-F227 PolarHBondContact O-N 2.81Å
224	N	93.1	Very high	92.5	Very high	5 Å²	5	46.6 Å²	46.6	3%	0.027	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-35.9	178.6	-164.8	71.7	0	0	0	112	E220 I222 W226 F227 T228 T257 F260 F261	E220-N224 WeakPolarHBondContact O-CB 3.32Å; E220-N224 PolarHBondContact O-N 2.96Å; I222-N224 PolarHBondContact O-N 3.27Å; N224-W226 VanDerWaalsContact C-N 3.33Å; N224-W226 PolarHBondContact O-N 3.07Å; N224-F227 PolarHBondContact O-N 3.1Å; N224-T228 WeakPolarHBondContact O-CG2 3.35Å; N224-T228 PolarHBondContact O-N 3.29Å; N224-T228 PolarHBondContact O-OG1 3.36Å; N224-T257 PolarHBondContact OD1-O 3.06Å; N224-F260 HydrophobicContact CB-CB 4.22Å; N224-F260 HydrophobicContact CB-CD1 3.86Å; N224-F260 HydrophobicContact CB-CD2 4.32Å; N224-F260 HydrophobicContact CB-CE1 4.23Å; N224-F260 HydrophobicContact CB-CG 3.87Å; N224-F260 VanDerWaalsContact CG-CB 3.49Å; N224-F260 WeakPolarHBondContact ND2-CD1 3.1Å; N224-F260 WeakPolarHBondContact OD1-CB 3.24Å; N224-F261 VanDerWaalsContact ND2-CE2 3.33Å; N224-F261 WeakPolarHBondContact ND2-CE2 3.23Å
225	T	94.6	Very high	92.9	Very high	75 Å²	75	46 Å²	46	46%	0.46	25%	0.246	S	C	.	.	H	α-helix	trans	-62.7	-39.5	173.2	-58.2	0	0	0	0	111.8	A221 I222 C223 T228 L229	A221-T225 WeakPolarHBondContact O-CB 3.22Å; A221-T225 PolarHBondContact O-N 2.89Å; A221-T225 PolarHBondContact O-OG1 3.25Å; I222-T225 WeakPolarHBondContact O-CB 3.5Å; I222-T225 PolarHBondContact O-N 3.34Å; C223-T225 VanDerWaalsContact C-N 3.3Å; C223-T225 PolarHBondContact O-N 2.79Å; T225-T228 WeakPolarHBondContact CA-OG1 3.39Å; T225-T228 PolarHBondContact O-OG1 3.05Å; T225-L229 HydrophobicContact CG2-CD1 4.41Å; T225-L229 VanDerWaalsContact O-CG 3.27Å; T225-L229 WeakPolarHBondContact O-CG 3.32Å; T225-L229 PolarHBondContact O-N 3.4Å; T225-L229 VanDerWaalsContact O-N 3.1Å
226	W	95.7	Very high	92.9	Very high	75 Å²	75	47.1 Å²	47.1	28%	0.284	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-47.8	172.9	176.9	-96.9	0	0	0	111.5	I155 T158 S159 T162 I222 C223 N224 T228 L229 E230	I155-W226 HydrophobicContact CG2-CZ2 4.4Å; T158-W226 HydrophobicContact CG2-CH2 4.1Å; T158-W226 HydrophobicContact CG2-CZ2 3.87Å; S159-W226 PolarHBondContact OG-NE1 3.19Å; T162-W226 HydrophobicContact CG2-CG 4.19Å; I222-W226 PolarHBondContact O-N 3.36Å; I222-W226 VanDerWaalsContact O-N 3.08Å; C223-W226 WeakPolarHBondContact O-CB 3.18Å; C223-W226 PolarHBondContact O-N 3.38Å; C223-W226 VanDerWaalsContact O-N 3.14Å; N224-W226 VanDerWaalsContact C-N 3.33Å; N224-W226 PolarHBondContact O-N 3.07Å; W226-T228 PolarHBondContact O-N 3.41Å; W226-L229 PolarHBondContact O-N 3.41Å; W226-E230 WeakPolarHBondContact O-CB 3.38Å; W226-E230 PolarHBondContact O-N 3.45Å
227	F	94.8	Very high	92.9	Very high	1 Å²	1	47.4 Å²	47.4	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-65.5	-36.9	-179.2	-58.9	-48.1	0	0	0	113	T162 I163 C223 N224 E230 I231 R288	T162-F227 WeakPolarHBondContact OG1-CE1 3.22Å; I163-F227 HydrophobicContact CG1-CE1 3.92Å; I163-F227 HydrophobicContact CG1-CZ 3.94Å; C223-F227 HydrophobicContact CB-CE2 3.97Å; C223-F227 WeakPolarHBondContact O-CD2 3.44Å; C223-F227 WeakPolarHBondContact O-CE2 3.43Å; C223-F227 WeakPolarHBondContact O-CG 3.23Å; C223-F227 PolarHBondContact O-N 2.81Å; N224-F227 PolarHBondContact O-N 3.1Å; F227-E230 WeakPolarHBondContact O-CB 3.4Å; F227-E230 PolarHBondContact O-N 3.31Å; F227-I231 WeakPolarHBondContact O-CG2 3.29Å; F227-I231 PolarHBondContact O-N 3.33Å; F227-R288 VanDerWaalsContact CE2-CZ 3.49Å
228	T	94.6	Very high	92.9	Very high	22 Å²	22	42.6 Å²	42.6	14%	0.135	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-42.4	175.1	57.7	0	0	0	0	111.3	N224 T225 W226 E230 I231 L232 T257 F261	N224-T228 WeakPolarHBondContact O-CG2 3.35Å; N224-T228 PolarHBondContact O-N 3.29Å; N224-T228 PolarHBondContact O-OG1 3.36Å; T225-T228 WeakPolarHBondContact CA-OG1 3.39Å; T225-T228 PolarHBondContact O-OG1 3.05Å; W226-T228 PolarHBondContact O-N 3.41Å; T228-E230 VanDerWaalsContact C-N 3.34Å; T228-I231 VanDerWaalsContact O-CG2 3.28Å; T228-I231 WeakPolarHBondContact O-CG2 3.46Å; T228-L232 WeakPolarHBondContact O-CB 3.5Å; T228-L232 WeakPolarHBondContact O-CD1 3.17Å; T228-L232 WeakPolarHBondContact O-CG 3.45Å; T228-L232 PolarHBondContact O-N 3.33Å; T228-T257 HydrophobicContact CG2-CG2 3.36Å; T228-F261 HydrophobicContact CG2-CE2 3.44Å; T228-F261 VanDerWaalsContact CG2-CE2 3.44Å; T228-F261 HydrophobicContact CG2-CZ 3.53Å
229	L	94.9	Very high	92.5	Very high	89 Å²	89	40.8 Å²	40.8	47%	0.466	22%	0.219	S	C	.	.	H	α-helix	trans	-63	-43	174.2	-69.1	174.1	0	0	0	111.2	T225 W226 I231 L232 I233	T225-L229 HydrophobicContact CG2-CD1 4.41Å; T225-L229 VanDerWaalsContact O-CG 3.27Å; T225-L229 WeakPolarHBondContact O-CG 3.32Å; T225-L229 PolarHBondContact O-N 3.4Å; T225-L229 VanDerWaalsContact O-N 3.1Å; W226-L229 PolarHBondContact O-N 3.41Å; L229-I231 PolarHBondContact O-N 2.95Å; L229-L232 PolarHBondContact O-N 2.85Å; L229-I233 WeakPolarHBondContact O-CB 3.22Å; L229-I233 WeakPolarHBondContact O-CD1 3.5Å; L229-I233 WeakPolarHBondContact O-CG1 3.4Å; L229-I233 PolarHBondContact O-N 3.15Å
230	E	93.4	Very high	92.2	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-49.9	178.9	-148.8	-173.4	135.1	0	0	111.9	F143 W226 F227 T228 R234 K291	F143-E230 HydrophobicContact CD1-CG 3.68Å; F143-E230 HydrophobicContact CE1-CG 4.07Å; W226-E230 WeakPolarHBondContact O-CB 3.38Å; W226-E230 PolarHBondContact O-N 3.45Å; F227-E230 WeakPolarHBondContact O-CB 3.4Å; F227-E230 PolarHBondContact O-N 3.31Å; T228-E230 VanDerWaalsContact C-N 3.34Å; E230-R234 VanDerWaalsContact CD-NH1 3.33Å; E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.09Å; E230-R234 IonicContact OE1-CZ 3.37Å; E230-R234 IonicContact OE1-NH1 3.77Å; E230-R234 PolarHBondContact OE1-NH1 3.2Å; E230-R234 IonicContact OE1-NH2 2.66Å; E230-R234 PolarHBondContact OE1-NH2 3.32Å; E230-K291 VanDerWaalsContact CD-CE 3.44Å; E230-K291 WeakPolarHBondContact OE1-CE 3.21Å; E230-K291 IonicContact OE1-NZ 3.44Å; E230-K291 PolarHBondContact OE1-NZ 2.99Å; E230-K291 WeakPolarHBondContact OE2-CE 3.36Å; E230-K291 IonicContact OE2-NZ 3.45Å; E230-K291 PolarHBondContact OE2-NZ 3.3Å
231	I	92.8	Very high	92.1	Very high	15 Å²	15	44.1 Å²	44.1	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-69.9	-36.9	179.2	-164.4	172	0	0	0	112.1	F227 T228 L229 R234 F235 F244 L254	F227-I231 WeakPolarHBondContact O-CG2 3.29Å; F227-I231 PolarHBondContact O-N 3.33Å; T228-I231 VanDerWaalsContact O-CG2 3.28Å; T228-I231 WeakPolarHBondContact O-CG2 3.46Å; L229-I231 PolarHBondContact O-N 2.95Å; I231-R234 PolarHBondContact O-N 2.84Å; I231-F235 WeakPolarHBondContact O-CB 3.38Å; I231-F235 PolarHBondContact O-N 3.15Å; I231-F244 HydrophobicContact CG1-CE1 4.28Å; I231-F244 HydrophobicContact CG1-CZ 3.91Å; I231-L254 HydrophobicContact CD1-CB 3.65Å; I231-L254 HydrophobicContact CD1-CD1 3.75Å; I231-L254 HydrophobicContact CD1-CG 4.29Å
232	L	93.9	Very high	92	Very high	99 Å²	99	47.4 Å²	47.4	52%	0.518	25%	0.253	S	S	.	.	H	α-helix	trans	-64.5	-44.8	176.4	-75.5	171.7	0	0	0	111.2	T228 L229 F235 V236	T228-L232 WeakPolarHBondContact O-CB 3.5Å; T228-L232 WeakPolarHBondContact O-CD1 3.17Å; T228-L232 WeakPolarHBondContact O-CG 3.45Å; T228-L232 PolarHBondContact O-N 3.33Å; L229-L232 PolarHBondContact O-N 2.85Å; L232-F235 PolarHBondContact O-N 3.12Å; L232-V236 WeakPolarHBondContact O-CB 3.11Å; L232-V236 VanDerWaalsContact O-CG2 3.27Å; L232-V236 WeakPolarHBondContact O-CG2 2.99Å; L232-V236 PolarHBondContact O-N 2.69Å
233	I	93.3	Very high	91.6	Very high	45 Å²	45	47.2 Å²	47.2	23%	0.231	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-52.7	176.1	-69.1	167.6	0	0	0	109.2	V139 F143 L229 F235 V236 F237	V139-I233 HydrophobicContact CG1-CG2 3.84Å; F143-I233 HydrophobicContact CD2-CG2 3.6Å; F143-I233 HydrophobicContact CE1-CD1 4.13Å; F143-I233 HydrophobicContact CE2-CD1 4.03Å; F143-I233 HydrophobicContact CE2-CG2 3.67Å; F143-I233 HydrophobicContact CG-CG2 4.1Å; F143-I233 HydrophobicContact CZ-CD1 3.6Å; F143-I233 HydrophobicContact CZ-CG2 4.21Å; L229-I233 WeakPolarHBondContact O-CB 3.22Å; L229-I233 WeakPolarHBondContact O-CD1 3.5Å; L229-I233 WeakPolarHBondContact O-CG1 3.4Å; L229-I233 PolarHBondContact O-N 3.15Å; I233-F235 VanDerWaalsContact C-N 3.26Å; I233-F235 PolarHBondContact O-N 3.42Å; I233-V236 PolarHBondContact O-N 2.89Å; I233-F237 HydrophobicContact CB-CD2 4.46Å; I233-F237 HydrophobicContact CG2-CD2 3.65Å; I233-F237 HydrophobicContact CG2-CE2 3.96Å; I233-F237 WeakPolarHBondContact O-CD2 3.18Å; I233-F237 PolarHBondContact O-N 3.23Å
234	R	91.1	Very high	91.4	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-55.9	-43.3	177.3	-72.9	-171.4	-178.4	104.5	11.6	111.8	F143 D144 E230 I231 C238 F244 D253	F143-R234 HydrophobicContact CB-CG 3.93Å; F143-R234 PolarHBondContact O-NE 3.27Å; F143-R234 PolarHBondContact O-NH2 3.41Å; D144-R234 IonicContact OD1-NE 3.07Å; D144-R234 PolarHBondContact OD1-NE 3.33Å; E230-R234 VanDerWaalsContact CD-NH1 3.33Å; E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.09Å; E230-R234 IonicContact OE1-CZ 3.37Å; E230-R234 IonicContact OE1-NH1 3.77Å; E230-R234 PolarHBondContact OE1-NH1 3.2Å; E230-R234 IonicContact OE1-NH2 2.66Å; E230-R234 PolarHBondContact OE1-NH2 3.32Å; I231-R234 PolarHBondContact O-N 2.84Å; R234-C238 WeakPolarHBondContact O-CB 3.34Å; R234-C238 PolarHBondContact O-N 3.43Å; R234-F244 HydrophobicContact CB-CE2 3.76Å; R234-F244 HydrophobicContact CB-CZ 4.25Å; R234-D253 IonicContact NH1-OD2 3.9Å
235	F	92.5	Very high	91.3	Very high	71 Å²	71	52.1 Å²	52.1	31%	0.311	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-45.3	178.3	177.4	-104.6	0	0	0	112.1	I231 L232 I233 C238 K241 F244 F245	I231-F235 WeakPolarHBondContact O-CB 3.38Å; I231-F235 PolarHBondContact O-N 3.15Å; L232-F235 PolarHBondContact O-N 3.12Å; I233-F235 VanDerWaalsContact C-N 3.26Å; I233-F235 PolarHBondContact O-N 3.42Å; F235-C238 PolarHBondContact O-SG 2.8Å; F235-K241 HydrophobicContact CD2-CD 4.34Å; F235-K241 HydrophobicContact CE2-CB 4.21Å; F235-K241 HydrophobicContact CE2-CD 3.85Å; F235-K241 HydrophobicContact CE2-CG 4.3Å; F235-K241 HydrophobicContact CZ-CD 4.07Å; F235-K241 HydrophobicContact CZ-CG 4.43Å; F235-K241 PolarHBondContact O-NZ 3.04Å; F235-F244 HydrophobicContact CB-CE1 4.31Å; F235-F244 HydrophobicContact CB-CZ 4.41Å; F235-F244 AromaticContact CD2-CD1 3.95Å; F235-F244 HydrophobicContact CD2-CD1 3.95Å; F235-F244 HydrophobicContact CD2-CE1 4.24Å; F235-F245 HydrophobicContact CD2-CE2 4.35Å; F235-F245 HydrophobicContact CD2-CZ 4.44Å; F235-F245 AromaticContact CE2-CE2 3.71Å; F235-F245 HydrophobicContact CE2-CE2 3.71Å; F235-F245 HydrophobicContact CE2-CZ 4.06Å
236	V	91.4	Very high	91.1	Very high	71 Å²	71	56 Å²	56	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-45.9	179.6	169	0	0	0	0	110.7	W132 L232 I233 K241	W132-V236 HydrophobicContact CZ2-CG1 4.46Å; L232-V236 WeakPolarHBondContact O-CB 3.11Å; L232-V236 VanDerWaalsContact O-CG2 3.27Å; L232-V236 WeakPolarHBondContact O-CG2 2.99Å; L232-V236 PolarHBondContact O-N 2.69Å; I233-V236 PolarHBondContact O-N 2.89Å; V236-K241 PolarHBondContact O-NZ 2.99Å
237	F	89.5	Confident	90.7	Very high	29 Å²	29	54.2 Å²	54.2	13%	0.127	28%	0.282	C	S	.	.	H	α-helix	trans	-89.8	-3.1	-172.5	-63.2	-76.9	0	0	0	114.7	F118 W132 K136 V139 W140 I233	F118-F237 WeakPolarHBondContact CE1-O 3.34Å; W132-F237 HydrophobicContact CH2-CD1 4.01Å; W132-F237 AromaticContact CH2-CE1 3.21Å; W132-F237 HydrophobicContact CH2-CE1 3.21Å; W132-F237 AromaticContact CH2-CZ 3.77Å; W132-F237 HydrophobicContact CH2-CZ 3.77Å; W132-F237 HydrophobicContact CZ2-CD1 4.06Å; W132-F237 AromaticContact CZ2-CE1 3.73Å; W132-F237 HydrophobicContact CZ2-CE1 3.73Å; W132-F237 AromaticContact CZ3-CE1 3.74Å; W132-F237 HydrophobicContact CZ3-CE1 3.74Å; W132-F237 HydrophobicContact CZ3-CZ 4.29Å; K136-F237 HydrophobicContact CB-CD1 4.18Å; K136-F237 WeakPolarHBondContact CE-O 3.23Å; K136-F237 HydrophobicContact CG-CB 4.19Å; K136-F237 HydrophobicContact CG-CD1 3.93Å; K136-F237 WeakPolarHBondContact CG-O 3.49Å; V139-F237 HydrophobicContact CB-CD1 4.15Å; V139-F237 HydrophobicContact CB-CD2 4.21Å; V139-F237 HydrophobicContact CB-CE1 4.25Å; V139-F237 HydrophobicContact CB-CE2 4.37Å; V139-F237 HydrophobicContact CB-CG 4.12Å; V139-F237 HydrophobicContact CB-CZ 4.38Å; V139-F237 HydrophobicContact CG1-CD1 4.33Å; V139-F237 HydrophobicContact CG1-CD2 3.53Å; V139-F237 HydrophobicContact CG1-CE1 4.33Å; V139-F237 HydrophobicContact CG1-CE2 3.59Å; V139-F237 HydrophobicContact CG1-CG 3.94Å; V139-F237 HydrophobicContact CG1-CZ 4Å; V139-F237 HydrophobicContact CG2-CE1 4.45Å; W140-F237 HydrophobicContact CB-CB 3.96Å; I233-F237 HydrophobicContact CB-CD2 4.46Å; I233-F237 HydrophobicContact CG2-CD2 3.65Å; I233-F237 HydrophobicContact CG2-CE2 3.96Å; I233-F237 WeakPolarHBondContact O-CD2 3.18Å; I233-F237 PolarHBondContact O-N 3.23Å
238	C	87.5	Confident	90.5	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.02	31%	0.309	C	S	.	.			trans	-65.3	151.7	178.6	70.6	0	0	0	0	113.3	K136 R234 F235 K241 F244	K136-C238 WeakPolarHBondContact CE-O 3.28Å; K136-C238 PolarHBondContact NZ-O 3.43Å; R234-C238 WeakPolarHBondContact O-CB 3.34Å; R234-C238 PolarHBondContact O-N 3.43Å; F235-C238 PolarHBondContact O-SG 2.8Å; C238-K241 WeakPolarHBondContact SG-CD 3.26Å; C238-F244 HydrophobicContact CB-CB 4.47Å; C238-F244 HydrophobicContact CB-CD2 4.19Å
239	P	83	Confident	90.2	Very high	41 Å²	41	59.8 Å²	59.8	27%	0.266	32%	0.315	S	S	.	.	S	Bend	trans	-67	-45	178.6	24.7	-33	0	0	0	112	R117 F118	R117-P239 WeakPolarHBondContact O-CB 3.43Å; F118-P239 HydrophobicContact CD1-CB 3.83Å; F118-P239 HydrophobicContact CE1-CB 3.93Å; F118-P239 HydrophobicContact CG-CB 4.18Å; F118-P239 HydrophobicContact CZ-CB 4.35Å
240	S	87.3	Confident	90.1	Very high	50 Å²	50	56.1 Å²	56.1	35%	0.35	30%	0.296	S	S	.	.			trans	-132.6	127.2	179.8	168.7	0	0	0	0	111.2	V242 L243 F244	S240-V242 VanDerWaalsContact C-N 3.33Å; S240-V242 PolarHBondContact O-N 3.47Å; S240-V242 PolarHBondContact OG-N 3.06Å; S240-L243 PolarHBondContact O-N 3.2Å; S240-L243 PolarHBondContact OG-N 3.46Å; S240-F244 PolarHBondContact O-N 3.06Å
241	K	88.6	Confident	90.1	Very high	83 Å²	83	58.8 Å²	58.8	36%	0.361	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-36.7	178.7	-50.9	-47	-175.6	-167.6	0	111.6	F235 V236 C238 F244 F245	F235-K241 HydrophobicContact CD2-CD 4.34Å; F235-K241 HydrophobicContact CE2-CB 4.21Å; F235-K241 HydrophobicContact CE2-CD 3.85Å; F235-K241 HydrophobicContact CE2-CG 4.3Å; F235-K241 HydrophobicContact CZ-CD 4.07Å; F235-K241 HydrophobicContact CZ-CG 4.43Å; F235-K241 PolarHBondContact O-NZ 3.04Å; V236-K241 PolarHBondContact O-NZ 2.99Å; C238-K241 WeakPolarHBondContact SG-CD 3.26Å; K241-F244 WeakPolarHBondContact O-CB 3.34Å; K241-F244 PolarHBondContact O-N 2.88Å; K241-F245 VanDerWaalsContact O-CD2 3.23Å; K241-F245 WeakPolarHBondContact O-CD2 3.46Å; K241-F245 PolarHBondContact O-N 3.46Å
242	V	90.6	Very high	90.1	Very high	94 Å²	94	60.1 Å²	60.1	57%	0.57	32%	0.319	S	S	*	.	H	α-helix	trans	-67.9	-41.7	178.2	179.9	0	0	0	0	110.7	S240 F244 F245 K246	S240-V242 VanDerWaalsContact C-N 3.33Å; S240-V242 PolarHBondContact O-N 3.47Å; S240-V242 PolarHBondContact OG-N 3.06Å; V242-F244 VanDerWaalsContact C-N 3.28Å; V242-F244 PolarHBondContact O-N 3.32Å; V242-F245 PolarHBondContact O-N 3.1Å; V242-K246 HydrophobicContact CG1-CD 4.22Å; V242-K246 WeakPolarHBondContact O-CG 3.35Å; V242-K246 PolarHBondContact O-N 3.45Å
243	L	86.8	Confident	90.1	Very high	110 Å²	110	55.6 Å²	55.6	58%	0.576	30%	0.295	S	S	*	.	H	α-helix	trans	-64.5	-37.2	176.7	-175.5	61.3	0	0	0	111.3	S240 F245 K246 S247	S240-L243 PolarHBondContact O-N 3.2Å; S240-L243 PolarHBondContact OG-N 3.46Å; L243-F245 PolarHBondContact O-N 3.05Å; L243-K246 PolarHBondContact O-N 3.42Å; L243-S247 PolarHBondContact O-N 3.38Å; L243-S247 VanDerWaalsContact O-N 3.15Å
244	F	90.4	Very high	90.1	Very high	12 Å²	12	55.9 Å²	55.9	5%	0.053	30%	0.297	C	S	.	.	H	α-helix	trans	-57	-48.8	176.3	-174.8	-94.9	0	0	0	112	I231 R234 F235 C238 S240 K241 V242 K246 S247 N250	I231-F244 HydrophobicContact CG1-CE1 4.28Å; I231-F244 HydrophobicContact CG1-CZ 3.91Å; R234-F244 HydrophobicContact CB-CE2 3.76Å; R234-F244 HydrophobicContact CB-CZ 4.25Å; F235-F244 HydrophobicContact CB-CE1 4.31Å; F235-F244 HydrophobicContact CB-CZ 4.41Å; F235-F244 AromaticContact CD2-CD1 3.95Å; F235-F244 HydrophobicContact CD2-CD1 3.95Å; F235-F244 HydrophobicContact CD2-CE1 4.24Å; C238-F244 HydrophobicContact CB-CB 4.47Å; C238-F244 HydrophobicContact CB-CD2 4.19Å; S240-F244 PolarHBondContact O-N 3.06Å; K241-F244 WeakPolarHBondContact O-CB 3.34Å; K241-F244 PolarHBondContact O-N 2.88Å; V242-F244 VanDerWaalsContact C-N 3.28Å; V242-F244 PolarHBondContact O-N 3.32Å; F244-K246 VanDerWaalsContact C-N 3.34Å; F244-K246 PolarHBondContact O-N 2.85Å; F244-S247 WeakPolarHBondContact O-CB 3.35Å; F244-S247 PolarHBondContact O-N 3.06Å; F244-N250 HydrophobicContact CD1-CB 4.48Å; F244-N250 HydrophobicContact CD2-CB 4.49Å; F244-N250 VanDerWaalsContact CD2-ND2 3.29Å; F244-N250 WeakPolarHBondContact CD2-ND2 3.28Å; F244-N250 HydrophobicContact CE1-CB 4.12Å; F244-N250 HydrophobicContact CE2-CB 4.1Å; F244-N250 VanDerWaalsContact CE2-ND2 3.32Å; F244-N250 WeakPolarHBondContact CE2-ND2 3.16Å; F244-N250 HydrophobicContact CZ-CB 3.91Å; F244-N250 WeakPolarHBondContact O-CB 3.2Å; F244-N250 PolarHBondContact O-ND2 3.16Å
245	F	90.6	Very high	90.1	Very high	105 Å²	105	59 Å²	59	46%	0.461	32%	0.317	S	S	.	.	H	α-helix	trans	-74.9	-18.2	177.1	-71.6	-69.1	0	0	0	114.4	F235 K241 V242 L243 S247 V251 L254	F235-F245 HydrophobicContact CD2-CE2 4.35Å; F235-F245 HydrophobicContact CD2-CZ 4.44Å; F235-F245 AromaticContact CE2-CE2 3.71Å; F235-F245 HydrophobicContact CE2-CE2 3.71Å; F235-F245 HydrophobicContact CE2-CZ 4.06Å; K241-F245 VanDerWaalsContact O-CD2 3.23Å; K241-F245 WeakPolarHBondContact O-CD2 3.46Å; K241-F245 PolarHBondContact O-N 3.46Å; V242-F245 PolarHBondContact O-N 3.1Å; L243-F245 PolarHBondContact O-N 3.05Å; F245-S247 VanDerWaalsContact C-N 3.33Å; F245-V251 WeakPolarHBondContact O-CG2 3.48Å; F245-L254 HydrophobicContact CD1-CD2 4.37Å; F245-L254 HydrophobicContact CE1-CD2 3.81Å
246	K	90.4	Very high	90.1	Very high	158 Å²	158	55.7 Å²	55.7	69%	0.687	30%	0.302	S	S	*	.	H	α-helix	trans	-78.8	-17	172	-77.2	-177.6	176.6	-175.2	0	113	V242 L243 F244	V242-K246 HydrophobicContact CG1-CD 4.22Å; V242-K246 WeakPolarHBondContact O-CG 3.35Å; V242-K246 PolarHBondContact O-N 3.45Å; L243-K246 PolarHBondContact O-N 3.42Å; F244-K246 VanDerWaalsContact C-N 3.34Å; F244-K246 PolarHBondContact O-N 2.85Å
247	S	88.3	Confident	90.2	Very high	37 Å²	37	52.3 Å²	52.3	26%	0.259	28%	0.281	S	S	.	.			trans	-75.8	119.8	177.1	178.9	0	0	0	0	110.5	L243 F244 F245 I249 N250 V251	L243-S247 PolarHBondContact O-N 3.38Å; L243-S247 VanDerWaalsContact O-N 3.15Å; F244-S247 WeakPolarHBondContact O-CB 3.35Å; F244-S247 PolarHBondContact O-N 3.06Å; F245-S247 VanDerWaalsContact C-N 3.33Å; S247-I249 VanDerWaalsContact C-N 3.28Å; S247-I249 PolarHBondContact O-N 3.22Å; S247-N250 WeakPolarHBondContact CB-ND2 3.48Å; S247-N250 PolarHBondContact O-N 3.16Å; S247-V251 WeakPolarHBondContact O-CG2 3.47Å; S247-V251 PolarHBondContact O-N 3.07Å; S247-V251 VanDerWaalsContact O-N 3.13Å
248	P	89.6	Confident	90.2	Very high	90 Å²	90	54.7 Å²	54.7	58%	0.584	29%	0.294	S	S	*	.	H	α-helix	trans	-63.1	-34.3	-175.6	24.7	-33.7	0	0	0	112.6	N250 V251 I252	P248-N250 VanDerWaalsContact C-N 3.34Å; P248-N250 PolarHBondContact O-N 3.4Å; P248-V251 PolarHBondContact O-N 3.32Å; P248-I252 VanDerWaalsContact O-CG1 3.27Å; P248-I252 WeakPolarHBondContact O-CG1 3.28Å; P248-I252 PolarHBondContact O-N 3.05Å
249	I	89.5	Confident	90.3	Very high	50 Å²	50	54.8 Å²	54.8	26%	0.256	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-41.9	179.3	-62.2	167.7	0	0	0	110.3	S247 I252 D253	S247-I249 VanDerWaalsContact C-N 3.28Å; S247-I249 PolarHBondContact O-N 3.22Å; I249-I252 PolarHBondContact O-N 3.39Å; I249-D253 PolarHBondContact O-N 2.95Å
