A0A087XB93_POEFO Loading...

Tetratricopeptide repeat domain 39C

AlphaFold DB , UniProt , Accession A0A087XB93, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 590 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	35.7	Very low	240 Å²	240	132.7 Å²	132.7	100%	1.182	85%	0.847	S	S	*	*				0	85.6	0	-72.5	177.4	163.8	0	0	105.9
2	A	38.3	Very low	35.5	Very low	106 Å²	106	130.8 Å²	130.8	88%	0.876	84%	0.84	S	S	*	*				63	94.3	74.7	0	0	0	0	0	112.8
3	D	31.6	Very low	35.1	Very low	156 Å²	156	135.3 Å²	135.3	83%	0.834	84%	0.843	S	S	*	*			trans	-157.4	121.8	132.9	-155.3	-7.7	0	0	0	110.5
4	P	41.4	Very low	34.9	Very low	103 Å²	103	138.1 Å²	138.1	67%	0.669	84%	0.842	S	S	*	*			trans	-109.7	127.1	179.3	35.2	-22.7	0	0	0	111.9
5	R	40.3	Very low	34.8	Very low	253 Å²	253	140.9 Å²	140.9	96%	0.955	84%	0.842	S	S	*	*			trans	-175.7	104.3	154.9	-104.4	157	-170.5	-161.5	4.5	111
6	A	33.3	Very low	34.7	Very low	105 Å²	105	144.5 Å²	144.5	87%	0.868	84%	0.843	S	S	*	*			trans	-148.6	120.5	151.1	0	0	0	0	0	108.2
7	A	32.2	Very low	35	Very low	99 Å²	99	143.8 Å²	143.8	82%	0.818	84%	0.841	S	S	*	*			trans	-63.7	137.8	-173.5	0	0	0	0	0	111.9
8	A	35.5	Very low	35.6	Very low	95 Å²	95	145.4 Å²	145.4	79%	0.785	84%	0.839	S	S	*	*			trans	-72.8	128	164.8	0	0	0	0	0	109.2	G10	A8-G10 PolarHBondContact O-N 2.91Å
9	P	36	Very low	37.1	Very low	122 Å²	122	147.2 Å²	147.2	79%	0.792	84%	0.839	S	S	*	*			trans	-81.3	100.6	163.4	30.2	-24.6	0	0	0	107.8	S11	P9-S11 PolarHBondContact O-N 2.79Å
10	G	34.9	Very low	39.2	Very low	81 Å²	81	142.8 Å²	142.8	84%	0.835	81%	0.812	S	S	*	*			trans	-70.4	109.6	152.1	0	0	0	0	0	107.9	A8	A8-G10 PolarHBondContact O-N 2.91Å
11	S	32.9	Very low	41.6	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	79%	0.794	S	S	*	*			trans	-120.1	100.3	155.3	55.5	0	0	0	0	106.5	P9 E13	P9-S11 PolarHBondContact O-N 2.79Å; S11-E13 PolarHBondContact O-N 3.01Å
12	S	32.8	Very low	44.3	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	75%	0.746	S	S	*	*			trans	-45.3	101.8	160.4	45.8	0	0	0	0	109.8	E14	S12-E14 PolarHBondContact O-N 3.48Å
13	E	31.3	Very low	46.9	Very low	190 Å²	190	125.3 Å²	125.3	89%	0.888	71%	0.708	S	S	*	*			trans	-65.7	94.8	151.8	-74.3	-177.2	162.7	0	0	105.7	S11 E15	S11-E13 PolarHBondContact O-N 3.01Å; E13-E15 PolarHBondContact O-N 3.21Å
14	E	32.2	Very low	49.9	Very low	175 Å²	175	124.3 Å²	124.3	82%	0.818	70%	0.698	S	S	*	*			trans	-58.2	95.9	157.1	-75.8	179.5	158.7	0	0	106.1	S12 K16	S12-E14 PolarHBondContact O-N 3.48Å; E14-K16 VanDerWaalsContact C-N 3.29Å; E14-K16 PolarHBondContact O-N 2.94Å
15	E	33.8	Very low	52.6	Low	180 Å²	180	120.6 Å²	120.6	84%	0.841	67%	0.672	S	S	*	*			trans	-48.1	102	158.4	-101.7	-179.8	159.3	0	0	106.3	E13 T17	E13-E15 PolarHBondContact O-N 3.21Å; E15-T17 PolarHBondContact O-N 3.4Å; E15-T17 PolarHBondContact O-OG1 3.17Å
16	K	32	Very low	55.3	Low	198 Å²	198	108.5 Å²	108.5	86%	0.861	63%	0.627	S	S	*	*			trans	-58.2	94.7	162.9	-79	179.9	178.9	175	0	105.5	E14 E18	E14-K16 VanDerWaalsContact C-N 3.29Å; E14-K16 PolarHBondContact O-N 2.94Å; K16-E18 VanDerWaalsContact C-N 3.29Å; K16-E18 PolarHBondContact O-N 3.16Å
17	T	39.7	Very low	58.3	Low	133 Å²	133	105.1 Å²	105.1	82%	0.816	59%	0.594	S	S	*	*			trans	-61.7	99	171.8	-26.3	0	0	0	0	105.3	E15 H19	E15-T17 PolarHBondContact O-N 3.4Å; E15-T17 PolarHBondContact O-OG1 3.17Å; T17-H19 PolarHBondContact O-N 3.42Å
18	E	46.2	Very low	61.4	Low	173 Å²	173	106 Å²	106	81%	0.808	58%	0.579	S	S	*	*			trans	-53.5	118	173.1	-78.7	-173	155.2	0	0	106.8	K16 I20	K16-E18 VanDerWaalsContact C-N 3.29Å; K16-E18 PolarHBondContact O-N 3.16Å; E18-I20 VanDerWaalsContact C-N 3.35Å; E18-I20 WeakPolarHBondContact O-CG1 3.48Å; E18-I20 PolarHBondContact O-N 3.09Å
19	H	64	Low	64.4	Low	178 Å²	178	101.5 Å²	101.5	82%	0.824	54%	0.542	S	S	*	.			trans	-69.5	96.3	178.4	179.9	-70.4	0	0	0	108.1	T17 N21	T17-H19 PolarHBondContact O-N 3.42Å; H19-N21 PolarHBondContact O-N 3.4Å
20	I	78.8	Confident	67.3	Low	59 Å²	59	95.7 Å²	95.7	30%	0.303	50%	0.504	S	S	.	.			trans	-66.2	124.3	-179.4	-56.1	-176.4	0	0	0	109.2	E18 L25 Y48	E18-I20 VanDerWaalsContact C-N 3.35Å; E18-I20 WeakPolarHBondContact O-CG1 3.48Å; E18-I20 PolarHBondContact O-N 3.09Å; I20-L25 HydrophobicContact CG2-CD2 3.7Å; I20-Y48 HydrophobicContact CD1-CD1 4.27Å; I20-Y48 HydrophobicContact CD1-CE1 3.5Å; I20-Y48 VanDerWaalsContact CD1-CE1 3.5Å
21	N	89.8	Confident	70.2	Confident	82 Å²	82	93.6 Å²	93.6	44%	0.439	47%	0.474	S	S	.	.			trans	-93.8	97.1	172.7	-178.1	-6.3	0	0	0	109.6	H19 A23 E24 L25	H19-N21 PolarHBondContact O-N 3.4Å; N21-A23 PolarHBondContact O-N 2.99Å; N21-A23 VanDerWaalsContact O-N 3.14Å; N21-A23 PolarHBondContact OD1-N 3.49Å; N21-E24 HydrophobicContact CB-CB 4.14Å; N21-E24 PolarHBondContact O-N 3.29Å; N21-E24 VanDerWaalsContact O-N 3.11Å; N21-L25 PolarHBondContact O-N 3.14Å
22	D	92.4	Very high	73.2	Confident	31 Å²	31	91.4 Å²	91.4	17%	0.166	45%	0.453	C	S	.	.	H	α-helix	trans	-53.5	-36.3	-177.2	-66.7	-13.9	0	0	0	114.2	L25 A26 H51 S52 L54 M55	D22-L25 PolarHBondContact O-N 3.42Å; D22-A26 WeakPolarHBondContact O-CB 3.19Å; D22-A26 PolarHBondContact O-N 2.96Å; D22-H51 IonicContact OD1-CD2 3.91Å; D22-H51 PolarHBondContact OD1-CD2 3.01Å; D22-H51 IonicContact OD1-NE2 2.69Å; D22-H51 IonicContact OD2-CD2 3.53Å; D22-S52 VanDerWaalsContact CG-OG 3.29Å; D22-S52 WeakPolarHBondContact OD2-CB 3.49Å; D22-S52 PolarHBondContact OD2-OG 3.46Å; D22-L54 HydrophobicContact CB-CD2 4.17Å; D22-M55 HydrophobicContact CB-CG 4.32Å
23	A	93.7	Very high	76.1	Confident	10 Å²	10	86.7 Å²	86.7	8%	0.083	42%	0.42	C	S	.	.	H	α-helix	trans	-66.2	-43.9	-179.1	0	0	0	0	0	111.7	N21 L27 L54	N21-A23 PolarHBondContact O-N 2.99Å; N21-A23 VanDerWaalsContact O-N 3.14Å; N21-A23 PolarHBondContact OD1-N 3.49Å; A23-L27 WeakPolarHBondContact O-CB 3.47Å; A23-L27 PolarHBondContact O-N 3.26Å; A23-L54 HydrophobicContact CB-CD2 4.33Å
24	E	95.3	Very high	79	Confident	134 Å²	134	78 Å²	78	63%	0.626	38%	0.379	S	S	*	.	H	α-helix	trans	-68.8	-41.3	177.1	-175	174.9	176.6	0	0	111	N21 L27 K28	N21-E24 HydrophobicContact CB-CB 4.14Å; N21-E24 PolarHBondContact O-N 3.29Å; N21-E24 VanDerWaalsContact O-N 3.11Å; E24-L27 PolarHBondContact O-N 3.29Å; E24-K28 WeakPolarHBondContact O-CB 3.33Å; E24-K28 PolarHBondContact O-N 2.92Å
25	L	96.8	Very high	82	Confident	25 Å²	25	72.3 Å²	72.3	13%	0.131	35%	0.354	C	S	.	.	H	α-helix	trans	-65.8	-42.4	178.3	-170.6	63.1	0	0	0	112.1	I20 N21 D22 K28 G29 L44 Y48 M55	I20-L25 HydrophobicContact CG2-CD2 3.7Å; N21-L25 PolarHBondContact O-N 3.14Å; D22-L25 PolarHBondContact O-N 3.42Å; L25-K28 WeakPolarHBondContact O-CB 3.4Å; L25-K28 PolarHBondContact O-N 3.49Å; L25-G29 PolarHBondContact O-N 3.47Å; L25-L44 HydrophobicContact CD1-CD1 3.91Å; L25-L44 HydrophobicContact CD1-CD2 4.39Å; L25-L44 HydrophobicContact CD1-CG 4.26Å; L25-L44 HydrophobicContact CG-CD2 4.18Å; L25-Y48 HydrophobicContact CD2-CD1 4.06Å; L25-Y48 HydrophobicContact CD2-CD2 3.62Å; L25-Y48 HydrophobicContact CD2-CE1 4.25Å; L25-Y48 HydrophobicContact CD2-CE2 3.81Å; L25-Y48 HydrophobicContact CD2-CG 3.74Å; L25-M55 HydrophobicContact CB-SD 4.4Å; L25-M55 HydrophobicContact CD2-CE 3.86Å; L25-M55 HydrophobicContact CD2-SD 4.37Å; L25-M55 HydrophobicContact CG-CE 3.91Å; L25-M55 HydrophobicContact CG-SD 4.42Å
26	A	97.3	Very high	84.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-64.4	-43	174.9	0	0	0	0	0	111.8	D22 K28 G29 I30 F45 L54 M55 M274	D22-A26 WeakPolarHBondContact O-CB 3.19Å; D22-A26 PolarHBondContact O-N 2.96Å; A26-K28 VanDerWaalsContact C-N 3.34Å; A26-K28 PolarHBondContact O-N 3.06Å; A26-G29 PolarHBondContact O-N 2.84Å; A26-I30 PolarHBondContact O-N 3.49Å; A26-F45 HydrophobicContact CB-CE1 4.15Å; A26-F45 WeakPolarHBondContact O-CZ 3.34Å; A26-L54 HydrophobicContact CB-CD2 4.29Å; A26-L54 HydrophobicContact CB-CG 4.18Å; A26-M55 HydrophobicContact CB-SD 3.91Å; A26-M274 HydrophobicContact CB-CB 3.94Å; A26-M274 HydrophobicContact CB-CE 4.39Å; A26-M274 HydrophobicContact CB-CG 4.45Å; A26-M274 HydrophobicContact CB-SD 3.95Å
27	L	97.6	Very high	87.8	Confident	34 Å²	34	57 Å²	57	18%	0.178	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-41.9	174.1	175.3	58.4	0	0	0	111.6	A23 E24 G29 I30 N31 P277	A23-L27 WeakPolarHBondContact O-CB 3.47Å; A23-L27 PolarHBondContact O-N 3.26Å; E24-L27 PolarHBondContact O-N 3.29Å; L27-G29 VanDerWaalsContact C-N 3.33Å; L27-G29 PolarHBondContact O-N 3.27Å; L27-I30 PolarHBondContact O-N 3.18Å; L27-N31 WeakPolarHBondContact CD1-ND2 3.42Å; L27-N31 PolarHBondContact O-N 3.31Å; L27-N31 PolarHBondContact O-ND2 3.34Å; L27-N31 VanDerWaalsContact O-ND2 3.11Å; L27-P277 HydrophobicContact CD1-CG 3.81Å
28	K	97.2	Very high	90.2	Very high	117 Å²	117	52 Å²	52	51%	0.509	26%	0.257	S	S	.	.	H	α-helix	trans	-57.9	-45.6	173.8	-172.6	-174.7	-173.7	-176	0	111.2	E24 L25 A26 I30 N31 M32	E24-K28 WeakPolarHBondContact O-CB 3.33Å; E24-K28 PolarHBondContact O-N 2.92Å; L25-K28 WeakPolarHBondContact O-CB 3.4Å; L25-K28 PolarHBondContact O-N 3.49Å; A26-K28 VanDerWaalsContact C-N 3.34Å; A26-K28 PolarHBondContact O-N 3.06Å; K28-I30 PolarHBondContact O-N 3.37Å; K28-N31 PolarHBondContact O-N 2.59Å; K28-M32 HydrophobicContact CD-CE 4.19Å; K28-M32 HydrophobicContact CG-CE 4.07Å; K28-M32 WeakPolarHBondContact O-CG 3.29Å; K28-M32 PolarHBondContact O-N 3.43Å
29	G	97.2	Very high	92.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.2	-44.3	176.6	0	0	0	0	0	113	L25 A26 L27 M32 L33 S41	L25-G29 PolarHBondContact O-N 3.47Å; A26-G29 PolarHBondContact O-N 2.84Å; L27-G29 VanDerWaalsContact C-N 3.33Å; L27-G29 PolarHBondContact O-N 3.27Å; G29-M32 WeakPolarHBondContact O-CB 3.2Å; G29-M32 PolarHBondContact O-N 3.11Å; G29-L33 PolarHBondContact O-N 3.44Å; G29-L33 VanDerWaalsContact O-N 3.14Å; G29-S41 WeakPolarHBondContact O-CB 3.29Å; G29-S41 PolarHBondContact O-OG 3.48Å
30	I	96.9	Very high	93.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.1	-37.7	176.5	-60.8	-56.8	0	0	0	112	A26 L27 K28 M32 L33 L34 F45 F61 M274 P277 L278	A26-I30 PolarHBondContact O-N 3.49Å; L27-I30 PolarHBondContact O-N 3.18Å; K28-I30 PolarHBondContact O-N 3.37Å; I30-M32 VanDerWaalsContact C-N 3.32Å; I30-M32 PolarHBondContact O-N 3.46Å; I30-L33 VanDerWaalsContact O-CB 3.31Å; I30-L33 WeakPolarHBondContact O-CB 3.47Å; I30-L33 PolarHBondContact O-N 3.29Å; I30-L34 PolarHBondContact O-N 2.87Å; I30-F45 HydrophobicContact CD1-CE2 4Å; I30-F45 HydrophobicContact CD1-CZ 4.03Å; I30-F45 HydrophobicContact CG1-CZ 4.21Å; I30-F61 HydrophobicContact CD1-CD1 3.82Å; I30-F61 HydrophobicContact CD1-CE1 3.84Å; I30-M274 HydrophobicContact CD1-CE 3.8Å; I30-M274 HydrophobicContact CG1-CB 4.03Å; I30-M274 HydrophobicContact CG1-CE 3.67Å; I30-P277 HydrophobicContact CG2-CB 3.95Å; I30-P277 HydrophobicContact CG2-CG 3.99Å; I30-L278 HydrophobicContact CG2-CD2 4.3Å; I30-L278 HydrophobicContact CG2-CG 4.36Å
31	N	96.7	Very high	94.6	Very high	38 Å²	38	43 Å²	43	20%	0.203	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-35	175.4	-77.7	-45.8	0	0	0	112.7	L27 K28 L34 N35 Y319	L27-N31 WeakPolarHBondContact CD1-ND2 3.42Å; L27-N31 PolarHBondContact O-N 3.31Å; L27-N31 PolarHBondContact O-ND2 3.34Å; L27-N31 VanDerWaalsContact O-ND2 3.11Å; K28-N31 PolarHBondContact O-N 2.59Å; N31-L34 PolarHBondContact O-N 3.13Å; N31-N35 WeakPolarHBondContact O-CB 3.34Å; N31-N35 PolarHBondContact O-N 2.95Å; N31-N35 PolarHBondContact O-ND2 2.7Å; N31-N35 VanDerWaalsContact O-ND2 3.11Å; N31-Y319 PolarHBondContact OD1-OH 2.94Å
32	M	95.7	Very high	94.8	Very high	54 Å²	54	41 Å²	41	27%	0.266	20%	0.202	S	C	.	.	H	α-helix	trans	-60.2	-49.7	170.7	-71.3	171.3	169	0	0	110.5	K28 G29 I30 L34 N35 G37 E40 L44	K28-M32 HydrophobicContact CD-CE 4.19Å; K28-M32 HydrophobicContact CG-CE 4.07Å; K28-M32 WeakPolarHBondContact O-CG 3.29Å; K28-M32 PolarHBondContact O-N 3.43Å; G29-M32 WeakPolarHBondContact O-CB 3.2Å; G29-M32 PolarHBondContact O-N 3.11Å; I30-M32 VanDerWaalsContact C-N 3.32Å; I30-M32 PolarHBondContact O-N 3.46Å; M32-L34 VanDerWaalsContact C-N 3.29Å; M32-L34 PolarHBondContact O-N 3.28Å; M32-N35 CarbonylContact O-C 3.5Å; M32-N35 PolarHBondContact O-N 2.93Å; M32-G37 CarbonylContact C-O 3.55Å; M32-G37 CarbonylContact O-C 3.45Å; M32-G37 VanDerWaalsContact O-CA 3.28Å; M32-G37 WeakPolarHBondContact O-CA 3.5Å; M32-G37 PolarHBondContact O-N 3.2Å; M32-E40 HydrophobicContact SD-CB 4.24Å; M32-L44 HydrophobicContact CE-CD1 4.21Å; M32-L44 HydrophobicContact SD-CD1 3.89Å
33	L	93.1	Very high	95	Very high	10 Å²	10	45.4 Å²	45.4	5%	0.052	22%	0.221	C	C	.	.	H	α-helix	trans	-52.8	-47.6	178.5	-171.3	76.9	0	0	0	111.5	G29 I30 N35 N36 F38 L65	G29-L33 PolarHBondContact O-N 3.44Å; G29-L33 VanDerWaalsContact O-N 3.14Å; I30-L33 VanDerWaalsContact O-CB 3.31Å; I30-L33 WeakPolarHBondContact O-CB 3.47Å; I30-L33 PolarHBondContact O-N 3.29Å; L33-N35 VanDerWaalsContact C-N 3.34Å; L33-N35 PolarHBondContact O-N 3.22Å; L33-N36 PolarHBondContact O-N 3.3Å; L33-F38 HydrophobicContact CD1-CB 4.44Å; L33-F38 HydrophobicContact CD1-CD1 3.24Å; L33-F38 HydrophobicContact CD1-CE1 3.59Å; L33-F38 HydrophobicContact CD1-CG 4.04Å; L33-F38 HydrophobicContact CG-CD1 4.06Å; L33-F38 HydrophobicContact CG-CE1 3.92Å; L33-F38 WeakPolarHBondContact O-CE2 3.43Å; L33-F38 VanDerWaalsContact O-CZ 3.28Å; L33-F38 WeakPolarHBondContact O-CZ 3.46Å; L33-L65 HydrophobicContact CD2-CD1 3.72Å
34	L	93.7	Very high	95.1	Very high	6 Å²	6	45.8 Å²	45.8	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-74.6	-22.3	-178.5	-61.8	-162	0	0	0	113.7	I30 N31 M32 N36 P277 L281 Y319 S322 L324 F325	I30-L34 PolarHBondContact O-N 2.87Å; N31-L34 PolarHBondContact O-N 3.13Å; M32-L34 VanDerWaalsContact C-N 3.29Å; M32-L34 PolarHBondContact O-N 3.28Å; L34-N36 VanDerWaalsContact C-N 3.27Å; L34-N36 PolarHBondContact O-N 2.82Å; L34-P277 HydrophobicContact CD1-CB 3.39Å; L34-P277 HydrophobicContact CG-CB 4.4Å; L34-L281 HydrophobicContact CD1-CD1 3.84Å; L34-L281 HydrophobicContact CD1-CG 4.17Å; L34-L281 HydrophobicContact CD2-CD1 3.64Å; L34-L281 HydrophobicContact CG-CD1 4.42Å; L34-Y319 HydrophobicContact CB-CD1 4.16Å; L34-Y319 HydrophobicContact CB-CE1 3.86Å; L34-Y319 HydrophobicContact CD1-CE1 4.14Å; L34-S322 WeakPolarHBondContact O-CB 3.4Å; L34-S322 PolarHBondContact O-OG 3.21Å; L34-L324 HydrophobicContact CD2-CD1 3.93Å; L34-F325 HydrophobicContact CD1-CE2 4.41Å