250	N	92	Very high	90.5	Very high	12 Å²	12	53.5 Å²	53.5	6%	0.064	29%	0.285	C	S	.	.	H	α-helix	trans	-70.2	-35.7	178.7	-65.7	-21.2	0	0	0	112.1	F244 S247 P248 D253 L254	F244-N250 HydrophobicContact CD1-CB 4.48Å; F244-N250 HydrophobicContact CD2-CB 4.49Å; F244-N250 VanDerWaalsContact CD2-ND2 3.29Å; F244-N250 WeakPolarHBondContact CD2-ND2 3.28Å; F244-N250 HydrophobicContact CE1-CB 4.12Å; F244-N250 HydrophobicContact CE2-CB 4.1Å; F244-N250 VanDerWaalsContact CE2-ND2 3.32Å; F244-N250 WeakPolarHBondContact CE2-ND2 3.16Å; F244-N250 HydrophobicContact CZ-CB 3.91Å; F244-N250 WeakPolarHBondContact O-CB 3.2Å; F244-N250 PolarHBondContact O-ND2 3.16Å; S247-N250 WeakPolarHBondContact CB-ND2 3.48Å; S247-N250 PolarHBondContact O-N 3.16Å; P248-N250 VanDerWaalsContact C-N 3.34Å; P248-N250 PolarHBondContact O-N 3.4Å; N250-D253 PolarHBondContact O-N 3.23Å; N250-L254 WeakPolarHBondContact O-CB 3.5Å; N250-L254 PolarHBondContact O-N 3.21Å
251	V	93.2	Very high	90.5	Very high	57 Å²	57	55.3 Å²	55.3	35%	0.345	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-44.8	173.8	174.8	0	0	0	0	110.5	F245 S247 P248 L254 V255	F245-V251 WeakPolarHBondContact O-CG2 3.48Å; S247-V251 WeakPolarHBondContact O-CG2 3.47Å; S247-V251 PolarHBondContact O-N 3.07Å; S247-V251 VanDerWaalsContact O-N 3.13Å; P248-V251 PolarHBondContact O-N 3.32Å; V251-L254 PolarHBondContact O-N 3.44Å; V251-V255 HydrophobicContact CG1-CG2 4.43Å; V251-V255 WeakPolarHBondContact O-CG2 3.41Å; V251-V255 PolarHBondContact O-N 3.26Å
252	I	92.4	Very high	90.2	Very high	44 Å²	44	54.5 Å²	54.5	23%	0.226	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-44.7	176.8	-68.9	165.9	0	0	0	110.9	P248 I249 L254 V255 A256 M287 F290	P248-I252 VanDerWaalsContact O-CG1 3.27Å; P248-I252 WeakPolarHBondContact O-CG1 3.28Å; P248-I252 PolarHBondContact O-N 3.05Å; I249-I252 PolarHBondContact O-N 3.39Å; I252-L254 VanDerWaalsContact C-N 3.33Å; I252-L254 PolarHBondContact O-N 3.2Å; I252-V255 PolarHBondContact O-N 2.81Å; I252-A256 VanDerWaalsContact O-CB 3.28Å; I252-A256 WeakPolarHBondContact O-CB 3.46Å; I252-A256 PolarHBondContact O-N 3.45Å; I252-M287 HydrophobicContact CD1-CE 4.5Å; I252-M287 HydrophobicContact CG1-CE 4.34Å; I252-M287 HydrophobicContact CG2-CB 3.87Å; I252-M287 HydrophobicContact CG2-CE 4.19Å; I252-M287 VanDerWaalsContact CG2-O 3.26Å; I252-M287 WeakPolarHBondContact CG2-O 3.37Å; I252-F290 HydrophobicContact CD1-CB 4.31Å; I252-F290 HydrophobicContact CD1-CG 4.49Å; I252-F290 HydrophobicContact CG2-CB 4.05Å; I252-F290 HydrophobicContact CG2-CD2 4.36Å
253	D	93.5	Very high	89.7	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-41.7	176.7	-163.9	19	0	0	0	111.5	R234 I249 N250 T257 K291	R234-D253 IonicContact NH1-OD2 3.9Å; I249-D253 PolarHBondContact O-N 2.95Å; N250-D253 PolarHBondContact O-N 3.23Å; D253-T257 VanDerWaalsContact O-CB 3.29Å; D253-T257 WeakPolarHBondContact O-CB 3.4Å; D253-T257 PolarHBondContact O-N 3.33Å; D253-T257 PolarHBondContact O-OG1 3.3Å; D253-K291 IonicContact OD1-NZ 3.18Å; D253-K291 PolarHBondContact OD1-NZ 3.07Å; D253-K291 WeakPolarHBondContact OD2-CE 3.32Å; D253-K291 IonicContact OD2-NZ 2.81Å; D253-K291 PolarHBondContact OD2-NZ 3.31Å
254	L	93.7	Very high	89.3	Confident	52 Å²	52	50 Å²	50	27%	0.272	25%	0.254	S	S	.	.	H	α-helix	trans	-62.2	-51.8	176	-178.7	63.3	0	0	0	111.7	I231 F245 N250 V251 I252 A256 T257 M258	I231-L254 HydrophobicContact CD1-CB 3.65Å; I231-L254 HydrophobicContact CD1-CD1 3.75Å; I231-L254 HydrophobicContact CD1-CG 4.29Å; F245-L254 HydrophobicContact CD1-CD2 4.37Å; F245-L254 HydrophobicContact CE1-CD2 3.81Å; N250-L254 WeakPolarHBondContact O-CB 3.5Å; N250-L254 PolarHBondContact O-N 3.21Å; V251-L254 PolarHBondContact O-N 3.44Å; I252-L254 VanDerWaalsContact C-N 3.33Å; I252-L254 PolarHBondContact O-N 3.2Å; L254-A256 VanDerWaalsContact C-N 3.33Å; L254-A256 PolarHBondContact O-N 2.9Å; L254-T257 PolarHBondContact O-N 3.45Å; L254-M258 HydrophobicContact CD1-CE 4.42Å; L254-M258 HydrophobicContact CD1-CG 4Å; L254-M258 HydrophobicContact CG-CG 4.26Å; L254-M258 WeakPolarHBondContact O-CB 3.33Å; L254-M258 VanDerWaalsContact O-CG 3.25Å; L254-M258 WeakPolarHBondContact O-CG 3.46Å; L254-M258 PolarHBondContact O-N 3.34Å
255	V	92.2	Very high	88.7	Confident	68 Å²	68	53.8 Å²	53.8	41%	0.412	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-42.4	-179.1	169.8	0	0	0	0	111	V251 I252 T257 M258 S259 I284	V251-V255 HydrophobicContact CG1-CG2 4.43Å; V251-V255 WeakPolarHBondContact O-CG2 3.41Å; V251-V255 PolarHBondContact O-N 3.26Å; I252-V255 PolarHBondContact O-N 2.81Å; V255-T257 VanDerWaalsContact C-N 3.31Å; V255-T257 PolarHBondContact O-N 3.11Å; V255-M258 PolarHBondContact O-N 2.81Å; V255-S259 PolarHBondContact O-N 3.43Å; V255-S259 VanDerWaalsContact O-N 3.12Å; V255-I284 HydrophobicContact CG1-CG2 3.55Å
256	A	92.6	Very high	87.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-31.3	177	0	0	0	0	0	113.1	I252 L254 S259 M287 R288	I252-A256 VanDerWaalsContact O-CB 3.28Å; I252-A256 WeakPolarHBondContact O-CB 3.46Å; I252-A256 PolarHBondContact O-N 3.45Å; L254-A256 VanDerWaalsContact C-N 3.33Å; L254-A256 PolarHBondContact O-N 2.9Å; A256-S259 PolarHBondContact O-OG 3.13Å; A256-M287 HydrophobicContact CB-CB 4.33Å; A256-R288 HydrophobicContact CB-CB 4.09Å; A256-R288 PolarHBondContact O-NH2 3.46Å; A256-R288 VanDerWaalsContact O-NH2 3.12Å
257	T	92.3	Very high	87	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-79.8	-36.9	176.4	-60.1	0	0	0	0	111.7	N224 T228 D253 L254 V255 S259 F260 F261	N224-T257 PolarHBondContact OD1-O 3.06Å; T228-T257 HydrophobicContact CG2-CG2 3.36Å; D253-T257 VanDerWaalsContact O-CB 3.29Å; D253-T257 WeakPolarHBondContact O-CB 3.4Å; D253-T257 PolarHBondContact O-N 3.33Å; D253-T257 PolarHBondContact O-OG1 3.3Å; L254-T257 PolarHBondContact O-N 3.45Å; V255-T257 VanDerWaalsContact C-N 3.31Å; V255-T257 PolarHBondContact O-N 3.11Å; T257-S259 VanDerWaalsContact C-N 3.32Å; T257-S259 PolarHBondContact O-N 3.27Å; T257-F260 PolarHBondContact O-N 3.03Å; T257-F261 HydrophobicContact CG2-CE2 4.15Å; T257-F261 WeakPolarHBondContact O-CD2 3.21Å
258	M	90.3	Very high	86.4	Confident	80 Å²	80	57.6 Å²	57.6	39%	0.394	29%	0.29	S	S	.	.	H	α-helix	trans	-67.4	-30.4	177.6	-72.1	-60.6	100	0	0	112.8	L254 V255 F260 F261 M262	L254-M258 HydrophobicContact CD1-CE 4.42Å; L254-M258 HydrophobicContact CD1-CG 4Å; L254-M258 HydrophobicContact CG-CG 4.26Å; L254-M258 WeakPolarHBondContact O-CB 3.33Å; L254-M258 VanDerWaalsContact O-CG 3.25Å; L254-M258 WeakPolarHBondContact O-CG 3.46Å; L254-M258 PolarHBondContact O-N 3.34Å; V255-M258 PolarHBondContact O-N 2.81Å; M258-F260 PolarHBondContact O-N 3.49Å; M258-F260 VanDerWaalsContact O-N 3.14Å; M258-F261 HydrophobicContact CE-CD2 3.52Å; M258-F261 HydrophobicContact CE-CE2 3.76Å; M258-F261 PolarHBondContact O-N 3.46Å; M258-F261 HydrophobicContact SD-CD2 4.35Å; M258-M262 WeakPolarHBondContact O-CG 3.47Å; M258-M262 PolarHBondContact O-N 3.39Å
259	S	88.9	Confident	85.5	Confident	5 Å²	5	58.6 Å²	58.6	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-25.8	177.4	70.4	0	0	0	0	113.9	V255 A256 T257 F281 R285	V255-S259 PolarHBondContact O-N 3.43Å; V255-S259 VanDerWaalsContact O-N 3.12Å; A256-S259 PolarHBondContact O-OG 3.13Å; T257-S259 VanDerWaalsContact C-N 3.32Å; T257-S259 PolarHBondContact O-N 3.27Å; S259-F281 WeakPolarHBondContact CB-O 3.24Å; S259-R285 PolarHBondContact O-NH2 3.39Å; S259-R285 WeakPolarHBondContact OG-CG 3.28Å
260	F	87.8	Confident	84.2	Confident	13 Å²	13	57.7 Å²	57.7	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-71.8	-42.3	172.3	179.8	-100.1	0	0	0	112	F217 E220 A221 N224 T257 M258 M262 D263 F264	F217-F260 HydrophobicContact CE2-CE2 4.42Å; F217-F260 HydrophobicContact CE2-CZ 4.37Å; E220-F260 HydrophobicContact CB-CD2 4.39Å; E220-F260 HydrophobicContact CB-CE2 3.99Å; A221-F260 HydrophobicContact CB-CE2 4.49Å; A221-F260 HydrophobicContact CB-CZ 3.75Å; N224-F260 HydrophobicContact CB-CB 4.22Å; N224-F260 HydrophobicContact CB-CD1 3.86Å; N224-F260 HydrophobicContact CB-CD2 4.32Å; N224-F260 HydrophobicContact CB-CE1 4.23Å; N224-F260 HydrophobicContact CB-CG 3.87Å; N224-F260 VanDerWaalsContact CG-CB 3.49Å; N224-F260 WeakPolarHBondContact ND2-CD1 3.1Å; N224-F260 WeakPolarHBondContact OD1-CB 3.24Å; T257-F260 PolarHBondContact O-N 3.03Å; M258-F260 PolarHBondContact O-N 3.49Å; M258-F260 VanDerWaalsContact O-N 3.14Å; F260-M262 VanDerWaalsContact C-N 3.3Å; F260-M262 PolarHBondContact O-N 2.9Å; F260-D263 WeakPolarHBondContact O-CB 3.3Å; F260-D263 PolarHBondContact O-N 2.9Å; F260-F264 HydrophobicContact CD1-CD2 4.43Å; F260-F264 AromaticContact CD1-CE2 3.72Å; F260-F264 HydrophobicContact CD1-CE2 3.72Å; F260-F264 HydrophobicContact CD2-CE2 4.44Å; F260-F264 HydrophobicContact CE1-CD2 4.3Å; F260-F264 AromaticContact CE1-CE2 3.26Å; F260-F264 HydrophobicContact CE1-CE2 3.26Å; F260-F264 AromaticContact CE1-CZ 3.77Å; F260-F264 HydrophobicContact CE1-CZ 3.77Å; F260-F264 HydrophobicContact CE2-CE2 4.02Å; F260-F264 HydrophobicContact CE2-CZ 4.44Å; F260-F264 HydrophobicContact CG-CE2 4.32Å; F260-F264 AromaticContact CZ-CE2 3.42Å; F260-F264 HydrophobicContact CZ-CE2 3.42Å; F260-F264 VanDerWaalsContact CZ-CE2 3.42Å; F260-F264 AromaticContact CZ-CZ 3.64Å; F260-F264 HydrophobicContact CZ-CZ 3.64Å; F260-F264 VanDerWaalsContact O-CD2 3.27Å; F260-F264 WeakPolarHBondContact O-CD2 3.49Å
261	F	87.2	Confident	82.8	Confident	88 Å²	88	66.3 Å²	66.3	39%	0.386	34%	0.337	S	S	.	.	H	α-helix	trans	-69.9	-28.9	178.3	-65.4	-74.3	0	0	0	112.8	N224 T228 T257 M258 D263 F264 L265	N224-F261 VanDerWaalsContact ND2-CE2 3.33Å; N224-F261 WeakPolarHBondContact ND2-CE2 3.23Å; T228-F261 HydrophobicContact CG2-CE2 3.44Å; T228-F261 VanDerWaalsContact CG2-CE2 3.44Å; T228-F261 HydrophobicContact CG2-CZ 3.53Å; T257-F261 HydrophobicContact CG2-CE2 4.15Å; T257-F261 WeakPolarHBondContact O-CD2 3.21Å; M258-F261 HydrophobicContact CE-CD2 3.52Å; M258-F261 HydrophobicContact CE-CE2 3.76Å; M258-F261 PolarHBondContact O-N 3.46Å; M258-F261 HydrophobicContact SD-CD2 4.35Å; F261-D263 PolarHBondContact O-N 3.45Å; F261-F264 PolarHBondContact O-N 2.94Å; F261-F264 VanDerWaalsContact O-N 3.15Å; F261-L265 PolarHBondContact O-N 3.4Å
262	M	82.7	Confident	81.4	Confident	67 Å²	67	69 Å²	69	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-59.7	-32.6	174.6	-68.2	-55.4	-68.1	0	0	112.2	M258 F260 F264 L265 L266	M258-M262 WeakPolarHBondContact O-CG 3.47Å; M258-M262 PolarHBondContact O-N 3.39Å; F260-M262 VanDerWaalsContact C-N 3.3Å; F260-M262 PolarHBondContact O-N 2.9Å; M262-F264 VanDerWaalsContact C-N 3.32Å; M262-F264 PolarHBondContact O-N 3.31Å; M262-L265 PolarHBondContact O-N 3Å; M262-L265 HydrophobicContact SD-CD2 4.22Å; M262-L266 VanDerWaalsContact O-CB 3.25Å; M262-L266 WeakPolarHBondContact O-CB 3.39Å; M262-L266 VanDerWaalsContact O-CG 3.23Å; M262-L266 WeakPolarHBondContact O-CG 3.17Å; M262-L266 PolarHBondContact O-N 3.43Å
263	D	78.8	Confident	79.9	Confident	27 Å²	27	68.9 Å²	68.9	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-61.4	-42.1	175.7	-68.7	3.7	0	0	0	111.5	F260 F261 K267 V278 R285	F260-D263 WeakPolarHBondContact O-CB 3.3Å; F260-D263 PolarHBondContact O-N 2.9Å; F261-D263 PolarHBondContact O-N 3.45Å; D263-K267 VanDerWaalsContact O-CB 3.28Å; D263-K267 WeakPolarHBondContact O-CB 3.39Å; D263-K267 PolarHBondContact O-N 3.15Å; D263-K267 VanDerWaalsContact O-N 3.15Å; D263-V278 HydrophobicContact CB-CG1 4.07Å; D263-V278 WeakPolarHBondContact OD1-CG1 3.32Å; D263-R285 IonicContact OD1-NH2 3.92Å; D263-R285 PolarHBondContact OD1-NH2 3.42Å; D263-R285 IonicContact OD2-CZ 2.99Å; D263-R285 IonicContact OD2-NH1 2.8Å; D263-R285 PolarHBondContact OD2-NH1 3.38Å; D263-R285 IonicContact OD2-NH2 3.83Å; D263-R285 PolarHBondContact OD2-NH2 3.46Å
264	F	78.2	Confident	78.6	Confident	82 Å²	82	73.2 Å²	73.2	36%	0.36	39%	0.387	S	S	.	.	H	α-helix	trans	-70.4	-46.9	178.1	-63.5	-93.4	0	0	0	111.3	F217 F260 F261 M262 L266 K267 E268	F217-F264 HydrophobicContact CE2-CE1 4Å; F217-F264 HydrophobicContact CE2-CE2 4.19Å; F217-F264 AromaticContact CE2-CZ 3.44Å; F217-F264 HydrophobicContact CE2-CZ 3.44Å; F217-F264 VanDerWaalsContact CE2-CZ 3.44Å; F217-F264 AromaticContact CZ-CE1 3.61Å; F217-F264 HydrophobicContact CZ-CE1 3.61Å; F217-F264 HydrophobicContact CZ-CE2 4.45Å; F217-F264 AromaticContact CZ-CZ 3.33Å; F217-F264 HydrophobicContact CZ-CZ 3.33Å; F260-F264 HydrophobicContact CD1-CD2 4.43Å; F260-F264 AromaticContact CD1-CE2 3.72Å; F260-F264 HydrophobicContact CD1-CE2 3.72Å; F260-F264 HydrophobicContact CD2-CE2 4.44Å; F260-F264 HydrophobicContact CE1-CD2 4.3Å; F260-F264 AromaticContact CE1-CE2 3.26Å; F260-F264 HydrophobicContact CE1-CE2 3.26Å; F260-F264 AromaticContact CE1-CZ 3.77Å; F260-F264 HydrophobicContact CE1-CZ 3.77Å; F260-F264 HydrophobicContact CE2-CE2 4.02Å; F260-F264 HydrophobicContact CE2-CZ 4.44Å; F260-F264 HydrophobicContact CG-CE2 4.32Å; F260-F264 AromaticContact CZ-CE2 3.42Å; F260-F264 HydrophobicContact CZ-CE2 3.42Å; F260-F264 VanDerWaalsContact CZ-CE2 3.42Å; F260-F264 AromaticContact CZ-CZ 3.64Å; F260-F264 HydrophobicContact CZ-CZ 3.64Å; F260-F264 VanDerWaalsContact O-CD2 3.27Å; F260-F264 WeakPolarHBondContact O-CD2 3.49Å; F261-F264 PolarHBondContact O-N 2.94Å; F261-F264 VanDerWaalsContact O-N 3.15Å; M262-F264 VanDerWaalsContact C-N 3.32Å; M262-F264 PolarHBondContact O-N 3.31Å; F264-L266 PolarHBondContact O-N 3.38Å; F264-K267 PolarHBondContact O-N 2.99Å; F264-E268 PolarHBondContact O-N 2.93Å; F264-E268 VanDerWaalsContact O-N 3.07Å
265	L	78.2	Confident	77.4	Confident	91 Å²	91	74.3 Å²	74.3	48%	0.476	39%	0.39	S	S	.	.	H	α-helix	trans	-63.2	-43.1	-178.2	-176.3	65.7	0	0	0	111.6	F261 M262 E268 V269	F261-L265 PolarHBondContact O-N 3.4Å; M262-L265 PolarHBondContact O-N 3Å; M262-L265 HydrophobicContact SD-CD2 4.22Å; L265-E268 PolarHBondContact O-N 2.73Å; L265-V269 HydrophobicContact CD1-CG2 3.89Å; L265-V269 HydrophobicContact CG-CG2 4.32Å; L265-V269 WeakPolarHBondContact O-CB 3.17Å; L265-V269 WeakPolarHBondContact O-CG2 3.4Å; L265-V269 PolarHBondContact O-N 3.02Å
266	L	74.2	Confident	76.4	Confident	40 Å²	40	76 Å²	76	21%	0.209	40%	0.396	C	S	.	.	H	α-helix	trans	-66.4	-38.8	177.2	-72	172.8	0	0	0	111.4	M262 F264 E268 A270 V278 F281	M262-L266 VanDerWaalsContact O-CB 3.25Å; M262-L266 WeakPolarHBondContact O-CB 3.39Å; M262-L266 VanDerWaalsContact O-CG 3.23Å; M262-L266 WeakPolarHBondContact O-CG 3.17Å; M262-L266 PolarHBondContact O-N 3.43Å; F264-L266 PolarHBondContact O-N 3.38Å; L266-E268 VanDerWaalsContact C-N 3.28Å; L266-E268 PolarHBondContact O-N 3.32Å; L266-A270 WeakPolarHBondContact O-CA 3.34Å; L266-A270 WeakPolarHBondContact O-CB 3.27Å; L266-A270 PolarHBondContact O-N 2.89Å; L266-V278 HydrophobicContact CB-CG2 4.34Å; L266-V278 HydrophobicContact CD1-CG2 4.21Å; L266-F281 HydrophobicContact CD1-CD2 3.93Å; L266-F281 HydrophobicContact CD1-CE2 4.12Å
267	K	71.7	Confident	75.4	Confident	182 Å²	182	81.5 Å²	81.5	79%	0.791	42%	0.423	S	S	*	.	H	α-helix	trans	-63.4	-33.3	176.6	-172.5	175	-178.1	179.4	0	112.9	D263 F264	D263-K267 VanDerWaalsContact O-CB 3.28Å; D263-K267 WeakPolarHBondContact O-CB 3.39Å; D263-K267 PolarHBondContact O-N 3.15Å; D263-K267 VanDerWaalsContact O-N 3.15Å; F264-K267 PolarHBondContact O-N 2.99Å
268	E	74.3	Confident	74.6	Confident	158 Å²	158	82.9 Å²	82.9	74%	0.738	43%	0.432	S	S	*	.	H	α-helix	trans	-81.5	-44.6	177.7	-72.2	-175.7	178	0	0	113.1	F264 L265 L266	F264-E268 PolarHBondContact O-N 2.93Å; F264-E268 VanDerWaalsContact O-N 3.07Å; L265-E268 PolarHBondContact O-N 2.73Å; L266-E268 VanDerWaalsContact C-N 3.28Å; L266-E268 PolarHBondContact O-N 3.32Å
269	V	71.3	Confident	73.8	Confident	112 Å²	112	82.6 Å²	82.6	68%	0.679	43%	0.429	S	S	*	.	H	α-helix	trans	-82.5	-39.1	-172.2	175.4	0	0	0	0	111.8	L265	L265-V269 HydrophobicContact CD1-CG2 3.89Å; L265-V269 HydrophobicContact CG-CG2 4.32Å; L265-V269 WeakPolarHBondContact O-CB 3.17Å; L265-V269 WeakPolarHBondContact O-CG2 3.4Å; L265-V269 PolarHBondContact O-N 3.02Å
270	A	63.7	Low	73.5	Confident	31 Å²	31	88.3 Å²	88.3	26%	0.256	45%	0.454	S	S	.	.			trans	-105.9	91.8	-173.3	0	0	0	0	0	109.7	L266 S272 A273	L266-A270 WeakPolarHBondContact O-CA 3.34Å; L266-A270 WeakPolarHBondContact O-CB 3.27Å; L266-A270 PolarHBondContact O-N 2.89Å; A270-S272 PolarHBondContact O-N 3.44Å; A270-A273 HydrophobicContact CB-CB 3.55Å; A270-A273 PolarHBondContact O-N 3.33Å
271	M	61	Low	73.3	Confident	193 Å²	193	91.1 Å²	91.1	95%	0.951	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-14.4	169.5	-72.7	-176.8	-81.7	0	0	113
272	S	63.8	Low	73	Confident	113 Å²	113	87.2 Å²	87.2	79%	0.79	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	17.6	-177.4	62.1	0	0	0	0	114.4	A270 N274	A270-S272 PolarHBondContact O-N 3.44Å; S272-N274 PolarHBondContact O-N 2.97Å; S272-N274 VanDerWaalsContact O-N 3.16Å
273	A	61.2	Low	73.3	Confident	41 Å²	41	88.1 Å²	88.1	34%	0.339	46%	0.455	S	S	.	.			trans	-60.1	126.1	175	0	0	0	0	0	109.6	A270 K275	A270-A273 HydrophobicContact CB-CB 3.55Å; A270-A273 PolarHBondContact O-N 3.33Å; A273-K275 PolarHBondContact O-N 3.39Å
274	N	67.6	Low	73.8	Confident	94 Å²	94	89.2 Å²	89.2	50%	0.503	46%	0.461	S	S	.	.			trans	-59.9	122.6	174.2	-163.8	2.7	0	0	0	108.1	S272 D276 M277	S272-N274 PolarHBondContact O-N 2.97Å; S272-N274 VanDerWaalsContact O-N 3.16Å; N274-D276 PolarHBondContact O-N 2.85Å; N274-M277 HydrophobicContact CB-CG 4.25Å; N274-M277 WeakPolarHBondContact O-CB 3.41Å; N274-M277 PolarHBondContact O-N 2.95Å
275	K	68.3	Low	74.3	Confident	76 Å²	76	85.8 Å²	85.8	33%	0.33	45%	0.445	S	S	.	.	H	α-helix	trans	-52.9	-33.7	-175.8	-176	-177	168	-156	0	111.2	T210 A273 M277 V278 E279	T210-K275 PolarHBondContact O-NZ 3.48Å; T210-K275 VanDerWaalsContact O-NZ 3.08Å; A273-K275 PolarHBondContact O-N 3.39Å; K275-M277 VanDerWaalsContact C-N 3.29Å; K275-M277 PolarHBondContact O-N 2.94Å; K275-V278 WeakPolarHBondContact O-CB 3.46Å; K275-V278 PolarHBondContact O-N 3.06Å; K275-V278 VanDerWaalsContact O-N 3.15Å; K275-E279 WeakPolarHBondContact CE-OE1 3.29Å; K275-E279 IonicContact NZ-OE1 2.86Å; K275-E279 PolarHBondContact O-N 3.42Å; K275-E279 VanDerWaalsContact O-N 3.11Å
276	D	70.2	Confident	75	Confident	103 Å²	103	84.5 Å²	84.5	55%	0.551	44%	0.438	S	S	*	.	H	α-helix	trans	-59.4	-35.2	176.7	-55.1	-17.6	0	0	0	113.1	N274 E279 F280	N274-D276 PolarHBondContact O-N 2.85Å; D276-E279 PolarHBondContact O-N 2.99Å; D276-F280 PolarHBondContact O-N 3.2Å
277	M	72.3	Confident	75.8	Confident	115 Å²	115	86 Å²	86	57%	0.567	45%	0.445	S	S	*	.	H	α-helix	trans	-69.8	-36.9	177.8	-68.8	-70.2	-176.4	0	0	111.7	N274 K275 E279 F280 F281	N274-M277 HydrophobicContact CB-CG 4.25Å; N274-M277 WeakPolarHBondContact O-CB 3.41Å; N274-M277 PolarHBondContact O-N 2.95Å; K275-M277 VanDerWaalsContact C-N 3.29Å; K275-M277 PolarHBondContact O-N 2.94Å; M277-E279 VanDerWaalsContact C-N 3.34Å; M277-F280 WeakPolarHBondContact O-CB 3.46Å; M277-F280 PolarHBondContact O-N 2.87Å; M277-F281 WeakPolarHBondContact O-CD2 3.45Å; M277-F281 PolarHBondContact O-N 2.9Å
278	V	74.2	Confident	76.8	Confident	30 Å²	30	77.6 Å²	77.6	18%	0.182	41%	0.408	C	S	.	.	H	α-helix	trans	-66	-40.9	175.5	-178.2	0	0	0	0	110	D263 L266 K275 F280 F281 S282	D263-V278 HydrophobicContact CB-CG1 4.07Å; D263-V278 WeakPolarHBondContact OD1-CG1 3.32Å; L266-V278 HydrophobicContact CB-CG2 4.34Å; L266-V278 HydrophobicContact CD1-CG2 4.21Å; K275-V278 WeakPolarHBondContact O-CB 3.46Å; K275-V278 PolarHBondContact O-N 3.06Å; K275-V278 VanDerWaalsContact O-N 3.15Å; V278-F280 VanDerWaalsContact C-N 3.33Å; V278-F280 PolarHBondContact O-N 3.49Å; V278-F281 PolarHBondContact O-N 3.32Å; V278-S282 PolarHBondContact O-N 2.62Å; V278-S282 PolarHBondContact O-OG 3.49Å
279	E	74.7	Confident	77.6	Confident	73 Å²	73	73.4 Å²	73.4	34%	0.341	39%	0.391	S	S	.	.	H	α-helix	trans	-63.8	-37.5	174.3	-67.3	-171.7	-167.1	0	0	112	K275 D276 M277 S282	K275-E279 WeakPolarHBondContact CE-OE1 3.29Å; K275-E279 IonicContact NZ-OE1 2.86Å; K275-E279 PolarHBondContact O-N 3.42Å; K275-E279 VanDerWaalsContact O-N 3.11Å; D276-E279 PolarHBondContact O-N 2.99Å; M277-E279 VanDerWaalsContact C-N 3.34Å; E279-S282 WeakPolarHBondContact O-CB 3.34Å; E279-S282 PolarHBondContact O-N 3.42Å; E279-S282 VanDerWaalsContact O-N 3.12Å