35	N	95.1	Very high	95.2	Very high	57 Å²	57	39.4 Å²	39.4	31%	0.305	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	34.1	175.2	-78	-55.6	0	0	0	112.6	N31 M32 L33 G37 T318 Y319	N31-N35 WeakPolarHBondContact O-CB 3.34Å; N31-N35 PolarHBondContact O-N 2.95Å; N31-N35 PolarHBondContact O-ND2 2.7Å; N31-N35 VanDerWaalsContact O-ND2 3.11Å; M32-N35 CarbonylContact O-C 3.5Å; M32-N35 PolarHBondContact O-N 2.93Å; L33-N35 VanDerWaalsContact C-N 3.34Å; L33-N35 PolarHBondContact O-N 3.22Å; N35-G37 PolarHBondContact O-N 3.5Å; N35-G37 VanDerWaalsContact O-N 3.15Å; N35-T318 PolarHBondContact ND2-O 3.12Å; N35-Y319 WeakPolarHBondContact ND2-CD1 3.46Å; N35-Y319 WeakPolarHBondContact OD1-CA 3.42Å
36	N	94.1	Very high	95.1	Very high	45 Å²	45	44.2 Å²	44.2	24%	0.241	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	4.6	179.2	-41.8	-43.7	0	0	0	115.8	L33 L34 F38 N321 S323	L33-N36 PolarHBondContact O-N 3.3Å; L34-N36 VanDerWaalsContact C-N 3.27Å; L34-N36 PolarHBondContact O-N 2.82Å; N36-F38 VanDerWaalsContact C-N 3.3Å; N36-F38 WeakPolarHBondContact O-CD2 3.2Å; N36-F38 PolarHBondContact O-N 3.35Å; N36-F38 VanDerWaalsContact O-N 3.12Å; N36-N321 PolarHBondContact ND2-O 3.5Å; N36-S323 WeakPolarHBondContact OD1-CB 3.22Å; N36-S323 PolarHBondContact OD1-N 3.09Å; N36-S323 PolarHBondContact OD1-OG 3.46Å
37	G	93.6	Very high	95.1	Very high	11 Å²	11	49.1 Å²	49.1	11%	0.113	24%	0.242	C	C	.	.			trans	-86.3	59.9	177	0	0	0	0	0	112.7	M32 N35 E40 S41	M32-G37 CarbonylContact C-O 3.55Å; M32-G37 CarbonylContact O-C 3.45Å; M32-G37 VanDerWaalsContact O-CA 3.28Å; M32-G37 WeakPolarHBondContact O-CA 3.5Å; M32-G37 PolarHBondContact O-N 3.2Å; N35-G37 PolarHBondContact O-N 3.5Å; N35-G37 VanDerWaalsContact O-N 3.15Å; G37-E40 WeakPolarHBondContact CA-OE2 3.44Å; G37-S41 VanDerWaalsContact O-CB 3.24Å; G37-S41 WeakPolarHBondContact O-CB 3.24Å; G37-S41 PolarHBondContact O-N 2.82Å
38	F	89.6	Confident	95	Very high	27 Å²	27	51.1 Å²	51.1	12%	0.118	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-40.3	-174.9	-71.2	-95.8	0	0	0	112.8	L33 N36 D42 Q356 I359	L33-F38 HydrophobicContact CD1-CB 4.44Å; L33-F38 HydrophobicContact CD1-CD1 3.24Å; L33-F38 HydrophobicContact CD1-CE1 3.59Å; L33-F38 HydrophobicContact CD1-CG 4.04Å; L33-F38 HydrophobicContact CG-CD1 4.06Å; L33-F38 HydrophobicContact CG-CE1 3.92Å; L33-F38 WeakPolarHBondContact O-CE2 3.43Å; L33-F38 VanDerWaalsContact O-CZ 3.28Å; L33-F38 WeakPolarHBondContact O-CZ 3.46Å; N36-F38 VanDerWaalsContact C-N 3.3Å; N36-F38 WeakPolarHBondContact O-CD2 3.2Å; N36-F38 PolarHBondContact O-N 3.35Å; N36-F38 VanDerWaalsContact O-N 3.12Å; F38-D42 WeakPolarHBondContact O-CB 3.4Å; F38-D42 PolarHBondContact O-N 3.25Å; F38-D42 VanDerWaalsContact O-N 3.08Å; F38-Q356 VanDerWaalsContact CB-NE2 3.3Å; F38-Q356 VanDerWaalsContact CD1-CD 3.41Å; F38-Q356 HydrophobicContact CD1-CG 4.06Å; F38-Q356 VanDerWaalsContact CD1-OE1 3.24Å; F38-Q356 VanDerWaalsContact CD2-CD 3.41Å; F38-Q356 HydrophobicContact CD2-CG 3.26Å; F38-Q356 HydrophobicContact CE1-CG 4.1Å; F38-Q356 HydrophobicContact CE2-CB 4.41Å; F38-Q356 HydrophobicContact CE2-CG 3.31Å; F38-Q356 HydrophobicContact CG-CG 3.7Å; F38-Q356 VanDerWaalsContact CG-NE2 3.28Å; F38-Q356 HydrophobicContact CZ-CG 3.77Å; F38-I359 HydrophobicContact CE1-CD1 4.3Å; F38-I359 HydrophobicContact CE2-CD1 4.06Å; F38-I359 HydrophobicContact CZ-CD1 3.46Å; F38-I359 VanDerWaalsContact CZ-CD1 3.46Å
39	K	91.8	Very high	94.8	Very high	121 Å²	121	47.6 Å²	47.6	53%	0.526	23%	0.231	S	C	.	.	H	α-helix	trans	-70.1	-43.8	179.8	-68.7	171.3	-179.3	150.3	0	110.2	S41 D42 E43 D355	K39-S41 VanDerWaalsContact C-N 3.35Å; K39-S41 PolarHBondContact O-N 3.41Å; K39-D42 PolarHBondContact O-N 3.14Å; K39-E43 WeakPolarHBondContact O-CB 3.35Å; K39-E43 WeakPolarHBondContact O-CG 3.41Å; K39-E43 PolarHBondContact O-N 2.75Å; K39-D355 IonicContact NZ-OD1 3.31Å; K39-D355 IonicContact NZ-OD2 3.29Å; K39-D355 PolarHBondContact NZ-OD2 3Å
40	E	94.4	Very high	94.6	Very high	102 Å²	102	54.9 Å²	54.9	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-41.4	178.5	-59.7	87.6	157.9	0	0	111.4	M32 G37 L44	M32-E40 HydrophobicContact SD-CB 4.24Å; G37-E40 WeakPolarHBondContact CA-OE2 3.44Å; E40-L44 VanDerWaalsContact O-CB 3.27Å; E40-L44 WeakPolarHBondContact O-CB 3.35Å; E40-L44 PolarHBondContact O-N 3.47Å
41	S	95.4	Very high	94.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-48.7	173.3	-174.1	0	0	0	0	111.7	G29 G37 K39 L44 F45	G29-S41 WeakPolarHBondContact O-CB 3.29Å; G29-S41 PolarHBondContact O-OG 3.48Å; G37-S41 VanDerWaalsContact O-CB 3.24Å; G37-S41 WeakPolarHBondContact O-CB 3.24Å; G37-S41 PolarHBondContact O-N 2.82Å; K39-S41 VanDerWaalsContact C-N 3.35Å; K39-S41 PolarHBondContact O-N 3.41Å; S41-L44 PolarHBondContact O-N 3.15Å; S41-F45 WeakPolarHBondContact O-CD2 3.49Å; S41-F45 PolarHBondContact O-N 3.16Å
42	D	93.6	Very high	94.2	Very high	40 Å²	40	58.7 Å²	58.7	21%	0.214	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-44.4	179.5	-179.1	57.4	0	0	0	112	F38 K39 L44 F45 K46 V62	F38-D42 WeakPolarHBondContact O-CB 3.4Å; F38-D42 PolarHBondContact O-N 3.25Å; F38-D42 VanDerWaalsContact O-N 3.08Å; K39-D42 PolarHBondContact O-N 3.14Å; D42-L44 PolarHBondContact O-N 3.31Å; D42-F45 PolarHBondContact O-N 3.16Å; D42-K46 WeakPolarHBondContact O-CB 3.44Å; D42-K46 VanDerWaalsContact O-CG 3.28Å; D42-K46 WeakPolarHBondContact O-CG 3.43Å; D42-K46 PolarHBondContact O-N 2.79Å; D42-K46 VanDerWaalsContact OD1-CE 3.29Å; D42-K46 WeakPolarHBondContact OD1-CE 3.27Å; D42-K46 IonicContact OD1-NZ 3.93Å; D42-K46 WeakPolarHBondContact OD2-CE 3.35Å; D42-K46 IonicContact OD2-NZ 3.7Å; D42-K46 PolarHBondContact OD2-NZ 2.97Å; D42-V62 HydrophobicContact CB-CG1 4.25Å
43	E	95.9	Very high	94.1	Very high	122 Å²	122	56.8 Å²	56.8	57%	0.57	28%	0.28	S	S	*	.	H	α-helix	trans	-60.7	-43.9	175.1	-75.7	175.1	-175.1	0	0	112.1	K39 K46 T47	K39-E43 WeakPolarHBondContact O-CB 3.35Å; K39-E43 WeakPolarHBondContact O-CG 3.41Å; K39-E43 PolarHBondContact O-N 2.75Å; E43-K46 PolarHBondContact O-N 3.26Å; E43-T47 WeakPolarHBondContact O-CB 3Å; E43-T47 PolarHBondContact O-N 2.94Å; E43-T47 PolarHBondContact O-OG1 3.25Å
44	L	97.2	Very high	94.3	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.099	28%	0.278	C	S	.	.	H	α-helix	trans	-59.1	-51.6	176	179.5	155.7	0	0	0	110.5	L25 M32 E40 S41 D42 K46 T47 Y48 M55	L25-L44 HydrophobicContact CD1-CD1 3.91Å; L25-L44 HydrophobicContact CD1-CD2 4.39Å; L25-L44 HydrophobicContact CD1-CG 4.26Å; L25-L44 HydrophobicContact CG-CD2 4.18Å; M32-L44 HydrophobicContact CE-CD1 4.21Å; M32-L44 HydrophobicContact SD-CD1 3.89Å; E40-L44 VanDerWaalsContact O-CB 3.27Å; E40-L44 WeakPolarHBondContact O-CB 3.35Å; E40-L44 PolarHBondContact O-N 3.47Å; S41-L44 PolarHBondContact O-N 3.15Å; D42-L44 PolarHBondContact O-N 3.31Å; L44-K46 PolarHBondContact O-N 3.49Å; L44-T47 PolarHBondContact O-N 3.47Å; L44-Y48 WeakPolarHBondContact O-CD2 3.18Å; L44-Y48 PolarHBondContact O-N 3.37Å; L44-M55 HydrophobicContact CD2-CE 3.73Å
45	F	97.2	Very high	94.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.2	-34.1	-178.5	-77.7	-61.7	0	0	0	113.1	A26 I30 S41 D42 R49 M55 A59 V62 M274	A26-F45 HydrophobicContact CB-CE1 4.15Å; A26-F45 WeakPolarHBondContact O-CZ 3.34Å; I30-F45 HydrophobicContact CD1-CE2 4Å; I30-F45 HydrophobicContact CD1-CZ 4.03Å; I30-F45 HydrophobicContact CG1-CZ 4.21Å; S41-F45 WeakPolarHBondContact O-CD2 3.49Å; S41-F45 PolarHBondContact O-N 3.16Å; D42-F45 PolarHBondContact O-N 3.16Å; F45-R49 WeakPolarHBondContact O-CA 3.32Å; F45-R49 WeakPolarHBondContact O-CB 3.47Å; F45-R49 PolarHBondContact O-N 3.3Å; F45-M55 HydrophobicContact CD1-CE 3.73Å; F45-M55 HydrophobicContact CE1-CE 3.94Å; F45-M55 HydrophobicContact CE1-SD 4.43Å; F45-A59 HydrophobicContact CB-CB 3.87Å; F45-V62 HydrophobicContact CD2-CG2 3.75Å; F45-V62 HydrophobicContact CE2-CG2 4.13Å; F45-M274 HydrophobicContact CE1-CE 4.4Å; F45-M274 HydrophobicContact CZ-CE 4.13Å
46	K	94.8	Very high	94.5	Very high	126 Å²	126	53.7 Å²	53.7	55%	0.548	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-44.6	173.3	-78.7	171.7	174.8	170	0	112.1	D42 E43 L44 Y48 R49	D42-K46 WeakPolarHBondContact O-CB 3.44Å; D42-K46 VanDerWaalsContact O-CG 3.28Å; D42-K46 WeakPolarHBondContact O-CG 3.43Å; D42-K46 PolarHBondContact O-N 2.79Å; D42-K46 VanDerWaalsContact OD1-CE 3.29Å; D42-K46 WeakPolarHBondContact OD1-CE 3.27Å; D42-K46 IonicContact OD1-NZ 3.93Å; D42-K46 WeakPolarHBondContact OD2-CE 3.35Å; D42-K46 IonicContact OD2-NZ 3.7Å; D42-K46 PolarHBondContact OD2-NZ 2.97Å; E43-K46 PolarHBondContact O-N 3.26Å; L44-K46 PolarHBondContact O-N 3.49Å; K46-Y48 VanDerWaalsContact C-N 3.31Å; K46-Y48 PolarHBondContact O-N 3.42Å; K46-R49 WeakPolarHBondContact O-CB 3.48Å; K46-R49 PolarHBondContact O-N 3.34Å
47	T	95.9	Very high	94.7	Very high	103 Å²	103	51.7 Å²	51.7	63%	0.632	25%	0.253	S	S	*	.	H	α-helix	trans	-58.6	-44.3	-179.6	-60.1	0	0	0	0	111.5	E43 L44	E43-T47 WeakPolarHBondContact O-CB 3Å; E43-T47 PolarHBondContact O-N 2.94Å; E43-T47 PolarHBondContact O-OG1 3.25Å; L44-T47 PolarHBondContact O-N 3.47Å
48	Y	95.2	Very high	94.8	Very high	75 Å²	75	51.1 Å²	51.1	29%	0.294	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	8.8	-175.9	-65.6	-77.8	0	0	0	114	I20 L25 L44 K46 N50 H51 M55	I20-Y48 HydrophobicContact CD1-CD1 4.27Å; I20-Y48 HydrophobicContact CD1-CE1 3.5Å; I20-Y48 VanDerWaalsContact CD1-CE1 3.5Å; L25-Y48 HydrophobicContact CD2-CD1 4.06Å; L25-Y48 HydrophobicContact CD2-CD2 3.62Å; L25-Y48 HydrophobicContact CD2-CE1 4.25Å; L25-Y48 HydrophobicContact CD2-CE2 3.81Å; L25-Y48 HydrophobicContact CD2-CG 3.74Å; L44-Y48 WeakPolarHBondContact O-CD2 3.18Å; L44-Y48 PolarHBondContact O-N 3.37Å; K46-Y48 VanDerWaalsContact C-N 3.31Å; K46-Y48 PolarHBondContact O-N 3.42Å; Y48-N50 PolarHBondContact O-N 3.05Å; Y48-N50 VanDerWaalsContact O-N 3.09Å; Y48-H51 HydrophobicContact CD1-CB 4.34Å; Y48-H51 WeakPolarHBondContact O-CB 3.13Å; Y48-H51 PolarHBondContact O-N 2.94Å; Y48-M55 HydrophobicContact CD2-CE 4.48Å; Y48-M55 HydrophobicContact CG-CE 4.32Å; Y48-M55 WeakPolarHBondContact O-CB 3.14Å
49	R	94.7	Very high	95.2	Very high	43 Å²	43	50 Å²	50	16%	0.162	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-39.9	-173.5	-172.8	176.1	-173.6	112.3	-1.7	113.6	F45 K46 S56 A59 D82	F45-R49 WeakPolarHBondContact O-CA 3.32Å; F45-R49 WeakPolarHBondContact O-CB 3.47Å; F45-R49 PolarHBondContact O-N 3.3Å; K46-R49 WeakPolarHBondContact O-CB 3.48Å; K46-R49 PolarHBondContact O-N 3.34Å; R49-S56 VanDerWaalsContact O-CA 3.28Å; R49-S56 WeakPolarHBondContact O-CA 3.29Å; R49-S56 VanDerWaalsContact O-CB 3.28Å; R49-S56 WeakPolarHBondContact O-CB 3.29Å; R49-S56 PolarHBondContact O-N 3.33Å; R49-A59 HydrophobicContact CB-CB 4.3Å; R49-A59 HydrophobicContact CG-CB 3.87Å; R49-D82 IonicContact CZ-OD1 3.08Å; R49-D82 IonicContact CZ-OD2 2.64Å; R49-D82 IonicContact NH1-OD1 2.76Å; R49-D82 IonicContact NH1-OD2 2.69Å; R49-D82 PolarHBondContact NH1-OD2 2.97Å; R49-D82 VanDerWaalsContact NH2-CB 3.33Å; R49-D82 IonicContact NH2-OD1 3.77Å; R49-D82 PolarHBondContact NH2-OD1 3.35Å; R49-D82 IonicContact NH2-OD2 2.94Å; R49-D82 PolarHBondContact NH2-OD2 3.44Å; R49-D82 VanDerWaalsContact NH2-OD2 3.16Å
50	N	92.8	Very high	95.5	Very high	154 Å²	154	44.2 Å²	44.2	82%	0.824	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.2	4.4	-177.5	-61	-32.2	0	0	0	113.1	Y48	Y48-N50 PolarHBondContact O-N 3.05Å; Y48-N50 VanDerWaalsContact O-N 3.09Å
51	H	91.9	Very high	95.5	Very high	103 Å²	103	39.7 Å²	39.7	48%	0.477	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-41.4	-178.3	-171.3	75	0	0	0	111.8	D22 Y48	D22-H51 IonicContact OD1-CD2 3.91Å; D22-H51 PolarHBondContact OD1-CD2 3.01Å; D22-H51 IonicContact OD1-NE2 2.69Å; D22-H51 IonicContact OD2-CD2 3.53Å; Y48-H51 HydrophobicContact CD1-CB 4.34Å; Y48-H51 WeakPolarHBondContact O-CB 3.13Å; Y48-H51 PolarHBondContact O-N 2.94Å
52	S	92.6	Very high	95.4	Very high	15 Å²	15	40.4 Å²	40.4	11%	0.105	20%	0.201	C	C	.	.			trans	-158.4	165.1	178.2	76.9	0	0	0	0	113.1	D22 L54 M55 S56	D22-S52 VanDerWaalsContact CG-OG 3.29Å; D22-S52 WeakPolarHBondContact OD2-CB 3.49Å; D22-S52 PolarHBondContact OD2-OG 3.46Å; S52-L54 PolarHBondContact O-N 2.87Å; S52-L54 PolarHBondContact OG-N 3.17Å; S52-M55 PolarHBondContact O-N 3.01Å; S52-M55 PolarHBondContact OG-N 2.87Å; S52-S56 WeakPolarHBondContact O-CB 3.35Å; S52-S56 PolarHBondContact O-N 3.29Å
53	P	94.5	Very high	95.5	Very high	13 Å²	13	39.7 Å²	39.7	8%	0.084	20%	0.199	C	C	.	.	H	α-helix	trans	-57.7	-33.2	175.5	-23.5	32.3	0	0	0	113.8	F57 L89 I127	P53-F57 VanDerWaalsContact O-CB 3.3Å; P53-F57 WeakPolarHBondContact O-CB 3.33Å; P53-F57 PolarHBondContact O-N 3.48Å; P53-L89 HydrophobicContact CB-CD2 4.35Å; P53-L89 HydrophobicContact CG-CD2 4.35Å; P53-L89 HydrophobicContact CG-CG 4.37Å; P53-I127 HydrophobicContact CB-CD1 4.14Å
54	L	95.6	Very high	95.4	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-69.4	-42.7	179.3	-177.1	60.3	0	0	0	111.4	D22 A23 A26 S52 F57 G58 I127 M274	D22-L54 HydrophobicContact CB-CD2 4.17Å; A23-L54 HydrophobicContact CB-CD2 4.33Å; A26-L54 HydrophobicContact CB-CD2 4.29Å; A26-L54 HydrophobicContact CB-CG 4.18Å; S52-L54 PolarHBondContact O-N 2.87Å; S52-L54 PolarHBondContact OG-N 3.17Å; L54-F57 WeakPolarHBondContact O-CB 3.32Å; L54-F57 PolarHBondContact O-N 2.73Å; L54-G58 PolarHBondContact O-N 3.45Å; L54-I127 HydrophobicContact CD1-CD1 4.47Å; L54-M274 HydrophobicContact CD1-SD 3.67Å; L54-M274 HydrophobicContact CG-SD 4.48Å
55	M	96.8	Very high	95.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-71.4	-37.4	177	-63.8	-52.5	-65.5	0	0	112	D22 L25 A26 L44 F45 Y48 S52 F57 G58 A59	D22-M55 HydrophobicContact CB-CG 4.32Å; L25-M55 HydrophobicContact CB-SD 4.4Å; L25-M55 HydrophobicContact CD2-CE 3.86Å; L25-M55 HydrophobicContact CD2-SD 4.37Å; L25-M55 HydrophobicContact CG-CE 3.91Å; L25-M55 HydrophobicContact CG-SD 4.42Å; A26-M55 HydrophobicContact CB-SD 3.91Å; L44-M55 HydrophobicContact CD2-CE 3.73Å; F45-M55 HydrophobicContact CD1-CE 3.73Å; F45-M55 HydrophobicContact CE1-CE 3.94Å; F45-M55 HydrophobicContact CE1-SD 4.43Å; Y48-M55 HydrophobicContact CD2-CE 4.48Å; Y48-M55 HydrophobicContact CG-CE 4.32Å; Y48-M55 WeakPolarHBondContact O-CB 3.14Å; S52-M55 PolarHBondContact O-N 3.01Å; S52-M55 PolarHBondContact OG-N 2.87Å; M55-F57 VanDerWaalsContact C-N 3.3Å; M55-F57 PolarHBondContact O-N 3.07Å; M55-G58 PolarHBondContact O-N 3.04Å; M55-A59 PolarHBondContact O-N 2.85Å
56	S	97.1	Very high	94.7	Very high	5 Å²	5	38.9 Å²	38.9	4%	0.035	20%	0.198	C	C	.	.	H	α-helix	trans	-57.4	-45.2	170	-172.1	0	0	0	0	111.1	R49 S52 A59 S60 T86	R49-S56 VanDerWaalsContact O-CA 3.28Å; R49-S56 WeakPolarHBondContact O-CA 3.29Å; R49-S56 VanDerWaalsContact O-CB 3.28Å; R49-S56 WeakPolarHBondContact O-CB 3.29Å; R49-S56 PolarHBondContact O-N 3.33Å; S52-S56 WeakPolarHBondContact O-CB 3.35Å; S52-S56 PolarHBondContact O-N 3.29Å; S56-A59 PolarHBondContact O-N 3.17Å; S56-S60 PolarHBondContact O-N 3.17Å; S56-S60 PolarHBondContact O-OG 3.02Å; S56-S60 VanDerWaalsContact O-OG 3.11Å; S56-T86 PolarHBondContact O-OG1 3.35Å; S56-T86 PolarHBondContact OG-OG1 3.39Å
57	F	97.6	Very high	94.5	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-45.2	176.1	172.7	-103.6	0	0	0	112.5	P53 L54 M55 A59 S60 F61 T86 I127 D130 Y134 M274	P53-F57 VanDerWaalsContact O-CB 3.3Å; P53-F57 WeakPolarHBondContact O-CB 3.33Å; P53-F57 PolarHBondContact O-N 3.48Å; L54-F57 WeakPolarHBondContact O-CB 3.32Å; L54-F57 PolarHBondContact O-N 2.73Å; M55-F57 VanDerWaalsContact C-N 3.3Å; M55-F57 PolarHBondContact O-N 3.07Å; F57-A59 VanDerWaalsContact C-N 3.29Å; F57-A59 PolarHBondContact O-N 3.29Å; F57-S60 CarbonylContact O-C 3.59Å; F57-S60 PolarHBondContact O-N 3.46Å; F57-F61 WeakPolarHBondContact O-CB 3.48Å; F57-F61 PolarHBondContact O-N 3.47Å; F57-T86 HydrophobicContact CB-CG2 3.95Å; F57-I127 HydrophobicContact CB-CD1 4.39Å; F57-I127 HydrophobicContact CB-CG1 4.25Å; F57-I127 HydrophobicContact CB-CG2 3.82Å; F57-I127 HydrophobicContact CD2-CG2 3.84Å; F57-I127 HydrophobicContact CG-CG1 4.24Å; F57-I127 HydrophobicContact CG-CG2 4Å; F57-D130 HydrophobicContact CD2-CB 4.4Å; F57-D130 HydrophobicContact CE2-CB 3.37Å; F57-D130 HydrophobicContact CZ-CB 3.53Å; F57-Y134 HydrophobicContact CE2-CD2 4.21Å; F57-Y134 AromaticContact CE2-CE2 3.61Å; F57-Y134 HydrophobicContact CE2-CE2 3.61Å; F57-Y134 AromaticContact CZ-CE2 3.63Å; F57-Y134 HydrophobicContact CZ-CE2 3.63Å; F57-M274 HydrophobicContact CD1-CE 4.34Å; F57-M274 HydrophobicContact CD1-SD 3.86Å; F57-M274 HydrophobicContact CE1-CE 4.35Å; F57-M274 HydrophobicContact CE1-SD 4.03Å
58	G	96.9	Very high	94.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.4	-41.5	176.7	0	0	0	0	0	112.8	L54 M55 F61 V62	L54-G58 PolarHBondContact O-N 3.45Å; M55-G58 PolarHBondContact O-N 3.04Å; G58-F61 WeakPolarHBondContact O-CB 3.26Å; G58-F61 PolarHBondContact O-N 3.44Å; G58-V62 PolarHBondContact O-N 3.27Å
59	A	96.9	Very high	93.6	Very high	3 Å²	3	29.4 Å²	29.4	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-44.9	174.4	0	0	0	0	0	112.3	F45 R49 M55 S56 F57 F61 V62 S63	F45-A59 HydrophobicContact CB-CB 3.87Å; R49-A59 HydrophobicContact CB-CB 4.3Å; R49-A59 HydrophobicContact CG-CB 3.87Å; M55-A59 PolarHBondContact O-N 2.85Å; S56-A59 PolarHBondContact O-N 3.17Å; F57-A59 VanDerWaalsContact C-N 3.29Å; F57-A59 PolarHBondContact O-N 3.29Å; A59-F61 VanDerWaalsContact C-N 3.27Å; A59-F61 PolarHBondContact O-N 2.83Å; A59-V62 PolarHBondContact O-N 3.32Å; A59-S63 PolarHBondContact O-N 3.01Å; A59-S63 VanDerWaalsContact O-N 3.09Å; A59-S63 PolarHBondContact O-OG 3.18Å
60	S	97.4	Very high	93	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-33.9	174.5	-58	0	0	0	0	112.8	S56 F57 F64 D82 T86	S56-S60 PolarHBondContact O-N 3.17Å; S56-S60 PolarHBondContact O-OG 3.02Å; S56-S60 VanDerWaalsContact O-OG 3.11Å; F57-S60 CarbonylContact O-C 3.59Å; F57-S60 PolarHBondContact O-N 3.46Å; S60-F64 WeakPolarHBondContact O-CB 3.03Å; S60-F64 PolarHBondContact O-N 3.16Å; S60-D82 PolarHBondContact OG-O 3.46Å; S60-D82 VanDerWaalsContact OG-O 3.14Å; S60-T86 PolarHBondContact OG-OG1 3.18Å
61	F	96	Very high	92.4	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-68	-43.4	177.5	174.7	-108.4	0	0	0	111.9	I30 F57 G58 A59 F64 L65 Y134 L278	I30-F61 HydrophobicContact CD1-CD1 3.82Å; I30-F61 HydrophobicContact CD1-CE1 3.84Å; F57-F61 WeakPolarHBondContact O-CB 3.48Å; F57-F61 PolarHBondContact O-N 3.47Å; G58-F61 WeakPolarHBondContact O-CB 3.26Å; G58-F61 PolarHBondContact O-N 3.44Å; A59-F61 VanDerWaalsContact C-N 3.27Å; A59-F61 PolarHBondContact O-N 2.83Å; F61-F64 HydrophobicContact CD2-CD1 4.26Å; F61-F64 HydrophobicContact CE2-CD1 4.43Å; F61-F64 WeakPolarHBondContact O-CB 3.45Å; F61-F64 PolarHBondContact O-N 3.04Å; F61-L65 HydrophobicContact CD1-CD1 4.1Å; F61-L65 HydrophobicContact CD1-CG 4.44Å; F61-L65 HydrophobicContact CD2-CG 4.38Å; F61-L65 HydrophobicContact CE1-CD1 3.35Å; F61-L65 HydrophobicContact CE1-CG 3.92Å; F61-L65 HydrophobicContact CE2-CD1 4.17Å; F61-L65 HydrophobicContact CE2-CD2 3.97Å; F61-L65 HydrophobicContact CE2-CG 3.86Å; F61-L65 HydrophobicContact CZ-CD1 3.4Å; F61-L65 HydrophobicContact CZ-CD2 3.83Å; F61-L65 HydrophobicContact CZ-CG 3.61Å; F61-L65 PolarHBondContact O-N 3.33Å; F61-Y134 HydrophobicContact CD2-CD2 4.41Å; F61-Y134 AromaticContact CD2-CE2 3.55Å; F61-Y134 HydrophobicContact CD2-CE2 3.55Å; F61-Y134 AromaticContact CD2-CZ 3.67Å; F61-Y134 HydrophobicContact CE2-CE2 4.24Å; F61-Y134 AromaticContact CE2-CZ 3.89Å; F61-Y134 HydrophobicContact CG-CE2 4.5Å; F61-L278 HydrophobicContact CE1-CD1 3.66Å; F61-L278 HydrophobicContact CE1-CD2 4.13Å; F61-L278 HydrophobicContact CE2-CD1 4.04Å; F61-L278 HydrophobicContact CZ-CD1 3.29Å; F61-L278 HydrophobicContact CZ-CD2 3.89Å; F61-L278 HydrophobicContact CZ-CG 4.23Å
62	V	93.7	Very high	92.2	Very high	15 Å²	15	19.5 Å²	19.5	9%	0.091	11%	0.105	C	C	.	.	H	α-helix	trans	-61.8	-45.4	174.1	173.2	0	0	0	0	110.9	D42 F45 G58 A59 F64 L65 N66	D42-V62 HydrophobicContact CB-CG1 4.25Å; F45-V62 HydrophobicContact CD2-CG2 3.75Å; F45-V62 HydrophobicContact CE2-CG2 4.13Å; G58-V62 PolarHBondContact O-N 3.27Å; A59-V62 PolarHBondContact O-N 3.32Å; V62-F64 VanDerWaalsContact C-N 3.3Å; V62-F64 PolarHBondContact O-N 3.43Å; V62-L65 PolarHBondContact O-N 3.4Å; V62-N66 WeakPolarHBondContact O-CB 3.5Å; V62-N66 PolarHBondContact O-N 2.65Å
63	S	94.1	Very high	91.9	Very high	24 Å²	24	26.5 Å²	26.5	17%	0.168	14%	0.136	C	C	.	.	H	α-helix	trans	-56	-44.9	172.9	-65.2	0	0	0	0	111.8	A59 N66 A67 D82	A59-S63 PolarHBondContact O-N 3.01Å; A59-S63 VanDerWaalsContact O-N 3.09Å; A59-S63 PolarHBondContact O-OG 3.18Å; S63-N66 PolarHBondContact O-N 2.85Å; S63-A67 WeakPolarHBondContact O-CB 3.38Å; S63-A67 PolarHBondContact O-N 3.36Å; S63-D82 VanDerWaalsContact CB-OD2 3.27Å; S63-D82 WeakPolarHBondContact CB-OD2 3.3Å; S63-D82 PolarHBondContact OG-OD2 3.3Å
64	F	95.1	Very high	91.8	Very high	15 Å²	15	33.7 Å²	33.7	7%	0.066	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-47.7	177.4	166.2	-100.6	0	0	0	112.8	S60 F61 V62 N66 A67 V68 A79 L83 Y134 V137 L138	S60-F64 WeakPolarHBondContact O-CB 3.03Å; S60-F64 PolarHBondContact O-N 3.16Å; F61-F64 HydrophobicContact CD2-CD1 4.26Å; F61-F64 HydrophobicContact CE2-CD1 4.43Å; F61-F64 WeakPolarHBondContact O-CB 3.45Å; F61-F64 PolarHBondContact O-N 3.04Å; V62-F64 VanDerWaalsContact C-N 3.3Å; V62-F64 PolarHBondContact O-N 3.43Å; F64-N66 PolarHBondContact O-N 3.05Å; F64-A67 WeakPolarHBondContact O-CB 3.45Å; F64-A67 PolarHBondContact O-N 3.41Å; F64-V68 HydrophobicContact CD2-CG2 3.86Å; F64-V68 HydrophobicContact CE1-CG2 4.27Å; F64-V68 HydrophobicContact CE2-CG2 3.4Å; F64-V68 VanDerWaalsContact CE2-CG2 3.4Å; F64-V68 HydrophobicContact CG-CG2 4.48Å; F64-V68 HydrophobicContact CZ-CG2 3.64Å; F64-V68 WeakPolarHBondContact O-CG2 3.36Å; F64-V68 PolarHBondContact O-N 3.15Å; F64-A79 HydrophobicContact CB-CB 4.46Å; F64-L83 HydrophobicContact CB-CD1 4.38Å; F64-L83 HydrophobicContact CD2-CD1 4.25Å; F64-Y134 HydrophobicContact CD1-CD1 4.03Å; F64-Y134 HydrophobicContact CD1-CD2 4.18Å; F64-Y134 HydrophobicContact CD1-CE1 4.46Å; F64-Y134 AromaticContact CD1-CG 3.9Å; F64-Y134 HydrophobicContact CD1-CG 3.9Å; F64-Y134 HydrophobicContact CD2-CG 4.23Å; F64-Y134 AromaticContact CE1-CD1 3.54Å; F64-Y134 HydrophobicContact CE1-CD1 3.54Å; F64-Y134 HydrophobicContact CE1-CD2 4.5Å; F64-Y134 HydrophobicContact CE1-CE1 4Å; F64-Y134 AromaticContact CE1-CG 3.85Å; F64-Y134 HydrophobicContact CE1-CG 3.85Å; F64-Y134 HydrophobicContact CE2-CD1 4.31Å; F64-Y134 HydrophobicContact CE2-CG 4.17Å; F64-Y134 WeakPolarHBondContact CE2-O 3.49Å; F64-Y134 HydrophobicContact CG-CD2 4.36Å; F64-Y134 HydrophobicContact CG-CG 4.08Å; F64-Y134 AromaticContact CZ-CD1 3.69Å; F64-Y134 HydrophobicContact CZ-CD1 3.69Å; F64-Y134 AromaticContact CZ-CG 3.97Å; F64-Y134 HydrophobicContact CZ-CG 3.97Å; F64-V137 HydrophobicContact CE2-CB 4.04Å; F64-V137 HydrophobicContact CE2-CG1 3.99Å; F64-V137 HydrophobicContact CZ-CB 4.01Å; F64-V137 HydrophobicContact CZ-CG1 3.84Å; F64-L138 HydrophobicContact CD2-CD1 4.22Å; F64-L138 HydrophobicContact CD2-CD2 4.07Å; F64-L138 HydrophobicContact CD2-CG 3.93Å; F64-L138 HydrophobicContact CE2-CD2 4.21Å; F64-L138 HydrophobicContact CE2-CG 4Å
65	L	90.7	Very high	91.6	Very high	44 Å²	44	36.5 Å²	36.5	23%	0.23	18%	0.18	C	C	.	.	H	α-helix	trans	-58.3	-48.8	177.4	-76	-176.7	0	0	0	111	L33 F61 V62 A67 V68 M69	L33-L65 HydrophobicContact CD2-CD1 3.72Å; F61-L65 HydrophobicContact CD1-CD1 4.1Å; F61-L65 HydrophobicContact CD1-CG 4.44Å; F61-L65 HydrophobicContact CD2-CG 4.38Å; F61-L65 HydrophobicContact CE1-CD1 3.35Å; F61-L65 HydrophobicContact CE1-CG 3.92Å; F61-L65 HydrophobicContact CE2-CD1 4.17Å; F61-L65 HydrophobicContact CE2-CD2 3.97Å; F61-L65 HydrophobicContact CE2-CG 3.86Å; F61-L65 HydrophobicContact CZ-CD1 3.4Å; F61-L65 HydrophobicContact CZ-CD2 3.83Å; F61-L65 HydrophobicContact CZ-CG 3.61Å; F61-L65 PolarHBondContact O-N 3.33Å; V62-L65 PolarHBondContact O-N 3.4Å; L65-A67 VanDerWaalsContact C-N 3.3Å; L65-A67 PolarHBondContact O-N 3.48Å; L65-V68 PolarHBondContact O-N 2.97Å; L65-M69 HydrophobicContact CB-CE 4.19Å; L65-M69 WeakPolarHBondContact O-CB 3.5Å; L65-M69 WeakPolarHBondContact O-CE 3.47Å; L65-M69 WeakPolarHBondContact O-CG 3.49Å; L65-M69 PolarHBondContact O-N 3.1Å
66	N	88.2	Confident	91.4	Very high	66 Å²	66	37.1 Å²	37.1	35%	0.353	18%	0.184	S	C	.	.	H	α-helix	trans	-58.3	-43.5	178.3	-169.5	-3.8	0	0	0	111.3	V62 S63 F64 T70	V62-N66 WeakPolarHBondContact O-CB 3.5Å; V62-N66 PolarHBondContact O-N 2.65Å; S63-N66 PolarHBondContact O-N 2.85Å; F64-N66 PolarHBondContact O-N 3.05Å; N66-T70 WeakPolarHBondContact O-CB 3.22Å; N66-T70 VanDerWaalsContact O-CG2 3.23Å; N66-T70 WeakPolarHBondContact O-CG2 3.49Å; N66-T70 PolarHBondContact O-N 3.22Å; N66-T70 PolarHBondContact O-OG1 2.98Å; N66-T70 VanDerWaalsContact OD1-CG2 3.29Å; N66-T70 WeakPolarHBondContact OD1-CG2 3.29Å
67	A	90.6	Very high	91.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-46.7	177.6	0	0	0	0	0	113.7	S63 F64 L65 F71 K75 M76 A79 L138	S63-A67 WeakPolarHBondContact O-CB 3.38Å; S63-A67 PolarHBondContact O-N 3.36Å; F64-A67 WeakPolarHBondContact O-CB 3.45Å; F64-A67 PolarHBondContact O-N 3.41Å; L65-A67 VanDerWaalsContact C-N 3.3Å; L65-A67 PolarHBondContact O-N 3.48Å; A67-F71 PolarHBondContact O-N 3.02Å; A67-K75 HydrophobicContact CB-CB 4.09Å; A67-K75 WeakPolarHBondContact CB-O 3.45Å; A67-M76 HydrophobicContact CB-CG 4.12Å; A67-A79 HydrophobicContact CB-CB 3.72Å; A67-L138 HydrophobicContact CB-CD2 4.37Å
68	V	87.5	Confident	91.1	Very high	39 Å²	39	44 Å²	44	24%	0.236	22%	0.22	C	C	.	.	H	α-helix	trans	-68.4	-38.6	-178.4	172.5	0	0	0	0	111.6	F64 L65 V137 L138 I141	F64-V68 HydrophobicContact CD2-CG2 3.86Å; F64-V68 HydrophobicContact CE1-CG2 4.27Å; F64-V68 HydrophobicContact CE2-CG2 3.4Å; F64-V68 VanDerWaalsContact CE2-CG2 3.4Å; F64-V68 HydrophobicContact CG-CG2 4.48Å; F64-V68 HydrophobicContact CZ-CG2 3.64Å; F64-V68 WeakPolarHBondContact O-CG2 3.36Å; F64-V68 PolarHBondContact O-N 3.15Å; L65-V68 PolarHBondContact O-N 2.97Å; V68-V137 HydrophobicContact CG2-CG1 4.24Å; V68-L138 HydrophobicContact CG2-CD2 4.08Å; V68-I141 HydrophobicContact CB-CD1 4.17Å; V68-I141 HydrophobicContact CG1-CD1 3.88Å; V68-I141 HydrophobicContact CG2-CD1 3.66Å
69	M	83.8	Confident	91	Very high	65 Å²	65	44 Å²	44	32%	0.32	22%	0.22	S	C	.	.	H	α-helix	trans	-71.1	-44.2	-179.3	-67	-172.4	-59.7	0	0	111.6	L65 E358	L65-M69 HydrophobicContact CB-CE 4.19Å; L65-M69 WeakPolarHBondContact O-CB 3.5Å; L65-M69 WeakPolarHBondContact O-CE 3.47Å; L65-M69 WeakPolarHBondContact O-CG 3.49Å; L65-M69 PolarHBondContact O-N 3.1Å; M69-E358 HydrophobicContact CB-CB 3.96Å; M69-E358 HydrophobicContact CB-CG 3.8Å; M69-E358 WeakPolarHBondContact O-CG 3.39Å
70	T	83.8	Confident	91	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.043	23%	0.234	C	C	.	.	H	α-helix	trans	-82.2	-24	-175.1	58.8	0	0	0	0	114.2	N66 E72 K75 E358 R392	N66-T70 WeakPolarHBondContact O-CB 3.22Å; N66-T70 VanDerWaalsContact O-CG2 3.23Å; N66-T70 WeakPolarHBondContact O-CG2 3.49Å; N66-T70 PolarHBondContact O-N 3.22Å; N66-T70 PolarHBondContact O-OG1 2.98Å; N66-T70 VanDerWaalsContact OD1-CG2 3.29Å; N66-T70 WeakPolarHBondContact OD1-CG2 3.29Å; T70-E72 PolarHBondContact O-N 3.37Å; T70-K75 HydrophobicContact CG2-CD 4.21Å; T70-K75 WeakPolarHBondContact OG1-CD 3.37Å; T70-E358 WeakPolarHBondContact CG2-OE1 3.23Å; T70-R392 VanDerWaalsContact O-CD 3.28Å; T70-R392 WeakPolarHBondContact O-CD 3.33Å
71	F	80.4	Confident	90.9	Very high	45 Å²	45	52.4 Å²	52.4	20%	0.197	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	37.2	-175.3	-149.4	-94.2	0	0	0	112.5	A67 I141 R392 W393	A67-F71 PolarHBondContact O-N 3.02Å; F71-I141 HydrophobicContact CD2-CG2 3.67Å; F71-I141 HydrophobicContact CE2-CB 4.34Å; F71-I141 HydrophobicContact CE2-CG2 3.22Å; F71-I141 HydrophobicContact CZ-CG2 3.9Å; F71-R392 PolarHBondContact O-NH1 2.82Å; F71-W393 HydrophobicContact CB-CZ2 4.3Å; F71-W393 AromaticContact CD2-CH2 3.5Å; F71-W393 HydrophobicContact CD2-CH2 3.5Å; F71-W393 AromaticContact CD2-CZ2 3.31Å; F71-W393 HydrophobicContact CD2-CZ2 3.31Å; F71-W393 HydrophobicContact CD2-CZ3 4.41Å; F71-W393 AromaticContact CE2-CH2 3.48Å; F71-W393 HydrophobicContact CE2-CH2 3.48Å; F71-W393 VanDerWaalsContact CE2-CH2 3.48Å; F71-W393 AromaticContact CE2-CZ2 3.83Å; F71-W393 HydrophobicContact CE2-CZ2 3.83Å; F71-W393 HydrophobicContact CE2-CZ3 4.14Å; F71-W393 HydrophobicContact CG-CZ2 4.1Å