280	F	81.5	Confident	78.6	Confident	126 Å²	126	73 Å²	73	55%	0.553	38%	0.38	S	S	*	.	H	α-helix	trans	-61.4	-45.7	175.4	-179.7	-98.7	0	0	0	112.9	D276 M277 V278 S282 I283	D276-F280 PolarHBondContact O-N 3.2Å; M277-F280 WeakPolarHBondContact O-CB 3.46Å; M277-F280 PolarHBondContact O-N 2.87Å; V278-F280 VanDerWaalsContact C-N 3.33Å; V278-F280 PolarHBondContact O-N 3.49Å; F280-S282 PolarHBondContact O-N 3.09Å; F280-I283 HydrophobicContact CD2-CD1 4.15Å; F280-I283 WeakPolarHBondContact O-CB 3.36Å; F280-I283 PolarHBondContact O-N 3.07Å
281	F	83.9	Confident	79.8	Confident	71 Å²	71	71.7 Å²	71.7	31%	0.311	37%	0.369	S	S	.	.	H	α-helix	trans	-62.2	-26	175.9	-75.3	-66.2	0	0	0	112.6	S259 L266 M277 V278 I283 I284	S259-F281 WeakPolarHBondContact CB-O 3.24Å; L266-F281 HydrophobicContact CD1-CD2 3.93Å; L266-F281 HydrophobicContact CD1-CE2 4.12Å; M277-F281 WeakPolarHBondContact O-CD2 3.45Å; M277-F281 PolarHBondContact O-N 2.9Å; V278-F281 PolarHBondContact O-N 3.32Å; F281-I283 PolarHBondContact O-N 3.4Å; F281-I284 HydrophobicContact CD1-CD1 3.79Å; F281-I284 HydrophobicContact CE1-CD1 4.47Å; F281-I284 WeakPolarHBondContact O-CB 3.17Å; F281-I284 PolarHBondContact O-N 2.96Å
282	S	81.8	Confident	81.1	Confident	7 Å²	7	64.7 Å²	64.7	5%	0.049	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-25	174.8	-60	0	0	0	0	112.8	V278 E279 F280 I284 R285	V278-S282 PolarHBondContact O-N 2.62Å; V278-S282 PolarHBondContact O-OG 3.49Å; E279-S282 WeakPolarHBondContact O-CB 3.34Å; E279-S282 PolarHBondContact O-N 3.42Å; E279-S282 VanDerWaalsContact O-N 3.12Å; F280-S282 PolarHBondContact O-N 3.09Å; S282-I284 VanDerWaalsContact C-N 3.27Å; S282-I284 PolarHBondContact O-N 3.26Å; S282-R285 WeakPolarHBondContact O-CB 3.35Å; S282-R285 WeakPolarHBondContact O-CG 3.38Å; S282-R285 PolarHBondContact O-N 3.4Å; S282-R285 VanDerWaalsContact O-N 3.14Å; S282-R285 PolarHBondContact OG-NH1 3.2Å; S282-R285 VanDerWaalsContact OG-NH1 3.09Å; S282-R285 PolarHBondContact OG-NH2 3.3Å
283	I	88.2	Confident	82.2	Confident	85 Å²	85	60.2 Å²	60.2	44%	0.436	30%	0.303	S	S	.	.	H	α-helix	trans	-64.9	-32.4	176.5	-59.6	174.4	0	0	0	111.3	F170 F280 F281 R285 I286	F170-I283 HydrophobicContact CZ-CG1 4.31Å; F280-I283 HydrophobicContact CD2-CD1 4.15Å; F280-I283 WeakPolarHBondContact O-CB 3.36Å; F280-I283 PolarHBondContact O-N 3.07Å; F281-I283 PolarHBondContact O-N 3.4Å; I283-R285 PolarHBondContact O-N 3.1Å; I283-I286 HydrophobicContact CG2-CD1 3.95Å; I283-I286 WeakPolarHBondContact O-CB 3.44Å; I283-I286 VanDerWaalsContact O-CG1 3.31Å; I283-I286 WeakPolarHBondContact O-CG1 3.46Å; I283-I286 PolarHBondContact O-N 3.31Å
284	I	90	Very high	83.1	Confident	51 Å²	51	58.7 Å²	58.7	26%	0.262	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-57.5	-23.2	177.1	-59.1	179.6	0	0	0	111.1	V255 F281 S282 I286 M287	V255-I284 HydrophobicContact CG1-CG2 3.55Å; F281-I284 HydrophobicContact CD1-CD1 3.79Å; F281-I284 HydrophobicContact CE1-CD1 4.47Å; F281-I284 WeakPolarHBondContact O-CB 3.17Å; F281-I284 PolarHBondContact O-N 2.96Å; S282-I284 VanDerWaalsContact C-N 3.27Å; S282-I284 PolarHBondContact O-N 3.26Å; I284-I286 PolarHBondContact O-N 2.99Å; I284-M287 HydrophobicContact CG2-CG 4.39Å; I284-M287 WeakPolarHBondContact O-CB 3.28Å; I284-M287 VanDerWaalsContact O-CG 3.29Å; I284-M287 WeakPolarHBondContact O-CG 3.34Å; I284-M287 PolarHBondContact O-N 2.71Å
285	R	88.5	Confident	83.9	Confident	10 Å²	10	55.6 Å²	55.6	4%	0.038	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-58	-29.5	174.3	-63.5	176.3	-176.8	136.4	29.8	112.7	E220 S259 D263 S282 I283 M287 R288	E220-R285 IonicContact OE2-CZ 3.12Å; E220-R285 IonicContact OE2-NH1 3.56Å; E220-R285 PolarHBondContact OE2-NH1 2.92Å; S259-R285 PolarHBondContact O-NH2 3.39Å; S259-R285 WeakPolarHBondContact OG-CG 3.28Å; D263-R285 IonicContact OD1-NH2 3.92Å; D263-R285 PolarHBondContact OD1-NH2 3.42Å; D263-R285 IonicContact OD2-CZ 2.99Å; D263-R285 IonicContact OD2-NH1 2.8Å; D263-R285 PolarHBondContact OD2-NH1 3.38Å; D263-R285 IonicContact OD2-NH2 3.83Å; D263-R285 PolarHBondContact OD2-NH2 3.46Å; S282-R285 WeakPolarHBondContact O-CB 3.35Å; S282-R285 WeakPolarHBondContact O-CG 3.38Å; S282-R285 PolarHBondContact O-N 3.4Å; S282-R285 VanDerWaalsContact O-N 3.14Å; S282-R285 PolarHBondContact OG-NH1 3.2Å; S282-R285 VanDerWaalsContact OG-NH1 3.09Å; S282-R285 PolarHBondContact OG-NH2 3.3Å; I283-R285 PolarHBondContact O-N 3.1Å; R285-M287 PolarHBondContact O-N 3.2Å; R285-R288 WeakPolarHBondContact O-CB 3.35Å; R285-R288 WeakPolarHBondContact O-CG 3.38Å; R285-R288 PolarHBondContact O-N 3.09Å; R285-R288 VanDerWaalsContact O-N 3.12Å; R285-R288 PolarHBondContact O-NE 3.46Å
286	I	91.7	Very high	84.6	Confident	63 Å²	63	54 Å²	54	32%	0.323	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-60.2	-29.1	177.4	-59.3	173.2	0	0	0	111.1	F170 I283 I284 R288 L289	F170-I286 HydrophobicContact CD1-CD1 4.29Å; F170-I286 HydrophobicContact CD1-CG1 4.09Å; F170-I286 HydrophobicContact CE1-CD1 3.53Å; F170-I286 HydrophobicContact CE1-CG1 3.76Å; F170-I286 HydrophobicContact CZ-CD1 3.96Å; F170-I286 HydrophobicContact CZ-CG1 4.18Å; I283-I286 HydrophobicContact CG2-CD1 3.95Å; I283-I286 WeakPolarHBondContact O-CB 3.44Å; I283-I286 VanDerWaalsContact O-CG1 3.31Å; I283-I286 WeakPolarHBondContact O-CG1 3.46Å; I283-I286 PolarHBondContact O-N 3.31Å; I284-I286 PolarHBondContact O-N 2.99Å; I286-R288 PolarHBondContact O-N 3.04Å; I286-L289 HydrophobicContact CG2-CD1 3.83Å; I286-L289 VanDerWaalsContact O-CB 3.32Å; I286-L289 WeakPolarHBondContact O-CB 3.29Å; I286-L289 WeakPolarHBondContact O-CG 3.27Å; I286-L289 PolarHBondContact O-N 3.05Å
287	M	91.8	Very high	84.8	Confident	73 Å²	73	52.4 Å²	52.4	36%	0.36	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-56.7	-20.5	177.5	-63.4	-64.7	-64.5	0	0	113	I252 A256 I284 R285 L289 F290	I252-M287 HydrophobicContact CD1-CE 4.5Å; I252-M287 HydrophobicContact CG1-CE 4.34Å; I252-M287 HydrophobicContact CG2-CB 3.87Å; I252-M287 HydrophobicContact CG2-CE 4.19Å; I252-M287 VanDerWaalsContact CG2-O 3.26Å; I252-M287 WeakPolarHBondContact CG2-O 3.37Å; A256-M287 HydrophobicContact CB-CB 4.33Å; I284-M287 HydrophobicContact CG2-CG 4.39Å; I284-M287 WeakPolarHBondContact O-CB 3.28Å; I284-M287 VanDerWaalsContact O-CG 3.29Å; I284-M287 WeakPolarHBondContact O-CG 3.34Å; I284-M287 PolarHBondContact O-N 2.71Å; R285-M287 PolarHBondContact O-N 3.2Å; M287-L289 PolarHBondContact O-N 2.84Å; M287-L289 VanDerWaalsContact O-N 3.15Å; M287-F290 HydrophobicContact CB-CD2 4.45Å; M287-F290 HydrophobicContact CE-CD2 3.62Å; M287-F290 HydrophobicContact CE-CE2 3.53Å; M287-F290 WeakPolarHBondContact O-CB 2.79Å; M287-F290 WeakPolarHBondContact O-CD2 3.02Å; M287-F290 PolarHBondContact O-N 3.21Å; M287-F290 HydrophobicContact SD-CD2 4.02Å; M287-F290 HydrophobicContact SD-CE2 3.65Å
288	R	91.8	Very high	85.1	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.015	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-61.2	-19.2	172.3	79.9	-178.1	53.1	-91.5	3.2	113.6	I163 S166 I167 F227 A256 R285 I286 F290 K291	I163-R288 HydrophobicContact CG2-CG 4.4Å; S166-R288 WeakPolarHBondContact OG-CD 3.4Å; S166-R288 PolarHBondContact OG-NE 3.33Å; I167-R288 HydrophobicContact CD1-CG 4.24Å; F227-R288 VanDerWaalsContact CE2-CZ 3.49Å; A256-R288 HydrophobicContact CB-CB 4.09Å; A256-R288 PolarHBondContact O-NH2 3.46Å; A256-R288 VanDerWaalsContact O-NH2 3.12Å; R285-R288 WeakPolarHBondContact O-CB 3.35Å; R285-R288 WeakPolarHBondContact O-CG 3.38Å; R285-R288 PolarHBondContact O-N 3.09Å; R285-R288 VanDerWaalsContact O-N 3.12Å; R285-R288 PolarHBondContact O-NE 3.46Å; I286-R288 PolarHBondContact O-N 3.04Å; R288-F290 PolarHBondContact O-N 2.94Å; R288-K291 WeakPolarHBondContact O-CB 3.33Å; R288-K291 PolarHBondContact O-N 3.18Å
289	L	92.5	Very high	85.5	Confident	70 Å²	70	50.6 Å²	50.6	37%	0.366	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-58.6	-31.8	171.4	-74.4	176.8	0	0	0	111.9	I163 I167 I286 M287 K291 L292	I163-L289 HydrophobicContact CG2-CD2 4.02Å; I167-L289 HydrophobicContact CD1-CD1 4.29Å; I167-L289 HydrophobicContact CD1-CD2 4.17Å; I167-L289 HydrophobicContact CD1-CG 3.88Å; I167-L289 HydrophobicContact CG1-CD2 3.76Å; I167-L289 HydrophobicContact CG1-CG 4.06Å; I286-L289 HydrophobicContact CG2-CD1 3.83Å; I286-L289 VanDerWaalsContact O-CB 3.32Å; I286-L289 WeakPolarHBondContact O-CB 3.29Å; I286-L289 WeakPolarHBondContact O-CG 3.27Å; I286-L289 PolarHBondContact O-N 3.05Å; M287-L289 PolarHBondContact O-N 2.84Å; M287-L289 VanDerWaalsContact O-N 3.15Å; L289-K291 PolarHBondContact O-N 3.47Å; L289-K291 VanDerWaalsContact O-N 3.16Å; L289-L292 HydrophobicContact CD2-CD1 3.96Å; L289-L292 WeakPolarHBondContact O-CB 3.36Å; L289-L292 WeakPolarHBondContact O-CG 3.38Å; L289-L292 PolarHBondContact O-N 3.03Å
290	F	91.9	Very high	85.9	Confident	105 Å²	105	49.5 Å²	49.5	46%	0.461	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-64.1	-19.6	175.2	-70.1	-70.7	0	0	0	112.7	I252 M287 R288 L292 T293	I252-F290 HydrophobicContact CD1-CB 4.31Å; I252-F290 HydrophobicContact CD1-CG 4.49Å; I252-F290 HydrophobicContact CG2-CB 4.05Å; I252-F290 HydrophobicContact CG2-CD2 4.36Å; M287-F290 HydrophobicContact CB-CD2 4.45Å; M287-F290 HydrophobicContact CE-CD2 3.62Å; M287-F290 HydrophobicContact CE-CE2 3.53Å; M287-F290 WeakPolarHBondContact O-CB 2.79Å; M287-F290 WeakPolarHBondContact O-CD2 3.02Å; M287-F290 PolarHBondContact O-N 3.21Å; M287-F290 HydrophobicContact SD-CD2 4.02Å; M287-F290 HydrophobicContact SD-CE2 3.65Å; R288-F290 PolarHBondContact O-N 2.94Å; F290-L292 PolarHBondContact O-N 3.24Å; F290-T293 VanDerWaalsContact O-CB 3.28Å; F290-T293 WeakPolarHBondContact O-CB 3.17Å; F290-T293 WeakPolarHBondContact O-CG2 3.45Å; F290-T293 PolarHBondContact O-N 3.26Å; F290-T293 VanDerWaalsContact O-N 3.09Å; F290-T293 PolarHBondContact O-OG1 3.3Å
291	K	87.9	Confident	85.7	Confident	3 Å²	3	44.4 Å²	44.4	1%	0.013	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-62.8	-25.9	171	-168.9	168.1	178.8	165.2	0	112.4	I163 E230 D253 R288 L289 T293 Q294	I163-K291 HydrophobicContact CD1-CB 4.04Å; I163-K291 HydrophobicContact CD1-CD 4.17Å; I163-K291 HydrophobicContact CD1-CG 4.18Å; E230-K291 VanDerWaalsContact CD-CE 3.44Å; E230-K291 WeakPolarHBondContact OE1-CE 3.21Å; E230-K291 IonicContact OE1-NZ 3.44Å; E230-K291 PolarHBondContact OE1-NZ 2.99Å; E230-K291 WeakPolarHBondContact OE2-CE 3.36Å; E230-K291 IonicContact OE2-NZ 3.45Å; E230-K291 PolarHBondContact OE2-NZ 3.3Å; D253-K291 IonicContact OD1-NZ 3.18Å; D253-K291 PolarHBondContact OD1-NZ 3.07Å; D253-K291 WeakPolarHBondContact OD2-CE 3.32Å; D253-K291 IonicContact OD2-NZ 2.81Å; D253-K291 PolarHBondContact OD2-NZ 3.31Å; R288-K291 WeakPolarHBondContact O-CB 3.33Å; R288-K291 PolarHBondContact O-N 3.18Å; L289-K291 PolarHBondContact O-N 3.47Å; L289-K291 VanDerWaalsContact O-N 3.16Å; K291-T293 PolarHBondContact O-N 3.46Å; K291-T293 VanDerWaalsContact O-N 3.1Å; K291-Q294 VanDerWaalsContact CE-NE2 3.31Å; K291-Q294 HydrophobicContact CG-CG 4.48Å; K291-Q294 WeakPolarHBondContact O-CB 3.24Å; K291-Q294 WeakPolarHBondContact O-CG 3.41Å; K291-Q294 PolarHBondContact O-N 2.92Å
292	L	88.3	Confident	85.8	Confident	46 Å²	46	44.1 Å²	44.1	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-22.9	173.8	-62.8	174.2	0	0	0	112.6	V160 I163 L289 F290 Q294 H295 S296 L299	V160-L292 HydrophobicContact CB-CD2 4.42Å; V160-L292 HydrophobicContact CG1-CD2 4.08Å; V160-L292 HydrophobicContact CG2-CD2 3.98Å; I163-L292 HydrophobicContact CD1-CD2 3.89Å; I163-L292 HydrophobicContact CD1-CG 4.38Å; I163-L292 HydrophobicContact CG2-CD2 4.3Å; I163-L292 HydrophobicContact CG2-CG 4.4Å; L289-L292 HydrophobicContact CD2-CD1 3.96Å; L289-L292 WeakPolarHBondContact O-CB 3.36Å; L289-L292 WeakPolarHBondContact O-CG 3.38Å; L289-L292 PolarHBondContact O-N 3.03Å; F290-L292 PolarHBondContact O-N 3.24Å; L292-Q294 PolarHBondContact O-N 3.29Å; L292-H295 PolarHBondContact O-N 3.5Å; L292-H295 VanDerWaalsContact O-N 3.09Å; L292-S296 PolarHBondContact O-N 3.17Å; L292-L299 HydrophobicContact CB-CD1 4.27Å
293	T	86.9	Confident	86	Confident	19 Å²	19	47.9 Å²	47.9	12%	0.117	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-29.8	173.2	65.6	0	0	0	0	112.2	F290 K291 H295 S296 L299 K300	F290-T293 VanDerWaalsContact O-CB 3.28Å; F290-T293 WeakPolarHBondContact O-CB 3.17Å; F290-T293 WeakPolarHBondContact O-CG2 3.45Å; F290-T293 PolarHBondContact O-N 3.26Å; F290-T293 VanDerWaalsContact O-N 3.09Å; F290-T293 PolarHBondContact O-OG1 3.3Å; K291-T293 PolarHBondContact O-N 3.46Å; K291-T293 VanDerWaalsContact O-N 3.1Å; T293-H295 VanDerWaalsContact C-N 3.29Å; T293-H295 PolarHBondContact O-N 2.89Å; T293-S296 VanDerWaalsContact O-O 3.11Å; T293-L299 HydrophobicContact CG2-CB 4.13Å; T293-L299 HydrophobicContact CG2-CD1 4.48Å; T293-K300 VanDerWaalsContact O-CE 3.23Å; T293-K300 WeakPolarHBondContact O-CE 3.42Å; T293-K300 WeakPolarHBondContact O-CG 3.11Å
294	Q	81.8	Confident	85.7	Confident	9 Å²	9	47 Å²	47	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-70	-28.8	178	88.1	-168.1	-16	0	0	112.3	K291 L292	K291-Q294 VanDerWaalsContact CE-NE2 3.31Å; K291-Q294 HydrophobicContact CG-CG 4.48Å; K291-Q294 WeakPolarHBondContact O-CB 3.24Å; K291-Q294 WeakPolarHBondContact O-CG 3.41Å; K291-Q294 PolarHBondContact O-N 2.92Å; L292-Q294 PolarHBondContact O-N 3.29Å
295	H	83.7	Confident	85.4	Confident	29 Å²	29	44.8 Å²	44.8	13%	0.134	25%	0.246	C	C	.	.	H	α-helix	trans	-94.9	-7.6	-176.7	-58.8	-56.8	0	0	0	113.7	Y147 V160 L292 T293	Y147-H295 PolarHBondContact OH-O 3.08Å; V160-H295 HydrophobicContact CG2-CB 4.13Å; L292-H295 PolarHBondContact O-N 3.5Å; L292-H295 VanDerWaalsContact O-N 3.09Å; T293-H295 VanDerWaalsContact C-N 3.29Å; T293-H295 PolarHBondContact O-N 2.89Å
296	S	83.3	Confident	85.3	Confident	42 Å²	42	49.4 Å²	49.4	29%	0.294	27%	0.266	S	S	.	.			trans	-126.5	110.8	179.1	176.4	0	0	0	0	110.6	L292 T293 G298 L299 K300	L292-S296 PolarHBondContact O-N 3.17Å; T293-S296 VanDerWaalsContact O-O 3.11Å; S296-G298 PolarHBondContact O-N 3.04Å; S296-G298 PolarHBondContact OG-N 3.38Å; S296-L299 PolarHBondContact O-N 3.43Å; S296-L299 PolarHBondContact OG-N 3.06Å; S296-K300 PolarHBondContact O-N 2.85Å
297	S	74.2	Confident	85.1	Confident	70 Å²	70	56 Å²	56	49%	0.49	29%	0.287	S	S	.	.	H	α-helix	trans	-58.2	-35.8	171.2	54.7	0	0	0	0	111.7	L299 K300 I301	S297-L299 PolarHBondContact O-N 3.39Å; S297-K300 PolarHBondContact O-N 3.38Å; S297-I301 WeakPolarHBondContact O-CD1 3.38Å; S297-I301 VanDerWaalsContact O-CG1 3.24Å; S297-I301 WeakPolarHBondContact O-CG1 3.33Å; S297-I301 PolarHBondContact O-N 3.5Å
298	G	78.1	Confident	84.7	Confident	39 Å²	39	55 Å²	55	40%	0.402	29%	0.29	S	S	.	.	H	α-helix	trans	-59.4	-41.7	175.8	0	0	0	0	0	113.4	S296 I301 L302	S296-G298 PolarHBondContact O-N 3.04Å; S296-G298 PolarHBondContact OG-N 3.38Å; G298-I301 PolarHBondContact O-N 2.94Å; G298-L302 PolarHBondContact O-N 3.33Å
299	L	84	Confident	84.5	Confident	67 Å²	67	54.8 Å²	54.8	35%	0.351	29%	0.29	S	S	.	.	H	α-helix	trans	-70.1	-36.7	176.3	-68.5	179.3	0	0	0	112.2	L292 T293 S296 S297 I301 L302 V303	L292-L299 HydrophobicContact CB-CD1 4.27Å; T293-L299 HydrophobicContact CG2-CB 4.13Å; T293-L299 HydrophobicContact CG2-CD1 4.48Å; S296-L299 PolarHBondContact O-N 3.43Å; S296-L299 PolarHBondContact OG-N 3.06Å; S297-L299 PolarHBondContact O-N 3.39Å; L299-I301 VanDerWaalsContact C-N 3.33Å; L299-L302 PolarHBondContact O-N 3.13Å; L299-V303 WeakPolarHBondContact O-CG2 3.36Å; L299-V303 PolarHBondContact O-N 3.3Å; L299-V303 VanDerWaalsContact O-N 3.16Å
300	K	81.5	Confident	84.4	Confident	50 Å²	50	53.8 Å²	53.8	22%	0.217	29%	0.291	C	S	.	.	H	α-helix	trans	-60.2	-45.8	172.3	-63.4	-175.3	-178.3	175.5	0	110.7	L102 T293 S296 S297 L302 V303 H304	L102-K300 HydrophobicContact CD2-CB 4.27Å; L102-K300 HydrophobicContact CD2-CD 4.43Å; T293-K300 VanDerWaalsContact O-CE 3.23Å; T293-K300 WeakPolarHBondContact O-CE 3.42Å; T293-K300 WeakPolarHBondContact O-CG 3.11Å; S296-K300 PolarHBondContact O-N 2.85Å; S297-K300 PolarHBondContact O-N 3.38Å; K300-L302 VanDerWaalsContact C-N 3.31Å; K300-L302 PolarHBondContact O-N 3.2Å; K300-V303 PolarHBondContact O-N 3.33Å; K300-H304 PolarHBondContact O-CD2 3.18Å; K300-H304 PolarHBondContact O-N 2.63Å
301	I	78.1	Confident	84.4	Confident	20 Å²	20	57.4 Å²	57.4	10%	0.103	31%	0.307	C	S	.	.	H	α-helix	trans	-57.5	-46.1	177.4	-66.2	156.9	0	0	0	110.2	L102 S297 G298 L299 V303 H304 T305 T407	L102-I301 HydrophobicContact CD1-CG1 4.42Å; S297-I301 WeakPolarHBondContact O-CD1 3.38Å; S297-I301 VanDerWaalsContact O-CG1 3.24Å; S297-I301 WeakPolarHBondContact O-CG1 3.33Å; S297-I301 PolarHBondContact O-N 3.5Å; G298-I301 PolarHBondContact O-N 2.94Å; L299-I301 VanDerWaalsContact C-N 3.33Å; I301-V303 VanDerWaalsContact C-N 3.34Å; I301-V303 PolarHBondContact O-N 3.47Å; I301-H304 PolarHBondContact O-N 2.94Å; I301-H304 VanDerWaalsContact O-N 3.1Å; I301-T305 PolarHBondContact O-N 2.97Å; I301-T305 PolarHBondContact O-OG1 3.36Å; I301-T305 VanDerWaalsContact O-OG1 3.07Å; I301-T407 HydrophobicContact CD1-CG2 3.6Å; I301-T407 HydrophobicContact CG1-CG2 4.02Å
302	L	85	Confident	84.5	Confident	65 Å²	65	59.9 Å²	59.9	34%	0.34	32%	0.318	S	S	.	.	H	α-helix	trans	-56.7	-45.5	178	-176.3	64.7	0	0	0	112.5	G298 L299 K300 H304 T305 F306 F400	G298-L302 PolarHBondContact O-N 3.33Å; L299-L302 PolarHBondContact O-N 3.13Å; K300-L302 VanDerWaalsContact C-N 3.31Å; K300-L302 PolarHBondContact O-N 3.2Å; L302-H304 VanDerWaalsContact C-N 3.33Å; L302-H304 PolarHBondContact O-N 3.1Å; L302-T305 PolarHBondContact O-N 2.94Å; L302-F306 HydrophobicContact CD1-CD2 4.02Å; L302-F306 HydrophobicContact CD1-CE2 3.53Å; L302-F306 HydrophobicContact CD1-CZ 4.25Å; L302-F306 HydrophobicContact CD2-CE2 4.13Å; L302-F306 HydrophobicContact CG-CD2 3.89Å; L302-F306 HydrophobicContact CG-CE2 3.61Å; L302-F306 WeakPolarHBondContact O-CD2 3.17Å; L302-F306 PolarHBondContact O-N 2.8Å; L302-F400 HydrophobicContact CD1-CD2 4.09Å; L302-F400 HydrophobicContact CD1-CE2 3.66Å
303	V	86.2	Confident	84.7	Confident	85 Å²	85	60.6 Å²	60.6	52%	0.515	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-42.2	176.4	173.9	0	0	0	0	111.4	L299 K300 I301 F306 R307	L299-V303 WeakPolarHBondContact O-CG2 3.36Å; L299-V303 PolarHBondContact O-N 3.3Å; L299-V303 VanDerWaalsContact O-N 3.16Å; K300-V303 PolarHBondContact O-N 3.33Å; I301-V303 VanDerWaalsContact C-N 3.34Å; I301-V303 PolarHBondContact O-N 3.47Å; V303-F306 PolarHBondContact O-N 2.94Å; V303-R307 PolarHBondContact O-N 3.38Å
304	H	82	Confident	84.9	Confident	68 Å²	68	63.6 Å²	63.6	32%	0.315	34%	0.344	S	S	.	.	H	α-helix	trans	-66.5	-40	176.8	-80.4	-75	0	0	0	112.6	V98 L102 K300 I301 L302 R307 A308	V98-H304 HydrophobicContact CG1-CB 4.39Å; L102-H304 WeakPolarHBondContact CD2-NE2 3.33Å; K300-H304 PolarHBondContact O-CD2 3.18Å; K300-H304 PolarHBondContact O-N 2.63Å; I301-H304 PolarHBondContact O-N 2.94Å; I301-H304 VanDerWaalsContact O-N 3.1Å; L302-H304 VanDerWaalsContact C-N 3.33Å; L302-H304 PolarHBondContact O-N 3.1Å; H304-R307 PolarHBondContact O-N 2.84Å; H304-A308 WeakPolarHBondContact O-CB 3.45Å; H304-A308 PolarHBondContact O-N 3.35Å
305	T	83.6	Confident	85.4	Confident	4 Å²	4	67.2 Å²	67.2	3%	0.025	36%	0.363	C	S	.	.	H	α-helix	trans	-63.7	-42.1	176.2	-54.6	0	0	0	0	111.6	I301 L302 R307 A308 S309 F400	I301-T305 PolarHBondContact O-N 2.97Å; I301-T305 PolarHBondContact O-OG1 3.36Å; I301-T305 VanDerWaalsContact O-OG1 3.07Å; L302-T305 PolarHBondContact O-N 2.94Å; T305-R307 VanDerWaalsContact C-N 3.32Å; T305-R307 PolarHBondContact O-N 3.31Å; T305-A308 PolarHBondContact O-N 2.8Å; T305-S309 WeakPolarHBondContact O-CB 3.45Å; T305-S309 PolarHBondContact O-N 2.98Å; T305-S309 PolarHBondContact O-OG 3.5Å; T305-F400 HydrophobicContact CG2-CB 3.84Å; T305-F400 HydrophobicContact CG2-CD2 3.84Å; T305-F400 HydrophobicContact CG2-CG 4.33Å
306	F	87.9	Confident	85.9	Confident	106 Å²	106	66.8 Å²	66.8	47%	0.465	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-40.4	174.4	-82.5	-60.1	0	0	0	112.1	L302 V303 S309 A310 L313	L302-F306 HydrophobicContact CD1-CD2 4.02Å; L302-F306 HydrophobicContact CD1-CE2 3.53Å; L302-F306 HydrophobicContact CD1-CZ 4.25Å; L302-F306 HydrophobicContact CD2-CE2 4.13Å; L302-F306 HydrophobicContact CG-CD2 3.89Å; L302-F306 HydrophobicContact CG-CE2 3.61Å; L302-F306 WeakPolarHBondContact O-CD2 3.17Å; L302-F306 PolarHBondContact O-N 2.8Å; V303-F306 PolarHBondContact O-N 2.94Å; F306-S309 CarbonylContact O-C 3.47Å; F306-S309 PolarHBondContact O-N 3.13Å; F306-A310 PolarHBondContact O-N 2.73Å; F306-A310 VanDerWaalsContact O-N 3.09Å; F306-L313 HydrophobicContact CD1-CD2 4.33Å