72	E	86	Confident	91	Very high	41 Å²	41	53.5 Å²	53.5	19%	0.192	26%	0.264	C	S	.	.			trans	-92.8	124.6	174.7	-78.9	169.7	-159.6	0	0	110.2	T70 E74 K75 M76 R392	T70-E72 PolarHBondContact O-N 3.37Å; E72-E74 VanDerWaalsContact C-N 3.29Å; E72-E74 PolarHBondContact O-N 3.16Å; E72-K75 HydrophobicContact CB-CB 4.04Å; E72-K75 HydrophobicContact CB-CD 4.05Å; E72-K75 HydrophobicContact CB-CG 4.04Å; E72-K75 PolarHBondContact O-N 3.22Å; E72-K75 VanDerWaalsContact O-N 3.13Å; E72-K75 IonicContact OE1-NZ 3.67Å; E72-K75 WeakPolarHBondContact OE2-CD 3.47Å; E72-K75 WeakPolarHBondContact OE2-CE 3.37Å; E72-K75 IonicContact OE2-NZ 3.48Å; E72-K75 PolarHBondContact OE2-NZ 3.35Å; E72-M76 WeakPolarHBondContact O-CG 3.43Å; E72-M76 PolarHBondContact O-N 3.18Å; E72-R392 VanDerWaalsContact CG-NH1 3.3Å; E72-R392 IonicContact OE1-NH2 3.93Å
73	E	86.9	Confident	91.2	Very high	162 Å²	162	52.8 Å²	52.8	76%	0.757	26%	0.26	S	S	*	.	H	α-helix	trans	-58.3	-40.3	-176.4	-68.4	-174.3	-179.6	0	0	112.7	M76 Q77	E73-M76 HydrophobicContact CB-CE 4.34Å; E73-M76 HydrophobicContact CG-CE 3.9Å; E73-M76 PolarHBondContact O-N 3.25Å; E73-Q77 WeakPolarHBondContact O-CB 3.42Å; E73-Q77 PolarHBondContact O-N 3.3Å
74	E	91.8	Very high	91.3	Very high	163 Å²	163	54.2 Å²	54.2	76%	0.762	26%	0.263	S	S	*	.	H	α-helix	trans	-63.4	-42.6	176.8	-63.1	179.4	179.1	0	0	112.1	E72 Q77 T78	E72-E74 VanDerWaalsContact C-N 3.29Å; E72-E74 PolarHBondContact O-N 3.16Å; E74-Q77 PolarHBondContact O-N 2.87Å; E74-T78 WeakPolarHBondContact O-CB 3.34Å; E74-T78 PolarHBondContact O-N 2.82Å; E74-T78 PolarHBondContact O-OG1 3.26Å
75	K	91.7	Very high	91.3	Very high	63 Å²	63	56.5 Å²	56.5	27%	0.274	28%	0.281	S	S	.	.	H	α-helix	trans	-68.3	-39.8	176.2	-69.4	-177.4	177	152.5	0	111.5	A67 T70 E72 Q77 T78 A79	A67-K75 HydrophobicContact CB-CB 4.09Å; A67-K75 WeakPolarHBondContact CB-O 3.45Å; T70-K75 HydrophobicContact CG2-CD 4.21Å; T70-K75 WeakPolarHBondContact OG1-CD 3.37Å; E72-K75 HydrophobicContact CB-CB 4.04Å; E72-K75 HydrophobicContact CB-CD 4.05Å; E72-K75 HydrophobicContact CB-CG 4.04Å; E72-K75 PolarHBondContact O-N 3.22Å; E72-K75 VanDerWaalsContact O-N 3.13Å; E72-K75 IonicContact OE1-NZ 3.67Å; E72-K75 WeakPolarHBondContact OE2-CD 3.47Å; E72-K75 WeakPolarHBondContact OE2-CE 3.37Å; E72-K75 IonicContact OE2-NZ 3.48Å; E72-K75 PolarHBondContact OE2-NZ 3.35Å; K75-Q77 VanDerWaalsContact C-N 3.32Å; K75-Q77 PolarHBondContact O-N 2.89Å; K75-T78 PolarHBondContact O-N 2.73Å; K75-A79 WeakPolarHBondContact O-CB 3.28Å; K75-A79 PolarHBondContact O-N 3.01Å
76	M	92.2	Very high	91.6	Very high	14 Å²	14	54.4 Å²	54.4	7%	0.069	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-40.3	173.8	-71.1	-171.4	-74.7	0	0	112.1	A67 E72 E73 F80 L138 I141	A67-M76 HydrophobicContact CB-CG 4.12Å; E72-M76 WeakPolarHBondContact O-CG 3.43Å; E72-M76 PolarHBondContact O-N 3.18Å; E73-M76 HydrophobicContact CB-CE 4.34Å; E73-M76 HydrophobicContact CG-CE 3.9Å; E73-M76 PolarHBondContact O-N 3.25Å; M76-F80 WeakPolarHBondContact O-CB 3.31Å; M76-F80 PolarHBondContact O-N 3.19Å; M76-L138 HydrophobicContact CB-CD2 4.43Å; M76-L138 HydrophobicContact CG-CD2 4.23Å; M76-I141 HydrophobicContact SD-CG2 3.49Å; M76-I141 WeakPolarHBondContact SD-CG2 3.16Å
77	Q	93.8	Very high	92	Very high	79 Å²	79	51.7 Å²	51.7	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-68	-44.7	176.4	-174.4	57.7	33.6	0	0	111.6	E73 E74 K75 A79 F80 E81	E73-Q77 WeakPolarHBondContact O-CB 3.42Å; E73-Q77 PolarHBondContact O-N 3.3Å; E74-Q77 PolarHBondContact O-N 2.87Å; K75-Q77 VanDerWaalsContact C-N 3.32Å; K75-Q77 PolarHBondContact O-N 2.89Å; Q77-A79 PolarHBondContact O-N 3.17Å; Q77-F80 WeakPolarHBondContact O-CB 3.48Å; Q77-F80 PolarHBondContact O-N 3.44Å; Q77-E81 PolarHBondContact NE2-OE1 2.96Å; Q77-E81 WeakPolarHBondContact O-CG 3.39Å; Q77-E81 PolarHBondContact O-N 3.4Å
78	T	94.9	Very high	92.2	Very high	72 Å²	72	59.3 Å²	59.3	44%	0.442	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-47.8	175.3	-56.2	0	0	0	0	111.2	E74 K75 F80 E81 D82	E74-T78 WeakPolarHBondContact O-CB 3.34Å; E74-T78 PolarHBondContact O-N 2.82Å; E74-T78 PolarHBondContact O-OG1 3.26Å; K75-T78 PolarHBondContact O-N 2.73Å; T78-F80 VanDerWaalsContact C-N 3.31Å; T78-F80 PolarHBondContact O-N 3.29Å; T78-E81 PolarHBondContact O-N 3.41Å; T78-D82 WeakPolarHBondContact O-CB 3.23Å; T78-D82 VanDerWaalsContact O-CG 3.31Å; T78-D82 PolarHBondContact O-N 3.39Å
79	A	96.2	Very high	92.5	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-39.3	176.6	0	0	0	0	0	112.3	F64 A67 K75 Q77 L83 L138	F64-A79 HydrophobicContact CB-CB 4.46Å; A67-A79 HydrophobicContact CB-CB 3.72Å; K75-A79 WeakPolarHBondContact O-CB 3.28Å; K75-A79 PolarHBondContact O-N 3.01Å; Q77-A79 PolarHBondContact O-N 3.17Å; A79-L83 WeakPolarHBondContact O-CB 3.38Å; A79-L83 WeakPolarHBondContact O-CD1 3.31Å; A79-L83 WeakPolarHBondContact O-CG 3.33Å; A79-L83 PolarHBondContact O-N 3.36Å; A79-L138 HydrophobicContact CB-CD1 4.09Å
80	F	95.8	Very high	93	Very high	73 Å²	73	57.3 Å²	57.3	32%	0.32	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-46.3	175.9	177.7	-85.7	0	0	0	111.9	M76 Q77 T78 K84 L135 L138	M76-F80 WeakPolarHBondContact O-CB 3.31Å; M76-F80 PolarHBondContact O-N 3.19Å; Q77-F80 WeakPolarHBondContact O-CB 3.48Å; Q77-F80 PolarHBondContact O-N 3.44Å; T78-F80 VanDerWaalsContact C-N 3.31Å; T78-F80 PolarHBondContact O-N 3.29Å; F80-K84 HydrophobicContact CD1-CG 4.36Å; F80-K84 HydrophobicContact CE1-CG 3.95Å; F80-K84 HydrophobicContact CZ-CG 4.15Å; F80-K84 WeakPolarHBondContact O-CB 3.36Å; F80-K84 WeakPolarHBondContact O-CG 3.46Å; F80-K84 PolarHBondContact O-N 3.14Å; F80-L135 HydrophobicContact CD2-CD2 3.33Å; F80-L135 HydrophobicContact CE2-CD2 3.62Å; F80-L135 HydrophobicContact CG-CD2 4.02Å; F80-L135 HydrophobicContact CZ-CD2 4.48Å; F80-L138 HydrophobicContact CB-CD1 4.19Å
81	E	96.8	Very high	93.2	Very high	107 Å²	107	61.3 Å²	61.3	50%	0.5	29%	0.291	S	S	.	.	H	α-helix	trans	-65.2	-43.6	179	-72.5	172	-164.8	0	0	111.8	Q77 T78 K84 S85	Q77-E81 PolarHBondContact NE2-OE1 2.96Å; Q77-E81 WeakPolarHBondContact O-CG 3.39Å; Q77-E81 PolarHBondContact O-N 3.4Å; T78-E81 PolarHBondContact O-N 3.41Å; E81-K84 PolarHBondContact O-N 2.87Å; E81-S85 PolarHBondContact O-N 2.9Å
82	D	96.9	Very high	92.8	Very high	30 Å²	30	62.8 Å²	62.8	16%	0.16	31%	0.307	C	S	.	.	H	α-helix	trans	-56.3	-51.9	175.3	-82.7	-7	0	0	0	112	R49 S60 S63 T78 K84 S85 T86	R49-D82 IonicContact CZ-OD1 3.08Å; R49-D82 IonicContact CZ-OD2 2.64Å; R49-D82 IonicContact NH1-OD1 2.76Å; R49-D82 IonicContact NH1-OD2 2.69Å; R49-D82 PolarHBondContact NH1-OD2 2.97Å; R49-D82 VanDerWaalsContact NH2-CB 3.33Å; R49-D82 IonicContact NH2-OD1 3.77Å; R49-D82 PolarHBondContact NH2-OD1 3.35Å; R49-D82 IonicContact NH2-OD2 2.94Å; R49-D82 PolarHBondContact NH2-OD2 3.44Å; R49-D82 VanDerWaalsContact NH2-OD2 3.16Å; S60-D82 PolarHBondContact OG-O 3.46Å; S60-D82 VanDerWaalsContact OG-O 3.14Å; S63-D82 VanDerWaalsContact CB-OD2 3.27Å; S63-D82 WeakPolarHBondContact CB-OD2 3.3Å; S63-D82 PolarHBondContact OG-OD2 3.3Å; T78-D82 WeakPolarHBondContact O-CB 3.23Å; T78-D82 VanDerWaalsContact O-CG 3.31Å; T78-D82 PolarHBondContact O-N 3.39Å; D82-K84 VanDerWaalsContact C-N 3.3Å; D82-K84 PolarHBondContact O-N 3.43Å; D82-S85 WeakPolarHBondContact O-CB 3.48Å; D82-S85 PolarHBondContact O-N 3.2Å; D82-T86 PolarHBondContact O-N 3.12Å; D82-T86 PolarHBondContact O-OG1 2.97Å
83	L	97.4	Very high	91.6	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-39.1	178.2	-69.9	165.9	0	0	0	111.7	F64 A79 T86 E87 C131 Y134 L135 L138	F64-L83 HydrophobicContact CB-CD1 4.38Å; F64-L83 HydrophobicContact CD2-CD1 4.25Å; A79-L83 WeakPolarHBondContact O-CB 3.38Å; A79-L83 WeakPolarHBondContact O-CD1 3.31Å; A79-L83 WeakPolarHBondContact O-CG 3.33Å; A79-L83 PolarHBondContact O-N 3.36Å; L83-T86 PolarHBondContact O-N 3.48Å; L83-E87 WeakPolarHBondContact O-CB 3.36Å; L83-E87 PolarHBondContact O-N 3.06Å; L83-C131 HydrophobicContact CD2-CB 4.44Å; L83-Y134 HydrophobicContact CD2-CD2 3.82Å; L83-Y134 HydrophobicContact CD2-CG 4.47Å; L83-L135 HydrophobicContact CB-CD2 4Å; L83-L135 HydrophobicContact CB-CG 4.11Å; L83-L135 HydrophobicContact CD1-CD2 4.13Å; L83-L135 HydrophobicContact CD1-CG 4.18Å; L83-L138 HydrophobicContact CD1-CD1 3.92Å
84	K	96.9	Very high	90	Very high	54 Å²	54	60.1 Å²	60.1	24%	0.235	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-36.4	176.4	-78.7	-71.4	168.3	-157.4	0	112.7	F80 E81 D82 E87 R88 L135	F80-K84 HydrophobicContact CD1-CG 4.36Å; F80-K84 HydrophobicContact CE1-CG 3.95Å; F80-K84 HydrophobicContact CZ-CG 4.15Å; F80-K84 WeakPolarHBondContact O-CB 3.36Å; F80-K84 WeakPolarHBondContact O-CG 3.46Å; F80-K84 PolarHBondContact O-N 3.14Å; E81-K84 PolarHBondContact O-N 2.87Å; D82-K84 VanDerWaalsContact C-N 3.3Å; D82-K84 PolarHBondContact O-N 3.43Å; K84-E87 IonicContact NZ-OE2 3.38Å; K84-E87 PolarHBondContact NZ-OE2 2.97Å; K84-R88 WeakPolarHBondContact O-CG 3.35Å; K84-R88 PolarHBondContact O-N 3.28Å; K84-R88 VanDerWaalsContact O-N 3.13Å; K84-L135 HydrophobicContact CD-CD1 4.24Å; K84-L135 VanDerWaalsContact CE-CD1 3.49Å; K84-L135 HydrophobicContact CG-CD1 4.48Å; K84-L135 HydrophobicContact CG-CD2 4.37Å
85	S	96.1	Very high	87.8	Confident	62 Å²	62	54.4 Å²	54.4	43%	0.434	28%	0.281	S	S	.	.	H	α-helix	trans	-64.1	-47.1	174.3	-170.2	0	0	0	0	111.1	E81 D82 E87 R88 L89	E81-S85 PolarHBondContact O-N 2.9Å; D82-S85 WeakPolarHBondContact O-CB 3.48Å; D82-S85 PolarHBondContact O-N 3.2Å; S85-E87 PolarHBondContact O-N 2.95Å; S85-R88 PolarHBondContact O-N 3.26Å; S85-L89 PolarHBondContact O-N 3.23Å
86	T	96.9	Very high	85.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-41.4	176.7	-65.7	0	0	0	0	111.9	S56 F57 S60 D82 L83 R88 L89 C90 I127	S56-T86 PolarHBondContact O-OG1 3.35Å; S56-T86 PolarHBondContact OG-OG1 3.39Å; F57-T86 HydrophobicContact CB-CG2 3.95Å; S60-T86 PolarHBondContact OG-OG1 3.18Å; D82-T86 PolarHBondContact O-N 3.12Å; D82-T86 PolarHBondContact O-OG1 2.97Å; L83-T86 PolarHBondContact O-N 3.48Å; T86-R88 PolarHBondContact O-N 2.92Å; T86-L89 WeakPolarHBondContact O-CB 3.43Å; T86-L89 PolarHBondContact O-N 3.28Å; T86-C90 PolarHBondContact O-N 3.39Å; T86-C90 VanDerWaalsContact O-N 3.09Å; T86-C90 PolarHBondContact O-SG 3.28Å; T86-I127 HydrophobicContact CG2-CG2 3.71Å
87	E	95.6	Very high	83.2	Confident	9 Å²	9	57.7 Å²	57.7	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-58.1	-47.5	174.9	-179.6	172.6	-140	0	0	111.8	L83 K84 S85 L89 C90 E91 I128 Q132 K157	L83-E87 WeakPolarHBondContact O-CB 3.36Å; L83-E87 PolarHBondContact O-N 3.06Å; K84-E87 IonicContact NZ-OE2 3.38Å; K84-E87 PolarHBondContact NZ-OE2 2.97Å; S85-E87 PolarHBondContact O-N 2.95Å; E87-L89 VanDerWaalsContact C-N 3.33Å; E87-L89 PolarHBondContact O-N 3.3Å; E87-C90 PolarHBondContact O-N 2.85Å; E87-E91 WeakPolarHBondContact O-CG 3.43Å; E87-E91 PolarHBondContact O-N 2.97Å; E87-I128 HydrophobicContact CG-CG2 4.34Å; E87-Q132 PolarHBondContact OE1-NE2 3.15Å; E87-Q132 PolarHBondContact OE2-NE2 3.47Å; E87-K157 IonicContact OE1-NZ 3.73Å
88	R	95.1	Very high	81	Confident	160 Å²	160	59.7 Å²	59.7	60%	0.604	32%	0.322	S	S	*	.	H	α-helix	trans	-62.5	-39.1	178	-69.4	171.7	-167.3	145.7	1.1	112.3	K84 S85 T86 C90 E91 S92	K84-R88 WeakPolarHBondContact O-CG 3.35Å; K84-R88 PolarHBondContact O-N 3.28Å; K84-R88 VanDerWaalsContact O-N 3.13Å; S85-R88 PolarHBondContact O-N 3.26Å; T86-R88 PolarHBondContact O-N 2.92Å; R88-C90 VanDerWaalsContact C-N 3.31Å; R88-C90 PolarHBondContact O-N 3.18Å; R88-E91 PolarHBondContact O-N 3.45Å; R88-S92 WeakPolarHBondContact O-CB 3.23Å; R88-S92 PolarHBondContact O-N 2.71Å; R88-S92 PolarHBondContact O-OG 3.31Å
89	L	93.9	Very high	78.4	Confident	62 Å²	62	63.2 Å²	63.2	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-58.6	-44.8	175.2	179	63.4	0	0	0	110.7	P53 S85 T86 E87 E91 S92 R124	P53-L89 HydrophobicContact CB-CD2 4.35Å; P53-L89 HydrophobicContact CG-CD2 4.35Å; P53-L89 HydrophobicContact CG-CG 4.37Å; S85-L89 PolarHBondContact O-N 3.23Å; T86-L89 WeakPolarHBondContact O-CB 3.43Å; T86-L89 PolarHBondContact O-N 3.28Å; E87-L89 VanDerWaalsContact C-N 3.33Å; E87-L89 PolarHBondContact O-N 3.3Å; L89-E91 PolarHBondContact O-N 3.17Å; L89-S92 PolarHBondContact O-OG 3.11Å; L89-R124 PolarHBondContact O-NH1 3.47Å
90	C	93.4	Very high	75.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-67.9	-31.2	176.3	-66.8	0	0	0	0	113.9	T86 E87 R88 N94 R124 I127 I128	T86-C90 PolarHBondContact O-N 3.39Å; T86-C90 VanDerWaalsContact O-N 3.09Å; T86-C90 PolarHBondContact O-SG 3.28Å; E87-C90 PolarHBondContact O-N 2.85Å; R88-C90 VanDerWaalsContact C-N 3.31Å; R88-C90 PolarHBondContact O-N 3.18Å; C90-N94 PolarHBondContact O-ND2 3.06Å; C90-R124 HydrophobicContact CB-CB 4.06Å; C90-R124 HydrophobicContact CB-CG 4.31Å; C90-I127 VanDerWaalsContact SG-CG2 3.52Å; C90-I128 HydrophobicContact CB-CD1 3.67Å; C90-I128 HydrophobicContact CB-CG1 3.5Å
91	E	88.7	Confident	73.5	Confident	91 Å²	91	67.2 Å²	67.2	43%	0.425	36%	0.36	S	S	.	.	H	α-helix	trans	-79	-38	179.6	-72.3	178.9	159.3	0	0	113.5	E87 R88 L89 E93 N94 I128	E87-E91 WeakPolarHBondContact O-CG 3.43Å; E87-E91 PolarHBondContact O-N 2.97Å; R88-E91 PolarHBondContact O-N 3.45Å; L89-E91 PolarHBondContact O-N 3.17Å; E91-E93 VanDerWaalsContact C-N 3.3Å; E91-E93 PolarHBondContact O-N 2.83Å; E91-N94 PolarHBondContact O-N 3.23Å; E91-N94 VanDerWaalsContact O-N 3.12Å; E91-I128 HydrophobicContact CG-CD1 4.03Å
92	S	71.3	Confident	70.9	Confident	76 Å²	76	70.2 Å²	70.2	53%	0.531	37%	0.371	S	S	.	.	H	α-helix	trans	-59.7	-31.7	-171.4	63.3	0	0	0	0	114.8	R88 L89	R88-S92 WeakPolarHBondContact O-CB 3.23Å; R88-S92 PolarHBondContact O-N 2.71Å; R88-S92 PolarHBondContact O-OG 3.31Å; L89-S92 PolarHBondContact O-OG 3.11Å
93	E	61.7	Low	68.2	Low	97 Å²	97	75.7 Å²	75.7	45%	0.453	40%	0.4	S	S	.	.	H	α-helix	trans	-90.3	-12.5	179.5	-73.1	-175.5	125.9	0	0	114	E91 G95 V97 R124	E91-E93 VanDerWaalsContact C-N 3.3Å; E91-E93 PolarHBondContact O-N 2.83Å; E93-G95 VanDerWaalsContact C-N 3.28Å; E93-G95 PolarHBondContact O-N 2.9Å; E93-V97 WeakPolarHBondContact O-CG2 3.43Å; E93-V97 PolarHBondContact O-N 2.98Å; E93-R124 IonicContact OE2-CZ 3.48Å; E93-R124 IonicContact OE2-NH1 2.79Å; E93-R124 PolarHBondContact OE2-NH1 3.43Å; E93-R124 IonicContact OE2-NH2 3.26Å; E93-R124 PolarHBondContact OE2-NH2 3.27Å
94	N	52.2	Low	65.6	Low	50 Å²	50	82.7 Å²	82.7	27%	0.267	43%	0.431	S	S	.	.	H	α-helix	trans	-69.3	-27.2	174.1	-80.5	-31.2	0	0	0	112.3	C90 E91 I98	C90-N94 PolarHBondContact O-ND2 3.06Å; E91-N94 PolarHBondContact O-N 3.23Å; E91-N94 VanDerWaalsContact O-N 3.12Å; N94-I98 WeakPolarHBondContact O-CD1 3.5Å; N94-I98 WeakPolarHBondContact O-CG1 3.46Å