307	R	86.6	Confident	86.4	Confident	202 Å²	202	68.3 Å²	68.3	76%	0.762	37%	0.369	S	S	*	.	H	α-helix	trans	-65.7	-39.3	175.9	-173.3	-179.3	177	113.2	2	112.1	V303 H304 T305 S309 A310	V303-R307 PolarHBondContact O-N 3.38Å; H304-R307 PolarHBondContact O-N 2.84Å; T305-R307 VanDerWaalsContact C-N 3.32Å; T305-R307 PolarHBondContact O-N 3.31Å; R307-S309 VanDerWaalsContact C-N 3.34Å; R307-A310 VanDerWaalsContact O-CB 3.27Å; R307-A310 WeakPolarHBondContact O-CB 3.27Å; R307-A310 PolarHBondContact O-N 3.26Å
308	A	83.6	Confident	87.4	Confident	51 Å²	51	71.3 Å²	71.3	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-65.8	-40.4	175.6	0	0	0	0	0	111.1	H304 T305 A310 F403	H304-A308 WeakPolarHBondContact O-CB 3.45Å; H304-A308 PolarHBondContact O-N 3.35Å; T305-A308 PolarHBondContact O-N 2.8Å; A308-A310 VanDerWaalsContact C-N 3.25Å; A308-A310 PolarHBondContact O-N 3.48Å; A308-F403 HydrophobicContact CB-CE2 4.11Å; A308-F403 HydrophobicContact CB-CZ 4Å
309	S	88	Confident	88.2	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.007	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	20.5	179.8	-47.1	0	0	0	0	113.1	T305 F306 R307 K311 E312 L313	T305-S309 WeakPolarHBondContact O-CB 3.45Å; T305-S309 PolarHBondContact O-N 2.98Å; T305-S309 PolarHBondContact O-OG 3.5Å; F306-S309 CarbonylContact O-C 3.47Å; F306-S309 PolarHBondContact O-N 3.13Å; R307-S309 VanDerWaalsContact C-N 3.34Å; S309-K311 VanDerWaalsContact C-N 3.29Å; S309-K311 PolarHBondContact O-N 2.87Å; S309-E312 WeakPolarHBondContact CA-OE2 3.22Å; S309-L313 WeakPolarHBondContact O-CA 3.39Å; S309-L313 PolarHBondContact O-N 3.47Å
310	A	90.9	Very high	88.7	Confident	49 Å²	49	72.6 Å²	72.6	41%	0.405	37%	0.367	S	S	.	.	H	α-helix	trans	-69.5	-27	-171.9	0	0	0	0	0	112.7	F306 R307 A308 L313 S314	F306-A310 PolarHBondContact O-N 2.73Å; F306-A310 VanDerWaalsContact O-N 3.09Å; R307-A310 VanDerWaalsContact O-CB 3.27Å; R307-A310 WeakPolarHBondContact O-CB 3.27Å; R307-A310 PolarHBondContact O-N 3.26Å; A308-A310 VanDerWaalsContact C-N 3.25Å; A308-A310 PolarHBondContact O-N 3.48Å; A310-L313 WeakPolarHBondContact O-CA 3.32Å; A310-S314 WeakPolarHBondContact O-CB 3.44Å; A310-S314 PolarHBondContact O-N 3.45Å
311	K	90.6	Very high	89.4	Confident	180 Å²	180	74.1 Å²	74.1	78%	0.783	38%	0.38	S	S	*	.	H	α-helix	trans	-72.8	-46.1	178.9	-69.4	179.3	179.2	174.4	0	110.6	S309 L313 S314 L315	S309-K311 VanDerWaalsContact C-N 3.29Å; S309-K311 PolarHBondContact O-N 2.87Å; K311-L313 VanDerWaalsContact C-N 3.33Å; K311-S314 PolarHBondContact O-N 2.75Å; K311-L315 WeakPolarHBondContact O-CB 3.29Å; K311-L315 PolarHBondContact O-N 3.02Å
312	E	90.6	Very high	90.3	Very high	55 Å²	55	77.5 Å²	77.5	26%	0.257	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-44.7	173	-55.3	89.8	154.3	0	0	110	S309 L315 L316 V395 I396 N399	S309-E312 WeakPolarHBondContact CA-OE2 3.22Å; E312-L315 PolarHBondContact O-N 2.85Å; E312-L316 PolarHBondContact O-N 3.41Å; E312-V395 HydrophobicContact CG-CG1 4.16Å; E312-I396 HydrophobicContact CB-CG1 4.1Å; E312-N399 PolarHBondContact OE1-ND2 3.48Å
313	L	91.4	Very high	90.8	Very high	62 Å²	62	75 Å²	75	33%	0.325	39%	0.388	S	S	.	.	H	α-helix	trans	-31.9	-72.5	160.1	172.3	144.4	0	0	0	112.9	F306 S309 A310 K311 L315 L316 V317 I396	F306-L313 HydrophobicContact CD1-CD2 4.33Å; S309-L313 WeakPolarHBondContact O-CA 3.39Å; S309-L313 PolarHBondContact O-N 3.47Å; A310-L313 WeakPolarHBondContact O-CA 3.32Å; K311-L313 VanDerWaalsContact C-N 3.33Å; L313-L315 VanDerWaalsContact C-N 3.31Å; L313-L315 PolarHBondContact O-N 2.99Å; L313-L316 HydrophobicContact CD1-CD2 4.43Å; L313-L316 PolarHBondContact O-N 2.64Å; L313-V317 HydrophobicContact CD1-CG2 4.18Å; L313-V317 HydrophobicContact CG-CG2 4.39Å; L313-V317 WeakPolarHBondContact O-CG2 3.18Å; L313-V317 PolarHBondContact O-N 3.25Å; L313-V317 VanDerWaalsContact O-N 3.15Å; L313-I396 HydrophobicContact CB-CD1 3.81Å
314	S	92.2	Very high	91.4	Very high	82 Å²	82	71.8 Å²	71.8	57%	0.573	37%	0.368	S	S	*	.	H	α-helix	trans	-63.2	-36.7	-173.8	-173.4	0	0	0	0	112.3	A310 K311 F318	A310-S314 WeakPolarHBondContact O-CB 3.44Å; A310-S314 PolarHBondContact O-N 3.45Å; K311-S314 PolarHBondContact O-N 2.75Å; S314-F318 VanDerWaalsContact O-CB 3.32Å; S314-F318 WeakPolarHBondContact O-CB 3.28Å; S314-F318 PolarHBondContact O-N 3.41Å
315	L	91.7	Very high	92.1	Very high	85 Å²	85	72.3 Å²	72.3	45%	0.445	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-47.1	177.4	179.8	158.3	0	0	0	110.9	K311 E312 L313 F318 F319 P392	K311-L315 WeakPolarHBondContact O-CB 3.29Å; K311-L315 PolarHBondContact O-N 3.02Å; E312-L315 PolarHBondContact O-N 2.85Å; L313-L315 VanDerWaalsContact C-N 3.31Å; L313-L315 PolarHBondContact O-N 2.99Å; L315-F318 PolarHBondContact O-N 3.46Å; L315-F319 HydrophobicContact CD1-CE2 4.28Å; L315-F319 HydrophobicContact CD2-CD2 3.48Å; L315-F319 VanDerWaalsContact CD2-CD2 3.48Å; L315-F319 HydrophobicContact CD2-CE2 3.56Å; L315-F319 HydrophobicContact CG-CD2 3.89Å; L315-F319 HydrophobicContact CG-CE2 3.66Å; L315-F319 VanDerWaalsContact O-CD2 3.3Å; L315-F319 WeakPolarHBondContact O-CD2 3.47Å; L315-F319 PolarHBondContact O-N 2.85Å; L315-F319 VanDerWaalsContact O-N 3.1Å; L315-P392 HydrophobicContact CD2-CG 4.26Å
316	L	93.6	Very high	92.8	Very high	19 Å²	19	75.3 Å²	75.3	10%	0.099	39%	0.394	C	S	.	.	H	α-helix	trans	-59.9	-49.4	178.3	172.7	62.2	0	0	0	111	E312 L313 F318 F319 L320 T388 I389 P392 V393	E312-L316 PolarHBondContact O-N 3.41Å; L313-L316 HydrophobicContact CD1-CD2 4.43Å; L313-L316 PolarHBondContact O-N 2.64Å; L316-F318 VanDerWaalsContact C-N 3.29Å; L316-F318 PolarHBondContact O-N 3.32Å; L316-F319 PolarHBondContact O-N 3.16Å; L316-L320 VanDerWaalsContact O-CB 3.28Å; L316-L320 WeakPolarHBondContact O-CB 3.29Å; L316-L320 PolarHBondContact O-N 3.3Å; L316-T388 HydrophobicContact CD1-CG2 4.44Å; L316-T388 WeakPolarHBondContact CD1-O 3.25Å; L316-I389 HydrophobicContact CD1-CG1 4.37Å; L316-P392 HydrophobicContact CB-CB 4.12Å; L316-P392 HydrophobicContact CB-CG 4.29Å; L316-P392 HydrophobicContact CD1-CB 4.4Å; L316-P392 HydrophobicContact CD1-CG 4.05Å; L316-V393 HydrophobicContact CD2-CG2 4.32Å
317	V	94.5	Very high	93.3	Very high	75 Å²	75	71.4 Å²	71.4	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-40.4	179.3	174.8	0	0	0	0	111.2	L313 L320 V321	L313-V317 HydrophobicContact CD1-CG2 4.18Å; L313-V317 HydrophobicContact CG-CG2 4.39Å; L313-V317 WeakPolarHBondContact O-CG2 3.18Å; L313-V317 PolarHBondContact O-N 3.25Å; L313-V317 VanDerWaalsContact O-N 3.15Å; V317-L320 PolarHBondContact O-N 3.28Å; V317-V321 HydrophobicContact CG1-CG2 4.22Å; V317-V321 WeakPolarHBondContact O-CB 3.18Å; V317-V321 VanDerWaalsContact O-CG2 3.29Å; V317-V321 WeakPolarHBondContact O-CG2 3.26Å; V317-V321 PolarHBondContact O-N 2.63Å
318	F	95.1	Very high	93.9	Very high	132 Å²	132	61.8 Å²	61.8	58%	0.579	34%	0.341	S	S	*	.	H	α-helix	trans	-61.2	-51.7	178.1	174.4	-98.6	0	0	0	112.5	S314 L315 L316 L320 V321 L322	S314-F318 VanDerWaalsContact O-CB 3.32Å; S314-F318 WeakPolarHBondContact O-CB 3.28Å; S314-F318 PolarHBondContact O-N 3.41Å; L315-F318 PolarHBondContact O-N 3.46Å; L316-F318 VanDerWaalsContact C-N 3.29Å; L316-F318 PolarHBondContact O-N 3.32Å; F318-L320 VanDerWaalsContact C-N 3.31Å; F318-L320 PolarHBondContact O-N 3.02Å; F318-V321 PolarHBondContact O-N 2.68Å; F318-L322 WeakPolarHBondContact O-CB 3.35Å; F318-L322 PolarHBondContact O-N 2.97Å
319	F	94.5	Very high	94.5	Very high	99 Å²	99	60.9 Å²	60.9	43%	0.434	33%	0.333	S	S	.	.	H	α-helix	trans	-66.1	-35.1	178.6	-74.7	-61.8	0	0	0	112.4	L315 L316 G323 T388	L315-F319 HydrophobicContact CD1-CE2 4.28Å; L315-F319 HydrophobicContact CD2-CD2 3.48Å; L315-F319 VanDerWaalsContact CD2-CD2 3.48Å; L315-F319 HydrophobicContact CD2-CE2 3.56Å; L315-F319 HydrophobicContact CG-CD2 3.89Å; L315-F319 HydrophobicContact CG-CE2 3.66Å; L315-F319 VanDerWaalsContact O-CD2 3.3Å; L315-F319 WeakPolarHBondContact O-CD2 3.47Å; L315-F319 PolarHBondContact O-N 2.85Å; L315-F319 VanDerWaalsContact O-N 3.1Å; L316-F319 PolarHBondContact O-N 3.16Å; F319-G323 PolarHBondContact O-N 2.94Å; F319-T388 HydrophobicContact CB-CG2 3.71Å
320	L	94.9	Very high	95	Very high	35 Å²	35	64.8 Å²	64.8	18%	0.183	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-47.9	176.5	-172.6	62.8	0	0	0	111.4	L316 V317 F318 L322 G323 I324 M359	L316-L320 VanDerWaalsContact O-CB 3.28Å; L316-L320 WeakPolarHBondContact O-CB 3.29Å; L316-L320 PolarHBondContact O-N 3.3Å; V317-L320 PolarHBondContact O-N 3.28Å; F318-L320 VanDerWaalsContact C-N 3.31Å; F318-L320 PolarHBondContact O-N 3.02Å; L320-L322 PolarHBondContact O-N 2.9Å; L320-G323 PolarHBondContact O-N 3.28Å; L320-I324 HydrophobicContact CD1-CD1 4.22Å; L320-I324 HydrophobicContact CD1-CG1 4.48Å; L320-I324 HydrophobicContact CG-CD1 3.78Å; L320-I324 HydrophobicContact CG-CG1 4.48Å; L320-I324 WeakPolarHBondContact O-CB 3.42Å; L320-I324 WeakPolarHBondContact O-CD1 3.21Å; L320-I324 WeakPolarHBondContact O-CG1 3.28Å; L320-I324 PolarHBondContact O-N 3.5Å; L320-M359 HydrophobicContact CD1-CB 3.9Å; L320-M359 HydrophobicContact CD1-CE 3.85Å; L320-M359 HydrophobicContact CD1-SD 4.23Å
321	V	96.5	Very high	95.2	Very high	82 Å²	82	62.4 Å²	62.4	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-44.3	177.5	170.7	0	0	0	0	111.3	V317 F318 I324 V325	V317-V321 HydrophobicContact CG1-CG2 4.22Å; V317-V321 WeakPolarHBondContact O-CB 3.18Å; V317-V321 VanDerWaalsContact O-CG2 3.29Å; V317-V321 WeakPolarHBondContact O-CG2 3.26Å; V317-V321 PolarHBondContact O-N 2.63Å; F318-V321 PolarHBondContact O-N 2.68Å; V321-I324 PolarHBondContact O-N 3.17Å; V321-V325 WeakPolarHBondContact O-CG2 3.44Å; V321-V325 PolarHBondContact O-N 2.73Å
322	L	96.8	Very high	95.5	Very high	90 Å²	90	56 Å²	56	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-48	175.8	177.5	62.8	0	0	0	111.2	F318 L320 V325 V326	F318-L322 WeakPolarHBondContact O-CB 3.35Å; F318-L322 PolarHBondContact O-N 2.97Å; L320-L322 PolarHBondContact O-N 2.9Å; L322-V325 PolarHBondContact O-N 3.43Å; L322-V326 HydrophobicContact CD1-CG2 4.18Å; L322-V326 WeakPolarHBondContact O-CB 3.39Å; L322-V326 VanDerWaalsContact O-CG2 3.28Å; L322-V326 WeakPolarHBondContact O-CG2 3.32Å; L322-V326 PolarHBondContact O-N 3.36Å
323	G	96.7	Very high	95.8	Very high	13 Å²	13	59.6 Å²	59.6	13%	0.134	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-47.6	177.2	0	0	0	0	0	112.3	F319 L320 V325 V326 F327	F319-G323 PolarHBondContact O-N 2.94Å; L320-G323 PolarHBondContact O-N 3.28Å; G323-V325 VanDerWaalsContact C-N 3.35Å; G323-V325 PolarHBondContact O-N 3.35Å; G323-V326 PolarHBondContact O-N 2.84Å; G323-F327 WeakPolarHBondContact O-CD2 3.41Å; G323-F327 PolarHBondContact O-N 2.9Å
324	I	97.5	Very high	95.9	Very high	18 Å²	18	57 Å²	57	9%	0.092	30%	0.304	C	S	.	.	H	α-helix	trans	-55.6	-49.5	178.8	-73.6	159.3	0	0	0	110.6	L320 V321 A328 L352 A355 I356 M359	L320-I324 HydrophobicContact CD1-CD1 4.22Å; L320-I324 HydrophobicContact CD1-CG1 4.48Å; L320-I324 HydrophobicContact CG-CD1 3.78Å; L320-I324 HydrophobicContact CG-CG1 4.48Å; L320-I324 WeakPolarHBondContact O-CB 3.42Å; L320-I324 WeakPolarHBondContact O-CD1 3.21Å; L320-I324 WeakPolarHBondContact O-CG1 3.28Å; L320-I324 PolarHBondContact O-N 3.5Å; V321-I324 PolarHBondContact O-N 3.17Å; I324-A328 WeakPolarHBondContact O-CB 3.42Å; I324-A328 PolarHBondContact O-N 3.43Å; I324-L352 HydrophobicContact CG2-CB 4.38Å; I324-L352 HydrophobicContact CG2-CD2 3.63Å; I324-A355 HydrophobicContact CG2-CB 4.21Å; I324-I356 HydrophobicContact CD1-CB 4.44Å; I324-I356 HydrophobicContact CD1-CG1 3.53Å; I324-I356 HydrophobicContact CG1-CG1 3.91Å; I324-I356 HydrophobicContact CG2-CD1 4.39Å; I324-I356 HydrophobicContact CG2-CG1 3.78Å; I324-M359 HydrophobicContact CG1-SD 3.88Å; I324-M359 PolarHBondContact N-SD 2.95Å; I324-M359 VanDerWaalsContact N-SD 3.38Å
325	V	97.7	Very high	96	Very high	78 Å²	78	53 Å²	53	47%	0.473	28%	0.277	S	S	.	.	H	α-helix	trans	-66.3	-43.1	-178	174	0	0	0	0	111.6	V321 L322 G323 A329 L352	V321-V325 WeakPolarHBondContact O-CG2 3.44Å; V321-V325 PolarHBondContact O-N 2.73Å; L322-V325 PolarHBondContact O-N 3.43Å; G323-V325 VanDerWaalsContact C-N 3.35Å; G323-V325 PolarHBondContact O-N 3.35Å; V325-A329 PolarHBondContact O-N 3.48Å; V325-A329 VanDerWaalsContact O-N 3.09Å; V325-L352 HydrophobicContact CB-CD2 4.49Å; V325-L352 HydrophobicContact CG2-CD2 4.03Å
326	V	98	Very high	95.9	Very high	68 Å²	68	56.2 Å²	56.2	41%	0.412	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-49.8	179.3	170.6	0	0	0	0	110.8	L322 G323 A329 L330	L322-V326 HydrophobicContact CD1-CG2 4.18Å; L322-V326 WeakPolarHBondContact O-CB 3.39Å; L322-V326 VanDerWaalsContact O-CG2 3.28Å; L322-V326 WeakPolarHBondContact O-CG2 3.32Å; L322-V326 PolarHBondContact O-N 3.36Å; G323-V326 PolarHBondContact O-N 2.84Å; V326-A329 PolarHBondContact O-N 3.39Å; V326-L330 HydrophobicContact CG1-CD1 3.85Å; V326-L330 HydrophobicContact CG1-CG 4.35Å; V326-L330 VanDerWaalsContact O-CG 3.3Å; V326-L330 WeakPolarHBondContact O-CG 3.44Å; V326-L330 PolarHBondContact O-N 3.36Å
327	F	98.3	Very high	95.7	Very high	24 Å²	24	61.4 Å²	61.4	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-69.4	-34	-179.6	-73.1	-63	0	0	0	113.1	G323 A329 L330 I331 A355 M359 V377 L380 C381 T384	G323-F327 WeakPolarHBondContact O-CD2 3.41Å; G323-F327 PolarHBondContact O-N 2.9Å; F327-A329 VanDerWaalsContact C-N 3.33Å; F327-A329 PolarHBondContact O-N 2.89Å; F327-L330 HydrophobicContact CD1-CD1 4.12Å; F327-L330 HydrophobicContact CE1-CD1 4.35Å; F327-L330 PolarHBondContact O-N 3.41Å; F327-I331 WeakPolarHBondContact O-CB 3.48Å; F327-I331 WeakPolarHBondContact O-CG2 3.47Å; F327-I331 PolarHBondContact O-N 2.85Å; F327-A355 HydrophobicContact CB-CB 4.4Å; F327-M359 HydrophobicContact CD2-SD 4.12Å; F327-V377 HydrophobicContact CD1-CG1 4.2Å; F327-L380 HydrophobicContact CE1-CB 4.25Å; F327-C381 HydrophobicContact CB-CB 4.19Å; F327-C381 HydrophobicContact CD1-CB 3.66Å; F327-C381 HydrophobicContact CD2-CB 4.1Å; F327-C381 HydrophobicContact CE1-CB 4.03Å; F327-C381 HydrophobicContact CE2-CB 4.46Å; F327-C381 HydrophobicContact CG-CB 3.71Å; F327-C381 HydrophobicContact CZ-CB 4.43Å; F327-T384 HydrophobicContact CE2-CG2 4.42Å; F327-T384 WeakPolarHBondContact CE2-OG1 3.32Å; F327-T384 HydrophobicContact CZ-CG2 3.99Å; F327-T384 WeakPolarHBondContact CZ-OG1 3.09Å
328	A	98	Very high	95.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-40.9	172.7	0	0	0	0	0	112.4	I324 I331 Y332 I348 G351 L352 A355	I324-A328 WeakPolarHBondContact O-CB 3.42Å; I324-A328 PolarHBondContact O-N 3.43Å; A328-I331 WeakPolarHBondContact O-CG2 3.32Å; A328-Y332 WeakPolarHBondContact O-CB 3.16Å; A328-Y332 PolarHBondContact O-N 3.2Å; A328-I348 HydrophobicContact CB-CG2 4.41Å; A328-G351 VanDerWaalsContact CB-C 3.41Å; A328-L352 HydrophobicContact CB-CB 4.41Å; A328-L352 HydrophobicContact CB-CD2 3.53Å; A328-L352 HydrophobicContact CB-CG 3.92Å; A328-A355 HydrophobicContact CB-CB 4.31Å
329	A	97.8	Very high	94.7	Very high	31 Å²	31	61.1 Å²	61.1	26%	0.256	32%	0.318	S	S	.	.	H	α-helix	trans	-69.3	-45	174.8	0	0	0	0	0	111.6	V325 V326 F327 I331 Y332 Y333	V325-A329 PolarHBondContact O-N 3.48Å; V325-A329 VanDerWaalsContact O-N 3.09Å; V326-A329 PolarHBondContact O-N 3.39Å; F327-A329 VanDerWaalsContact C-N 3.33Å; F327-A329 PolarHBondContact O-N 2.89Å; A329-I331 PolarHBondContact O-N 2.91Å; A329-Y332 PolarHBondContact O-N 3.2Å; A329-Y333 WeakPolarHBondContact O-CD2 3.44Å; A329-Y333 PolarHBondContact O-N 3.06Å; A329-Y333 VanDerWaalsContact O-N 3.08Å
330	L	97.4	Very high	94.1	Very high	83 Å²	83	57.8 Å²	57.8	44%	0.435	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-44.9	179.6	-72.6	174.2	0	0	0	112.1	V326 F327 Y333 A334 V377	V326-L330 HydrophobicContact CG1-CD1 3.85Å; V326-L330 HydrophobicContact CG1-CG 4.35Å; V326-L330 VanDerWaalsContact O-CG 3.3Å; V326-L330 WeakPolarHBondContact O-CG 3.44Å; V326-L330 PolarHBondContact O-N 3.36Å; F327-L330 HydrophobicContact CD1-CD1 4.12Å; F327-L330 HydrophobicContact CE1-CD1 4.35Å; F327-L330 PolarHBondContact O-N 3.41Å; L330-Y333 PolarHBondContact O-N 3.34Å; L330-A334 VanDerWaalsContact O-CB 3.24Å; L330-A334 WeakPolarHBondContact O-CB 3.45Å; L330-A334 PolarHBondContact O-N 3.49Å; L330-V377 HydrophobicContact CB-CG1 3.8Å; L330-V377 HydrophobicContact CB-CG2 4.4Å
331	I	96.5	Very high	93.6	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-68	-38.9	-179.3	-164.2	67.6	0	0	0	111.8	F327 A328 A329 Y333 A334 E335 F345 W354 P369 G374 V377	F327-I331 WeakPolarHBondContact O-CB 3.48Å; F327-I331 WeakPolarHBondContact O-CG2 3.47Å; F327-I331 PolarHBondContact O-N 2.85Å; A328-I331 WeakPolarHBondContact O-CG2 3.32Å; A329-I331 PolarHBondContact O-N 2.91Å; I331-Y333 PolarHBondContact O-N 3.36Å; I331-A334 PolarHBondContact O-N 3.09Å; I331-E335 HydrophobicContact CD1-CG 4.21Å; I331-E335 HydrophobicContact CG1-CG 4.24Å; I331-E335 WeakPolarHBondContact O-CB 3.22Å; I331-E335 WeakPolarHBondContact O-CG 3.47Å; I331-E335 PolarHBondContact O-N 3.49Å; I331-F345 HydrophobicContact CB-CD1 4.43Å; I331-F345 HydrophobicContact CB-CE1 4.38Å; I331-F345 HydrophobicContact CG1-CD1 3.92Å; I331-F345 HydrophobicContact CG1-CD2 4.2Å; I331-F345 HydrophobicContact CG1-CE1 3.68Å; I331-F345 HydrophobicContact CG1-CE2 3.97Å; I331-F345 HydrophobicContact CG1-CG 4.16Å; I331-F345 HydrophobicContact CG1-CZ 3.7Å; I331-F345 HydrophobicContact CG2-CD1 3.62Å; I331-F345 HydrophobicContact CG2-CE1 3.72Å; I331-F345 HydrophobicContact CG2-CG 4.4Å; I331-W354 HydrophobicContact CB-CE3 4.22Å; I331-W354 HydrophobicContact CB-CH2 4.17Å; I331-W354 HydrophobicContact CB-CZ3 3.71Å; I331-W354 HydrophobicContact CD1-CH2 4.08Å; I331-W354 HydrophobicContact CD1-CZ2 4.46Å; I331-W354 HydrophobicContact CD1-CZ3 4.47Å; I331-W354 HydrophobicContact CG1-CE3 4.32Å; I331-W354 HydrophobicContact CG1-CH2 4.04Å; I331-W354 HydrophobicContact CG1-CZ2 4.49Å; I331-W354 HydrophobicContact CG1-CZ3 3.95Å; I331-W354 HydrophobicContact CG2-CE3 3.75Å; I331-W354 HydrophobicContact CG2-CZ3 3.69Å; I331-P369 HydrophobicContact CD1-CB 3.77Å; I331-G374 WeakPolarHBondContact CD1-O 3.17Å; I331-V377 HydrophobicContact CB-CG1 4.24Å; I331-V377 HydrophobicContact CD1-CB 4.29Å; I331-V377 HydrophobicContact CD1-CG1 4.2Å
332	Y	96.2	Very high	93.2	Very high	45 Å²	45	65.1 Å²	65.1	18%	0.176	35%	0.345	C	S	.	.	H	α-helix	trans	-57.9	-47.7	174.5	171	-101.9	0	0	0	111.5	A328 A329 R336 F345 I346 I348	A328-Y332 WeakPolarHBondContact O-CB 3.16Å; A328-Y332 PolarHBondContact O-N 3.2Å; A329-Y332 PolarHBondContact O-N 3.2Å; Y332-R336 HydrophobicContact CE2-CG 4.31Å; Y332-R336 WeakPolarHBondContact O-CG 3.36Å; Y332-R336 PolarHBondContact O-N 3.38Å; Y332-R336 PolarHBondContact OH-NE 2.94Å; Y332-F345 WeakPolarHBondContact CD2-O 3.5Å; Y332-I346 WeakPolarHBondContact CE2-O 3.46Å; Y332-I348 HydrophobicContact CD1-CD1 4.45Å; Y332-I348 HydrophobicContact CD1-CG1 3.96Å; Y332-I348 HydrophobicContact CD2-CG1 4.46Å; Y332-I348 HydrophobicContact CE1-CG1 4.47Å; Y332-I348 HydrophobicContact CG-CG1 3.95Å
333	Y	95.7	Very high	92.8	Very high	130 Å²	130	62.6 Å²	62.6	51%	0.51	33%	0.331	S	S	.	.	H	α-helix	trans	-71.7	-38.8	178.2	-73.9	-65.4	0	0	0	112.7	A329 L330 I331 E335 R336 I337	A329-Y333 WeakPolarHBondContact O-CD2 3.44Å; A329-Y333 PolarHBondContact O-N 3.06Å; A329-Y333 VanDerWaalsContact O-N 3.08Å; L330-Y333 PolarHBondContact O-N 3.34Å; I331-Y333 PolarHBondContact O-N 3.36Å; Y333-E335 PolarHBondContact O-N 3.08Å; Y333-R336 PolarHBondContact O-N 3.4Å; Y333-I337 WeakPolarHBondContact O-CD1 3.46Å; Y333-I337 VanDerWaalsContact O-CG1 3.26Å; Y333-I337 WeakPolarHBondContact O-CG1 3.42Å; Y333-I337 PolarHBondContact O-N 3.46Å
334	A	94.7	Very high	92.6	Very high	7 Å²	7	64.2 Å²	64.2	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-47	178.7	0	0	0	0	0	111.9	L330 I331 R336 I337 L373 V377	L330-A334 VanDerWaalsContact O-CB 3.24Å; L330-A334 WeakPolarHBondContact O-CB 3.45Å; L330-A334 PolarHBondContact O-N 3.49Å; I331-A334 PolarHBondContact O-N 3.09Å; A334-R336 VanDerWaalsContact C-N 3.25Å; A334-R336 PolarHBondContact O-N 3.38Å; A334-I337 PolarHBondContact O-N 2.97Å; A334-L373 HydrophobicContact CB-CB 4.07Å; A334-V377 HydrophobicContact CB-CG2 4.22Å
335	E	93.6	Very high	92.4	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-74.1	-12.8	179.6	-70.6	-72.9	136.5	0	0	113.3	I331 Y333 N340 N343 F345 P369 K370 T371	I331-E335 HydrophobicContact CD1-CG 4.21Å; I331-E335 HydrophobicContact CG1-CG 4.24Å; I331-E335 WeakPolarHBondContact O-CB 3.22Å; I331-E335 WeakPolarHBondContact O-CG 3.47Å; I331-E335 PolarHBondContact O-N 3.49Å; Y333-E335 PolarHBondContact O-N 3.08Å; E335-N340 VanDerWaalsContact O-CG 3.26Å; E335-N340 PolarHBondContact O-ND2 3.25Å; E335-N340 PolarHBondContact O-OD1 2.92Å; E335-N340 PolarHBondContact OE2-ND2 2.94Å; E335-N343 PolarHBondContact O-ND2 3.32Å; E335-N343 VanDerWaalsContact O-ND2 3.11Å; E335-F345 HydrophobicContact CB-CB 4.32Å; E335-F345 HydrophobicContact CB-CD2 4.28Å; E335-F345 HydrophobicContact CG-CD2 3.64Å; E335-F345 HydrophobicContact CG-CE2 4.19Å; E335-F345 HydrophobicContact CG-CG 4.31Å; E335-P369 WeakPolarHBondContact OE1-CA 3.46Å; E335-K370 PolarHBondContact OE1-N 3.34Å; E335-K370 PolarHBondContact OE2-N 3.19Å; E335-T371 VanDerWaalsContact CD-OG1 3.25Å; E335-T371 WeakPolarHBondContact OE1-CB 3.38Å; E335-T371 PolarHBondContact OE1-N 2.97Å; E335-T371 PolarHBondContact OE1-OG1 3.31Å; E335-T371 WeakPolarHBondContact OE2-CG2 3.27Å
336	R	90.3	Very high	92.1	Very high	152 Å²	152	65.8 Å²	65.8	57%	0.574	34%	0.342	S	S	*	.	H	α-helix	trans	-91.6	-17.9	173.3	-76.5	-135.4	-49.3	132.3	8.9	114.2	Y332 Y333 A334	Y332-R336 HydrophobicContact CE2-CG 4.31Å; Y332-R336 WeakPolarHBondContact O-CG 3.36Å; Y332-R336 PolarHBondContact O-N 3.38Å; Y332-R336 PolarHBondContact OH-NE 2.94Å; Y333-R336 PolarHBondContact O-N 3.4Å; A334-R336 VanDerWaalsContact C-N 3.25Å; A334-R336 PolarHBondContact O-N 3.38Å
337	I	89.7	Confident	92	Very high	127 Å²	127	64.7 Å²	64.7	65%	0.651	34%	0.337	S	S	*	.	H	α-helix	trans	-73	-40.5	-178.2	-73.1	161.2	0	0	0	110.6	Y333 A334 L373	Y333-I337 WeakPolarHBondContact O-CD1 3.46Å; Y333-I337 VanDerWaalsContact O-CG1 3.26Å; Y333-I337 WeakPolarHBondContact O-CG1 3.42Å; Y333-I337 PolarHBondContact O-N 3.46Å; A334-I337 PolarHBondContact O-N 2.97Å; I337-L373 HydrophobicContact CD1-CD1 4.37Å; I337-L373 HydrophobicContact CG2-CD1 4.32Å
338	E	86.6	Confident	91.9	Very high	81 Å²	81	66.7 Å²	66.7	38%	0.379	35%	0.348	S	S	.	.	S	Bend	trans	-97.4	139.2	177.2	178.4	170.3	-159.2	0	0	109.9	N340 T371 Y372	E338-N340 PolarHBondContact O-N 3.16Å; E338-N340 VanDerWaalsContact O-N 3.08Å; E338-N340 PolarHBondContact O-OD1 3.26Å; E338-T371 HydrophobicContact CB-CG2 3.67Å; E338-T371 HydrophobicContact CG-CG2 4.02Å; E338-T371 WeakPolarHBondContact OE2-CA 3.38Å; E338-T371 WeakPolarHBondContact OE2-CB 3.26Å; E338-Y372 PolarHBondContact OE2-N 3.37Å
339	S	81.2	Confident	91.8	Very high	121 Å²	121	71 Å²	71	85%	0.846	38%	0.376	S	S	*	.			trans	-73	102.6	-178.4	177.1	0	0	0	0	110.6
340	N	82.9	Confident	91.7	Very high	29 Å²	29	73 Å²	73	16%	0.155	38%	0.382	C	S	.	.			trans	-114.5	109.1	178.6	54.7	-6.9	0	0	0	111.2	E335 E338 E342 N343 T371	E335-N340 VanDerWaalsContact O-CG 3.26Å; E335-N340 PolarHBondContact O-ND2 3.25Å; E335-N340 PolarHBondContact O-OD1 2.92Å; E335-N340 PolarHBondContact OE2-ND2 2.94Å; E338-N340 PolarHBondContact O-N 3.16Å; E338-N340 VanDerWaalsContact O-N 3.08Å; E338-N340 PolarHBondContact O-OD1 3.26Å; N340-E342 PolarHBondContact O-N 2.88Å; N340-N343 WeakPolarHBondContact ND2-CB 3.25Å; N340-N343 PolarHBondContact ND2-ND2 3.35Å; N340-N343 VanDerWaalsContact ND2-ND2 3.14Å; N340-N343 PolarHBondContact O-N 3.45Å; N340-N343 WeakPolarHBondContact OD1-CB 3.33Å; N340-N343 PolarHBondContact OD1-ND2 2.88Å; N340-T371 HydrophobicContact CB-CG2 4.27Å
341	P	84.2	Confident	91.7	Very high	135 Å²	135	69 Å²	69	88%	0.877	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-25.2	-179.3	22.9	-30.5	0	0	0	113.3
342	E	86.5	Confident	91.8	Very high	136 Å²	136	71.5 Å²	71.5	64%	0.636	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	46.5	178.1	-53.8	-174.6	170.4	0	0	112.1	N340 D344 K370	N340-E342 PolarHBondContact O-N 2.88Å; E342-D344 PolarHBondContact O-N 2.85Å; E342-K370 HydrophobicContact CB-CD 4.07Å; E342-K370 VanDerWaalsContact O-CD 3.25Å; E342-K370 WeakPolarHBondContact O-CD 3.33Å; E342-K370 VanDerWaalsContact O-CE 3.24Å; E342-K370 WeakPolarHBondContact O-CE 3.33Å; E342-K370 PolarHBondContact O-NZ 3.32Å; E342-K370 IonicContact OE2-NZ 3.56Å; E342-K370 PolarHBondContact OE2-NZ 2.89Å
343	N	89.7	Confident	91.8	Very high	36 Å²	36	74.9 Å²	74.9	19%	0.193	39%	0.387	C	S	.	.			trans	-71.5	116.4	-178.6	-165.5	-20.2	0	0	0	112.5	E335 N340 F345	E335-N343 PolarHBondContact O-ND2 3.32Å; E335-N343 VanDerWaalsContact O-ND2 3.11Å; N340-N343 WeakPolarHBondContact ND2-CB 3.25Å; N340-N343 PolarHBondContact ND2-ND2 3.35Å; N340-N343 VanDerWaalsContact ND2-ND2 3.14Å; N340-N343 PolarHBondContact O-N 3.45Å; N340-N343 WeakPolarHBondContact OD1-CB 3.33Å; N340-N343 PolarHBondContact OD1-ND2 2.88Å; N343-F345 WeakPolarHBondContact OD1-CA 3.4Å; N343-F345 WeakPolarHBondContact OD1-CB 3.48Å; N343-F345 PolarHBondContact OD1-N 3.39Å
344	D	91.8	Very high	91.9	Very high	47 Å²	47	69.2 Å²	69.2	25%	0.251	37%	0.365	S	S	.	.	S	Bend	trans	-79.6	-23.2	175.8	-55.5	-27.7	0	0	0	111.8	E342 I346 M367 T368 K370	E342-D344 PolarHBondContact O-N 2.85Å; D344-I346 PolarHBondContact O-N 3.47Å; D344-I346 VanDerWaalsContact O-N 3.14Å; D344-M367 HydrophobicContact CB-CB 4.28Å; D344-M367 HydrophobicContact CB-CE 4.13Å; D344-M367 HydrophobicContact CB-CG 4.34Å; D344-M367 VanDerWaalsContact O-CE 3.24Å; D344-M367 WeakPolarHBondContact O-CE 2.97Å; D344-T368 PolarHBondContact OD2-N 3.23Å; D344-K370 IonicContact OD1-NZ 3.69Å; D344-K370 IonicContact OD2-NZ 2.73Å
345	F	93.4	Very high	92.1	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.362	C	S	.	.			trans	-92	59.1	-173	-59.8	-86.8	0	0	0	112.7	I331 Y332 E335 N343 S347 W354 M367	I331-F345 HydrophobicContact CB-CD1 4.43Å; I331-F345 HydrophobicContact CB-CE1 4.38Å; I331-F345 HydrophobicContact CG1-CD1 3.92Å; I331-F345 HydrophobicContact CG1-CD2 4.2Å; I331-F345 HydrophobicContact CG1-CE1 3.68Å; I331-F345 HydrophobicContact CG1-CE2 3.97Å; I331-F345 HydrophobicContact CG1-CG 4.16Å; I331-F345 HydrophobicContact CG1-CZ 3.7Å; I331-F345 HydrophobicContact CG2-CD1 3.62Å; I331-F345 HydrophobicContact CG2-CE1 3.72Å; I331-F345 HydrophobicContact CG2-CG 4.4Å; Y332-F345 WeakPolarHBondContact CD2-O 3.5Å; E335-F345 HydrophobicContact CB-CB 4.32Å; E335-F345 HydrophobicContact CB-CD2 4.28Å; E335-F345 HydrophobicContact CG-CD2 3.64Å; E335-F345 HydrophobicContact CG-CE2 4.19Å; E335-F345 HydrophobicContact CG-CG 4.31Å; N343-F345 WeakPolarHBondContact OD1-CA 3.4Å; N343-F345 WeakPolarHBondContact OD1-CB 3.48Å; N343-F345 PolarHBondContact OD1-N 3.39Å; F345-S347 VanDerWaalsContact C-N 3.29Å; F345-S347 PolarHBondContact O-N 2.92Å; F345-W354 HydrophobicContact CE1-CB 3.69Å; F345-W354 AromaticContact CE1-CD2 3.61Å; F345-W354 HydrophobicContact CE1-CD2 3.61Å; F345-W354 AromaticContact CE1-CE3 3.93Å; F345-W354 HydrophobicContact CE1-CE3 3.93Å; F345-W354 AromaticContact CE1-CG 3.49Å; F345-W354 HydrophobicContact CE1-CG 3.49Å; F345-W354 VanDerWaalsContact CE1-CG 3.49Å; F345-W354 HydrophobicContact CZ-CB 4.3Å; F345-W354 AromaticContact CZ-CD1 3.82Å; F345-W354 AromaticContact CZ-CD2 3.8Å; F345-W354 HydrophobicContact CZ-CD2 3.8Å; F345-W354 AromaticContact CZ-CE2 3.98Å; F345-W354 HydrophobicContact CZ-CE3 4.42Å; F345-W354 AromaticContact CZ-CG 3.71Å; F345-W354 HydrophobicContact CZ-CG 3.71Å; F345-W354 AromaticContact CZ-NE1 3.97Å; F345-M367 HydrophobicContact CD1-CE 4.08Å; F345-M367 HydrophobicContact CE1-CE 4.19Å
346	I	92.3	Very high	92.2	Very high	129 Å²	129	72.4 Å²	72.4	66%	0.662	38%	0.38	S	S	*	.	S	Bend	trans	-70.2	-27.2	-176.4	-51.1	168.2	0	0	0	111.9	Y332 D344 L350	Y332-I346 WeakPolarHBondContact CE2-O 3.46Å; D344-I346 PolarHBondContact O-N 3.47Å; D344-I346 VanDerWaalsContact O-N 3.14Å; I346-L350 HydrophobicContact CB-CD1 4.28Å
347	S	94.9	Very high	92.5	Very high	45 Å²	45	65.5 Å²	65.5	32%	0.315	35%	0.354	S	S	.	.	S	Bend	trans	-147.3	157.5	-178.7	70.1	0	0	0	0	112.3	F345 L350 G351	F345-S347 VanDerWaalsContact C-N 3.29Å; F345-S347 PolarHBondContact O-N 2.92Å; S347-L350 PolarHBondContact O-N 3.45Å; S347-L350 WeakPolarHBondContact OG-CG 3.48Å; S347-G351 PolarHBondContact O-N 2.87Å; S347-G351 VanDerWaalsContact O-N 3.14Å
348	I	95.6	Very high	92.8	Very high	67 Å²	67	60.6 Å²	60.6	34%	0.344	33%	0.33	S	S	.	.	H	α-helix	trans	-60.4	-41.2	179.3	-58.9	172.7	0	0	0	112.3	A328 Y332 L350 G351 L352	A328-I348 HydrophobicContact CB-CG2 4.41Å; Y332-I348 HydrophobicContact CD1-CD1 4.45Å; Y332-I348 HydrophobicContact CD1-CG1 3.96Å; Y332-I348 HydrophobicContact CD2-CG1 4.46Å; Y332-I348 HydrophobicContact CE1-CG1 4.47Å; Y332-I348 HydrophobicContact CG-CG1 3.95Å; I348-L350 VanDerWaalsContact C-N 3.28Å; I348-L350 PolarHBondContact O-N 2.8Å; I348-G351 CarbonylContact O-C 3.56Å; I348-G351 WeakPolarHBondContact O-CA 3.41Å; I348-G351 PolarHBondContact O-N 2.98Å; I348-L352 PolarHBondContact O-N 2.96Å
349	P	97.5	Very high	93.2	Very high	90 Å²	90	56.8 Å²	56.8	58%	0.584	31%	0.313	S	S	*	.	H	α-helix	trans	-59.4	-34.3	176.1	-27.4	37	0	0	0	114.6	L352 W353	P349-L352 WeakPolarHBondContact O-CB 3.39Å; P349-L352 PolarHBondContact O-N 2.92Å; P349-W353 PolarHBondContact O-N 3.39Å
350	L	96	Very high	93.8	Very high	72 Å²	72	53.4 Å²	53.4	38%	0.377	29%	0.287	S	S	.	.	H	α-helix	trans	-68.5	-39.4	172.1	-67.3	169.3	0	0	0	110.8	I346 S347 I348 L352 W353 W354 M367	I346-L350 HydrophobicContact CB-CD1 4.28Å; S347-L350 PolarHBondContact O-N 3.45Å; S347-L350 WeakPolarHBondContact OG-CG 3.48Å; I348-L350 VanDerWaalsContact C-N 3.28Å; I348-L350 PolarHBondContact O-N 2.8Å; L350-L352 VanDerWaalsContact C-N 3.28Å; L350-L352 PolarHBondContact O-N 3.36Å; L350-W353 WeakPolarHBondContact O-CB 3.43Å; L350-W353 PolarHBondContact O-N 3.36Å; L350-W354 PolarHBondContact O-N 3.49Å; L350-W354 VanDerWaalsContact O-N 3.14Å; L350-M367 HydrophobicContact CB-CE 3.78Å
351	G	96.8	Very high	94.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-33.9	170.2	0	0	0	0	0	113.6	A328 S347 I348 W354 A355	A328-G351 VanDerWaalsContact CB-C 3.41Å; S347-G351 PolarHBondContact O-N 2.87Å; S347-G351 VanDerWaalsContact O-N 3.14Å; I348-G351 CarbonylContact O-C 3.56Å; I348-G351 WeakPolarHBondContact O-CA 3.41Å; I348-G351 PolarHBondContact O-N 2.98Å; G351-W354 PolarHBondContact O-N 2.87Å; G351-A355 VanDerWaalsContact O-CB 3.22Å; G351-A355 WeakPolarHBondContact O-CB 3.21Å; G351-A355 PolarHBondContact O-N 3.38Å
352	L	97.8	Very high	94.9	Very high	52 Å²	52	53.9 Å²	53.9	27%	0.272	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-42.7	174.7	-66.4	172.8	0	0	0	111.2	I324 V325 A328 I348 P349 L350 A355 I356	I324-L352 HydrophobicContact CG2-CB 4.38Å; I324-L352 HydrophobicContact CG2-CD2 3.63Å; V325-L352 HydrophobicContact CB-CD2 4.49Å; V325-L352 HydrophobicContact CG2-CD2 4.03Å; A328-L352 HydrophobicContact CB-CB 4.41Å; A328-L352 HydrophobicContact CB-CD2 3.53Å; A328-L352 HydrophobicContact CB-CG 3.92Å; I348-L352 PolarHBondContact O-N 2.96Å; P349-L352 WeakPolarHBondContact O-CB 3.39Å; P349-L352 PolarHBondContact O-N 2.92Å; L350-L352 VanDerWaalsContact C-N 3.28Å; L350-L352 PolarHBondContact O-N 3.36Å; L352-A355 PolarHBondContact O-N 3.37Å; L352-I356 WeakPolarHBondContact O-CB 3.44Å; L352-I356 WeakPolarHBondContact O-CD1 3.14Å; L352-I356 WeakPolarHBondContact O-CG1 3.33Å; L352-I356 PolarHBondContact O-N 3.37Å
353	W	97.7	Very high	95.2	Very high	116 Å²	116	49.8 Å²	49.8	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-58.1	-52.3	174.5	167.6	-105.8	0	0	0	111.3	P349 L350 A355 I356 V357 Y364 D366	P349-W353 PolarHBondContact O-N 3.39Å; L350-W353 WeakPolarHBondContact O-CB 3.43Å; L350-W353 PolarHBondContact O-N 3.36Å; W353-A355 VanDerWaalsContact C-N 3.34Å; W353-A355 PolarHBondContact O-N 2.8Å; W353-I356 PolarHBondContact O-N 3.04Å; W353-V357 HydrophobicContact CD2-CG2 4.14Å; W353-V357 HydrophobicContact CE3-CG2 4.35Å; W353-V357 HydrophobicContact CH2-CG2 4.2Å; W353-V357 HydrophobicContact CZ2-CG2 3.97Å; W353-V357 HydrophobicContact CZ3-CG2 4.39Å; W353-V357 WeakPolarHBondContact O-CG2 3.08Å; W353-V357 PolarHBondContact O-N 3.21Å; W353-Y364 HydrophobicContact CH2-CD2 4.4Å; W353-Y364 AromaticContact CH2-CE2 3.92Å; W353-Y364 HydrophobicContact CH2-CE2 3.92Å; W353-Y364 AromaticContact CZ2-CD2 3.84Å; W353-Y364 HydrophobicContact CZ2-CD2 3.84Å; W353-Y364 AromaticContact CZ2-CE2 3.83Å; W353-Y364 HydrophobicContact CZ2-CE2 3.83Å; W353-D366 PolarHBondContact NE1-OD2 2.89Å
354	W	97.8	Very high	95.4	Very high	12 Å²	12	55.6 Å²	55.6	5%	0.045	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-42.8	176.4	169.5	83.8	0	0	0	112.6	I331 F345 L350 G351 V357 T358 M367 C381	I331-W354 HydrophobicContact CB-CE3 4.22Å; I331-W354 HydrophobicContact CB-CH2 4.17Å; I331-W354 HydrophobicContact CB-CZ3 3.71Å; I331-W354 HydrophobicContact CD1-CH2 4.08Å; I331-W354 HydrophobicContact CD1-CZ2 4.46Å; I331-W354 HydrophobicContact CD1-CZ3 4.47Å; I331-W354 HydrophobicContact CG1-CE3 4.32Å; I331-W354 HydrophobicContact CG1-CH2 4.04Å; I331-W354 HydrophobicContact CG1-CZ2 4.49Å; I331-W354 HydrophobicContact CG1-CZ3 3.95Å; I331-W354 HydrophobicContact CG2-CE3 3.75Å; I331-W354 HydrophobicContact CG2-CZ3 3.69Å; F345-W354 HydrophobicContact CE1-CB 3.69Å; F345-W354 AromaticContact CE1-CD2 3.61Å; F345-W354 HydrophobicContact CE1-CD2 3.61Å; F345-W354 AromaticContact CE1-CE3 3.93Å; F345-W354 HydrophobicContact CE1-CE3 3.93Å; F345-W354 AromaticContact CE1-CG 3.49Å; F345-W354 HydrophobicContact CE1-CG 3.49Å; F345-W354 VanDerWaalsContact CE1-CG 3.49Å; F345-W354 HydrophobicContact CZ-CB 4.3Å; F345-W354 AromaticContact CZ-CD1 3.82Å; F345-W354 AromaticContact CZ-CD2 3.8Å; F345-W354 HydrophobicContact CZ-CD2 3.8Å; F345-W354 AromaticContact CZ-CE2 3.98Å; F345-W354 HydrophobicContact CZ-CE3 4.42Å; F345-W354 AromaticContact CZ-CG 3.71Å; F345-W354 HydrophobicContact CZ-CG 3.71Å; F345-W354 AromaticContact CZ-NE1 3.97Å; L350-W354 PolarHBondContact O-N 3.49Å; L350-W354 VanDerWaalsContact O-N 3.14Å; G351-W354 PolarHBondContact O-N 2.87Å; W354-V357 PolarHBondContact O-N 2.89Å; W354-T358 HydrophobicContact CZ2-CG2 4.42Å; W354-T358 PolarHBondContact NE1-OG1 3.44Å; W354-T358 VanDerWaalsContact O-CB 3.29Å; W354-T358 WeakPolarHBondContact O-CB 3.49Å; W354-T358 PolarHBondContact O-N 3.15Å; W354-T358 PolarHBondContact O-OG1 3.29Å; W354-M367 HydrophobicContact CB-CB 4.39Å; W354-M367 HydrophobicContact CB-SD 4.36Å; W354-M367 VanDerWaalsContact CD1-O 3.24Å; W354-C381 HydrophobicContact CH2-CB 4.06Å
355	A	97.7	Very high	95.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-39.7	-179.4	0	0	0	0	0	111.8	I324 F327 A328 G351 L352 W353 T358 M359	I324-A355 HydrophobicContact CG2-CB 4.21Å; F327-A355 HydrophobicContact CB-CB 4.4Å; A328-A355 HydrophobicContact CB-CB 4.31Å; G351-A355 VanDerWaalsContact O-CB 3.22Å; G351-A355 WeakPolarHBondContact O-CB 3.21Å; G351-A355 PolarHBondContact O-N 3.38Å; L352-A355 PolarHBondContact O-N 3.37Å; W353-A355 VanDerWaalsContact C-N 3.34Å; W353-A355 PolarHBondContact O-N 2.8Å; A355-T358 PolarHBondContact O-N 3.12Å; A355-M359 VanDerWaalsContact O-CB 3.27Å; A355-M359 WeakPolarHBondContact O-CB 3.36Å; A355-M359 WeakPolarHBondContact O-CG 3.31Å; A355-M359 PolarHBondContact O-N 3.27Å
356	I	96.2	Very high	95.5	Very high	73 Å²	73	59.9 Å²	59.9	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-58.5	-52.3	172.6	-71.5	160.8	0	0	0	109.8	I324 L352 W353 T358 T360	I324-I356 HydrophobicContact CD1-CB 4.44Å; I324-I356 HydrophobicContact CD1-CG1 3.53Å; I324-I356 HydrophobicContact CG1-CG1 3.91Å; I324-I356 HydrophobicContact CG2-CD1 4.39Å; I324-I356 HydrophobicContact CG2-CG1 3.78Å; L352-I356 WeakPolarHBondContact O-CB 3.44Å; L352-I356 WeakPolarHBondContact O-CD1 3.14Å; L352-I356 WeakPolarHBondContact O-CG1 3.33Å; L352-I356 PolarHBondContact O-N 3.37Å; W353-I356 PolarHBondContact O-N 3.04Å; I356-T358 VanDerWaalsContact C-N 3.32Å; I356-T358 PolarHBondContact O-N 3.22Å; I356-T360 WeakPolarHBondContact O-CB 3.36Å; I356-T360 VanDerWaalsContact O-CG2 3.28Å; I356-T360 WeakPolarHBondContact O-CG2 3.17Å; I356-T360 PolarHBondContact O-N 3.12Å; I356-T360 PolarHBondContact O-OG1 3.2Å
357	V	96.7	Very high	95.5	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-37.4	-177.5	169.7	0	0	0	0	111.7	W353 W354 T360 T361 V362 G363 Y364	W353-V357 HydrophobicContact CD2-CG2 4.14Å; W353-V357 HydrophobicContact CE3-CG2 4.35Å; W353-V357 HydrophobicContact CH2-CG2 4.2Å; W353-V357 HydrophobicContact CZ2-CG2 3.97Å; W353-V357 HydrophobicContact CZ3-CG2 4.39Å; W353-V357 WeakPolarHBondContact O-CG2 3.08Å; W353-V357 PolarHBondContact O-N 3.21Å; W354-V357 PolarHBondContact O-N 2.89Å; V357-T360 PolarHBondContact O-OG1 3.45Å; V357-T361 PolarHBondContact O-N 3.04Å; V357-V362 HydrophobicContact CG1-CB 4.16Å; V357-V362 HydrophobicContact CG1-CG1 4.4Å; V357-V362 PolarHBondContact O-N 3.43Å; V357-G363 VanDerWaalsContact CG1-N 3.3Å; V357-G363 PolarHBondContact O-N 2.97Å; V357-Y364 HydrophobicContact CB-CD2 4.45Å; V357-Y364 HydrophobicContact CG1-CD2 3.71Å; V357-Y364 HydrophobicContact CG1-CE2 4.34Å; V357-Y364 HydrophobicContact CG1-CG 4.28Å; V357-Y364 HydrophobicContact CG2-CD2 3.8Å; V357-Y364 HydrophobicContact CG2-CE2 3.92Å
358	T	96.2	Very high	95.5	Very high	24 Å²	24	55.5 Å²	55.5	15%	0.147	32%	0.315	C	S	.	.	H	α-helix	trans	-76.2	-46.8	179.7	-57	0	0	0	0	112.1	W354 A355 I356 T360 T361 C381 A382	W354-T358 HydrophobicContact CZ2-CG2 4.42Å; W354-T358 PolarHBondContact NE1-OG1 3.44Å; W354-T358 VanDerWaalsContact O-CB 3.29Å; W354-T358 WeakPolarHBondContact O-CB 3.49Å; W354-T358 PolarHBondContact O-N 3.15Å; W354-T358 PolarHBondContact O-OG1 3.29Å; A355-T358 PolarHBondContact O-N 3.12Å; I356-T358 VanDerWaalsContact C-N 3.32Å; I356-T358 PolarHBondContact O-N 3.22Å; T358-T360 VanDerWaalsContact C-N 3.3Å; T358-T360 PolarHBondContact O-N 2.97Å; T358-T361 WeakPolarHBondContact O-CA 3.49Å; T358-T361 PolarHBondContact O-N 2.75Å; T358-C381 HydrophobicContact CG2-CB 4.45Å; T358-A382 HydrophobicContact CG2-CB 4.17Å
359	M	95.1	Very high	95.4	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-30.9	180	-73.9	-168.9	74	0	0	112.7	L320 I324 F327 A355 T361 I389	L320-M359 HydrophobicContact CD1-CB 3.9Å; L320-M359 HydrophobicContact CD1-CE 3.85Å; L320-M359 HydrophobicContact CD1-SD 4.23Å; I324-M359 HydrophobicContact CG1-SD 3.88Å; I324-M359 PolarHBondContact N-SD 2.95Å; I324-M359 VanDerWaalsContact N-SD 3.38Å; F327-M359 HydrophobicContact CD2-SD 4.12Å; A355-M359 VanDerWaalsContact O-CB 3.27Å; A355-M359 WeakPolarHBondContact O-CB 3.36Å; A355-M359 WeakPolarHBondContact O-CG 3.31Å; A355-M359 PolarHBondContact O-N 3.27Å; M359-T361 PolarHBondContact O-N 2.93Å; M359-I389 VanDerWaalsContact O-CD1 3.28Å; M359-I389 WeakPolarHBondContact O-CD1 3.24Å
360	T	93.7	Very high	95.2	Very high	50 Å²	50	52.7 Å²	52.7	31%	0.307	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	3.6	172.2	57.3	0	0	0	0	113.3	I356 V357 T358 V362	I356-T360 WeakPolarHBondContact O-CB 3.36Å; I356-T360 VanDerWaalsContact O-CG2 3.28Å; I356-T360 WeakPolarHBondContact O-CG2 3.17Å; I356-T360 PolarHBondContact O-N 3.12Å; I356-T360 PolarHBondContact O-OG1 3.2Å; V357-T360 PolarHBondContact O-OG1 3.45Å; T358-T360 VanDerWaalsContact C-N 3.3Å; T358-T360 PolarHBondContact O-N 2.97Å; T360-V362 PolarHBondContact O-N 3.27Å
361	T	94.3	Very high	95.1	Very high	96 Å²	96	49.4 Å²	49.4	59%	0.589	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	18.7	177.5	68.8	0	0	0	0	115	V357 T358 M359 V386	V357-T361 PolarHBondContact O-N 3.04Å; T358-T361 WeakPolarHBondContact O-CA 3.49Å; T358-T361 PolarHBondContact O-N 2.75Å; M359-T361 PolarHBondContact O-N 2.93Å; T361-V386 HydrophobicContact CG2-CG2 3.61Å