95	G	45.4	Very low	63.3	Low	44 Å²	44	86.7 Å²	86.7	45%	0.454	45%	0.454	S	S	.	.	H	α-helix	trans	-74.2	-46.4	177.4	0	0	0	0	0	113.4	E93 V97 I98 E99	E93-G95 VanDerWaalsContact C-N 3.28Å; E93-G95 PolarHBondContact O-N 2.9Å; G95-V97 PolarHBondContact O-N 3.37Å; G95-I98 PolarHBondContact O-N 2.86Å; G95-E99 PolarHBondContact O-N 3.45Å
96	S	41.2	Very low	60.8	Low	74 Å²	74	92.9 Å²	92.9	52%	0.517	47%	0.473	S	S	.	.	H	α-helix	trans	-69.3	-31.5	-175.8	-168.6	0	0	0	0	113.1	T100	S96-T100 VanDerWaalsContact O-CB 3.32Å; S96-T100 WeakPolarHBondContact O-CB 3.49Å; S96-T100 PolarHBondContact O-N 3.39Å; S96-T100 VanDerWaalsContact O-N 3.09Å; S96-T100 PolarHBondContact O-OG1 2.95Å
97	V	47.1	Very low	58.3	Low	71 Å²	71	103.8 Å²	103.8	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-74.5	-34.7	-179.6	176	0	0	0	0	111.4	E93 G95 I101	E93-V97 WeakPolarHBondContact O-CG2 3.43Å; E93-V97 PolarHBondContact O-N 2.98Å; G95-V97 PolarHBondContact O-N 3.37Å; V97-I101 HydrophobicContact CG1-CD1 3.45Å; V97-I101 VanDerWaalsContact CG1-CD1 3.45Å; V97-I101 HydrophobicContact CG1-CG1 4.14Å; V97-I101 VanDerWaalsContact O-CB 3.31Å; V97-I101 WeakPolarHBondContact O-CB 3.36Å; V97-I101 WeakPolarHBondContact O-CD1 3.21Å; V97-I101 WeakPolarHBondContact O-CG1 3.43Å; V97-I101 PolarHBondContact O-N 3.33Å
98	I	47	Very low	56.1	Low	121 Å²	121	109.4 Å²	109.4	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-69.3	-39.8	177.8	-66	172.2	0	0	0	111.4	N94 G95 K102	N94-I98 WeakPolarHBondContact O-CD1 3.5Å; N94-I98 WeakPolarHBondContact O-CG1 3.46Å; G95-I98 PolarHBondContact O-N 2.86Å; I98-K102 WeakPolarHBondContact O-CB 3.47Å; I98-K102 PolarHBondContact O-N 3.23Å
99	E	40.1	Very low	54	Low	146 Å²	146	105.4 Å²	105.4	68%	0.682	55%	0.547	S	S	*	.	H	α-helix	trans	-70.8	-38.1	175	-87.5	-174.6	147	0	0	113	G95 K102 N103	G95-E99 PolarHBondContact O-N 3.45Å; E99-K102 PolarHBondContact O-N 2.92Å; E99-N103 PolarHBondContact O-N 3.19Å
100	T	39.8	Very low	52.3	Low	67 Å²	67	108.3 Å²	108.3	41%	0.411	56%	0.563	S	S	.	*	H	α-helix	trans	-73.4	-34	-179.3	-51.8	0	0	0	0	112.1	S96 K104	S96-T100 VanDerWaalsContact O-CB 3.32Å; S96-T100 WeakPolarHBondContact O-CB 3.49Å; S96-T100 PolarHBondContact O-N 3.39Å; S96-T100 VanDerWaalsContact O-N 3.09Å; S96-T100 PolarHBondContact O-OG1 2.95Å; T100-K104 HydrophobicContact CG2-CD 4.27Å; T100-K104 WeakPolarHBondContact O-CB 3.45Å; T100-K104 PolarHBondContact O-N 3.2Å
101	I	49.6	Very low	50.6	Low	90 Å²	90	112.3 Å²	112.3	46%	0.462	59%	0.591	S	S	.	*	H	α-helix	trans	-68.4	-42.9	174.4	-70	169.7	0	0	0	110.1	V97 N103 K104 I105	V97-I101 HydrophobicContact CG1-CD1 3.45Å; V97-I101 VanDerWaalsContact CG1-CD1 3.45Å; V97-I101 HydrophobicContact CG1-CG1 4.14Å; V97-I101 VanDerWaalsContact O-CB 3.31Å; V97-I101 WeakPolarHBondContact O-CB 3.36Å; V97-I101 WeakPolarHBondContact O-CD1 3.21Å; V97-I101 WeakPolarHBondContact O-CG1 3.43Å; V97-I101 PolarHBondContact O-N 3.33Å; I101-N103 PolarHBondContact O-N 2.92Å; I101-K104 PolarHBondContact O-N 3.24Å; I101-I105 HydrophobicContact CG2-CD1 4.28Å; I101-I105 HydrophobicContact CG2-CG1 4.41Å; I101-I105 WeakPolarHBondContact O-CD1 3.25Å; I101-I105 VanDerWaalsContact O-CG1 3.28Å; I101-I105 WeakPolarHBondContact O-CG1 3.46Å; I101-I105 PolarHBondContact O-N 3.28Å
102	K	42.4	Very low	49.2	Very low	170 Å²	170	113.3 Å²	113.3	74%	0.739	60%	0.596	S	S	*	*	H	α-helix	trans	-62.1	-29.7	-179.1	-148.3	177.4	-176.9	-176.1	0	112.9	I98 E99	I98-K102 WeakPolarHBondContact O-CB 3.47Å; I98-K102 PolarHBondContact O-N 3.23Å; E99-K102 PolarHBondContact O-N 2.92Å
103	N	41.2	Very low	48.8	Very low	145 Å²	145	118.7 Å²	118.7	78%	0.775	60%	0.604	S	S	*	*	H	α-helix	trans	-94.5	-4.1	179.6	-70.9	-14.9	0	0	0	115	E99 I101	E99-N103 PolarHBondContact O-N 3.19Å; I101-N103 PolarHBondContact O-N 2.92Å
104	K	42.1	Very low	49.2	Very low	147 Å²	147	118.8 Å²	118.8	64%	0.639	61%	0.608	S	S	*	*	H	α-helix	trans	-120.7	12.8	-178.8	-81.7	-175.5	176.5	178.1	0	115.6	T100 I101 K106	T100-K104 HydrophobicContact CG2-CD 4.27Å; T100-K104 WeakPolarHBondContact O-CB 3.45Å; T100-K104 PolarHBondContact O-N 3.2Å; I101-K104 PolarHBondContact O-N 3.24Å; K104-K106 PolarHBondContact O-N 3.34Å
105	I	48.2	Very low	50.1	Low	139 Å²	139	117.1 Å²	117.1	71%	0.713	60%	0.602	S	S	*	*			trans	-72.9	49.1	170	-60	153.8	0	0	0	110.7	I101	I101-I105 HydrophobicContact CG2-CD1 4.28Å; I101-I105 HydrophobicContact CG2-CG1 4.41Å; I101-I105 WeakPolarHBondContact O-CD1 3.25Å; I101-I105 VanDerWaalsContact O-CG1 3.28Å; I101-I105 WeakPolarHBondContact O-CG1 3.46Å; I101-I105 PolarHBondContact O-N 3.28Å
106	K	44.6	Very low	51.5	Low	192 Å²	192	121 Å²	121	84%	0.835	61%	0.609	S	S	*	*	S	Bend	trans	-152.9	52.3	173.1	-143.8	179.8	-171.6	-179	0	110.7	K104	K104-K106 PolarHBondContact O-N 3.34Å
107	R	44.6	Very low	53.4	Low	229 Å²	229	119.8 Å²	119.8	86%	0.864	60%	0.604	S	S	*	*	S	Bend	trans	-177.9	142.7	154.6	-101.3	157.3	-178.8	-171.8	0.1	109.3	V109	R107-V109 WeakPolarHBondContact O-CG2 3.25Å; R107-V109 PolarHBondContact O-N 2.9Å; R107-V109 VanDerWaalsContact O-N 3.09Å
108	S	48.5	Very low	55.1	Low	126 Å²	126	117.7 Å²	117.7	88%	0.881	59%	0.594	S	S	*	*			trans	-49.1	111.3	-176.7	55.6	0	0	0	0	111.6
109	V	50.4	Low	57	Low	77 Å²	77	112.9 Å²	112.9	47%	0.467	57%	0.57	S	S	.	*			trans	-91.5	131	176.4	179.3	0	0	0	0	108.3	R107 S111 L114	R107-V109 WeakPolarHBondContact O-CG2 3.25Å; R107-V109 PolarHBondContact O-N 2.9Å; R107-V109 VanDerWaalsContact O-N 3.09Å; V109-S111 PolarHBondContact O-N 3.49Å; V109-L114 HydrophobicContact CB-CD1 4.45Å; V109-L114 HydrophobicContact CG1-CD1 4.23Å; V109-L114 HydrophobicContact CG1-CD2 4.39Å; V109-L114 HydrophobicContact CG1-CG 3.96Å
110	D	57.8	Low	59.3	Low	123 Å²	123	108.9 Å²	108.9	66%	0.658	55%	0.554	S	S	*	*			trans	-54.9	123.1	174.5	-65.1	-44.2	0	0	0	111	Q112 R113 L114	D110-Q112 PolarHBondContact O-N 2.77Å; D110-Q112 VanDerWaalsContact O-N 3.09Å; D110-R113 WeakPolarHBondContact O-CB 3.45Å; D110-R113 PolarHBondContact O-N 3.26Å; D110-L114 PolarHBondContact O-N 3.32Å
111	S	59	Low	61.7	Low	84 Å²	84	111.3 Å²	111.3	59%	0.587	56%	0.555	S	S	*	*	H	α-helix	trans	-52.9	-31.6	178.9	-60.3	0	0	0	0	112.9	V109 R113 L114 G115	V109-S111 PolarHBondContact O-N 3.49Å; S111-R113 PolarHBondContact O-N 2.65Å; S111-L114 PolarHBondContact O-N 2.86Å; S111-G115 PolarHBondContact O-N 3.38Å
112	Q	58.8	Low	63.9	Low	111 Å²	111	107.1 Å²	107.1	52%	0.519	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-40.4	176	-170.1	178.8	-0.2	0	0	112.8	D110 L114 G115 M116 D213	D110-Q112 PolarHBondContact O-N 2.77Å; D110-Q112 VanDerWaalsContact O-N 3.09Å; Q112-L114 VanDerWaalsContact C-N 3.35Å; Q112-G115 PolarHBondContact O-N 3.16Å; Q112-M116 WeakPolarHBondContact O-CG 3.28Å; Q112-M116 PolarHBondContact O-N 3.43Å; Q112-D213 HydrophobicContact CB-CB 4.44Å
113	R	64.1	Low	66.4	Low	189 Å²	189	100.1 Å²	100.1	71%	0.713	50%	0.504	S	S	*	.	H	α-helix	trans	-69.9	-34.5	-179.7	-167.4	176.2	-178.3	171.6	4.3	111.7	D110 S111 A117	D110-R113 WeakPolarHBondContact O-CB 3.45Å; D110-R113 PolarHBondContact O-N 3.26Å; S111-R113 PolarHBondContact O-N 2.65Å; R113-A117 WeakPolarHBondContact O-CB 3.43Å; R113-A117 PolarHBondContact O-N 3.1Å
114	L	68.6	Low	69	Low	100 Å²	100	93.9 Å²	93.9	52%	0.524	47%	0.47	S	S	.	.	H	α-helix	trans	-68.1	-41	173.8	-71.3	165.6	0	0	0	111.6	V109 D110 S111 Q112 A117 A118	V109-L114 HydrophobicContact CB-CD1 4.45Å; V109-L114 HydrophobicContact CG1-CD1 4.23Å; V109-L114 HydrophobicContact CG1-CD2 4.39Å; V109-L114 HydrophobicContact CG1-CG 3.96Å; D110-L114 PolarHBondContact O-N 3.32Å; S111-L114 PolarHBondContact O-N 2.86Å; Q112-L114 VanDerWaalsContact C-N 3.35Å; L114-A117 PolarHBondContact O-N 3.07Å; L114-A118 PolarHBondContact O-N 3.5Å
115	G	72.4	Confident	71.6	Confident	14 Å²	14	88.8 Å²	88.8	14%	0.144	45%	0.448	C	S	.	.	H	α-helix	trans	-61.5	-48.2	174.7	0	0	0	0	0	112.7	S111 Q112 A117 A118 V119 V215	S111-G115 PolarHBondContact O-N 3.38Å; Q112-G115 PolarHBondContact O-N 3.16Å; G115-A117 VanDerWaalsContact C-N 3.35Å; G115-A117 PolarHBondContact O-N 3.2Å; G115-A118 WeakPolarHBondContact O-CB 3.3Å; G115-A118 PolarHBondContact O-N 2.83Å; G115-V119 WeakPolarHBondContact O-CG2 3.41Å; G115-V119 PolarHBondContact O-N 3.25Å; G115-V215 VanDerWaalsContact C-CG2 3.47Å; G115-V215 WeakPolarHBondContact O-CG2 3.49Å
116	M	73.6	Confident	74	Confident	125 Å²	125	82.1 Å²	82.1	62%	0.616	41%	0.414	S	S	*	.	H	α-helix	trans	-62.3	-39.7	176.6	-72.5	178.9	58	0	0	112.7	Q112 A118 V119 D120	Q112-M116 WeakPolarHBondContact O-CG 3.28Å; Q112-M116 PolarHBondContact O-N 3.43Å; M116-A118 VanDerWaalsContact C-N 3.31Å; M116-A118 PolarHBondContact O-N 2.89Å; M116-V119 PolarHBondContact O-N 3.08Å; M116-D120 PolarHBondContact O-N 2.71Å
117	A	80.8	Confident	76.5	Confident	50 Å²	50	73.1 Å²	73.1	41%	0.413	38%	0.375	S	S	.	.	H	α-helix	trans	-64.8	-34.8	175.1	0	0	0	0	0	112.4	R113 L114 G115 R121	R113-A117 WeakPolarHBondContact O-CB 3.43Å; R113-A117 PolarHBondContact O-N 3.1Å; L114-A117 PolarHBondContact O-N 3.07Å; G115-A117 VanDerWaalsContact C-N 3.35Å; G115-A117 PolarHBondContact O-N 3.2Å; A117-R121 VanDerWaalsContact O-CB 3.29Å; A117-R121 WeakPolarHBondContact O-CB 3.33Å; A117-R121 PolarHBondContact O-N 2.87Å
118	A	83.6	Confident	79	Confident	26 Å²	26	62.6 Å²	62.6	22%	0.215	34%	0.335	C	S	.	.	H	α-helix	trans	-67.3	-42.5	175	0	0	0	0	0	112	L114 G115 M116 R121 L122	L114-A118 PolarHBondContact O-N 3.5Å; G115-A118 WeakPolarHBondContact O-CB 3.3Å; G115-A118 PolarHBondContact O-N 2.83Å; M116-A118 VanDerWaalsContact C-N 3.31Å; M116-A118 PolarHBondContact O-N 2.89Å; A118-R121 PolarHBondContact O-N 3.13Å; A118-L122 VanDerWaalsContact O-CG 3.32Å; A118-L122 WeakPolarHBondContact O-CG 3.46Å; A118-L122 PolarHBondContact O-N 3.41Å
119	V	86.4	Confident	81.4	Confident	20 Å²	20	56.6 Å²	56.6	12%	0.121	29%	0.293	C	S	.	.	H	α-helix	trans	-60.1	-50.4	174.9	166.6	0	0	0	0	111.3	G115 M116 R121 L122 Q123 V215 V219 L223	G115-V119 WeakPolarHBondContact O-CG2 3.41Å; G115-V119 PolarHBondContact O-N 3.25Å; M116-V119 PolarHBondContact O-N 3.08Å; V119-R121 VanDerWaalsContact C-N 3.34Å; V119-R121 PolarHBondContact O-N 2.88Å; V119-L122 PolarHBondContact O-N 3.44Å; V119-Q123 PolarHBondContact O-N 3Å; V119-V215 HydrophobicContact CG2-CB 4.35Å; V119-V215 HydrophobicContact CG2-CG1 3.36Å; V119-V215 HydrophobicContact CG2-CG2 3.98Å; V119-V219 HydrophobicContact CB-CG1 4.41Å; V119-V219 HydrophobicContact CG1-CG1 3.46Å; V119-V219 VanDerWaalsContact CG1-CG1 3.46Å; V119-V219 HydrophobicContact CG2-CG1 4Å; V119-L223 HydrophobicContact CB-CD1 4.16Å; V119-L223 HydrophobicContact CG1-CD1 3.7Å; V119-L223 HydrophobicContact CG2-CD1 4.28Å
120	D	88.8	Confident	83.6	Confident	62 Å²	62	52.9 Å²	52.9	33%	0.332	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-43.8	179.5	177.7	69.9	0	0	0	111.5	M116 L122 Q123 R124	M116-D120 PolarHBondContact O-N 2.71Å; D120-L122 PolarHBondContact O-N 3.35Å; D120-Q123 PolarHBondContact O-N 3.22Å; D120-R124 WeakPolarHBondContact O-CG 3.44Å; D120-R124 PolarHBondContact O-N 3.29Å; D120-R124 IonicContact OD1-CZ 2.7Å; D120-R124 IonicContact OD1-NE 2.75Å; D120-R124 PolarHBondContact OD1-NE 3.45Å; D120-R124 IonicContact OD1-NH2 2.69Å; D120-R124 PolarHBondContact OD1-NH2 3.48Å; D120-R124 IonicContact OD2-CZ 3.79Å; D120-R124 IonicContact OD2-NE 3.56Å; D120-R124 PolarHBondContact OD2-NE 3.33Å; D120-R124 IonicContact OD2-NH2 3.51Å; D120-R124 PolarHBondContact OD2-NH2 2.86Å
121	R	91.4	Very high	85.5	Confident	119 Å²	119	47 Å²	47	45%	0.449	24%	0.24	S	C	.	.	H	α-helix	trans	-58.7	-45.2	175.2	-174.7	-176.1	70.7	-171	0.3	112.3	A117 A118 V119 R124 Q125	A117-R121 VanDerWaalsContact O-CB 3.29Å; A117-R121 WeakPolarHBondContact O-CB 3.33Å; A117-R121 PolarHBondContact O-N 2.87Å; A118-R121 PolarHBondContact O-N 3.13Å; V119-R121 VanDerWaalsContact C-N 3.34Å; V119-R121 PolarHBondContact O-N 2.88Å; R121-R124 PolarHBondContact O-N 3.45Å; R121-Q125 WeakPolarHBondContact O-CG 3.37Å; R121-Q125 PolarHBondContact O-N 3.31Å
122	L	93.9	Very high	87.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-43.7	178	-74.5	164.9	0	0	0	111	A118 V119 D120 R124 Q125 I126 C165 D168 I169 L172 L223	A118-L122 VanDerWaalsContact O-CG 3.32Å; A118-L122 WeakPolarHBondContact O-CG 3.46Å; A118-L122 PolarHBondContact O-N 3.41Å; V119-L122 PolarHBondContact O-N 3.44Å; D120-L122 PolarHBondContact O-N 3.35Å; L122-R124 PolarHBondContact O-N 2.96Å; L122-Q125 PolarHBondContact O-N 3.1Å; L122-I126 WeakPolarHBondContact O-CD1 3.39Å; L122-I126 VanDerWaalsContact O-CG1 3.27Å; L122-I126 WeakPolarHBondContact O-CG1 3.31Å; L122-I126 PolarHBondContact O-N 2.95Å; L122-C165 HydrophobicContact CD2-CB 4.34Å; L122-D168 HydrophobicContact CD2-CB 4.09Å; L122-I169 HydrophobicContact CD1-CG1 3.82Å; L122-I169 HydrophobicContact CD2-CG1 4.27Å; L122-L172 HydrophobicContact CD1-CD1 3.83Å; L122-L223 HydrophobicContact CB-CD1 4.19Å
123	Q	95	Very high	89	Confident	23 Å²	23	39.6 Å²	39.6	11%	0.107	20%	0.197	C	C	.	.	H	α-helix	trans	-57.8	-47.1	176.7	-169.4	169.1	-87.2	0	0	111.6	V119 D120 Q125 I126 I127 R222 L223	V119-Q123 PolarHBondContact O-N 3Å; D120-Q123 PolarHBondContact O-N 3.22Å; Q123-Q125 PolarHBondContact O-N 3.02Å; Q123-I126 PolarHBondContact O-N 3.41Å; Q123-I127 HydrophobicContact CG-CD1 4.04Å; Q123-I127 WeakPolarHBondContact O-CG1 3.28Å; Q123-I127 PolarHBondContact O-N 3.46Å; Q123-R222 VanDerWaalsContact OE1-NH1 3.16Å; Q123-L223 HydrophobicContact CB-CD2 3.86Å; Q123-L223 HydrophobicContact CG-CD2 4.18Å
124	R	96.2	Very high	90.5	Very high	14 Å²	14	31.4 Å²	31.4	5%	0.053	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-41.3	176.9	-70.7	173.5	-169.2	-96.1	-5.8	112.6	L89 C90 E93 D120 R121 L122 I126 I127 I128	L89-R124 PolarHBondContact O-NH1 3.47Å; C90-R124 HydrophobicContact CB-CB 4.06Å; C90-R124 HydrophobicContact CB-CG 4.31Å; E93-R124 IonicContact OE2-CZ 3.48Å; E93-R124 IonicContact OE2-NH1 2.79Å; E93-R124 PolarHBondContact OE2-NH1 3.43Å; E93-R124 IonicContact OE2-NH2 3.26Å; E93-R124 PolarHBondContact OE2-NH2 3.27Å; D120-R124 WeakPolarHBondContact O-CG 3.44Å; D120-R124 PolarHBondContact O-N 3.29Å; D120-R124 IonicContact OD1-CZ 2.7Å; D120-R124 IonicContact OD1-NE 2.75Å; D120-R124 PolarHBondContact OD1-NE 3.45Å; D120-R124 IonicContact OD1-NH2 2.69Å; D120-R124 PolarHBondContact OD1-NH2 3.48Å; D120-R124 IonicContact OD2-CZ 3.79Å; D120-R124 IonicContact OD2-NE 3.56Å; D120-R124 PolarHBondContact OD2-NE 3.33Å; D120-R124 IonicContact OD2-NH2 3.51Å; D120-R124 PolarHBondContact OD2-NH2 2.86Å; R121-R124 PolarHBondContact O-N 3.45Å; L122-R124 PolarHBondContact O-N 2.96Å; R124-I126 VanDerWaalsContact C-N 3.33Å; R124-I126 PolarHBondContact O-N 3.11Å; R124-I127 PolarHBondContact O-N 3.21Å; R124-I128 VanDerWaalsContact O-CG1 3.26Å; R124-I128 WeakPolarHBondContact O-CG1 3.5Å; R124-I128 PolarHBondContact O-N 2.86Å