362	V	94.8	Very high	94.9	Very high	79 Å²	79	57.9 Å²	57.9	48%	0.479	31%	0.309	S	S	.	.			trans	-78.2	-55.1	180	177.4	0	0	0	0	110.9	V357 T360 Y364	V357-V362 HydrophobicContact CG1-CB 4.16Å; V357-V362 HydrophobicContact CG1-CG1 4.4Å; V357-V362 PolarHBondContact O-N 3.43Å; T360-V362 PolarHBondContact O-N 3.27Å; V362-Y364 HydrophobicContact CG1-CD1 4.08Å; V362-Y364 HydrophobicContact CG1-CD2 4.34Å; V362-Y364 HydrophobicContact CG1-CE1 3.76Å; V362-Y364 HydrophobicContact CG1-CE2 4.03Å; V362-Y364 HydrophobicContact CG1-CG 4.35Å
363	G	93.9	Very high	94.8	Very high	50 Å²	50	59.3 Å²	59.3	52%	0.515	32%	0.317	S	S	.	.			trans	58.7	62.3	174.8	0	0	0	0	0	115.7	V357 G365	V357-G363 VanDerWaalsContact CG1-N 3.3Å; V357-G363 PolarHBondContact O-N 2.97Å; G363-G365 PolarHBondContact O-N 2.95Å; G363-G365 VanDerWaalsContact O-N 3.12Å
364	Y	94.3	Very high	94.7	Very high	158 Å²	158	53.8 Å²	53.8	62%	0.62	30%	0.296	S	S	*	.			trans	-55.8	-29.4	178.7	-68.2	-58.8	0	0	0	114.2	W353 V357 V362 D366	W353-Y364 HydrophobicContact CH2-CD2 4.4Å; W353-Y364 AromaticContact CH2-CE2 3.92Å; W353-Y364 HydrophobicContact CH2-CE2 3.92Å; W353-Y364 AromaticContact CZ2-CD2 3.84Å; W353-Y364 HydrophobicContact CZ2-CD2 3.84Å; W353-Y364 AromaticContact CZ2-CE2 3.83Å; W353-Y364 HydrophobicContact CZ2-CE2 3.83Å; V357-Y364 HydrophobicContact CB-CD2 4.45Å; V357-Y364 HydrophobicContact CG1-CD2 3.71Å; V357-Y364 HydrophobicContact CG1-CE2 4.34Å; V357-Y364 HydrophobicContact CG1-CG 4.28Å; V357-Y364 HydrophobicContact CG2-CD2 3.8Å; V357-Y364 HydrophobicContact CG2-CE2 3.92Å; V362-Y364 HydrophobicContact CG1-CD1 4.08Å; V362-Y364 HydrophobicContact CG1-CD2 4.34Å; V362-Y364 HydrophobicContact CG1-CE1 3.76Å; V362-Y364 HydrophobicContact CG1-CE2 4.03Å; V362-Y364 HydrophobicContact CG1-CG 4.35Å; Y364-D366 VanDerWaalsContact C-N 3.27Å
365	G	92.2	Very high	94.6	Very high	52 Å²	52	57.6 Å²	57.6	54%	0.536	32%	0.315	S	S	.	.	S	Bend	trans	77.5	12.2	-178.2	0	0	0	0	0	114	G363 M367	G363-G365 PolarHBondContact O-N 2.95Å; G363-G365 VanDerWaalsContact O-N 3.12Å; G365-M367 VanDerWaalsContact C-N 3.26Å
366	D	93.6	Very high	94.5	Very high	85 Å²	85	62.3 Å²	62.3	46%	0.455	34%	0.339	S	S	.	.	S	Bend	trans	-68.8	-26.4	170.8	61.1	-37.3	0	0	0	112.6	W353 Y364	W353-D366 PolarHBondContact NE1-OD2 2.89Å; Y364-D366 VanDerWaalsContact C-N 3.27Å
367	M	92.9	Very high	94.5	Very high	19 Å²	19	59.9 Å²	59.9	9%	0.094	33%	0.328	C	S	.	.	S	Bend	trans	-136.2	131.7	174.7	-60.1	179.2	72.3	0	0	109.4	D344 F345 L350 W354 G365	D344-M367 HydrophobicContact CB-CB 4.28Å; D344-M367 HydrophobicContact CB-CE 4.13Å; D344-M367 HydrophobicContact CB-CG 4.34Å; D344-M367 VanDerWaalsContact O-CE 3.24Å; D344-M367 WeakPolarHBondContact O-CE 2.97Å; F345-M367 HydrophobicContact CD1-CE 4.08Å; F345-M367 HydrophobicContact CE1-CE 4.19Å; L350-M367 HydrophobicContact CB-CE 3.78Å; W354-M367 HydrophobicContact CB-CB 4.39Å; W354-M367 HydrophobicContact CB-SD 4.36Å; W354-M367 VanDerWaalsContact CD1-O 3.24Å; G365-M367 VanDerWaalsContact C-N 3.26Å
368	T	94.1	Very high	94.5	Very high	63 Å²	63	60 Å²	60	39%	0.387	33%	0.331	S	S	.	.			trans	-143.9	144.7	-179.7	57.7	0	0	0	0	112.2	D344 K370	D344-T368 PolarHBondContact OD2-N 3.23Å; T368-K370 PolarHBondContact O-N 2.99Å
369	P	94.7	Very high	94.5	Very high	23 Å²	23	62.8 Å²	62.8	15%	0.149	35%	0.351	C	S	.	.			trans	-66.8	130.1	175.1	27.2	-33.3	0	0	0	110.9	I331 E335 G374	I331-P369 HydrophobicContact CD1-CB 3.77Å; E335-P369 WeakPolarHBondContact OE1-CA 3.46Å; P369-G374 WeakPolarHBondContact CB-O 3.44Å
370	K	92.7	Very high	94.6	Very high	75 Å²	75	67 Å²	67	33%	0.326	37%	0.373	S	S	.	.			trans	-105.2	-24.1	-179.1	-61.7	-178.2	-174.1	178.2	0	112.1	E335 E342 D344 T368	E335-K370 PolarHBondContact OE1-N 3.34Å; E335-K370 PolarHBondContact OE2-N 3.19Å; E342-K370 HydrophobicContact CB-CD 4.07Å; E342-K370 VanDerWaalsContact O-CD 3.25Å; E342-K370 WeakPolarHBondContact O-CD 3.33Å; E342-K370 VanDerWaalsContact O-CE 3.24Å; E342-K370 WeakPolarHBondContact O-CE 3.33Å; E342-K370 PolarHBondContact O-NZ 3.32Å; E342-K370 IonicContact OE2-NZ 3.56Å; E342-K370 PolarHBondContact OE2-NZ 2.89Å; D344-K370 IonicContact OD1-NZ 3.69Å; D344-K370 IonicContact OD2-NZ 2.73Å; T368-K370 PolarHBondContact O-N 2.99Å
371	T	94.3	Very high	94.8	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.012	36%	0.359	C	S	.	.	S	Bend	trans	-83.7	154	178.9	65.5	0	0	0	0	111.7	E335 E338 N340 L373 G374 M375	E335-T371 VanDerWaalsContact CD-OG1 3.25Å; E335-T371 WeakPolarHBondContact OE1-CB 3.38Å; E335-T371 PolarHBondContact OE1-N 2.97Å; E335-T371 PolarHBondContact OE1-OG1 3.31Å; E335-T371 WeakPolarHBondContact OE2-CG2 3.27Å; E338-T371 HydrophobicContact CB-CG2 3.67Å; E338-T371 HydrophobicContact CG-CG2 4.02Å; E338-T371 WeakPolarHBondContact OE2-CA 3.38Å; E338-T371 WeakPolarHBondContact OE2-CB 3.26Å; N340-T371 HydrophobicContact CB-CG2 4.27Å; T371-L373 VanDerWaalsContact C-N 3.31Å; T371-L373 PolarHBondContact O-N 3.22Å; T371-G374 PolarHBondContact O-N 3.5Å; T371-G374 VanDerWaalsContact O-N 3.16Å; T371-G374 WeakPolarHBondContact OG1-CA 3.48Å; T371-G374 PolarHBondContact OG1-N 3.44Å; T371-M375 WeakPolarHBondContact O-CG 3.36Å; T371-M375 PolarHBondContact O-N 3.3Å
372	Y	93	Very high	94.9	Very high	179 Å²	179	62 Å²	62	70%	0.702	35%	0.346	S	S	*	.	H	α-helix	trans	-61.7	-40.9	178.4	-67.8	-74.4	0	0	0	112.1	E338 M375 I376	E338-Y372 PolarHBondContact OE2-N 3.37Å; Y372-M375 PolarHBondContact O-N 3.14Å; Y372-I376 WeakPolarHBondContact O-CG1 3.46Å; Y372-I376 PolarHBondContact O-N 3Å; Y372-I376 VanDerWaalsContact O-N 3.13Å
373	L	94.2	Very high	94.9	Very high	82 Å²	82	63.3 Å²	63.3	43%	0.429	35%	0.35	S	S	.	.	H	α-helix	trans	-65.5	-41.2	175.4	-66.5	-178.3	0	0	0	111.2	A334 I337 T371 M375 I376 V377	A334-L373 HydrophobicContact CB-CB 4.07Å; I337-L373 HydrophobicContact CD1-CD1 4.37Å; I337-L373 HydrophobicContact CG2-CD1 4.32Å; T371-L373 VanDerWaalsContact C-N 3.31Å; T371-L373 PolarHBondContact O-N 3.22Å; L373-M375 VanDerWaalsContact C-N 3.32Å; L373-M375 PolarHBondContact O-N 3.34Å; L373-I376 PolarHBondContact O-N 3.22Å; L373-V377 WeakPolarHBondContact O-CG2 3.4Å; L373-V377 PolarHBondContact O-N 3.01Å
374	G	95.6	Very high	95	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.9	-41.3	174.7	0	0	0	0	0	112.4	I331 P369 T371 I376 V377 G378	I331-G374 WeakPolarHBondContact CD1-O 3.17Å; P369-G374 WeakPolarHBondContact CB-O 3.44Å; T371-G374 PolarHBondContact O-N 3.5Å; T371-G374 VanDerWaalsContact O-N 3.16Å; T371-G374 WeakPolarHBondContact OG1-CA 3.48Å; T371-G374 PolarHBondContact OG1-N 3.44Å; G374-I376 PolarHBondContact O-N 3.34Å; G374-V377 PolarHBondContact O-N 2.95Å; G374-G378 PolarHBondContact O-N 3.22Å
375	M	95.2	Very high	95.1	Very high	91 Å²	91	55.6 Å²	55.6	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-38.5	176.8	-69	178.5	-174.1	0	0	112.3	T371 Y372 L373 G378 S379	T371-M375 WeakPolarHBondContact O-CG 3.36Å; T371-M375 PolarHBondContact O-N 3.3Å; Y372-M375 PolarHBondContact O-N 3.14Å; L373-M375 VanDerWaalsContact C-N 3.32Å; L373-M375 PolarHBondContact O-N 3.34Å; M375-G378 PolarHBondContact O-N 3.23Å; M375-S379 WeakPolarHBondContact O-CB 3.32Å; M375-S379 PolarHBondContact O-N 2.85Å; M375-S379 PolarHBondContact O-OG 3.31Å
376	I	96.8	Very high	95.2	Very high	99 Å²	99	56.6 Å²	56.6	51%	0.508	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-47.9	173.6	-67.1	169.1	0	0	0	110.1	Y372 L373 G374 G378 S379 L380	Y372-I376 WeakPolarHBondContact O-CG1 3.46Å; Y372-I376 PolarHBondContact O-N 3Å; Y372-I376 VanDerWaalsContact O-N 3.13Å; L373-I376 PolarHBondContact O-N 3.22Å; G374-I376 PolarHBondContact O-N 3.34Å; I376-G378 VanDerWaalsContact C-N 3.33Å; I376-G378 PolarHBondContact O-N 3.26Å; I376-S379 PolarHBondContact O-N 3.38Å; I376-L380 HydrophobicContact CG2-CD1 4.15Å; I376-L380 WeakPolarHBondContact O-CG 3.21Å; I376-L380 PolarHBondContact O-N 3.2Å
377	V	96.9	Very high	95.2	Very high	22 Å²	22	57.2 Å²	57.2	13%	0.133	31%	0.308	C	S	.	.	H	α-helix	trans	-60.5	-43.2	177	171.4	0	0	0	0	111	F327 L330 I331 A334 L373 G374 L380 C381	F327-V377 HydrophobicContact CD1-CG1 4.2Å; L330-V377 HydrophobicContact CB-CG1 3.8Å; L330-V377 HydrophobicContact CB-CG2 4.4Å; I331-V377 HydrophobicContact CB-CG1 4.24Å; I331-V377 HydrophobicContact CD1-CB 4.29Å; I331-V377 HydrophobicContact CD1-CG1 4.2Å; A334-V377 HydrophobicContact CB-CG2 4.22Å; L373-V377 WeakPolarHBondContact O-CG2 3.4Å; L373-V377 PolarHBondContact O-N 3.01Å; G374-V377 PolarHBondContact O-N 2.95Å; V377-L380 PolarHBondContact O-N 3.11Å; V377-C381 VanDerWaalsContact O-CB 3.24Å; V377-C381 WeakPolarHBondContact O-CB 3.29Å; V377-C381 PolarHBondContact O-N 2.95Å
378	G	96.2	Very high	95.1	Very high	10 Å²	10	58 Å²	58	10%	0.103	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-42.4	175.5	0	0	0	0	0	112.9	G374 M375 I376 C381 A382	G374-G378 PolarHBondContact O-N 3.22Å; M375-G378 PolarHBondContact O-N 3.23Å; I376-G378 VanDerWaalsContact C-N 3.33Å; I376-G378 PolarHBondContact O-N 3.26Å; G378-C381 WeakPolarHBondContact O-CB 3.46Å; G378-C381 PolarHBondContact O-N 3.03Å; G378-A382 WeakPolarHBondContact O-CB 3.5Å; G378-A382 PolarHBondContact O-N 3.44Å
379	S	96	Very high	95	Very high	82 Å²	82	57.2 Å²	57.2	57%	0.573	31%	0.307	S	S	*	.	H	α-helix	trans	-63.3	-44.6	175.9	-58.4	0	0	0	0	111.6	M375 I376 A382 L383	M375-S379 WeakPolarHBondContact O-CB 3.32Å; M375-S379 PolarHBondContact O-N 2.85Å; M375-S379 PolarHBondContact O-OG 3.31Å; I376-S379 PolarHBondContact O-N 3.38Å; S379-A382 PolarHBondContact O-N 3.28Å; S379-L383 WeakPolarHBondContact O-CB 3.37Å; S379-L383 PolarHBondContact O-N 3.14Å
380	L	97	Very high	94.8	Very high	91 Å²	91	58.5 Å²	58.5	48%	0.476	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-40.8	175.1	-69.2	174.1	0	0	0	111.7	F327 I376 V377 L383 T384	F327-L380 HydrophobicContact CE1-CB 4.25Å; I376-L380 HydrophobicContact CG2-CD1 4.15Å; I376-L380 WeakPolarHBondContact O-CG 3.21Å; I376-L380 PolarHBondContact O-N 3.2Å; V377-L380 PolarHBondContact O-N 3.11Å; L380-L383 PolarHBondContact O-N 3.38Å; L380-T384 WeakPolarHBondContact O-CB 3.37Å; L380-T384 VanDerWaalsContact O-CG2 3.23Å; L380-T384 WeakPolarHBondContact O-CG2 3.49Å; L380-T384 PolarHBondContact O-N 3.2Å; L380-T384 PolarHBondContact O-OG1 3.12Å
381	C	97.4	Very high	94.5	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.7	-48.7	175.9	-178.7	0	0	0	0	111.3	F327 W354 T358 V377 G378 T384 G385	F327-C381 HydrophobicContact CB-CB 4.19Å; F327-C381 HydrophobicContact CD1-CB 3.66Å; F327-C381 HydrophobicContact CD2-CB 4.1Å; F327-C381 HydrophobicContact CE1-CB 4.03Å; F327-C381 HydrophobicContact CE2-CB 4.46Å; F327-C381 HydrophobicContact CG-CB 3.71Å; F327-C381 HydrophobicContact CZ-CB 4.43Å; W354-C381 HydrophobicContact CH2-CB 4.06Å; T358-C381 HydrophobicContact CG2-CB 4.45Å; V377-C381 VanDerWaalsContact O-CB 3.24Å; V377-C381 WeakPolarHBondContact O-CB 3.29Å; V377-C381 PolarHBondContact O-N 2.95Å; G378-C381 WeakPolarHBondContact O-CB 3.46Å; G378-C381 PolarHBondContact O-N 3.03Å; C381-T384 WeakPolarHBondContact CA-OG1 3.36Å; C381-T384 PolarHBondContact O-N 2.82Å; C381-T384 PolarHBondContact O-OG1 2.91Å; C381-G385 PolarHBondContact O-N 2.6Å
382	A	96.3	Very high	94.2	Very high	40 Å²	40	62.1 Å²	62.1	33%	0.331	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-47.1	177.7	0	0	0	0	0	112	T358 G378 S379 G385 V386	T358-A382 HydrophobicContact CG2-CB 4.17Å; G378-A382 WeakPolarHBondContact O-CB 3.5Å; G378-A382 PolarHBondContact O-N 3.44Å; S379-A382 PolarHBondContact O-N 3.28Å; A382-G385 PolarHBondContact O-N 2.85Å; A382-V386 WeakPolarHBondContact O-CG2 3.39Å; A382-V386 PolarHBondContact O-N 3.12Å; A382-V386 VanDerWaalsContact O-N 3.07Å
383	L	96	Very high	94	Very high	106 Å²	106	56.2 Å²	56.2	56%	0.555	33%	0.325	S	S	*	.	H	α-helix	trans	-62.8	-46.9	179.4	-178.9	62.5	0	0	0	112.1	S379 L380 V386 L387	S379-L383 WeakPolarHBondContact O-CB 3.37Å; S379-L383 PolarHBondContact O-N 3.14Å; L380-L383 PolarHBondContact O-N 3.38Å; L383-V386 PolarHBondContact O-N 3.39Å; L383-L387 HydrophobicContact CD1-CD1 4.37Å; L383-L387 HydrophobicContact CG-CD1 4.19Å; L383-L387 WeakPolarHBondContact O-CG 3.33Å; L383-L387 PolarHBondContact O-N 3.42Å
384	T	95.5	Very high	93.9	Very high	46 Å²	46	56 Å²	56	28%	0.282	33%	0.328	S	S	.	.	H	α-helix	trans	-67.6	-35.9	179.2	53.6	0	0	0	0	112.4	F327 L380 C381 L387 T388	F327-T384 HydrophobicContact CE2-CG2 4.42Å; F327-T384 WeakPolarHBondContact CE2-OG1 3.32Å; F327-T384 HydrophobicContact CZ-CG2 3.99Å; F327-T384 WeakPolarHBondContact CZ-OG1 3.09Å; L380-T384 WeakPolarHBondContact O-CB 3.37Å; L380-T384 VanDerWaalsContact O-CG2 3.23Å; L380-T384 WeakPolarHBondContact O-CG2 3.49Å; L380-T384 PolarHBondContact O-N 3.2Å; L380-T384 PolarHBondContact O-OG1 3.12Å; C381-T384 WeakPolarHBondContact CA-OG1 3.36Å; C381-T384 PolarHBondContact O-N 2.82Å; C381-T384 PolarHBondContact O-OG1 2.91Å; T384-L387 PolarHBondContact O-N 3.18Å; T384-T388 VanDerWaalsContact O-CB 3.3Å; T384-T388 WeakPolarHBondContact O-CB 3.24Å; T384-T388 PolarHBondContact O-N 2.76Å; T384-T388 PolarHBondContact O-OG1 3Å
385	G	95.9	Very high	93.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.4	-51	173	0	0	0	0	0	112.3	C381 A382 L387 T388 I389	C381-G385 PolarHBondContact O-N 2.6Å; A382-G385 PolarHBondContact O-N 2.85Å; G385-L387 PolarHBondContact O-N 3.44Å; G385-T388 PolarHBondContact O-N 2.77Å; G385-I389 PolarHBondContact O-N 3.34Å
386	V	94.6	Very high	93.1	Very high	74 Å²	74	56.1 Å²	56.1	45%	0.448	33%	0.333	S	S	.	.	H	α-helix	trans	-57	-48.8	175.8	173.1	0	0	0	0	111	T361 A382 L383 T388 I389 A390	T361-V386 HydrophobicContact CG2-CG2 3.61Å; A382-V386 WeakPolarHBondContact O-CG2 3.39Å; A382-V386 PolarHBondContact O-N 3.12Å; A382-V386 VanDerWaalsContact O-N 3.07Å; L383-V386 PolarHBondContact O-N 3.39Å; V386-T388 VanDerWaalsContact C-N 3.34Å; V386-T388 PolarHBondContact O-N 2.93Å; V386-I389 PolarHBondContact O-N 3.35Å; V386-A390 WeakPolarHBondContact O-CB 3.1Å; V386-A390 PolarHBondContact O-N 2.94Å
387	L	92.9	Very high	92.8	Very high	97 Å²	97	55.6 Å²	55.6	51%	0.508	33%	0.334	S	S	.	.	H	α-helix	trans	-63.4	-38.5	179.8	-70	172.6	0	0	0	112.7	L383 T384 G385	L383-L387 HydrophobicContact CD1-CD1 4.37Å; L383-L387 HydrophobicContact CG-CD1 4.19Å; L383-L387 WeakPolarHBondContact O-CG 3.33Å; L383-L387 PolarHBondContact O-N 3.42Å; T384-L387 PolarHBondContact O-N 3.18Å; G385-L387 PolarHBondContact O-N 3.44Å
388	T	91.8	Very high	92.4	Very high	35 Å²	35	58.1 Å²	58.1	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-67.4	-37.3	-179.6	-58.7	0	0	0	0	111.8	L316 F319 T384 G385 V386 P392	L316-T388 HydrophobicContact CD1-CG2 4.44Å; L316-T388 WeakPolarHBondContact CD1-O 3.25Å; F319-T388 HydrophobicContact CB-CG2 3.71Å; T384-T388 VanDerWaalsContact O-CB 3.3Å; T384-T388 WeakPolarHBondContact O-CB 3.24Å; T384-T388 PolarHBondContact O-N 2.76Å; T384-T388 PolarHBondContact O-OG1 3Å; G385-T388 PolarHBondContact O-N 2.77Å; V386-T388 VanDerWaalsContact C-N 3.34Å; V386-T388 PolarHBondContact O-N 2.93Å; T388-P392 WeakPolarHBondContact O-CD 3.32Å; T388-P392 WeakPolarHBondContact O-CG 3.21Å
389	I	92	Very high	91.7	Very high	47 Å²	47	59.5 Å²	59.5	24%	0.241	36%	0.358	C	S	.	.	H	α-helix	trans	-82.3	-37.4	178.5	-64.3	177.1	0	0	0	111.3	L316 M359 G385 V386 L391 P392 V393	L316-I389 HydrophobicContact CD1-CG1 4.37Å; M359-I389 VanDerWaalsContact O-CD1 3.28Å; M359-I389 WeakPolarHBondContact O-CD1 3.24Å; G385-I389 PolarHBondContact O-N 3.34Å; V386-I389 PolarHBondContact O-N 3.35Å; I389-L391 VanDerWaalsContact C-N 3.3Å; I389-L391 PolarHBondContact O-N 3.4Å; I389-P392 WeakPolarHBondContact O-CD 3.5Å; I389-V393 HydrophobicContact CG2-CG2 3.66Å; I389-V393 WeakPolarHBondContact O-CB 3.21Å; I389-V393 VanDerWaalsContact O-CG2 3.24Å; I389-V393 WeakPolarHBondContact O-CG2 3.21Å; I389-V393 PolarHBondContact O-N 3.14Å
390	A	90.5	Very high	91.2	Very high	50 Å²	50	59.3 Å²	59.3	41%	0.413	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-28.6	-174.4	0	0	0	0	0	114.1	V386 P394	V386-A390 WeakPolarHBondContact O-CB 3.1Å; V386-A390 PolarHBondContact O-N 2.94Å; A390-P394 WeakPolarHBondContact O-CD 3.44Å; A390-P394 WeakPolarHBondContact O-CG 3.33Å
391	L	86.8	Confident	90.7	Very high	135 Å²	135	57.5 Å²	57.5	71%	0.707	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-46	-178.2	-62	173.8	0	0	0	113.6	I389	I389-L391 VanDerWaalsContact C-N 3.3Å; I389-L391 PolarHBondContact O-N 3.4Å
392	P	86.7	Confident	90.1	Very high	18 Å²	18	60 Å²	60	12%	0.117	36%	0.358	C	S	.	.	H	α-helix	trans	-82.3	-31.7	-177.2	-18.7	36	0	0	0	114.3	L315 L316 T388 I389 V395 I396	L315-P392 HydrophobicContact CD2-CG 4.26Å; L316-P392 HydrophobicContact CB-CB 4.12Å; L316-P392 HydrophobicContact CB-CG 4.29Å; L316-P392 HydrophobicContact CD1-CB 4.4Å; L316-P392 HydrophobicContact CD1-CG 4.05Å; T388-P392 WeakPolarHBondContact O-CD 3.32Å; T388-P392 WeakPolarHBondContact O-CG 3.21Å; I389-P392 WeakPolarHBondContact O-CD 3.5Å; P392-V395 WeakPolarHBondContact O-CB 3.5Å; P392-V395 PolarHBondContact O-N 3.48Å; P392-V395 VanDerWaalsContact O-N 3.15Å; P392-I396 WeakPolarHBondContact O-CG1 3.32Å; P392-I396 PolarHBondContact O-N 2.82Å; P392-I396 VanDerWaalsContact O-N 3.13Å
393	V	90.4	Very high	89.4	Confident	56 Å²	56	58.9 Å²	58.9	34%	0.339	35%	0.345	S	S	.	.	H	α-helix	trans	-60.4	-45.1	-175.8	171.1	0	0	0	0	112.4	L316 I389 V395 I396 V397	L316-V393 HydrophobicContact CD2-CG2 4.32Å; I389-V393 HydrophobicContact CG2-CG2 3.66Å; I389-V393 WeakPolarHBondContact O-CB 3.21Å; I389-V393 VanDerWaalsContact O-CG2 3.24Å; I389-V393 WeakPolarHBondContact O-CG2 3.21Å; I389-V393 PolarHBondContact O-N 3.14Å; V393-V395 VanDerWaalsContact C-N 3.27Å; V393-V395 PolarHBondContact O-N 3.27Å; V393-I396 PolarHBondContact O-N 3.35Å; V393-V397 HydrophobicContact CG1-CG2 4.17Å; V393-V397 WeakPolarHBondContact O-CG2 3.43Å; V393-V397 PolarHBondContact O-N 2.85Å
394	P	90.8	Very high	88.8	Confident	76 Å²	76	59.8 Å²	59.8	49%	0.494	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-33.4	175.5	-26.5	36.7	0	0	0	114	A390 V397 S398	A390-P394 WeakPolarHBondContact O-CD 3.44Å; A390-P394 WeakPolarHBondContact O-CG 3.33Å; P394-V397 PolarHBondContact O-N 3.25Å; P394-S398 VanDerWaalsContact O-CB 3.3Å; P394-S398 WeakPolarHBondContact O-CB 3.28Å; P394-S398 PolarHBondContact O-N 3.06Å
395	V	88	Confident	88.4	Confident	70 Å²	70	60.2 Å²	60.2	42%	0.424	35%	0.347	S	S	.	.	H	α-helix	trans	-65.4	-46.6	175.9	-179.3	0	0	0	0	110.1	E312 P392 V393 V397 S398 N399	E312-V395 HydrophobicContact CG-CG1 4.16Å; P392-V395 WeakPolarHBondContact O-CB 3.5Å; P392-V395 PolarHBondContact O-N 3.48Å; P392-V395 VanDerWaalsContact O-N 3.15Å; V393-V395 VanDerWaalsContact C-N 3.27Å; V393-V395 PolarHBondContact O-N 3.27Å; V395-V397 VanDerWaalsContact C-N 3.35Å; V395-V397 PolarHBondContact O-N 3.1Å; V395-S398 WeakPolarHBondContact O-CB 3.43Å; V395-S398 PolarHBondContact O-N 3.49Å; V395-N399 PolarHBondContact O-N 2.97Å
396	I	87.5	Confident	87.7	Confident	25 Å²	25	62 Å²	62	13%	0.128	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-43.6	177	-61.6	167.5	0	0	0	110.7	E312 L313 P392 V393 N399 F400	E312-I396 HydrophobicContact CB-CG1 4.1Å; L313-I396 HydrophobicContact CB-CD1 3.81Å; P392-I396 WeakPolarHBondContact O-CG1 3.32Å; P392-I396 PolarHBondContact O-N 2.82Å; P392-I396 VanDerWaalsContact O-N 3.13Å; V393-I396 PolarHBondContact O-N 3.35Å; I396-N399 PolarHBondContact O-N 3.14Å; I396-F400 PolarHBondContact O-N 2.8Å
397	V	89.7	Confident	87	Confident	87 Å²	87	59.9 Å²	59.9	53%	0.527	34%	0.342	S	S	.	.	H	α-helix	trans	-64.7	-39.2	177.6	173	0	0	0	0	111.3	V393 P394 V395 F400 A401	V393-V397 HydrophobicContact CG1-CG2 4.17Å; V393-V397 WeakPolarHBondContact O-CG2 3.43Å; V393-V397 PolarHBondContact O-N 2.85Å; P394-V397 PolarHBondContact O-N 3.25Å; V395-V397 VanDerWaalsContact C-N 3.35Å; V395-V397 PolarHBondContact O-N 3.1Å; V397-F400 PolarHBondContact O-N 3.35Å; V397-A401 WeakPolarHBondContact O-CB 3.39Å; V397-A401 PolarHBondContact O-N 2.89Å
398	S	87.6	Confident	86.5	Confident	75 Å²	75	59.6 Å²	59.6	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-45.9	175.7	-172	0	0	0	0	111.7	P394 V395 F400 A401 M402	P394-S398 VanDerWaalsContact O-CB 3.3Å; P394-S398 WeakPolarHBondContact O-CB 3.28Å; P394-S398 PolarHBondContact O-N 3.06Å; V395-S398 WeakPolarHBondContact O-CB 3.43Å; V395-S398 PolarHBondContact O-N 3.49Å; S398-F400 VanDerWaalsContact C-N 3.32Å; S398-F400 PolarHBondContact O-N 3.33Å; S398-A401 PolarHBondContact O-N 3.04Å; S398-M402 WeakPolarHBondContact O-CB 3.15Å; S398-M402 PolarHBondContact O-N 3.23Å
399	N	83.5	Confident	86	Confident	40 Å²	40	60.5 Å²	60.5	21%	0.214	35%	0.349	C	S	.	.	H	α-helix	trans	-59.3	-43	173.7	-73.3	-10.6	0	0	0	111.3	E312 V395 I396 M402 F403	E312-N399 PolarHBondContact OE1-ND2 3.48Å; V395-N399 PolarHBondContact O-N 2.97Å; I396-N399 PolarHBondContact O-N 3.14Å; N399-M402 WeakPolarHBondContact O-CB 3.23Å; N399-M402 PolarHBondContact O-N 3.08Å; N399-F403 WeakPolarHBondContact O-CD2 3.47Å; N399-F403 PolarHBondContact O-N 2.87Å
400	F	84.7	Confident	85.2	Confident	77 Å²	77	60 Å²	60	34%	0.338	34%	0.344	S	S	.	.	H	α-helix	trans	-62.7	-45.5	175.8	-176.3	-93.3	0	0	0	112.5	L302 T305 I396 V397 S398 M402 F403 Y404	L302-F400 HydrophobicContact CD1-CD2 4.09Å; L302-F400 HydrophobicContact CD1-CE2 3.66Å; T305-F400 HydrophobicContact CG2-CB 3.84Å; T305-F400 HydrophobicContact CG2-CD2 3.84Å; T305-F400 HydrophobicContact CG2-CG 4.33Å; I396-F400 PolarHBondContact O-N 2.8Å; V397-F400 PolarHBondContact O-N 3.35Å; S398-F400 VanDerWaalsContact C-N 3.32Å; S398-F400 PolarHBondContact O-N 3.33Å; F400-M402 VanDerWaalsContact C-N 3.27Å; F400-M402 PolarHBondContact O-N 3.49Å; F400-F403 PolarHBondContact O-N 3.45Å; F400-Y404 HydrophobicContact CE1-CD2 4.35Å; F400-Y404 HydrophobicContact CE1-CG 4.47Å; F400-Y404 HydrophobicContact CZ-CD2 4.34Å; F400-Y404 WeakPolarHBondContact O-CB 3.38Å; F400-Y404 PolarHBondContact O-N 3.4Å
401	A	87.3	Confident	84.5	Confident	53 Å²	53	61.8 Å²	61.8	44%	0.438	36%	0.359	S	S	.	.	H	α-helix	trans	-59.9	-39.5	176.6	0	0	0	0	0	111.5	V397 S398 Y404 S405	V397-A401 WeakPolarHBondContact O-CB 3.39Å; V397-A401 PolarHBondContact O-N 2.89Å; S398-A401 PolarHBondContact O-N 3.04Å; A401-Y404 PolarHBondContact O-N 3.39Å; A401-S405 VanDerWaalsContact O-CB 3.27Å; A401-S405 WeakPolarHBondContact O-CB 3.5Å; A401-S405 PolarHBondContact O-N 3.17Å; A401-S405 PolarHBondContact O-OG 2.8Å
402	M	83.3	Confident	84.2	Confident	54 Å²	54	62.9 Å²	62.9	27%	0.266	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-56.1	175	-177.8	-87.6	-77.8	0	0	111	T95 S398 N399 F400 Y404 S405 H406	T95-M402 HydrophobicContact CG2-SD 3.77Å; T95-M402 WeakPolarHBondContact OG1-CE 3.44Å; S398-M402 WeakPolarHBondContact O-CB 3.15Å; S398-M402 PolarHBondContact O-N 3.23Å; N399-M402 WeakPolarHBondContact O-CB 3.23Å; N399-M402 PolarHBondContact O-N 3.08Å; F400-M402 VanDerWaalsContact C-N 3.27Å; F400-M402 PolarHBondContact O-N 3.49Å; M402-Y404 VanDerWaalsContact C-N 3.32Å; M402-Y404 PolarHBondContact O-N 3.43Å; M402-S405 PolarHBondContact O-N 2.89Å; M402-S405 PolarHBondContact O-OG 3.14Å; M402-H406 PolarHBondContact O-CD2 3.12Å; M402-H406 PolarHBondContact O-N 3.14Å; M402-H406 VanDerWaalsContact O-N 3.07Å; M402-H406 PolarHBondContact SD-CD2 3.3Å
403	F	81.5	Confident	83.7	Confident	15 Å²	15	67.8 Å²	67.8	7%	0.066	38%	0.383	C	S	.	.	H	α-helix	trans	-58.8	-41.8	177.5	-87.9	-99.5	0	0	0	112.4	T95 V98 A308 N399 F400 H406 T407	T95-F403 HydrophobicContact CG2-CD1 3.69Å; T95-F403 HydrophobicContact CG2-CD2 4.22Å; T95-F403 HydrophobicContact CG2-CE1 3.66Å; T95-F403 HydrophobicContact CG2-CE2 4.2Å; T95-F403 HydrophobicContact CG2-CG 3.98Å; T95-F403 HydrophobicContact CG2-CZ 3.92Å; V98-F403 HydrophobicContact CG1-CE1 4.47Å; A308-F403 HydrophobicContact CB-CE2 4.11Å; A308-F403 HydrophobicContact CB-CZ 4Å; N399-F403 WeakPolarHBondContact O-CD2 3.47Å; N399-F403 PolarHBondContact O-N 2.87Å; F400-F403 PolarHBondContact O-N 3.45Å; F403-H406 PolarHBondContact O-N 3.2Å; F403-T407 WeakPolarHBondContact O-CG2 3.25Å; F403-T407 PolarHBondContact O-N 3.39Å; F403-T407 VanDerWaalsContact O-N 3.08Å; F403-T407 PolarHBondContact O-OG1 2.88Å
404	Y	84.1	Confident	82.6	Confident	126 Å²	126	69.1 Å²	69.1	49%	0.494	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-43.3	178.3	-171.8	-95.2	0	0	0	111.6	F400 A401 M402 H406 T407 Q408	F400-Y404 HydrophobicContact CE1-CD2 4.35Å; F400-Y404 HydrophobicContact CE1-CG 4.47Å; F400-Y404 HydrophobicContact CZ-CD2 4.34Å; F400-Y404 WeakPolarHBondContact O-CB 3.38Å; F400-Y404 PolarHBondContact O-N 3.4Å; A401-Y404 PolarHBondContact O-N 3.39Å; M402-Y404 VanDerWaalsContact C-N 3.32Å; M402-Y404 PolarHBondContact O-N 3.43Å; Y404-H406 PolarHBondContact O-N 3.29Å; Y404-T407 WeakPolarHBondContact CA-OG1 3.37Å; Y404-T407 PolarHBondContact O-N 3.17Å; Y404-T407 PolarHBondContact O-OG1 3.01Å; Y404-Q408 WeakPolarHBondContact O-CB 3.27Å; Y404-Q408 PolarHBondContact O-N 3.14Å
405	S	86.5	Confident	81.2	Confident	55 Å²	55	74 Å²	74	39%	0.385	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-39.3	178.4	74.2	0	0	0	0	112.2	A401 M402 Q408 A409	A401-S405 VanDerWaalsContact O-CB 3.27Å; A401-S405 WeakPolarHBondContact O-CB 3.5Å; A401-S405 PolarHBondContact O-N 3.17Å; A401-S405 PolarHBondContact O-OG 2.8Å; M402-S405 PolarHBondContact O-N 2.89Å; M402-S405 PolarHBondContact O-OG 3.14Å; S405-Q408 PolarHBondContact O-N 3.07Å; S405-A409 VanDerWaalsContact O-CB 3.29Å; S405-A409 WeakPolarHBondContact O-CB 3.31Å; S405-A409 PolarHBondContact O-N 3.08Å
406	H	82.1	Confident	79.7	Confident	38 Å²	38	80.6 Å²	80.6	18%	0.176	43%	0.429	C	S	.	.	H	α-helix	trans	-64.5	-41.5	174.7	-77	-67	0	0	0	112.1	T95 L99 M402 F403 Y404 R410	T95-H406 HydrophobicContact CG2-CB 4.44Å; L99-H406 HydrophobicContact CD1-CB 3.72Å; M402-H406 PolarHBondContact O-CD2 3.12Å; M402-H406 PolarHBondContact O-N 3.14Å; M402-H406 VanDerWaalsContact O-N 3.07Å; M402-H406 PolarHBondContact SD-CD2 3.3Å; F403-H406 PolarHBondContact O-N 3.2Å; Y404-H406 PolarHBondContact O-N 3.29Å; H406-R410 WeakPolarHBondContact O-CB 3.4Å; H406-R410 VanDerWaalsContact O-CG 3.22Å; H406-R410 WeakPolarHBondContact O-CG 3.32Å; H406-R410 PolarHBondContact O-N 2.98Å
407	T	78.7	Confident	77.9	Confident	29 Å²	29	88.9 Å²	88.9	18%	0.178	46%	0.459	C	S	.	.	H	α-helix	trans	-67.1	-39.6	176.6	58.2	0	0	0	0	112	L99 I301 F403 Y404 R410 A411	L99-T407 HydrophobicContact CD1-CG2 3.62Å; L99-T407 HydrophobicContact CD2-CG2 3.3Å; L99-T407 HydrophobicContact CG-CG2 4.07Å; I301-T407 HydrophobicContact CD1-CG2 3.6Å; I301-T407 HydrophobicContact CG1-CG2 4.02Å; F403-T407 WeakPolarHBondContact O-CG2 3.25Å; F403-T407 PolarHBondContact O-N 3.39Å; F403-T407 VanDerWaalsContact O-N 3.08Å; F403-T407 PolarHBondContact O-OG1 2.88Å; Y404-T407 WeakPolarHBondContact CA-OG1 3.37Å; Y404-T407 PolarHBondContact O-N 3.17Å; Y404-T407 PolarHBondContact O-OG1 3.01Å; T407-R410 PolarHBondContact O-N 3.33Å; T407-A411 WeakPolarHBondContact O-CB 3.24Å; T407-A411 PolarHBondContact O-N 3.02Å
408	Q	83.1	Confident	76.2	Confident	91 Å²	91	89.3 Å²	89.3	43%	0.425	45%	0.451	S	S	.	.	H	α-helix	trans	-66.7	-43.3	175.8	-167.6	-171.7	25.1	0	0	112.1	Y404 S405 R410 A411 K412	Y404-Q408 WeakPolarHBondContact O-CB 3.27Å; Y404-Q408 PolarHBondContact O-N 3.14Å; S405-Q408 PolarHBondContact O-N 3.07Å; Q408-R410 VanDerWaalsContact C-N 3.3Å; Q408-R410 PolarHBondContact O-N 3.27Å; Q408-A411 PolarHBondContact O-N 3.4Å; Q408-K412 WeakPolarHBondContact O-CG 3.45Å; Q408-K412 PolarHBondContact O-N 3.32Å
409	A	82.2	Confident	74.4	Confident	53 Å²	53	92.1 Å²	92.1	44%	0.438	45%	0.45	S	S	.	.	H	α-helix	trans	-60.5	-42.1	175.7	0	0	0	0	0	110.9	S405 K412 L413	S405-A409 VanDerWaalsContact O-CB 3.29Å; S405-A409 WeakPolarHBondContact O-CB 3.31Å; S405-A409 PolarHBondContact O-N 3.08Å; A409-K412 PolarHBondContact O-N 2.85Å; A409-L413 PolarHBondContact O-N 3.45Å
410	R	74.3	Confident	72.8	Confident	37 Å²	37	95.8 Å²	95.8	14%	0.14	47%	0.473	C	S	.	.	H	α-helix	trans	-65.1	-39.7	175.1	-73.5	174.6	68.7	90.4	1.8	113	D100 D103 H406 T407 Q408 K412 L413	D100-R410 IonicContact OD1-CZ 2.58Å; D100-R410 IonicContact OD1-NH1 3.3Å; D100-R410 PolarHBondContact OD1-NH1 3.37Å; D100-R410 IonicContact OD1-NH2 3.39Å; D100-R410 PolarHBondContact OD1-NH2 2.67Å; D103-R410 IonicContact OD2-CZ 3.57Å; D103-R410 IonicContact OD2-NE 3.2Å; D103-R410 PolarHBondContact OD2-NE 2.73Å; D103-R410 IonicContact OD2-NH2 2.87Å; D103-R410 PolarHBondContact OD2-NH2 3.09Å; H406-R410 WeakPolarHBondContact O-CB 3.4Å; H406-R410 VanDerWaalsContact O-CG 3.22Å; H406-R410 WeakPolarHBondContact O-CG 3.32Å; H406-R410 PolarHBondContact O-N 2.98Å; T407-R410 PolarHBondContact O-N 3.33Å; Q408-R410 VanDerWaalsContact C-N 3.3Å; Q408-R410 PolarHBondContact O-N 3.27Å; R410-K412 PolarHBondContact O-N 3.44Å; R410-L413 PolarHBondContact O-N 3.3Å
411	A	75	Confident	71.2	Confident	88 Å²	88	95 Å²	95	73%	0.727	47%	0.472	S	S	*	.	H	α-helix	trans	-62.1	-23.5	176.5	0	0	0	0	0	113	T407 Q408	T407-A411 WeakPolarHBondContact O-CB 3.24Å; T407-A411 PolarHBondContact O-N 3.02Å; Q408-A411 PolarHBondContact O-N 3.4Å
412	K	81.5	Confident	69.5	Low	157 Å²	157	96.3 Å²	96.3	68%	0.683	48%	0.477	S	S	*	.	H	α-helix	trans	-85.2	-18.2	175.4	-66.5	173.8	-179	176.9	0	113.7	Q408 A409 R410	Q408-K412 WeakPolarHBondContact O-CG 3.45Å; Q408-K412 PolarHBondContact O-N 3.32Å; A409-K412 PolarHBondContact O-N 2.85Å; R410-K412 PolarHBondContact O-N 3.44Å
413	L	75.1	Confident	68.1	Low	121 Å²	121	100 Å²	100	63%	0.634	50%	0.496	S	S	*	.	S	Bend	trans	-74.1	139.5	-179.5	-69.2	173.9	0	0	0	111.2	A409 R410 K415	A409-L413 PolarHBondContact O-N 3.45Å; R410-L413 PolarHBondContact O-N 3.3Å; L413-K415 PolarHBondContact O-N 2.89Å
414	P	68.1	Low	66.8	Low	85 Å²	85	105.7 Å²	105.7	55%	0.552	52%	0.523	S	S	*	.			trans	-65.8	126.7	178.5	25.9	-33.1	0	0	0	111.1	K416 R417	P414-K416 PolarHBondContact O-N 3.4Å; P414-R417 HydrophobicContact CG-CB 4.35Å; P414-R417 PolarHBondContact O-N 3.27Å
415	K	62.2	Low	65.4	Low	177 Å²	177	104.9 Å²	104.9	77%	0.77	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-49	-37	-176	-64.8	-170.1	176.8	-165.9	0	114.5	L413 R417 R418	L413-K415 PolarHBondContact O-N 2.89Å; K415-R417 VanDerWaalsContact C-N 3.29Å; K415-R417 PolarHBondContact O-N 2.69Å; K415-R418 WeakPolarHBondContact O-CB 3.35Å; K415-R418 PolarHBondContact O-N 3.03Å
416	K	54.8	Low	63.9	Low	209 Å²	209	103.9 Å²	103.9	91%	0.909	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-65.7	-24.5	-178.2	-82.6	-174.1	176.2	-178.4	0	114.3	P414	P414-K416 PolarHBondContact O-N 3.4Å
417	R	50.4	Low	62.7	Low	199 Å²	199	110.2 Å²	110.2	75%	0.751	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-88.7	-3.6	-178.1	-139.9	-177.7	-117.5	-104.6	4.8	113.1	P414 K415 R419 V420	P414-R417 HydrophobicContact CG-CB 4.35Å; P414-R417 PolarHBondContact O-N 3.27Å; K415-R417 VanDerWaalsContact C-N 3.29Å; K415-R417 PolarHBondContact O-N 2.69Å; R417-R419 VanDerWaalsContact C-N 3.25Å; R417-R419 PolarHBondContact O-N 3.47Å; R417-V420 HydrophobicContact CG-CG2 4.44Å; R417-V420 WeakPolarHBondContact O-CG2 3.44Å
418	R	53.7	Low	61.6	Low	97 Å²	97	115.5 Å²	115.5	37%	0.366	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	-24.2	-174.6	-155.4	176.6	-143.6	178.8	9.7	113.5	D103 D107 K415	D103-R418 VanDerWaalsContact CG-CZ 3.42Å; D103-R418 IonicContact OD1-CZ 2.85Å; D103-R418 IonicContact OD1-NH1 3.03Å; D103-R418 PolarHBondContact OD1-NH1 3.06Å; D103-R418 VanDerWaalsContact OD1-NH1 3.12Å; D103-R418 IonicContact OD1-NH2 3.84Å; D103-R418 PolarHBondContact OD1-NH2 3.46Å; D103-R418 IonicContact OD2-CZ 3.77Å; D103-R418 IonicContact OD2-NH1 3.32Å; D103-R418 IonicContact OD2-NH2 2.67Å; D103-R418 PolarHBondContact OD2-NH2 3.26Å; D107-R418 IonicContact OD2-CZ 3.22Å; D107-R418 IonicContact OD2-NH1 3.07Å; D107-R418 PolarHBondContact OD2-NH1 3.4Å; K415-R418 WeakPolarHBondContact O-CB 3.35Å; K415-R418 PolarHBondContact O-N 3.03Å
419	R	51.3	Low	60.3	Low	134 Å²	134	115.1 Å²	115.1	51%	0.506	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.4	65.8	178.5	-57.9	-177.9	-166.3	-147.2	15.9	110.1	D107 D110 R417 L421	D107-R419 PolarHBondContact O-NH2 2.98Å; D107-R419 VanDerWaalsContact O-NH2 3.16Å; D110-R419 IonicContact OD2-CZ 3.45Å; D110-R419 IonicContact OD2-NH1 3.16Å; D110-R419 PolarHBondContact OD2-NH1 2.85Å; D110-R419 IonicContact OD2-NH2 3.54Å; R417-R419 VanDerWaalsContact C-N 3.25Å; R417-R419 PolarHBondContact O-N 3.47Å; R419-L421 HydrophobicContact CB-CD1 4.35Å; R419-L421 PolarHBondContact O-N 3.34Å
420	V	48.9	Very low	59.2	Low	116 Å²	116	117.3 Å²	117.3	70%	0.703	57%	0.572	S	S	*	*			trans	-71.9	89.4	156.5	-143.1	0	0	0	0	104.4	R417	R417-V420 HydrophobicContact CG-CG2 4.44Å; R417-V420 WeakPolarHBondContact O-CG2 3.44Å
421	L	50.7	Low	58.2	Low	60 Å²	60	124.8 Å²	124.8	31%	0.314	60%	0.601	S	S	.	*			trans	-55.8	135.2	168.4	-80.4	100.2	0	0	0	106.5	R419 L423 Q425 A426	R419-L421 HydrophobicContact CB-CD1 4.35Å; R419-L421 PolarHBondContact O-N 3.34Å; L421-L423 PolarHBondContact O-N 3.47Å; L421-Q425 HydrophobicContact CB-CB 4.33Å; L421-Q425 HydrophobicContact CD2-CB 3.75Å; L421-A426 HydrophobicContact CB-CB 4.21Å
422	P	52.6	Low	57.2	Low	81 Å²	81	128.5 Å²	128.5	53%	0.526	60%	0.596	S	S	.	*			trans	-42.4	132.3	162.8	-28.5	33.6	0	0	0	109.3	E424 Q425 A426	P422-E424 PolarHBondContact O-N 3.26Å; P422-Q425 PolarHBondContact O-N 3.49Å; P422-A426 PolarHBondContact O-N 3.01Å; P422-A426 VanDerWaalsContact O-N 3.16Å
423	L	53.7	Low	55.9	Low	131 Å²	131	128.4 Å²	128.4	69%	0.686	60%	0.595	S	S	*	*	H	α-helix	trans	-47.6	-34	-174.8	-98.6	143.3	0	0	0	112.7	L421 R427	L421-L423 PolarHBondContact O-N 3.47Å; L423-R427 WeakPolarHBondContact O-CB 3.19Å; L423-R427 WeakPolarHBondContact O-CG 3.33Å; L423-R427 PolarHBondContact O-N 2.99Å
424	E	54.1	Low	54.8	Low	135 Å²	135	126 Å²	126	63%	0.631	59%	0.593	S	S	*	*	H	α-helix	trans	-57.1	-49.7	173	-126.4	68.1	-142	0	0	113.5	P422 R427 M428	P422-E424 PolarHBondContact O-N 3.26Å; E424-R427 PolarHBondContact O-N 2.88Å; E424-M428 PolarHBondContact O-N 2.67Å
425	Q	53.7	Low	54	Low	110 Å²	110	128 Å²	128	51%	0.514	60%	0.597	S	S	.	*	H	α-helix	trans	-72.1	-37.7	-178.2	-72.8	175.9	-18.5	0	0	111.2	L421 P422 M428 Q429	L421-Q425 HydrophobicContact CB-CB 4.33Å; L421-Q425 HydrophobicContact CD2-CB 3.75Å; P422-Q425 PolarHBondContact O-N 3.49Å; Q425-M428 PolarHBondContact O-N 2.97Å; Q425-Q429 PolarHBondContact O-N 2.87Å
426	A	55.5	Low	53.3	Low	34 Å²	34	121.8 Å²	121.8	28%	0.281	58%	0.584	S	S	.	*	H	α-helix	trans	-59.9	-46.8	173.2	0	0	0	0	0	110.9	L421 P422 M428 Q429 T430	L421-A426 HydrophobicContact CB-CB 4.21Å; P422-A426 PolarHBondContact O-N 3.01Å; P422-A426 VanDerWaalsContact O-N 3.16Å; A426-M428 PolarHBondContact O-N 3.42Å; A426-Q429 PolarHBondContact O-N 2.87Å; A426-T430 PolarHBondContact O-N 3.29Å; A426-T430 PolarHBondContact O-OG1 2.96Å
427	R	57.6	Low	53	Low	171 Å²	171	118 Å²	118	65%	0.645	57%	0.573	S	S	*	*	H	α-helix	trans	-61.1	-43.1	175.8	-78.3	177	174	174.8	-1.2	112.4	L423 E424 T430 R431	L423-R427 WeakPolarHBondContact O-CB 3.19Å; L423-R427 WeakPolarHBondContact O-CG 3.33Å; L423-R427 PolarHBondContact O-N 2.99Å; E424-R427 PolarHBondContact O-N 2.88Å; R427-T430 PolarHBondContact O-N 3.26Å; R427-R431 WeakPolarHBondContact O-CB 3.44Å; R427-R431 PolarHBondContact O-N 3.4Å
428	M	56.2	Low	52.6	Low	139 Å²	139	110.7 Å²	110.7	69%	0.685	56%	0.56	S	S	*	*	H	α-helix	trans	-62.4	-42.2	175.2	-88	-170.6	-178.9	0	0	112.4	E424 Q425 A426 R431 R432	E424-M428 PolarHBondContact O-N 2.67Å; Q425-M428 PolarHBondContact O-N 2.97Å; A426-M428 PolarHBondContact O-N 3.42Å; M428-R431 PolarHBondContact O-N 3.39Å; M428-R432 WeakPolarHBondContact O-CB 3.39Å; M428-R432 PolarHBondContact O-N 2.99Å
429	Q	55.8	Low	51.9	Low	83 Å²	83	112.2 Å²	112.2	39%	0.388	58%	0.58	S	S	.	*	H	α-helix	trans	-63.4	-44.7	175.7	-86.6	-173.1	-24.4	0	0	112	Q425 A426 R431 R432 K433	Q425-Q429 PolarHBondContact O-N 2.87Å; A426-Q429 PolarHBondContact O-N 2.87Å; Q429-R431 VanDerWaalsContact C-N 3.29Å; Q429-R431 PolarHBondContact O-N 3.46Å; Q429-R432 PolarHBondContact O-N 3.11Å; Q429-K433 PolarHBondContact O-N 3.15Å
430	T	57.5	Low	51	Low	99 Å²	99	108.9 Å²	108.9	61%	0.607	59%	0.588	S	S	*	*	H	α-helix	trans	-60.5	-41.7	175.6	-49.4	0	0	0	0	111	A426 R427 K433 A434	A426-T430 PolarHBondContact O-N 3.29Å; A426-T430 PolarHBondContact O-OG1 2.96Å; R427-T430 PolarHBondContact O-N 3.26Å; T430-K433 PolarHBondContact O-N 3.07Å; T430-A434 WeakPolarHBondContact O-CB 3.35Å; T430-A434 PolarHBondContact O-N 3.43Å
431	R	54.2	Low	50.3	Low	195 Å²	195	110.6 Å²	110.6	74%	0.736	59%	0.592	S	S	*	*	H	α-helix	trans	-66.1	-38.9	177.5	-145.6	-179.9	-154.4	-167.8	5.8	112.3	R427 M428 Q429 I435	R427-R431 WeakPolarHBondContact O-CB 3.44Å; R427-R431 PolarHBondContact O-N 3.4Å; M428-R431 PolarHBondContact O-N 3.39Å; Q429-R431 VanDerWaalsContact C-N 3.29Å; Q429-R431 PolarHBondContact O-N 3.46Å; R431-I435 WeakPolarHBondContact O-CD1 3.28Å; R431-I435 WeakPolarHBondContact O-CG1 3.49Å; R431-I435 PolarHBondContact O-N 3.3Å
432	R	54	Low	49.4	Very low	165 Å²	165	115.3 Å²	115.3	62%	0.623	62%	0.617	S	S	*	*	H	α-helix	trans	-64.3	-46.1	174.4	-97.5	-178.9	167.2	-177.3	-5.1	112.1	M428 Q429 A434 I435 G436	M428-R432 WeakPolarHBondContact O-CB 3.39Å; M428-R432 PolarHBondContact O-N 2.99Å; Q429-R432 PolarHBondContact O-N 3.11Å; R432-A434 VanDerWaalsContact C-N 3.35Å; R432-A434 PolarHBondContact O-N 3.23Å; R432-I435 PolarHBondContact O-N 3.32Å; R432-G436 PolarHBondContact O-N 3.46Å
433	K	53.6	Low	48.2	Very low	156 Å²	156	123.1 Å²	123.1	68%	0.678	64%	0.638	S	S	*	*	H	α-helix	trans	-61.6	-42.5	177	-77.1	-174.7	176	-177.4	0	112	Q429 T430 I435 G436 D437	Q429-K433 PolarHBondContact O-N 3.15Å; T430-K433 PolarHBondContact O-N 3.07Å; K433-I435 VanDerWaalsContact C-N 3.25Å; K433-I435 PolarHBondContact O-N 3.31Å; K433-G436 PolarHBondContact O-N 3.44Å; K433-D437 PolarHBondContact O-N 3.15Å; K433-D437 VanDerWaalsContact O-N 3.15Å
434	A	51.9	Low	47	Very low	71 Å²	71	119.5 Å²	119.5	59%	0.587	63%	0.632	S	S	*	*	H	α-helix	trans	-60.9	-33.2	177	0	0	0	0	0	113.1	T430 R432	T430-A434 WeakPolarHBondContact O-CB 3.35Å; T430-A434 PolarHBondContact O-N 3.43Å; R432-A434 VanDerWaalsContact C-N 3.35Å; R432-A434 PolarHBondContact O-N 3.23Å
435	I	52	Low	45.6	Very low	125 Å²	125	124.7 Å²	124.7	64%	0.641	65%	0.646	S	S	*	*	H	α-helix	trans	-75.4	-39.4	176.5	-67.1	165	0	0	0	111.1	R431 R432 K433 G438	R431-I435 WeakPolarHBondContact O-CD1 3.28Å; R431-I435 WeakPolarHBondContact O-CG1 3.49Å; R431-I435 PolarHBondContact O-N 3.3Å; R432-I435 PolarHBondContact O-N 3.32Å; K433-I435 VanDerWaalsContact C-N 3.25Å; K433-I435 PolarHBondContact O-N 3.31Å; I435-G438 PolarHBondContact O-N 2.81Å
436	G	47.7	Very low	44.4	Very low	47 Å²	47	126 Å²	126	49%	0.485	66%	0.661	S	S	.	*	H	α-helix	trans	-67.9	-36.4	-178.1	0	0	0	0	0	114.7	R432 K433 G438 T439	R432-G436 PolarHBondContact O-N 3.46Å; K433-G436 PolarHBondContact O-N 3.44Å; G436-G438 VanDerWaalsContact C-N 3.28Å; G436-G438 PolarHBondContact O-N 3.47Å; G436-T439 PolarHBondContact O-OG1 3.15Å
437	D	49	Very low	43.1	Very low	129 Å²	129	129.6 Å²	129.6	69%	0.69	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-75.3	-16.7	178.6	-81.8	-21.8	0	0	0	113.2	K433 T439	K433-D437 PolarHBondContact O-N 3.15Å; K433-D437 VanDerWaalsContact O-N 3.15Å; D437-T439 VanDerWaalsContact C-N 3.31Å; D437-T439 PolarHBondContact O-N 3.29Å
438	G	41.4	Very low	41.5	Very low	46 Å²	46	125.7 Å²	125.7	47%	0.474	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-69.5	-21.4	-176.7	0	0	0	0	0	114.9	I435 G436	I435-G438 PolarHBondContact O-N 2.81Å; G436-G438 VanDerWaalsContact C-N 3.28Å; G436-G438 PolarHBondContact O-N 3.47Å
439	T	39.8	Very low	40.1	Very low	129 Å²	129	122.6 Å²	122.6	79%	0.791	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-90.1	-8.8	-177.2	42.3	0	0	0	0	114.4	G436 D437	G436-T439 PolarHBondContact O-OG1 3.15Å; D437-T439 VanDerWaalsContact C-N 3.31Å; D437-T439 PolarHBondContact O-N 3.29Å
440	G	31.7	Very low	38.5	Very low	65 Å²	65	128.2 Å²	128.2	67%	0.67	73%	0.725	S	S	*	*	S	Bend	trans	-92	-17.5	-174.8	0	0	0	0	0	116.4
441	L	33.1	Very low	37.1	Very low	151 Å²	151	135.3 Å²	135.3	79%	0.791	74%	0.74	S	S	*	*	S	Bend	trans	-113	4.4	-165.2	-71.1	174.5	0	0	0	116	Y443	L441-Y443 VanDerWaalsContact C-N 3.28Å; L441-Y443 PolarHBondContact O-N 3.15Å
442	L	31.9	Very low	35.7	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	14.4	-177.7	-78.7	169.8	0	0	0	115.7
443	Y	27.7	Very low	34.3	Very low	244 Å²	244	132.9 Å²	132.9	96%	0.957	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	39.2	168.8	-117.6	-95	0	0	0	112.2	L441	L441-Y443 VanDerWaalsContact C-N 3.28Å; L441-Y443 PolarHBondContact O-N 3.15Å