125	Q	96.8	Very high	91.7	Very high	39 Å²	39	26.9 Å²	26.9	18%	0.182	14%	0.143	C	C	.	.	H	α-helix	trans	-64.1	-39.3	176.9	-75.2	178.5	-11.2	0	0	111.9	R121 L122 Q123 I128 A129 M161 C165	R121-Q125 WeakPolarHBondContact O-CG 3.37Å; R121-Q125 PolarHBondContact O-N 3.31Å; L122-Q125 PolarHBondContact O-N 3.1Å; Q123-Q125 PolarHBondContact O-N 3.02Å; Q125-I128 PolarHBondContact O-N 2.84Å; Q125-A129 PolarHBondContact O-N 2.83Å; Q125-M161 HydrophobicContact CB-CE 4.42Å; Q125-M161 VanDerWaalsContact O-CE 3.25Å; Q125-M161 WeakPolarHBondContact O-CE 3.33Å; Q125-C165 VanDerWaalsContact CB-SG 3.56Å
126	I	97.9	Very high	92.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.1	-46.8	174.6	-63.3	160.1	0	0	0	110.3	L122 Q123 R124 I128 A129 D130 Y162 C165 I169 L223 S226 V227	L122-I126 WeakPolarHBondContact O-CD1 3.39Å; L122-I126 VanDerWaalsContact O-CG1 3.27Å; L122-I126 WeakPolarHBondContact O-CG1 3.31Å; L122-I126 PolarHBondContact O-N 2.95Å; Q123-I126 PolarHBondContact O-N 3.41Å; R124-I126 VanDerWaalsContact C-N 3.33Å; R124-I126 PolarHBondContact O-N 3.11Å; I126-I128 VanDerWaalsContact C-N 3.34Å; I126-I128 PolarHBondContact O-N 3.23Å; I126-A129 WeakPolarHBondContact O-CA 3.35Å; I126-A129 WeakPolarHBondContact O-CB 3.41Å; I126-A129 PolarHBondContact O-N 2.89Å; I126-D130 VanDerWaalsContact O-CG 3.3Å; I126-D130 PolarHBondContact O-N 3.25Å; I126-Y162 HydrophobicContact CG2-CE1 4.35Å; I126-C165 HydrophobicContact CG1-CB 4.04Å; I126-I169 HydrophobicContact CD1-CD1 4.11Å; I126-L223 HydrophobicContact CD1-CD2 4.28Å; I126-S226 WeakPolarHBondContact CG2-OG 3.25Å; I126-V227 HydrophobicContact CD1-CB 3.8Å; I126-V227 HydrophobicContact CD1-CG2 4.45Å; I126-V227 HydrophobicContact CG1-CB 3.98Å; I126-V227 HydrophobicContact CG1-CG2 4.15Å
127	I	98	Very high	93.5	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-59.5	-42.1	177.8	-69.8	165	0	0	0	111.8	P53 L54 F57 T86 C90 Q123 R124 A129 D130 C131	P53-I127 HydrophobicContact CB-CD1 4.14Å; L54-I127 HydrophobicContact CD1-CD1 4.47Å; F57-I127 HydrophobicContact CB-CD1 4.39Å; F57-I127 HydrophobicContact CB-CG1 4.25Å; F57-I127 HydrophobicContact CB-CG2 3.82Å; F57-I127 HydrophobicContact CD2-CG2 3.84Å; F57-I127 HydrophobicContact CG-CG1 4.24Å; F57-I127 HydrophobicContact CG-CG2 4Å; T86-I127 HydrophobicContact CG2-CG2 3.71Å; C90-I127 VanDerWaalsContact SG-CG2 3.52Å; Q123-I127 HydrophobicContact CG-CD1 4.04Å; Q123-I127 WeakPolarHBondContact O-CG1 3.28Å; Q123-I127 PolarHBondContact O-N 3.46Å; R124-I127 PolarHBondContact O-N 3.21Å; I127-A129 VanDerWaalsContact C-N 3.32Å; I127-A129 PolarHBondContact O-N 3.47Å; I127-D130 PolarHBondContact O-N 3.35Å; I127-C131 PolarHBondContact O-N 3.47Å; I127-C131 PolarHBondContact O-SG 3.17Å
128	I	97.9	Very high	93.9	Very high	8 Å²	8	20.4 Å²	20.4	4%	0.041	10%	0.102	C	C	.	.	H	α-helix	trans	-62.3	-42.8	175.3	-67.4	163.5	0	0	0	110.2	E87 C90 E91 R124 Q125 I126 D130 C131 Q132 M161	E87-I128 HydrophobicContact CG-CG2 4.34Å; C90-I128 HydrophobicContact CB-CD1 3.67Å; C90-I128 HydrophobicContact CB-CG1 3.5Å; E91-I128 HydrophobicContact CG-CD1 4.03Å; R124-I128 VanDerWaalsContact O-CG1 3.26Å; R124-I128 WeakPolarHBondContact O-CG1 3.5Å; R124-I128 PolarHBondContact O-N 2.86Å; Q125-I128 PolarHBondContact O-N 2.84Å; I126-I128 VanDerWaalsContact C-N 3.34Å; I126-I128 PolarHBondContact O-N 3.23Å; I128-D130 VanDerWaalsContact C-N 3.34Å; I128-D130 PolarHBondContact O-N 3.28Å; I128-C131 PolarHBondContact O-N 2.94Å; I128-Q132 HydrophobicContact CG2-CG 4.4Å; I128-Q132 VanDerWaalsContact O-CG 3.22Å; I128-Q132 WeakPolarHBondContact O-CG 3.03Å; I128-Q132 PolarHBondContact O-N 3.34Å; I128-M161 HydrophobicContact CB-CE 3.62Å; I128-M161 HydrophobicContact CG2-CE 3.44Å; I128-M161 VanDerWaalsContact CG2-CE 3.44Å; I128-M161 HydrophobicContact CG2-SD 4.02Å
129	A	97.6	Very high	94	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.4	-43.4	176.8	0	0	0	0	0	111.5	Q125 I126 I127 Q132 V133 M161 Y162	Q125-A129 PolarHBondContact O-N 2.83Å; I126-A129 WeakPolarHBondContact O-CA 3.35Å; I126-A129 WeakPolarHBondContact O-CB 3.41Å; I126-A129 PolarHBondContact O-N 2.89Å; I127-A129 VanDerWaalsContact C-N 3.32Å; I127-A129 PolarHBondContact O-N 3.47Å; A129-Q132 WeakPolarHBondContact O-CB 3.45Å; A129-Q132 PolarHBondContact O-N 2.95Å; A129-V133 WeakPolarHBondContact O-CG2 3.32Å; A129-V133 PolarHBondContact O-N 2.86Å; A129-M161 HydrophobicContact CB-CB 3.85Å; A129-M161 HydrophobicContact CB-CE 4.48Å; A129-Y162 HydrophobicContact CB-CD1 4.08Å; A129-Y162 HydrophobicContact CB-CD2 4.01Å; A129-Y162 HydrophobicContact CB-CE1 3.82Å; A129-Y162 HydrophobicContact CB-CE2 3.73Å; A129-Y162 HydrophobicContact CB-CG 4.17Å
130	D	97.5	Very high	93.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60	-47.9	175.2	-62.2	-41.6	0	0	0	111.4	F57 I126 I127 I128 Q132 V133 Y134 Y162 K275	F57-D130 HydrophobicContact CD2-CB 4.4Å; F57-D130 HydrophobicContact CE2-CB 3.37Å; F57-D130 HydrophobicContact CZ-CB 3.53Å; I126-D130 VanDerWaalsContact O-CG 3.3Å; I126-D130 PolarHBondContact O-N 3.25Å; I127-D130 PolarHBondContact O-N 3.35Å; I128-D130 VanDerWaalsContact C-N 3.34Å; I128-D130 PolarHBondContact O-N 3.28Å; D130-Q132 VanDerWaalsContact C-N 3.29Å; D130-Q132 PolarHBondContact O-N 3.41Å; D130-V133 PolarHBondContact O-N 3.37Å; D130-V133 VanDerWaalsContact O-N 3.14Å; D130-Y134 HydrophobicContact CB-CE2 4.21Å; D130-Y134 WeakPolarHBondContact O-CD2 3.34Å; D130-Y134 VanDerWaalsContact O-CG 3.31Å; D130-Y134 PolarHBondContact O-N 3.08Å; D130-Y162 VanDerWaalsContact CA-OH 3.23Å; D130-Y162 WeakPolarHBondContact CA-OH 3.46Å; D130-Y162 PolarHBondContact N-OH 2.96Å; D130-Y162 PolarHBondContact OD1-OH 2.82Å; D130-K275 VanDerWaalsContact OD1-CE 3.31Å; D130-K275 WeakPolarHBondContact OD1-CE 3.28Å; D130-K275 IonicContact OD1-NZ 3.62Å; D130-K275 WeakPolarHBondContact OD2-CE 3.28Å; D130-K275 IonicContact OD2-NZ 3.88Å; D130-K275 PolarHBondContact OD2-NZ 3.01Å
131	C	97.7	Very high	93.5	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.6	-42	177.4	-67.6	0	0	0	0	111.5	L83 I127 I128 Y134 L135	L83-C131 HydrophobicContact CD2-CB 4.44Å; I127-C131 PolarHBondContact O-N 3.47Å; I127-C131 PolarHBondContact O-SG 3.17Å; I128-C131 PolarHBondContact O-N 2.94Å; C131-Y134 PolarHBondContact O-N 3.49Å; C131-L135 WeakPolarHBondContact O-CB 3.39Å; C131-L135 WeakPolarHBondContact O-CD1 3.41Å; C131-L135 WeakPolarHBondContact O-CG 3.4Å; C131-L135 PolarHBondContact O-N 2.88Å
132	Q	95.8	Very high	92.6	Very high	11 Å²	11	20 Å²	20	5%	0.051	10%	0.097	C	C	.	.	H	α-helix	trans	-62.2	-43.7	176.5	-69.7	-75.5	-61.2	0	0	111.5	E87 I128 A129 D130 L135 A136 I154 A158	E87-Q132 PolarHBondContact OE1-NE2 3.15Å; E87-Q132 PolarHBondContact OE2-NE2 3.47Å; I128-Q132 HydrophobicContact CG2-CG 4.4Å; I128-Q132 VanDerWaalsContact O-CG 3.22Å; I128-Q132 WeakPolarHBondContact O-CG 3.03Å; I128-Q132 PolarHBondContact O-N 3.34Å; A129-Q132 WeakPolarHBondContact O-CB 3.45Å; A129-Q132 PolarHBondContact O-N 2.95Å; D130-Q132 VanDerWaalsContact C-N 3.29Å; D130-Q132 PolarHBondContact O-N 3.41Å; Q132-L135 PolarHBondContact O-N 3.22Å; Q132-A136 PolarHBondContact O-N 3.14Å; Q132-I154 HydrophobicContact CB-CG2 3.96Å; Q132-I154 WeakPolarHBondContact O-CG2 3.25Å; Q132-A158 HydrophobicContact CB-CB 3.91Å
133	V	95.1	Very high	91.3	Very high	27 Å²	27	24.6 Å²	24.6	16%	0.164	12%	0.119	C	C	.	.	H	α-helix	trans	-58.8	-50	175.1	173.6	0	0	0	0	110.9	A129 D130 L135 A136 V137 L155 A158 Y162 F234	A129-V133 WeakPolarHBondContact O-CG2 3.32Å; A129-V133 PolarHBondContact O-N 2.86Å; D130-V133 PolarHBondContact O-N 3.37Å; D130-V133 VanDerWaalsContact O-N 3.14Å; V133-L135 VanDerWaalsContact C-N 3.35Å; V133-L135 PolarHBondContact O-N 3.44Å; V133-A136 WeakPolarHBondContact O-CB 3.29Å; V133-A136 PolarHBondContact O-N 2.87Å; V133-A136 VanDerWaalsContact O-N 3.11Å; V133-V137 WeakPolarHBondContact O-CG2 3.46Å; V133-V137 PolarHBondContact O-N 3.19Å; V133-L155 HydrophobicContact CG1-CD2 4.43Å; V133-L155 HydrophobicContact CG2-CD2 4.31Å; V133-A158 HydrophobicContact CG2-CB 3.76Å; V133-Y162 HydrophobicContact CG2-CE2 3.78Å; V133-F234 HydrophobicContact CG2-CE2 3.7Å; V133-F234 HydrophobicContact CG2-CZ 4.08Å
134	Y	95.4	Very high	90.4	Very high	18 Å²	18	29 Å²	29	7%	0.071	14%	0.139	C	C	.	.	H	α-helix	trans	-65.5	-37.9	-177.2	-60	-21.5	0	0	0	112.5	F57 F61 F64 L83 D130 C131 A136 V137 L138	F57-Y134 HydrophobicContact CE2-CD2 4.21Å; F57-Y134 AromaticContact CE2-CE2 3.61Å; F57-Y134 HydrophobicContact CE2-CE2 3.61Å; F57-Y134 AromaticContact CZ-CE2 3.63Å; F57-Y134 HydrophobicContact CZ-CE2 3.63Å; F61-Y134 HydrophobicContact CD2-CD2 4.41Å; F61-Y134 AromaticContact CD2-CE2 3.55Å; F61-Y134 HydrophobicContact CD2-CE2 3.55Å; F61-Y134 AromaticContact CD2-CZ 3.67Å; F61-Y134 HydrophobicContact CE2-CE2 4.24Å; F61-Y134 AromaticContact CE2-CZ 3.89Å; F61-Y134 HydrophobicContact CG-CE2 4.5Å; F64-Y134 HydrophobicContact CD1-CD1 4.03Å; F64-Y134 HydrophobicContact CD1-CD2 4.18Å; F64-Y134 HydrophobicContact CD1-CE1 4.46Å; F64-Y134 AromaticContact CD1-CG 3.9Å; F64-Y134 HydrophobicContact CD1-CG 3.9Å; F64-Y134 HydrophobicContact CD2-CG 4.23Å; F64-Y134 AromaticContact CE1-CD1 3.54Å; F64-Y134 HydrophobicContact CE1-CD1 3.54Å; F64-Y134 HydrophobicContact CE1-CD2 4.5Å; F64-Y134 HydrophobicContact CE1-CE1 4Å; F64-Y134 AromaticContact CE1-CG 3.85Å; F64-Y134 HydrophobicContact CE1-CG 3.85Å; F64-Y134 HydrophobicContact CE2-CD1 4.31Å; F64-Y134 HydrophobicContact CE2-CG 4.17Å; F64-Y134 WeakPolarHBondContact CE2-O 3.49Å; F64-Y134 HydrophobicContact CG-CD2 4.36Å; F64-Y134 HydrophobicContact CG-CG 4.08Å; F64-Y134 AromaticContact CZ-CD1 3.69Å; F64-Y134 HydrophobicContact CZ-CD1 3.69Å; F64-Y134 AromaticContact CZ-CG 3.97Å; F64-Y134 HydrophobicContact CZ-CG 3.97Å; L83-Y134 HydrophobicContact CD2-CD2 3.82Å; L83-Y134 HydrophobicContact CD2-CG 4.47Å; D130-Y134 HydrophobicContact CB-CE2 4.21Å; D130-Y134 WeakPolarHBondContact O-CD2 3.34Å; D130-Y134 VanDerWaalsContact O-CG 3.31Å; D130-Y134 PolarHBondContact O-N 3.08Å; C131-Y134 PolarHBondContact O-N 3.49Å; Y134-A136 VanDerWaalsContact C-N 3.34Å; Y134-A136 PolarHBondContact O-N 3.37Å; Y134-V137 PolarHBondContact O-N 2.92Å; Y134-L138 WeakPolarHBondContact O-CG 3.3Å; Y134-L138 PolarHBondContact O-N 3.01Å
135	L	94.1	Very high	89.1	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-36.4	172.3	-71.1	167.7	0	0	0	112.6	F80 L83 K84 C131 Q132 V133 S139	F80-L135 HydrophobicContact CD2-CD2 3.33Å; F80-L135 HydrophobicContact CE2-CD2 3.62Å; F80-L135 HydrophobicContact CG-CD2 4.02Å; F80-L135 HydrophobicContact CZ-CD2 4.48Å; L83-L135 HydrophobicContact CB-CD2 4Å; L83-L135 HydrophobicContact CB-CG 4.11Å; L83-L135 HydrophobicContact CD1-CD2 4.13Å; L83-L135 HydrophobicContact CD1-CG 4.18Å; K84-L135 HydrophobicContact CD-CD1 4.24Å; K84-L135 VanDerWaalsContact CE-CD1 3.49Å; K84-L135 HydrophobicContact CG-CD1 4.48Å; K84-L135 HydrophobicContact CG-CD2 4.37Å; C131-L135 WeakPolarHBondContact O-CB 3.39Å; C131-L135 WeakPolarHBondContact O-CD1 3.41Å; C131-L135 WeakPolarHBondContact O-CG 3.4Å; C131-L135 PolarHBondContact O-N 2.88Å; Q132-L135 PolarHBondContact O-N 3.22Å; V133-L135 VanDerWaalsContact C-N 3.35Å; V133-L135 PolarHBondContact O-N 3.44Å; L135-S139 WeakPolarHBondContact O-CB 3.42Å; L135-S139 PolarHBondContact O-N 3.36Å; L135-S139 PolarHBondContact O-OG 2.89Å
136	A	92.1	Very high	88.1	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-43.6	173.3	0	0	0	0	0	111.2	Q132 V133 Y134 S139 F140 I154 L155	Q132-A136 PolarHBondContact O-N 3.14Å; V133-A136 WeakPolarHBondContact O-CB 3.29Å; V133-A136 PolarHBondContact O-N 2.87Å; V133-A136 VanDerWaalsContact O-N 3.11Å; Y134-A136 VanDerWaalsContact C-N 3.34Å; Y134-A136 PolarHBondContact O-N 3.37Å; A136-S139 WeakPolarHBondContact O-CB 3.47Å; A136-S139 PolarHBondContact O-N 3.41Å; A136-S139 VanDerWaalsContact O-N 3.11Å; A136-F140 HydrophobicContact CB-CE2 4.25Å; A136-F140 VanDerWaalsContact O-CD2 3.31Å; A136-F140 WeakPolarHBondContact O-CD2 3.37Å; A136-F140 VanDerWaalsContact O-CG 3.31Å; A136-F140 WeakPolarHBondContact O-CG 3.44Å; A136-F140 PolarHBondContact O-N 3.4Å; A136-I154 HydrophobicContact CB-CB 4.19Å; A136-I154 HydrophobicContact CB-CG2 3.83Å; A136-L155 HydrophobicContact CB-CD2 3.89Å; A136-L155 HydrophobicContact CB-CG 3.84Å
137	V	91.5	Very high	87.1	Confident	47 Å²	47	37.6 Å²	37.6	29%	0.285	20%	0.195	S	C	.	.	H	α-helix	trans	-59.1	-49.6	175.7	172.8	0	0	0	0	111.2	F64 V68 V133 Y134 S139 F140 I141	F64-V137 HydrophobicContact CE2-CB 4.04Å; F64-V137 HydrophobicContact CE2-CG1 3.99Å; F64-V137 HydrophobicContact CZ-CB 4.01Å; F64-V137 HydrophobicContact CZ-CG1 3.84Å; V68-V137 HydrophobicContact CG2-CG1 4.24Å; V133-V137 WeakPolarHBondContact O-CG2 3.46Å; V133-V137 PolarHBondContact O-N 3.19Å; Y134-V137 PolarHBondContact O-N 2.92Å; V137-S139 PolarHBondContact O-N 2.87Å; V137-F140 PolarHBondContact O-N 3.34Å; V137-F140 VanDerWaalsContact O-N 3.11Å; V137-I141 HydrophobicContact CG1-CD1 3.84Å; V137-I141 HydrophobicContact CG1-CG1 4.43Å; V137-I141 VanDerWaalsContact O-CG1 3.28Å; V137-I141 WeakPolarHBondContact O-CG1 3.49Å; V137-I141 PolarHBondContact O-N 3.04Å
138	L	89.4	Confident	86.1	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-33.7	175.3	-70	176.9	0	0	0	112.4	F64 A67 V68 M76 A79 F80 L83 Y134	F64-L138 HydrophobicContact CD2-CD1 4.22Å; F64-L138 HydrophobicContact CD2-CD2 4.07Å; F64-L138 HydrophobicContact CD2-CG 3.93Å; F64-L138 HydrophobicContact CE2-CD2 4.21Å; F64-L138 HydrophobicContact CE2-CG 4Å; A67-L138 HydrophobicContact CB-CD2 4.37Å; V68-L138 HydrophobicContact CG2-CD2 4.08Å; M76-L138 HydrophobicContact CB-CD2 4.43Å; M76-L138 HydrophobicContact CG-CD2 4.23Å; A79-L138 HydrophobicContact CB-CD1 4.09Å; F80-L138 HydrophobicContact CB-CD1 4.19Å; L83-L138 HydrophobicContact CD1-CD1 3.92Å; Y134-L138 WeakPolarHBondContact O-CG 3.3Å; Y134-L138 PolarHBondContact O-N 3.01Å
139	S	86.3	Confident	85.2	Confident	17 Å²	17	47.6 Å²	47.6	12%	0.119	24%	0.24	C	C	.	.	H	α-helix	trans	-70.7	-41.6	176.2	-57.4	0	0	0	0	112.1	L135 A136 V137 I141 K142 A147	L135-S139 WeakPolarHBondContact O-CB 3.42Å; L135-S139 PolarHBondContact O-N 3.36Å; L135-S139 PolarHBondContact O-OG 2.89Å; A136-S139 WeakPolarHBondContact O-CB 3.47Å; A136-S139 PolarHBondContact O-N 3.41Å; A136-S139 VanDerWaalsContact O-N 3.11Å; V137-S139 PolarHBondContact O-N 2.87Å; S139-I141 VanDerWaalsContact C-N 3.32Å; S139-I141 PolarHBondContact O-N 2.97Å; S139-K142 PolarHBondContact O-N 2.94Å; S139-A147 WeakPolarHBondContact O-CB 3.33Å
140	F	83.9	Confident	84.4	Confident	58 Å²	58	53.9 Å²	53.9	25%	0.254	27%	0.267	S	S	.	.	H	α-helix	trans	-67.4	-33.3	178.7	-62.9	-35	0	0	0	113.3	A136 V137 K142 Q143 Y148 G151 L155	A136-F140 HydrophobicContact CB-CE2 4.25Å; A136-F140 VanDerWaalsContact O-CD2 3.31Å; A136-F140 WeakPolarHBondContact O-CD2 3.37Å; A136-F140 VanDerWaalsContact O-CG 3.31Å; A136-F140 WeakPolarHBondContact O-CG 3.44Å; A136-F140 PolarHBondContact O-N 3.4Å; V137-F140 PolarHBondContact O-N 3.34Å; V137-F140 VanDerWaalsContact O-N 3.11Å; F140-K142 PolarHBondContact O-N 3.12Å; F140-Q143 PolarHBondContact O-N 3.11Å; F140-Y148 HydrophobicContact CB-CE1 4.39Å; F140-Y148 AromaticContact CD1-CD1 3.63Å; F140-Y148 HydrophobicContact CD1-CD1 3.63Å; F140-Y148 HydrophobicContact CD1-CE1 4.26Å; F140-Y148 HydrophobicContact CE1-CD1 4.21Å; F140-Y148 HydrophobicContact CG-CD1 4.43Å; F140-G151 VanDerWaalsContact CE1-CA 3.49Å; F140-G151 VanDerWaalsContact CZ-C 3.45Å; F140-L155 HydrophobicContact CE2-CD1 3.71Å; F140-L155 HydrophobicContact CE2-CG 4.31Å; F140-L155 HydrophobicContact CZ-CD1 3.83Å; F140-L155 HydrophobicContact CZ-CG 4.38Å
141	I	80.6	Confident	83.8	Confident	23 Å²	23	53.9 Å²	53.9	12%	0.118	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-30.6	176.5	-75.7	173.5	0	0	0	111.6	V68 F71 M76 V137 S139 Q143	V68-I141 HydrophobicContact CB-CD1 4.17Å; V68-I141 HydrophobicContact CG1-CD1 3.88Å; V68-I141 HydrophobicContact CG2-CD1 3.66Å; F71-I141 HydrophobicContact CD2-CG2 3.67Å; F71-I141 HydrophobicContact CE2-CB 4.34Å; F71-I141 HydrophobicContact CE2-CG2 3.22Å; F71-I141 HydrophobicContact CZ-CG2 3.9Å; M76-I141 HydrophobicContact SD-CG2 3.49Å; M76-I141 WeakPolarHBondContact SD-CG2 3.16Å; V137-I141 HydrophobicContact CG1-CD1 3.84Å; V137-I141 HydrophobicContact CG1-CG1 4.43Å; V137-I141 VanDerWaalsContact O-CG1 3.28Å; V137-I141 WeakPolarHBondContact O-CG1 3.49Å; V137-I141 PolarHBondContact O-N 3.04Å; S139-I141 VanDerWaalsContact C-N 3.32Å; S139-I141 PolarHBondContact O-N 2.97Å; I141-Q143 PolarHBondContact O-N 3.39Å
142	K	72.3	Confident	83.1	Confident	120 Å²	120	54.4 Å²	54.4	52%	0.522	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.4	174.8	-64.4	-171.7	176.6	-169.5	0	114.1	S139 F140 E144	S139-K142 PolarHBondContact O-N 2.94Å; F140-K142 PolarHBondContact O-N 3.12Å; K142-E144 PolarHBondContact O-N 2.99Å; K142-E144 VanDerWaalsContact O-N 3.12Å
143	Q	67	Low	82.6	Confident	99 Å²	99	61.5 Å²	61.5	46%	0.463	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	26.5	173.8	-60.9	-177.6	6	0	0	116.2	F140 I141 Y148	F140-Q143 PolarHBondContact O-N 3.11Å; I141-Q143 PolarHBondContact O-N 3.39Å; Q143-Y148 WeakPolarHBondContact CA-OH 3.44Å
144	E	75.1	Confident	82.3	Confident	114 Å²	114	61.6 Å²	61.6	53%	0.533	30%	0.299	S	S	.	.			trans	-90.2	140.4	174.3	-63.6	-178.7	174.8	0	0	111.6	K142 S146 A147 Y148	K142-E144 PolarHBondContact O-N 2.99Å; K142-E144 VanDerWaalsContact O-N 3.12Å; E144-S146 VanDerWaalsContact C-N 3.3Å; E144-S146 PolarHBondContact O-N 3.06Å; E144-A147 HydrophobicContact CB-CB 3.95Å; E144-A147 WeakPolarHBondContact O-CA 3.25Å; E144-A147 VanDerWaalsContact O-CB 3.3Å; E144-A147 WeakPolarHBondContact O-CB 3.39Å; E144-A147 PolarHBondContact O-N 3.07Å; E144-Y148 WeakPolarHBondContact O-CD2 3.49Å; E144-Y148 PolarHBondContact O-N 2.86Å; E144-Y148 VanDerWaalsContact O-N 3.15Å
145	L	69.8	Low	82	Confident	144 Å²	144	62.8 Å²	62.8	75%	0.754	31%	0.306	S	S	*	.	H	α-helix	trans	-58.5	-41.5	-178.1	-161.5	81.3	0	0	0	112.6	A147 Y148	L145-A147 VanDerWaalsContact C-N 3.29Å; L145-A147 PolarHBondContact O-N 3.36Å; L145-Y148 PolarHBondContact O-N 3.47Å
146	S	74.8	Confident	81.8	Confident	79 Å²	79	65.6 Å²	65.6	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-64.2	-33.5	175.1	54.4	0	0	0	0	112.3	E144 I149 K150	E144-S146 VanDerWaalsContact C-N 3.3Å; E144-S146 PolarHBondContact O-N 3.06Å; S146-I149 PolarHBondContact O-N 3.31Å; S146-K150 PolarHBondContact O-N 2.93Å; S146-K150 VanDerWaalsContact O-N 3.15Å
147	A	77	Confident	81.7	Confident	12 Å²	12	69.9 Å²	69.9	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-69.4	-32	177.2	0	0	0	0	0	112.1	S139 E144 L145 G151	S139-A147 WeakPolarHBondContact O-CB 3.33Å; E144-A147 HydrophobicContact CB-CB 3.95Å; E144-A147 WeakPolarHBondContact O-CA 3.25Å; E144-A147 VanDerWaalsContact O-CB 3.3Å; E144-A147 WeakPolarHBondContact O-CB 3.39Å; E144-A147 PolarHBondContact O-N 3.07Å; L145-A147 VanDerWaalsContact C-N 3.29Å; L145-A147 PolarHBondContact O-N 3.36Å; A147-G151 PolarHBondContact O-N 3.2Å
148	Y	76.8	Confident	81.8	Confident	104 Å²	104	67.6 Å²	67.6	41%	0.408	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-42.5	174.5	-64	-53.1	0	0	0	112.7	F140 Q143 E144 L145 G152	F140-Y148 HydrophobicContact CB-CE1 4.39Å; F140-Y148 AromaticContact CD1-CD1 3.63Å; F140-Y148 HydrophobicContact CD1-CD1 3.63Å; F140-Y148 HydrophobicContact CD1-CE1 4.26Å; F140-Y148 HydrophobicContact CE1-CD1 4.21Å; F140-Y148 HydrophobicContact CG-CD1 4.43Å; Q143-Y148 WeakPolarHBondContact CA-OH 3.44Å; E144-Y148 WeakPolarHBondContact O-CD2 3.49Å; E144-Y148 PolarHBondContact O-N 2.86Å; E144-Y148 VanDerWaalsContact O-N 3.15Å; L145-Y148 PolarHBondContact O-N 3.47Å; Y148-G152 PolarHBondContact O-N 3.35Å
149	I	79	Confident	82	Confident	116 Å²	116	67.8 Å²	67.8	60%	0.595	32%	0.322	S	S	*	.	H	α-helix	trans	-65.6	-48.2	178.3	-60.8	174.5	0	0	0	110.2	S146 G152 W153	S146-I149 PolarHBondContact O-N 3.31Å; I149-G152 PolarHBondContact O-N 2.96Å; I149-W153 PolarHBondContact O-N 2.72Å; I149-W153 VanDerWaalsContact O-N 3.08Å
150	K	81.3	Confident	82.3	Confident	131 Å²	131	72.7 Å²	72.7	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-61.2	-46.5	178.2	-175.6	179.6	178.1	-177.9	0	111.3	S146 G152 W153 I154	S146-K150 PolarHBondContact O-N 2.93Å; S146-K150 VanDerWaalsContact O-N 3.15Å; K150-G152 PolarHBondContact O-N 2.88Å; K150-W153 PolarHBondContact O-N 3.45Å; K150-I154 HydrophobicContact CG-CD1 3.98Å; K150-I154 VanDerWaalsContact O-CG1 3.31Å; K150-I154 WeakPolarHBondContact O-CG1 3.07Å; K150-I154 PolarHBondContact O-N 3.28Å
151	G	84.2	Confident	82.9	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-40.4	178.1	0	0	0	0	0	112.4	F140 A147 W153 I154 L155	F140-G151 VanDerWaalsContact CE1-CA 3.49Å; F140-G151 VanDerWaalsContact CZ-C 3.45Å; A147-G151 PolarHBondContact O-N 3.2Å; G151-W153 VanDerWaalsContact C-N 3.34Å; G151-W153 PolarHBondContact O-N 3.4Å; G151-I154 PolarHBondContact O-N 3.25Å; G151-L155 WeakPolarHBondContact O-CG 3.04Å; G151-L155 PolarHBondContact O-N 3.16Å
152	G	84.3	Confident	83.6	Confident	12 Å²	12	70.8 Å²	70.8	12%	0.124	33%	0.332	C	S	.	.	H	α-helix	trans	-60.2	-40.8	173.5	0	0	0	0	0	113	Y148 I149 K150 R156	Y148-G152 PolarHBondContact O-N 3.35Å; I149-G152 PolarHBondContact O-N 2.96Å; K150-G152 PolarHBondContact O-N 2.88Å; G152-R156 WeakPolarHBondContact O-CB 3.46Å; G152-R156 PolarHBondContact O-N 3.27Å
153	W	84.5	Confident	84.7	Confident	159 Å²	159	67.5 Å²	67.5	60%	0.602	32%	0.321	S	S	*	.	H	α-helix	trans	-68.2	-35.8	173.8	-103.1	102.7	0	0	0	113.7	I149 K150 G151 R156 K157	I149-W153 PolarHBondContact O-N 2.72Å; I149-W153 VanDerWaalsContact O-N 3.08Å; K150-W153 PolarHBondContact O-N 3.45Å; G151-W153 VanDerWaalsContact C-N 3.34Å; G151-W153 PolarHBondContact O-N 3.4Å; W153-R156 HydrophobicContact CE3-CB 4.48Å; W153-R156 WeakPolarHBondContact O-CA 3.34Å; W153-R156 WeakPolarHBondContact O-CB 3.39Å; W153-R156 PolarHBondContact O-N 3.39Å; W153-R156 VanDerWaalsContact O-N 3.14Å; W153-K157 PolarHBondContact O-N 2.85Å; W153-K157 VanDerWaalsContact O-N 3.17Å
154	I	88.9	Confident	86.1	Confident	29 Å²	29	68.1 Å²	68.1	15%	0.149	32%	0.322	C	S	.	.	H	α-helix	trans	-67.8	-47.2	176.2	-71.9	169.1	0	0	0	110.4	Q132 A136 K150 G151 R156 K157 A158	Q132-I154 HydrophobicContact CB-CG2 3.96Å; Q132-I154 WeakPolarHBondContact O-CG2 3.25Å; A136-I154 HydrophobicContact CB-CB 4.19Å; A136-I154 HydrophobicContact CB-CG2 3.83Å; K150-I154 HydrophobicContact CG-CD1 3.98Å; K150-I154 VanDerWaalsContact O-CG1 3.31Å; K150-I154 WeakPolarHBondContact O-CG1 3.07Å; K150-I154 PolarHBondContact O-N 3.28Å; G151-I154 PolarHBondContact O-N 3.25Å; I154-R156 PolarHBondContact O-N 3.18Å; I154-R156 VanDerWaalsContact O-N 3.15Å; I154-K157 WeakPolarHBondContact O-CB 3.34Å; I154-K157 PolarHBondContact O-N 3.24Å; I154-K157 VanDerWaalsContact O-N 3.08Å; I154-A158 PolarHBondContact O-N 2.97Å
155	L	89.8	Confident	87.1	Confident	43 Å²	43	62.7 Å²	62.7	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-54.5	-34	169.8	-74.1	-177.3	0	0	0	110.7	V133 A136 F140 G151 K157 A158 W159 F234	V133-L155 HydrophobicContact CG1-CD2 4.43Å; V133-L155 HydrophobicContact CG2-CD2 4.31Å; A136-L155 HydrophobicContact CB-CD2 3.89Å; A136-L155 HydrophobicContact CB-CG 3.84Å; F140-L155 HydrophobicContact CE2-CD1 3.71Å; F140-L155 HydrophobicContact CE2-CG 4.31Å; F140-L155 HydrophobicContact CZ-CD1 3.83Å; F140-L155 HydrophobicContact CZ-CG 4.38Å; G151-L155 WeakPolarHBondContact O-CG 3.04Å; G151-L155 PolarHBondContact O-N 3.16Å; L155-K157 VanDerWaalsContact C-N 3.35Å; L155-K157 PolarHBondContact O-N 3.08Å; L155-A158 PolarHBondContact O-N 3.31Å; L155-W159 PolarHBondContact O-N 3.16Å; L155-F234 HydrophobicContact CB-CE1 4.15Å; L155-F234 HydrophobicContact CB-CZ 4.23Å; L155-F234 HydrophobicContact CD2-CE1 4.25Å; L155-F234 HydrophobicContact CD2-CZ 3.79Å
156	R	88.4	Confident	88.4	Confident	64 Å²	64	57.9 Å²	57.9	24%	0.242	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-46.2	178.3	-162.5	-169.3	-173.6	176.6	2.9	113.2	G152 W153 I154 L252 F254	G152-R156 WeakPolarHBondContact O-CB 3.46Å; G152-R156 PolarHBondContact O-N 3.27Å; W153-R156 HydrophobicContact CE3-CB 4.48Å; W153-R156 WeakPolarHBondContact O-CA 3.34Å; W153-R156 WeakPolarHBondContact O-CB 3.39Å; W153-R156 PolarHBondContact O-N 3.39Å; W153-R156 VanDerWaalsContact O-N 3.14Å; I154-R156 PolarHBondContact O-N 3.18Å; I154-R156 VanDerWaalsContact O-N 3.15Å; R156-L252 VanDerWaalsContact CZ-O 3.32Å; R156-L252 PolarHBondContact NE-O 3.49Å; R156-L252 PolarHBondContact NH2-O 3.42Å; R156-F254 HydrophobicContact CB-CE2 3.69Å; R156-F254 HydrophobicContact CB-CZ 3.54Å; R156-F254 HydrophobicContact CG-CE1 4.14Å; R156-F254 HydrophobicContact CG-CE2 3.54Å; R156-F254 HydrophobicContact CG-CZ 3.08Å; R156-F254 VanDerWaalsContact O-CZ 3.23Å; R156-F254 WeakPolarHBondContact O-CZ 3.23Å
157	K	90.6	Very high	89.4	Confident	89 Å²	89	57.1 Å²	57.1	39%	0.387	26%	0.258	S	S	.	.	H	α-helix	trans	-65.1	-46.6	176.9	-173.9	-175.2	172.4	-164.7	0	110.6	E87 W153 I154 L155 W159 K160 M161	E87-K157 IonicContact OE1-NZ 3.73Å; W153-K157 PolarHBondContact O-N 2.85Å; W153-K157 VanDerWaalsContact O-N 3.17Å; I154-K157 WeakPolarHBondContact O-CB 3.34Å; I154-K157 PolarHBondContact O-N 3.24Å; I154-K157 VanDerWaalsContact O-N 3.08Å; L155-K157 VanDerWaalsContact C-N 3.35Å; L155-K157 PolarHBondContact O-N 3.08Å; K157-W159 PolarHBondContact O-N 2.96Å; K157-K160 PolarHBondContact O-N 3.41Å; K157-M161 HydrophobicContact CG-SD 4.24Å; K157-M161 WeakPolarHBondContact O-CG 3.36Å; K157-M161 PolarHBondContact O-N 3.49Å
158	A	94.1	Very high	90.1	Very high	0 Å²	0	59 Å²	59	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-48.4	-178.4	0	0	0	0	0	112.4	Q132 V133 I154 L155 K160 M161 Y162 F234	Q132-A158 HydrophobicContact CB-CB 3.91Å; V133-A158 HydrophobicContact CG2-CB 3.76Å; I154-A158 PolarHBondContact O-N 2.97Å; L155-A158 PolarHBondContact O-N 3.31Å; A158-K160 VanDerWaalsContact C-N 3.34Å; A158-K160 PolarHBondContact O-N 3.25Å; A158-M161 WeakPolarHBondContact O-CB 3.02Å; A158-M161 PolarHBondContact O-N 3.34Å; A158-M161 VanDerWaalsContact O-N 3.12Å; A158-Y162 HydrophobicContact CB-CE2 4.29Å; A158-Y162 WeakPolarHBondContact O-CD2 3.43Å; A158-Y162 PolarHBondContact O-N 3.44Å; A158-F234 HydrophobicContact CB-CE2 4.36Å; A158-F234 HydrophobicContact CB-CZ 4.1Å
159	W	93.8	Very high	91	Very high	11 Å²	11	54.1 Å²	54.1	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-54.8	-48.7	176.9	167.1	-89.1	0	0	0	112.5	L155 K157 M161 Y162 N163 Y231 F234 H235 F254 P255	L155-W159 PolarHBondContact O-N 3.16Å; K157-W159 PolarHBondContact O-N 2.96Å; W159-M161 PolarHBondContact O-N 3.3Å; W159-Y162 PolarHBondContact O-N 2.89Å; W159-Y162 VanDerWaalsContact O-N 3.13Å; W159-N163 HydrophobicContact CD2-CB 4.48Å; W159-N163 HydrophobicContact CH2-CB 4.47Å; W159-N163 HydrophobicContact CZ2-CB 3.95Å; W159-N163 WeakPolarHBondContact O-CB 3.37Å; W159-N163 PolarHBondContact O-N 3.07Å; W159-Y231 AromaticContact CH2-CD2 3.69Å; W159-Y231 HydrophobicContact CH2-CD2 3.69Å; W159-Y231 AromaticContact CH2-CE2 3.42Å; W159-Y231 HydrophobicContact CH2-CE2 3.42Å; W159-Y231 VanDerWaalsContact CH2-CE2 3.42Å; W159-Y231 HydrophobicContact CZ2-CE2 4.21Å; W159-Y231 AromaticContact CZ3-CD2 3.77Å; W159-Y231 HydrophobicContact CZ3-CD2 3.77Å; W159-Y231 HydrophobicContact CZ3-CE2 4.01Å; W159-Y231 HydrophobicContact CZ3-CG 4.43Å; W159-F234 HydrophobicContact CB-CD1 4.08Å; W159-F234 HydrophobicContact CB-CE1 3.89Å; W159-F234 HydrophobicContact CB-CZ 4.2Å; W159-F234 HydrophobicContact CE3-CB 3.38Å; W159-F234 AromaticContact CE3-CD1 3.99Å; W159-F234 HydrophobicContact CE3-CD1 3.99Å; W159-F234 HydrophobicContact CE3-CD2 4.18Å; W159-F234 AromaticContact CE3-CG 3.6Å; W159-F234 HydrophobicContact CE3-CG 3.6Å; W159-F234 HydrophobicContact CZ3-CB 3.58Å; W159-F234 HydrophobicContact CZ3-CG 4.29Å; W159-H235 AromaticContact CH2-CD2 3.51Å; W159-H235 AromaticContact CH2-NE2 3.23Å; W159-H235 WeakPolarHBondContact CH2-NE2 3.47Å; W159-H235 AromaticContact CZ3-CD2 3.83Å; W159-F254 HydrophobicContact CB-CD1 3.55Å; W159-F254 HydrophobicContact CB-CE1 3.45Å; W159-F254 VanDerWaalsContact CB-CE1 3.45Å; W159-F254 HydrophobicContact CB-CE2 4.4Å; W159-F254 HydrophobicContact CB-CG 4.08Å; W159-F254 HydrophobicContact CB-CZ 3.84Å; W159-F254 AromaticContact CD1-CD1 2.87Å; W159-F254 AromaticContact CD1-CE1 3Å; W159-F254 AromaticContact CD2-CD1 3.84Å; W159-F254 HydrophobicContact CD2-CD1 3.84Å; W159-F254 HydrophobicContact CD2-CE1 4.48Å; W159-F254 HydrophobicContact CD2-CG 4.37Å; W159-F254 AromaticContact CE2-CD1 3.99Å; W159-F254 HydrophobicContact CG-CB 4.42Å; W159-F254 AromaticContact CG-CD1 3.05Å; W159-F254 HydrophobicContact CG-CD1 3.05Å; W159-F254 AromaticContact CG-CE1 3.32Å; W159-F254 HydrophobicContact CG-CE1 3.32Å; W159-F254 AromaticContact CG-CG 3.8Å; W159-F254 HydrophobicContact CG-CG 3.8Å; W159-F254 HydrophobicContact CG-CZ 4.18Å; W159-F254 AromaticContact NE1-CD1 3.35Å; W159-F254 VanDerWaalsContact NE1-CD1 3.35Å; W159-F254 AromaticContact NE1-CE1 3.86Å; W159-P255 HydrophobicContact CH2-CG 4.38Å; W159-P255 HydrophobicContact CZ2-CG 3.74Å