444	G	27.8	Very low	33.1	Very low	55 Å²	55	135.5 Å²	135.5	57%	0.567	77%	0.769	S	S	*	*			trans	-105.3	93.6	173.6	0	0	0	0	0	111.6	V446	G444-V446 PolarHBondContact O-N 3.38Å; G444-V446 VanDerWaalsContact O-N 3.15Å
445	R	25.4	Very low	31.8	Very low	244 Å²	244	135.7 Å²	135.7	92%	0.921	78%	0.778	S	S	*	*			trans	-36	107.5	170.9	-172.3	-177.3	-136.3	171.7	3.1	113.2	P447	R445-P447 WeakPolarHBondContact O-CD 3.39Å
446	V	29.2	Very low	30.5	Very low	137 Å²	137	133.3 Å²	133.3	83%	0.83	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-84.2	117.7	170.1	-179.2	0	0	0	0	109	G444	G444-V446 PolarHBondContact O-N 3.38Å; G444-V446 VanDerWaalsContact O-N 3.15Å
447	P	27.7	Very low	29.5	Very low	111 Å²	111	138.7 Å²	138.7	72%	0.721	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.2	139	171.8	-8.3	25.8	0	0	0	110	R445 G449	R445-P447 WeakPolarHBondContact O-CD 3.39Å; P447-G449 PolarHBondContact O-N 3.37Å
448	G	24.9	Very low	28.6	Very low	89 Å²	89	140.2 Å²	140.2	92%	0.918	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-52.5	128.3	-174.3	0	0	0	0	0	114.4
449	G	25.6	Very low	27.9	Very low	73 Å²	73	146.8 Å²	146.8	75%	0.753	83%	0.827	S	S	*	*			trans	-140	102.9	165.5	0	0	0	0	0	108.2	P447 R451	P447-G449 PolarHBondContact O-N 3.37Å; G449-R451 PolarHBondContact O-N 3.08Å
450	Q	23.4	Very low	27.2	Very low	201 Å²	201	147 Å²	147	94%	0.939	83%	0.828	S	S	*	*			trans	-61.7	118.1	170.2	-75.2	160.2	-44.9	0	0	108.6
451	R	26.2	Very low	26.9	Very low	248 Å²	248	152.1 Å²	152.1	94%	0.936	84%	0.835	S	S	*	*			trans	-143.6	133.9	159.2	-129.6	177.3	-176.4	-174.3	0.8	111	G449	G449-R451 PolarHBondContact O-N 3.08Å
452	E	26.2	Very low	26.7	Very low	191 Å²	191	150.2 Å²	150.2	89%	0.893	83%	0.831	S	S	*	*			trans	-69.6	145.8	-159.4	-65.9	164.6	135	0	0	114.1	K454	E452-K454 PolarHBondContact O-N 3.2Å
453	S	23.7	Very low	26.5	Very low	118 Å²	118	150.7 Å²	150.7	83%	0.825	83%	0.833	S	S	*	*			trans	-58.7	115.9	173	169.7	0	0	0	0	112.2
454	K	29	Very low	26.6	Very low	211 Å²	211	146.9 Å²	146.9	92%	0.917	83%	0.828	S	S	*	*			trans	-115.6	102.1	152.7	-80.4	-169.4	175.6	-176.3	0	108.1	E452	E452-K454 PolarHBondContact O-N 3.2Å
455	G	24.4	Very low	26.8	Very low	76 Å²	76	149.4 Å²	149.4	78%	0.784	84%	0.837	S	S	*	*			trans	-73.9	121.9	174.8	0	0	0	0	0	111.1
456	G	25.7	Very low	27.2	Very low	74 Å²	74	141.3 Å²	141.3	76%	0.763	82%	0.818	S	S	*	*			trans	-137.4	95.7	160.6	0	0	0	0	0	105.9	D458	G456-D458 PolarHBondContact O-N 3.34Å
457	L	26.1	Very low	27.7	Very low	161 Å²	161	139.7 Å²	139.7	84%	0.843	81%	0.81	S	S	*	*			trans	-89.7	92.2	178.9	-79.7	154.6	0	0	0	107.5
458	D	30.4	Very low	28.3	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	82%	0.815	S	S	*	*			trans	-87.2	104	158.7	-72.7	-28.5	0	0	0	107	G456 V460	G456-D458 PolarHBondContact O-N 3.34Å; D458-V460 PolarHBondContact O-N 3.18Å
459	E	25.1	Very low	29	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	81%	0.809	S	S	*	*			trans	-63.6	100	178.3	-72.3	177.7	147.5	0	0	110.3
460	V	26.5	Very low	30.1	Very low	132 Å²	132	152.6 Å²	152.6	80%	0.8	80%	0.803	S	S	*	*			trans	-90.7	102.4	163.6	-180	0	0	0	0	107.3	D458	D458-V460 PolarHBondContact O-N 3.18Å
461	E	24.7	Very low	31.3	Very low	174 Å²	174	152.2 Å²	152.2	81%	0.813	79%	0.793	S	S	*	*			trans	-55.4	124.2	174.4	-82.3	-172.2	143.3	0	0	110.7	I463	E461-I463 PolarHBondContact O-N 2.98Å
462	P	28.4	Very low	32.3	Very low	110 Å²	110	148.8 Å²	148.8	71%	0.714	78%	0.781	S	S	*	*			trans	-72.2	121.9	175.8	27.5	-29.6	0	0	0	109.1	L464	P462-L464 PolarHBondContact O-N 3.32Å
463	I	29.1	Very low	33.1	Very low	171 Å²	171	142 Å²	142	88%	0.877	76%	0.757	S	S	*	*			trans	-54.1	101.1	171.6	-60.9	168.3	0	0	0	108.1	E461 S465	E461-I463 PolarHBondContact O-N 2.98Å; I463-S465 PolarHBondContact O-N 3.18Å
464	L	29.1	Very low	34.7	Very low	163 Å²	163	142.8 Å²	142.8	85%	0.853	75%	0.748	S	S	*	*			trans	-56.2	106.7	177.1	-81.8	156.9	0	0	0	109.3	P462 S466	P462-L464 PolarHBondContact O-N 3.32Å; L464-S466 PolarHBondContact O-N 3.09Å; L464-S466 VanDerWaalsContact O-N 3.1Å
465	S	31.5	Very low	36	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	74%	0.738	S	S	*	*			trans	-56.4	112.9	164.8	45.4	0	0	0	0	108.2	I463	I463-S465 PolarHBondContact O-N 3.18Å
466	S	34.2	Very low	37.7	Very low	73 Å²	73	141.8 Å²	141.8	51%	0.51	72%	0.723	S	S	.	*			trans	-57.5	130.5	-172.7	75.2	0	0	0	0	111.2	L464 R468	L464-S466 PolarHBondContact O-N 3.09Å; L464-S466 VanDerWaalsContact O-N 3.1Å; S466-R468 PolarHBondContact O-N 3.23Å
467	P	39.2	Very low	39.3	Very low	103 Å²	103	143 Å²	143	67%	0.669	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	5.7	-180	-19.1	31.4	0	0	0	114.8
468	R	41.4	Very low	40.9	Very low	217 Å²	217	138 Å²	138	82%	0.819	69%	0.693	S	S	*	*	H	α-helix	trans	-80.5	-24.5	-176.5	-73.3	-170.5	-178.9	-176.5	2.1	113.5	S466	S466-R468 PolarHBondContact O-N 3.23Å
469	R	39.7	Very low	42.2	Very low	212 Å²	212	135 Å²	135	80%	0.8	68%	0.677	S	S	*	*	H	α-helix	trans	-75	-35.1	179.5	-76.1	-171.7	177.9	-162.6	-0.1	113	R471 Y472 A473	R469-R471 PolarHBondContact O-N 3.16Å; R469-Y472 PolarHBondContact O-N 3.39Å; R469-A473 PolarHBondContact O-N 2.93Å
470	D	48.3	Very low	43.3	Very low	116 Å²	116	129 Å²	129	62%	0.62	66%	0.659	S	S	*	*	H	α-helix	trans	-69.4	-35.2	-179	-79.8	-14.7	0	0	0	113.4	Y472 A473 Q474	D470-Y472 VanDerWaalsContact C-N 3.3Å; D470-Y472 PolarHBondContact O-N 2.94Å; D470-A473 PolarHBondContact O-N 3.35Å; D470-Q474 WeakPolarHBondContact O-CB 3.39Å; D470-Q474 WeakPolarHBondContact O-CG 3.46Å; D470-Q474 PolarHBondContact O-N 3.25Å
471	R	48.6	Very low	44.5	Very low	193 Å²	193	129.3 Å²	129.3	73%	0.728	65%	0.649	S	S	*	*	H	α-helix	trans	-66.4	-32.7	176.1	-66.8	-164.7	-158	-170.4	5.6	112.5	R469 R475	R469-R471 PolarHBondContact O-N 3.16Å; R471-R475 VanDerWaalsContact O-CB 3.32Å; R471-R475 WeakPolarHBondContact O-CB 3.24Å; R471-R475 PolarHBondContact O-N 3.32Å; R471-R475 VanDerWaalsContact O-N 3.11Å
472	Y	46.5	Very low	45.8	Very low	176 Å²	176	124.3 Å²	124.3	69%	0.69	63%	0.633	S	S	*	*	H	α-helix	trans	-70.5	-47.1	178.2	-171.8	-98.2	0	0	0	111.1	R469 D470 Q474 R475 V476	R469-Y472 PolarHBondContact O-N 3.39Å; D470-Y472 VanDerWaalsContact C-N 3.3Å; D470-Y472 PolarHBondContact O-N 2.94Å; Y472-Q474 PolarHBondContact O-N 3.15Å; Y472-R475 PolarHBondContact O-N 2.88Å; Y472-V476 HydrophobicContact CD1-CG2 4.18Å; Y472-V476 HydrophobicContact CE1-CG2 3.84Å; Y472-V476 WeakPolarHBondContact O-CG2 3.23Å; Y472-V476 PolarHBondContact O-N 3.08Å
473	A	44.7	Very low	46.7	Very low	47 Å²	47	122.9 Å²	122.9	39%	0.388	62%	0.623	S	S	.	*	H	α-helix	trans	-61.3	-44.1	177.6	0	0	0	0	0	112.2	R469 D470 R475 V476 I477	R469-A473 PolarHBondContact O-N 2.93Å; D470-A473 PolarHBondContact O-N 3.35Å; A473-R475 VanDerWaalsContact C-N 3.32Å; A473-R475 PolarHBondContact O-N 3.06Å; A473-V476 PolarHBondContact O-N 2.8Å; A473-I477 WeakPolarHBondContact O-CG1 3.48Å; A473-I477 PolarHBondContact O-N 3.07Å
474	Q	56	Low	47.5	Very low	136 Å²	136	120.5 Å²	120.5	64%	0.636	61%	0.611	S	S	*	*	H	α-helix	trans	-63	-36.7	176.1	-76.9	178.1	-7.9	0	0	112.6	D470 Y472 I477 A478	D470-Q474 WeakPolarHBondContact O-CB 3.39Å; D470-Q474 WeakPolarHBondContact O-CG 3.46Å; D470-Q474 PolarHBondContact O-N 3.25Å; Y472-Q474 PolarHBondContact O-N 3.15Å; Q474-I477 PolarHBondContact O-N 3.46Å; Q474-A478 WeakPolarHBondContact O-CB 3.39Å; Q474-A478 PolarHBondContact O-N 3.42Å
475	R	56.8	Low	48.5	Very low	190 Å²	190	121.7 Å²	121.7	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-70.5	-37	178.8	-152.7	173	-164.2	179.7	3.3	112.3	R471 Y472 A473 N479	R471-R475 VanDerWaalsContact O-CB 3.32Å; R471-R475 WeakPolarHBondContact O-CB 3.24Å; R471-R475 PolarHBondContact O-N 3.32Å; R471-R475 VanDerWaalsContact O-N 3.11Å; Y472-R475 PolarHBondContact O-N 2.88Å; A473-R475 VanDerWaalsContact C-N 3.32Å; A473-R475 PolarHBondContact O-N 3.06Å; R475-N479 WeakPolarHBondContact O-CB 3.15Å; R475-N479 PolarHBondContact O-N 3.12Å
476	V	60.9	Low	49.2	Very low	76 Å²	76	119.2 Å²	119.2	46%	0.461	59%	0.592	S	S	.	*	H	α-helix	trans	-65.3	-43.1	174.2	174.4	0	0	0	0	110.8	Y472 A473 A480	Y472-V476 HydrophobicContact CD1-CG2 4.18Å; Y472-V476 HydrophobicContact CE1-CG2 3.84Å; Y472-V476 WeakPolarHBondContact O-CG2 3.23Å; Y472-V476 PolarHBondContact O-N 3.08Å; A473-V476 PolarHBondContact O-N 2.8Å; V476-A480 WeakPolarHBondContact O-CB 3.35Å; V476-A480 PolarHBondContact O-N 3.09Å
477	I	59	Low	49.6	Very low	99 Å²	99	123.6 Å²	123.6	51%	0.508	60%	0.602	S	S	.	*	H	α-helix	trans	-67.6	-40.7	178.1	-64.8	167.2	0	0	0	111.5	A473 Q474 A480 K481	A473-I477 WeakPolarHBondContact O-CG1 3.48Å; A473-I477 PolarHBondContact O-N 3.07Å; Q474-I477 PolarHBondContact O-N 3.46Å; I477-A480 PolarHBondContact O-N 3.19Å; I477-K481 PolarHBondContact O-N 2.96Å
478	A	59.5	Low	49.8	Very low	56 Å²	56	124.7 Å²	124.7	46%	0.463	60%	0.602	S	S	.	*	H	α-helix	trans	-64.7	-42.4	177.7	0	0	0	0	0	112.1	Q474 K481 S482	Q474-A478 WeakPolarHBondContact O-CB 3.39Å; Q474-A478 PolarHBondContact O-N 3.42Å; A478-K481 PolarHBondContact O-N 3.08Å; A478-S482 PolarHBondContact O-N 2.77Å
479	N	57.4	Low	49.8	Very low	98 Å²	98	118.8 Å²	118.8	52%	0.524	59%	0.594	S	S	.	*	H	α-helix	trans	-64.1	-45.4	175.1	-80.8	-2.1	0	0	0	111.2	R475 K481 S482 T483	R475-N479 WeakPolarHBondContact O-CB 3.15Å; R475-N479 PolarHBondContact O-N 3.12Å; N479-K481 VanDerWaalsContact C-N 3.31Å; N479-K481 PolarHBondContact O-N 3.08Å; N479-S482 PolarHBondContact O-N 3.2Å; N479-S482 VanDerWaalsContact O-N 3.14Å; N479-S482 PolarHBondContact O-OG 3.09Å; N479-T483 PolarHBondContact O-N 2.86Å; N479-T483 PolarHBondContact O-OG1 3.2Å
480	A	47.6	Very low	49.9	Very low	58 Å²	58	114.6 Å²	114.6	48%	0.479	59%	0.592	S	S	.	*	H	α-helix	trans	-59	-39.9	177.6	0	0	0	0	0	112.6	V476 I477 T483 L484	V476-A480 WeakPolarHBondContact O-CB 3.35Å; V476-A480 PolarHBondContact O-N 3.09Å; I477-A480 PolarHBondContact O-N 3.19Å; A480-T483 PolarHBondContact O-N 3.45Å; A480-L484 PolarHBondContact O-N 3.26Å; A480-L484 VanDerWaalsContact O-N 3.08Å
481	K	51.7	Low	49.4	Very low	139 Å²	139	113.7 Å²	113.7	60%	0.604	59%	0.594	S	S	*	*	H	α-helix	trans	-66.2	-40.7	175.1	-78.7	-175.4	176.6	-177.6	0	112.7	I477 A478 N479 T483 L484 Y485	I477-K481 PolarHBondContact O-N 2.96Å; A478-K481 PolarHBondContact O-N 3.08Å; N479-K481 VanDerWaalsContact C-N 3.31Å; N479-K481 PolarHBondContact O-N 3.08Å; K481-T483 VanDerWaalsContact C-N 3.33Å; K481-T483 PolarHBondContact O-N 3.43Å; K481-L484 PolarHBondContact O-N 3.4Å; K481-Y485 WeakPolarHBondContact O-CD2 3.19Å; K481-Y485 PolarHBondContact O-N 3.3Å; K481-Y485 VanDerWaalsContact O-N 3.11Å
482	S	51.3	Low	48.8	Very low	68 Å²	68	113.8 Å²	113.8	48%	0.476	60%	0.603	S	S	.	*	H	α-helix	trans	-65.2	-36.9	177.7	72	0	0	0	0	112.5	A478 N479 Y485 A486	A478-S482 PolarHBondContact O-N 2.77Å; N479-S482 PolarHBondContact O-N 3.2Å; N479-S482 VanDerWaalsContact O-N 3.14Å; N479-S482 PolarHBondContact O-OG 3.09Å; S482-Y485 PolarHBondContact O-N 2.81Å; S482-A486 PolarHBondContact O-N 3.43Å; S482-A486 VanDerWaalsContact O-N 3.09Å
483	T	49.2	Very low	48.2	Very low	80 Å²	80	110 Å²	110	49%	0.491	61%	0.608	S	S	.	*	H	α-helix	trans	-69.2	-35.2	175.7	-44.9	0	0	0	0	111.8	N479 A480 K481 A486 F487	N479-T483 PolarHBondContact O-N 2.86Å; N479-T483 PolarHBondContact O-OG1 3.2Å; A480-T483 PolarHBondContact O-N 3.45Å; K481-T483 VanDerWaalsContact C-N 3.33Å; K481-T483 PolarHBondContact O-N 3.43Å; T483-A486 PolarHBondContact O-N 3.28Å; T483-F487 PolarHBondContact O-N 3.4Å; T483-F487 VanDerWaalsContact O-N 3.11Å
484	L	45.5	Very low	47.6	Very low	121 Å²	121	117.3 Å²	117.3	63%	0.634	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-37.9	176.7	-148.7	84	0	0	0	112.2	A480 K481 F487 N488	A480-L484 PolarHBondContact O-N 3.26Å; A480-L484 VanDerWaalsContact O-N 3.08Å; K481-L484 PolarHBondContact O-N 3.4Å; L484-F487 PolarHBondContact O-N 3.35Å; L484-N488 PolarHBondContact O-N 2.92Å
485	Y	49	Very low	46.5	Very low	189 Å²	189	116.5 Å²	116.5	74%	0.741	64%	0.637	S	S	*	*	H	α-helix	trans	-69	-35.5	173.9	-90.4	-80.9	0	0	0	112.6	K481 S482 F487 N488	K481-Y485 WeakPolarHBondContact O-CD2 3.19Å; K481-Y485 PolarHBondContact O-N 3.3Å; K481-Y485 VanDerWaalsContact O-N 3.11Å; S482-Y485 PolarHBondContact O-N 2.81Å; Y485-F487 VanDerWaalsContact C-N 3.29Å; Y485-F487 PolarHBondContact O-N 3.49Å; Y485-N488 PolarHBondContact O-N 3.37Å
486	A	47.6	Very low	45.1	Very low	57 Å²	57	114 Å²	114	47%	0.471	64%	0.644	S	S	.	*	H	α-helix	trans	-68.4	-27.2	175.7	0	0	0	0	0	113.1	S482 T483 S489	S482-A486 PolarHBondContact O-N 3.43Å; S482-A486 VanDerWaalsContact O-N 3.09Å; T483-A486 PolarHBondContact O-N 3.28Å; A486-S489 PolarHBondContact O-OG 3.44Å
487	F	41.7	Very low	43.3	Very low	164 Å²	164	119 Å²	119	72%	0.719	66%	0.662	S	S	*	*	H	α-helix	trans	-76	-32.3	175.4	-109.8	-89	0	0	0	113	T483 L484 Y485 S489	T483-F487 PolarHBondContact O-N 3.4Å; T483-F487 VanDerWaalsContact O-N 3.11Å; L484-F487 PolarHBondContact O-N 3.35Å; Y485-F487 VanDerWaalsContact C-N 3.29Å; Y485-F487 PolarHBondContact O-N 3.49Å; F487-S489 VanDerWaalsContact C-N 3.29Å; F487-S489 PolarHBondContact O-N 3.44Å
488	N	42.7	Very low	41.7	Very low	127 Å²	127	120.4 Å²	120.4	68%	0.679	68%	0.675	S	S	*	*	H	α-helix	trans	-77.2	-10.6	179.9	-82.4	-8.6	0	0	0	114.2	L484 Y485	L484-N488 PolarHBondContact O-N 2.92Å; Y485-N488 PolarHBondContact O-N 3.37Å
489	S	41.4	Very low	39.9	Very low	92 Å²	92	126.4 Å²	126.4	64%	0.643	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	0.5	176.5	59.9	0	0	0	0	114.7	A486 F487	A486-S489 PolarHBondContact O-OG 3.44Å; F487-S489 VanDerWaalsContact C-N 3.29Å; F487-S489 PolarHBondContact O-N 3.44Å
490	V	42	Very low	38.1	Very low	124 Å²	124	129.7 Å²	129.7	75%	0.752	71%	0.707	S	S	*	*	S	Bend	trans	-104.6	0.4	-176.3	-176.5	0	0	0	0	113.5
491	S	38.2	Very low	37.1	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	72%	0.724	S	S	*	*			trans	-111.7	53.8	179.2	78.9	0	0	0	0	114.3
492	E	35.4	Very low	35.9	Very low	196 Å²	196	131.9 Å²	131.9	92%	0.916	73%	0.731	S	S	*	*			trans	-106.3	63.1	160.1	-77.7	-169.2	163.2	0	0	110.2
493	A	35.1	Very low	34.8	Very low	95 Å²	95	132.5 Å²	132.5	79%	0.785	75%	0.747	S	S	*	*			trans	-100.8	105.7	165.3	0	0	0	0	0	108.6
494	K	32.6	Very low	33.6	Very low	202 Å²	202	139.4 Å²	139.4	88%	0.878	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-56.8	132.9	-179.1	-78.5	175.4	176.6	173.2	0	111.5	T496	K494-T496 PolarHBondContact O-N 3.46Å
495	P	31.5	Very low	32.7	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-76.2	119.5	178.5	29.5	-31.8	0	0	0	111	Q497	P495-Q497 PolarHBondContact O-N 2.91Å
496	T	27	Very low	31.4	Very low	139 Å²	139	143.8 Å²	143.8	85%	0.853	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-68.1	117	166.6	28.1	0	0	0	0	110.2	K494	K494-T496 PolarHBondContact O-N 3.46Å
497	Q	24.3	Very low	30.1	Very low	179 Å²	179	147 Å²	147	84%	0.836	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.3	124.8	176.6	-67.8	-175.9	-4.7	0	0	111.1	P495	P495-Q497 PolarHBondContact O-N 2.91Å
498	V	24.2	Very low	29.1	Very low	130 Å²	130	146.6 Å²	146.6	79%	0.788	80%	0.803	S	S	*	*			trans	-118.2	111.3	164	-178.4	0	0	0	0	107.9
499	K	21.8	Very low	28.1	Very low	182 Å²	182	148.3 Å²	148.3	79%	0.791	81%	0.811	S	S	*	*			trans	-79	121.8	175.5	-87.2	177.2	173.6	174.1	0	109.6
500	L	21.2	Very low	27.1	Very low	166 Å²	166	150 Å²	150	87%	0.869	82%	0.817	S	S	*	*			trans	-108.1	120.3	164.2	-91.5	148.8	0	0	0	108.6
501	V	25.9	Very low	26.2	Very low	138 Å²	138	149 Å²	149	84%	0.836	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-87.2	130	-174.3	174.6	0	0	0	0	110
502	S	26.1	Very low	25.3	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-83	127.8	-178.2	114.9	0	0	0	0	111.6
503	G	28	Very low	24.8	Very low	80 Å²	80	145.1 Å²	145.1	83%	0.825	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-98.5	120.6	169.3	0	0	0	0	0	111.7
504	R	23.8	Very low	24.1	Very low	226 Å²	226	145.9 Å²	145.9	85%	0.853	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-78.1	136.2	175.6	-65.8	171.2	171.3	175.8	-3.4	110.2
505	H	27.5	Very low	23.7	Very low	192 Å²	192	141.1 Å²	141.1	89%	0.889	82%	0.822	S	S	*	*			trans	-155.2	111.7	142.2	-89.2	-68.2	0	0	0	109.5
506	K	20.7	Very low	23.3	Very low	210 Å²	210	140.7 Å²	140.7	91%	0.913	82%	0.822	S	S	*	*			trans	-96.4	125.5	167	-78.3	-178.8	174.1	-177.3	0	107.1
507	V	21.9	Very low	23.4	Very low	123 Å²	123	142.8 Å²	142.8	75%	0.745	83%	0.826	S	S	*	*			trans	-124.3	120.1	166.3	179.4	0	0	0	0	107.4	L509	V507-L509 HydrophobicContact CG1-CD1 4.23Å; V507-L509 HydrophobicContact CG1-CG 4.32Å
508	L	20.4	Very low	23.6	Very low	157 Å²	157	137.7 Å²	137.7	82%	0.822	82%	0.822	S	S	*	*			trans	-101.3	114.4	-178.6	-161.6	104	0	0	0	106.6
509	L	20.6	Very low	23.6	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	83%	0.83	S	S	*	*			trans	-119.9	96.5	175.5	-85.9	160.4	0	0	0	109	V507	V507-L509 HydrophobicContact CG1-CD1 4.23Å; V507-L509 HydrophobicContact CG1-CG 4.32Å
510	T	20.1	Very low	23.9	Very low	126 Å²	126	141.4 Å²	141.4	77%	0.773	83%	0.834	S	S	*	*			trans	-82.6	118	166.7	36.1	0	0	0	0	109.2
511	A	23.2	Very low	24.1	Very low	105 Å²	105	142.5 Å²	142.5	87%	0.868	83%	0.834	S	S	*	*			trans	-128.5	96.6	165.9	0	0	0	0	0	108.5
512	A	20.8	Very low	24.2	Very low	106 Å²	106	144.1 Å²	144.1	88%	0.876	84%	0.837	S	S	*	*			trans	-89.9	121.1	165.9	0	0	0	0	0	107.5
513	A	24.1	Very low	24.1	Very low	105 Å²	105	147.7 Å²	147.7	87%	0.868	84%	0.842	S	S	*	*			trans	-132.7	107	168	0	0	0	0	0	108.4
514	S	21.1	Very low	24	Very low	111 Å²	111	152.9 Å²	152.9	78%	0.776	85%	0.847	S	S	*	*			trans	-83	172.4	174.6	48.6	0	0	0	0	112.2
515	S	24.5	Very low	24.2	Very low	102 Å²	102	151.5 Å²	151.5	71%	0.713	85%	0.848	S	S	*	*			trans	82.7	105.1	169.3	73.1	0	0	0	0	114.9
516	S	22.9	Very low	24.1	Very low	109 Å²	109	151.3 Å²	151.3	76%	0.762	85%	0.847	S	S	*	*				62.9	102.1	69.8	78.6	0	0	0	0	112.5
517	L	28.2	Very low	24.7	Very low	182 Å²	182	150 Å²	150	95%	0.953	85%	0.847	S	S	*	*			trans	-169.1	125.7	156.2	-102.7	147.9	0	0	0	110.6
518	G	28	Very low	25.2	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	84%	0.842	S	S	*	*			trans	92.9	91.5	136.9	0	0	0	0	0	118.1
519	E	24.4	Very low	26	Very low	202 Å²	202	149.7 Å²	149.7	94%	0.944	87%	0.868	S	S	*	*			trans	-66.2	121.2	156.5	-67.9	170.1	142.2	0	0	109.9
520	E	28.6	Very low	26.3	Very low	188 Å²	188	149 Å²	149	88%	0.879	87%	0.868	S	S	*	*			trans	-112.6	117.3	161.9	-87.5	-173	151.8	0	0	109.5	L522	E520-L522 PolarHBondContact O-N 2.8Å
521	Q	25.5	Very low	26.6	Very low	188 Å²	188	150.2 Å²	150.2	88%	0.879	87%	0.873	S	S	*	*			trans	-67.3	111.6	178.5	-70.5	-170.8	-17.5	0	0	110.9	Q523	Q521-Q523 PolarHBondContact O-N 3.11Å
522	L	26.9	Very low	26.8	Very low	172 Å²	172	152.7 Å²	152.7	90%	0.901	87%	0.874	S	S	*	*			trans	-79.4	103.5	169.5	-99.2	141.3	0	0	0	109.9	E520 M524	E520-L522 PolarHBondContact O-N 2.8Å; L522-M524 PolarHBondContact O-N 2.87Å
523	Q	24.6	Very low	27.2	Very low	181 Å²	181	155.5 Å²	155.5	85%	0.846	87%	0.874	S	S	*	*			trans	-69.9	111.2	166.7	-81.6	179.2	-14.7	0	0	109.7	Q521 K525	Q521-Q523 PolarHBondContact O-N 3.11Å; Q523-K525 PolarHBondContact O-N 2.82Å
524	M	26.1	Very low	27.4	Very low	189 Å²	189	158.6 Å²	158.6	93%	0.931	87%	0.874	S	S	*	*			trans	-66.1	121.2	167.1	-70.5	-166.2	-152.5	0	0	109.4	L522	L522-M524 PolarHBondContact O-N 2.87Å
525	K	27.2	Very low	27.8	Very low	197 Å²	197	161.8 Å²	161.8	86%	0.857	88%	0.88	S	S	*	*			trans	-101.7	102.2	169.6	-150.9	173.6	-173.9	178.4	0	107.4	Q523 M527	Q523-K525 PolarHBondContact O-N 2.82Å; K525-M527 PolarHBondContact O-N 3.12Å
526	E	27.4	Very low	28	Very low	189 Å²	189	166.1 Å²	166.1	88%	0.883	89%	0.892	S	S	*	*			trans	-55.7	114.6	170.8	-70.6	174.1	148.8	0	0	109.1
527	M	32.7	Very low	28.4	Very low	183 Å²	183	170.5 Å²	170.5	90%	0.901	90%	0.902	S	S	*	*			trans	-95.1	112.1	159.5	-80.7	-169.8	-84.5	0	0	106.4	K525	K525-M527 PolarHBondContact O-N 3.12Å
528	G	32	Very low	28.5	Very low	63 Å²	63	169.5 Å²	169.5	65%	0.649	90%	0.898	S	S	*	*			trans	-62.3	176.6	175.2	0	0	0	0	0	113.1
529	P	38.2	Very low	28.5	Very low	209 Å²	209	178.3 Å²	178.3	100%	1.357	91%	0.911	S	S	*	*			trans	-60.9	0	-157.5	25.8	-35.9	0	0	0	115.7

Retrieved 529 of 529 residues in 356.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).