160	K	93.1	Very high	91.6	Very high	120 Å²	120	50.2 Å²	50.2	52%	0.522	23%	0.229	S	C	.	.	H	α-helix	trans	-59	-36	-177.6	-73.1	-176.9	176.7	-176.2	0	111.2	K157 A158 K164 F254	K157-K160 PolarHBondContact O-N 3.41Å; A158-K160 VanDerWaalsContact C-N 3.34Å; A158-K160 PolarHBondContact O-N 3.25Å; K160-K164 VanDerWaalsContact O-CB 3.29Å; K160-K164 WeakPolarHBondContact O-CB 3.39Å; K160-K164 PolarHBondContact O-N 3.49Å; K160-K164 VanDerWaalsContact O-N 3.09Å; K160-F254 HydrophobicContact CG-CE1 4.41Å
161	M	95.1	Very high	92	Very high	36 Å²	36	49.9 Å²	49.9	18%	0.177	23%	0.23	C	C	.	.	H	α-helix	trans	-69.3	-47.4	176.2	-64.7	179.1	61.1	0	0	111.5	Q125 I128 A129 K157 A158 W159 K164 C165	Q125-M161 HydrophobicContact CB-CE 4.42Å; Q125-M161 VanDerWaalsContact O-CE 3.25Å; Q125-M161 WeakPolarHBondContact O-CE 3.33Å; I128-M161 HydrophobicContact CB-CE 3.62Å; I128-M161 HydrophobicContact CG2-CE 3.44Å; I128-M161 VanDerWaalsContact CG2-CE 3.44Å; I128-M161 HydrophobicContact CG2-SD 4.02Å; A129-M161 HydrophobicContact CB-CB 3.85Å; A129-M161 HydrophobicContact CB-CE 4.48Å; K157-M161 HydrophobicContact CG-SD 4.24Å; K157-M161 WeakPolarHBondContact O-CG 3.36Å; K157-M161 PolarHBondContact O-N 3.49Å; A158-M161 WeakPolarHBondContact O-CB 3.02Å; A158-M161 PolarHBondContact O-N 3.34Å; A158-M161 VanDerWaalsContact O-N 3.12Å; W159-M161 PolarHBondContact O-N 3.3Å; M161-K164 PolarHBondContact O-N 2.93Å; M161-C165 WeakPolarHBondContact O-CB 3.43Å; M161-C165 PolarHBondContact O-N 2.76Å; M161-C165 PolarHBondContact O-SG 3.41Å
162	Y	96.4	Very high	92.2	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-51.8	174.8	-73.7	-62	0	0	0	112	I126 A129 D130 V133 A158 W159 K164 C165 Y166 V227 F234	I126-Y162 HydrophobicContact CG2-CE1 4.35Å; A129-Y162 HydrophobicContact CB-CD1 4.08Å; A129-Y162 HydrophobicContact CB-CD2 4.01Å; A129-Y162 HydrophobicContact CB-CE1 3.82Å; A129-Y162 HydrophobicContact CB-CE2 3.73Å; A129-Y162 HydrophobicContact CB-CG 4.17Å; D130-Y162 VanDerWaalsContact CA-OH 3.23Å; D130-Y162 WeakPolarHBondContact CA-OH 3.46Å; D130-Y162 PolarHBondContact N-OH 2.96Å; D130-Y162 PolarHBondContact OD1-OH 2.82Å; V133-Y162 HydrophobicContact CG2-CE2 3.78Å; A158-Y162 HydrophobicContact CB-CE2 4.29Å; A158-Y162 WeakPolarHBondContact O-CD2 3.43Å; A158-Y162 PolarHBondContact O-N 3.44Å; W159-Y162 PolarHBondContact O-N 2.89Å; W159-Y162 VanDerWaalsContact O-N 3.13Å; Y162-K164 VanDerWaalsContact C-N 3.3Å; Y162-K164 PolarHBondContact O-N 3.17Å; Y162-C165 PolarHBondContact O-N 3.33Å; Y162-Y166 WeakPolarHBondContact O-CB 3.42Å; Y162-Y166 PolarHBondContact O-N 2.89Å; Y162-V227 HydrophobicContact CD1-CG2 3.98Å; Y162-V227 WeakPolarHBondContact O-CG2 3.37Å; Y162-F234 HydrophobicContact CD2-CD2 4.01Å; Y162-F234 AromaticContact CD2-CE2 3.77Å; Y162-F234 HydrophobicContact CD2-CE2 3.77Å; Y162-F234 HydrophobicContact CE2-CD2 4.22Å; Y162-F234 AromaticContact CE2-CE2 3.74Å; Y162-F234 HydrophobicContact CE2-CE2 3.74Å
163	N	95.3	Very high	92.4	Very high	51 Å²	51	53.6 Å²	53.6	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-42.5	-178.7	-175.5	60.6	0	0	0	111.6	W159 N167	W159-N163 HydrophobicContact CD2-CB 4.48Å; W159-N163 HydrophobicContact CH2-CB 4.47Å; W159-N163 HydrophobicContact CZ2-CB 3.95Å; W159-N163 WeakPolarHBondContact O-CB 3.37Å; W159-N163 PolarHBondContact O-N 3.07Å; N163-N167 VanDerWaalsContact O-CG 3.26Å; N163-N167 PolarHBondContact O-N 3.4Å; N163-N167 VanDerWaalsContact O-N 3.13Å; N163-N167 PolarHBondContact O-ND2 2.76Å; N163-N167 VanDerWaalsContact O-ND2 3.12Å
164	K	95.4	Very high	92.5	Very high	112 Å²	112	49.4 Å²	49.4	49%	0.487	23%	0.233	S	C	.	.	H	α-helix	trans	-62.5	-53.1	174.9	-177.2	-179.1	176.2	-177.1	0	111.7	K160 M161 Y162 Y166 N167 D168	K160-K164 VanDerWaalsContact O-CB 3.29Å; K160-K164 WeakPolarHBondContact O-CB 3.39Å; K160-K164 PolarHBondContact O-N 3.49Å; K160-K164 VanDerWaalsContact O-N 3.09Å; M161-K164 PolarHBondContact O-N 2.93Å; Y162-K164 VanDerWaalsContact C-N 3.3Å; Y162-K164 PolarHBondContact O-N 3.17Å; K164-Y166 VanDerWaalsContact C-N 3.27Å; K164-Y166 PolarHBondContact O-N 2.95Å; K164-N167 PolarHBondContact O-N 3.05Å; K164-D168 WeakPolarHBondContact CE-OD2 3.35Å; K164-D168 WeakPolarHBondContact O-CB 3.28Å; K164-D168 VanDerWaalsContact O-CG 3.29Å; K164-D168 PolarHBondContact O-N 2.91Å
165	C	96.8	Very high	92.1	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-39.6	-179.2	-65.2	0	0	0	0	111.5	L122 Q125 I126 M161 Y162 N167 D168 I169 V227	L122-C165 HydrophobicContact CD2-CB 4.34Å; Q125-C165 VanDerWaalsContact CB-SG 3.56Å; I126-C165 HydrophobicContact CG1-CB 4.04Å; M161-C165 WeakPolarHBondContact O-CB 3.43Å; M161-C165 PolarHBondContact O-N 2.76Å; M161-C165 PolarHBondContact O-SG 3.41Å; Y162-C165 PolarHBondContact O-N 3.33Å; C165-N167 PolarHBondContact O-N 3.36Å; C165-D168 PolarHBondContact O-N 3.13Å; C165-I169 WeakPolarHBondContact O-CB 3.35Å; C165-I169 WeakPolarHBondContact O-CD1 3.42Å; C165-I169 WeakPolarHBondContact O-CG1 3.49Å; C165-I169 PolarHBondContact O-N 3.29Å; C165-V227 HydrophobicContact CB-CG2 3.73Å
166	Y	96.6	Very high	91.5	Very high	44 Å²	44	50.8 Å²	50.8	17%	0.173	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-47.4	178.8	-174	-87.1	0	0	0	110.9	Y162 K164 T170 K224 V227 S228 Y231	Y162-Y166 WeakPolarHBondContact O-CB 3.42Å; Y162-Y166 PolarHBondContact O-N 2.89Å; K164-Y166 VanDerWaalsContact C-N 3.27Å; K164-Y166 PolarHBondContact O-N 2.95Å; Y166-T170 PolarHBondContact O-N 3.4Å; Y166-T170 PolarHBondContact O-OG1 2.66Å; Y166-K224 HydrophobicContact CD2-CD 4.45Å; Y166-K224 HydrophobicContact CE2-CD 4.39Å; Y166-K224 VanDerWaalsContact CE2-CE 3.47Å; Y166-K224 VanDerWaalsContact CG-NZ 3.26Å; Y166-K224 PolarHBondContact O-NZ 2.97Å; Y166-V227 HydrophobicContact CD2-CG1 4.03Å; Y166-S228 WeakPolarHBondContact CE2-OG 3.45Å; Y166-Y231 HydrophobicContact CD1-CD2 4.47Å; Y166-Y231 HydrophobicContact CD1-CE1 4.29Å; Y166-Y231 HydrophobicContact CD1-CE2 4.18Å; Y166-Y231 AromaticContact CD2-CD1 3.8Å; Y166-Y231 HydrophobicContact CD2-CD1 3.8Å; Y166-Y231 HydrophobicContact CD2-CD2 4.17Å; Y166-Y231 HydrophobicContact CD2-CE1 4.26Å; Y166-Y231 AromaticContact CD2-CG 3.73Å; Y166-Y231 HydrophobicContact CD2-CG 3.73Å; Y166-Y231 HydrophobicContact CE1-CE1 4.04Å; Y166-Y231 AromaticContact CE2-CD1 3.7Å; Y166-Y231 HydrophobicContact CE2-CD1 3.7Å; Y166-Y231 HydrophobicContact CE2-CE1 4.01Å; Y166-Y231 HydrophobicContact CE2-CG 4.14Å; Y166-Y231 HydrophobicContact CG-CD1 4.26Å; Y166-Y231 AromaticContact CG-CD2 3.98Å; Y166-Y231 HydrophobicContact CG-CD2 3.98Å; Y166-Y231 HydrophobicContact CG-CE1 4.41Å; Y166-Y231 HydrophobicContact CG-CE2 4.15Å; Y166-Y231 HydrophobicContact CG-CG 4.03Å; Y166-Y231 AromaticContact CZ-CE1 3.89Å
167	N	95.4	Very high	90.9	Very high	63 Å²	63	55.8 Å²	55.8	34%	0.337	27%	0.269	S	S	.	.	H	α-helix	trans	-69.9	-44.1	178.7	-66.7	-25.4	0	0	0	112.2	N163 K164 C165 I169 T170 H171	N163-N167 VanDerWaalsContact O-CG 3.26Å; N163-N167 PolarHBondContact O-N 3.4Å; N163-N167 VanDerWaalsContact O-N 3.13Å; N163-N167 PolarHBondContact O-ND2 2.76Å; N163-N167 VanDerWaalsContact O-ND2 3.12Å; K164-N167 PolarHBondContact O-N 3.05Å; C165-N167 PolarHBondContact O-N 3.36Å; N167-I169 VanDerWaalsContact C-N 3.31Å; N167-I169 PolarHBondContact O-N 3.47Å; N167-T170 PolarHBondContact O-N 2.96Å; N167-H171 PolarHBondContact O-CD2 2.99Å; N167-H171 PolarHBondContact O-N 2.91Å
168	D	93	Very high	89.9	Confident	52 Å²	52	58.9 Å²	58.9	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-58.2	-44.4	177.6	-72.9	-7.5	0	0	0	110.7	L122 K164 C165 H171 L172	L122-D168 HydrophobicContact CD2-CB 4.09Å; K164-D168 WeakPolarHBondContact CE-OD2 3.35Å; K164-D168 WeakPolarHBondContact O-CB 3.28Å; K164-D168 VanDerWaalsContact O-CG 3.29Å; K164-D168 PolarHBondContact O-N 2.91Å; C165-D168 PolarHBondContact O-N 3.13Å; D168-H171 PolarHBondContact O-N 3.19Å; D168-L172 WeakPolarHBondContact O-CG 3.09Å; D168-L172 PolarHBondContact O-N 2.88Å; D168-L172 VanDerWaalsContact O-N 3.1Å
169	I	94	Very high	88.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.1	-41.7	177.7	-65.7	161.6	0	0	0	111.4	L122 I126 C165 N167 H171 L172 Q173 L223 K224 V227	L122-I169 HydrophobicContact CD1-CG1 3.82Å; L122-I169 HydrophobicContact CD2-CG1 4.27Å; I126-I169 HydrophobicContact CD1-CD1 4.11Å; C165-I169 WeakPolarHBondContact O-CB 3.35Å; C165-I169 WeakPolarHBondContact O-CD1 3.42Å; C165-I169 WeakPolarHBondContact O-CG1 3.49Å; C165-I169 PolarHBondContact O-N 3.29Å; N167-I169 VanDerWaalsContact C-N 3.31Å; N167-I169 PolarHBondContact O-N 3.47Å; I169-H171 VanDerWaalsContact C-N 3.31Å; I169-H171 PolarHBondContact O-N 2.87Å; I169-L172 PolarHBondContact O-N 3.22Å; I169-Q173 HydrophobicContact CG2-CG 4.43Å; I169-Q173 WeakPolarHBondContact O-CG 3.11Å; I169-Q173 PolarHBondContact O-N 3.28Å; I169-L223 HydrophobicContact CD1-CB 3.97Å; I169-K224 HydrophobicContact CB-CD 4.36Å; I169-K224 HydrophobicContact CG2-CB 3.79Å; I169-K224 HydrophobicContact CG2-CD 3.88Å; I169-K224 HydrophobicContact CG2-CG 4.38Å; I169-V227 HydrophobicContact CD1-CB 4.37Å; I169-V227 HydrophobicContact CD1-CG1 3.83Å
170	T	93.1	Very high	86.5	Confident	35 Å²	35	63.8 Å²	63.8	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-56.8	-47.1	175.6	-56	0	0	0	0	110.9	Y166 N167 L172 Q173 E174 K224	Y166-T170 PolarHBondContact O-N 3.4Å; Y166-T170 PolarHBondContact O-OG1 2.66Å; N167-T170 PolarHBondContact O-N 2.96Å; T170-L172 VanDerWaalsContact C-N 3.32Å; T170-L172 PolarHBondContact O-N 2.84Å; T170-Q173 PolarHBondContact O-N 3.08Å; T170-E174 HydrophobicContact CG2-CG 4.45Å; T170-E174 WeakPolarHBondContact O-CG 3.4Å; T170-E174 PolarHBondContact O-N 3.19Å; T170-K224 PolarHBondContact OG1-NZ 2.89Å
171	H	90.1	Very high	84.5	Confident	124 Å²	124	64.7 Å²	64.7	57%	0.574	32%	0.321	S	S	*	.	H	α-helix	trans	-63.1	-37.6	178.5	-77.2	-54.7	0	0	0	112.7	N167 D168 I169 E174 G175	N167-H171 PolarHBondContact O-CD2 2.99Å; N167-H171 PolarHBondContact O-N 2.91Å; D168-H171 PolarHBondContact O-N 3.19Å; I169-H171 VanDerWaalsContact C-N 3.31Å; I169-H171 PolarHBondContact O-N 2.87Å; H171-E174 IonicContact ND1-OE2 3.26Å; H171-E174 PolarHBondContact O-N 3.12Å; H171-G175 PolarHBondContact O-N 3.03Å
172	L	88.1	Confident	82.3	Confident	72 Å²	72	69.7 Å²	69.7	38%	0.377	34%	0.344	S	S	.	.	H	α-helix	trans	-65	-41.3	174.1	-70.1	171.9	0	0	0	112	L122 D168 I169 T170 G175 N176 L220	L122-L172 HydrophobicContact CD1-CD1 3.83Å; D168-L172 WeakPolarHBondContact O-CG 3.09Å; D168-L172 PolarHBondContact O-N 2.88Å; D168-L172 VanDerWaalsContact O-N 3.1Å; I169-L172 PolarHBondContact O-N 3.22Å; T170-L172 VanDerWaalsContact C-N 3.32Å; T170-L172 PolarHBondContact O-N 2.84Å; L172-G175 PolarHBondContact O-N 2.64Å; L172-N176 PolarHBondContact O-N 3.35Å; L172-L220 HydrophobicContact CB-CD1 4.18Å; L172-L220 HydrophobicContact CB-CD2 4.12Å; L172-L220 HydrophobicContact CD1-CD2 4.14Å
173	Q	88.1	Confident	79.9	Confident	17 Å²	17	74.1 Å²	74.1	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-64.2	-43.6	175.5	-73.7	174	-50.7	0	0	111.8	I169 T170 N176 R177 L220 D221 Y267	I169-Q173 HydrophobicContact CG2-CG 4.43Å; I169-Q173 WeakPolarHBondContact O-CG 3.11Å; I169-Q173 PolarHBondContact O-N 3.28Å; T170-Q173 PolarHBondContact O-N 3.08Å; Q173-N176 PolarHBondContact O-N 3.07Å; Q173-R177 WeakPolarHBondContact O-CG 3.38Å; Q173-R177 PolarHBondContact O-N 3.07Å; Q173-L220 HydrophobicContact CG-CB 4.08Å; Q173-D221 PolarHBondContact NE2-OD1 2.96Å; Q173-Y267 PolarHBondContact NE2-OH 2.82Å
174	E	86.7	Confident	77.6	Confident	72 Å²	72	74.3 Å²	74.3	34%	0.336	37%	0.373	S	S	.	.	H	α-helix	trans	-64.1	-41.7	176.2	-72.5	175.7	177.9	0	0	112.3	T170 H171 N176 R177 R178	T170-E174 HydrophobicContact CG2-CG 4.45Å; T170-E174 WeakPolarHBondContact O-CG 3.4Å; T170-E174 PolarHBondContact O-N 3.19Å; H171-E174 IonicContact ND1-OE2 3.26Å; H171-E174 PolarHBondContact O-N 3.12Å; E174-N176 VanDerWaalsContact C-N 3.33Å; E174-N176 PolarHBondContact O-N 3.25Å; E174-R177 PolarHBondContact O-N 3.43Å; E174-R178 WeakPolarHBondContact O-CG 3.3Å; E174-R178 PolarHBondContact O-N 3.46Å
175	G	81	Confident	75.3	Confident	40 Å²	40	72.4 Å²	72.4	41%	0.412	37%	0.374	S	S	.	.	H	α-helix	trans	-59.1	-44	174.3	0	0	0	0	0	112.2	H171 L172 R177 R178 A179	H171-G175 PolarHBondContact O-N 3.03Å; L172-G175 PolarHBondContact O-N 2.64Å; G175-R177 VanDerWaalsContact C-N 3.33Å; G175-R177 PolarHBondContact O-N 3.19Å; G175-R178 PolarHBondContact O-N 3.09Å; G175-A179 PolarHBondContact O-N 3.31Å
176	N	76.1	Confident	72.8	Confident	61 Å²	61	75.9 Å²	75.9	33%	0.326	40%	0.399	S	S	.	.	H	α-helix	trans	-65.5	-32.6	175.7	-82.3	8.4	0	0	0	113.1	L172 Q173 E174 P180 V215 L220	L172-N176 PolarHBondContact O-N 3.35Å; Q173-N176 PolarHBondContact O-N 3.07Å; E174-N176 VanDerWaalsContact C-N 3.33Å; E174-N176 PolarHBondContact O-N 3.25Å; N176-P180 WeakPolarHBondContact O-CD 3.41Å; N176-V215 PolarHBondContact ND2-O 2.87Å; N176-L220 WeakPolarHBondContact ND2-CD1 3.32Å
177	R	76	Confident	70.3	Confident	169 Å²	169	77.7 Å²	77.7	64%	0.638	42%	0.418	S	S	*	.	H	α-helix	trans	-73.6	-34	177	-74.4	173.7	177.6	162	0.3	113.2	Q173 E174 G175 P180	Q173-R177 WeakPolarHBondContact O-CG 3.38Å; Q173-R177 PolarHBondContact O-N 3.07Å; E174-R177 PolarHBondContact O-N 3.43Å; G175-R177 VanDerWaalsContact C-N 3.33Å; G175-R177 PolarHBondContact O-N 3.19Å; R177-P180 VanDerWaalsContact O-CD 3.31Å; R177-P180 WeakPolarHBondContact O-CD 3.41Å; R177-P180 WeakPolarHBondContact O-CG 3.35Å
178	R	70.1	Confident	67.8	Low	153 Å²	153	81.4 Å²	81.4	58%	0.577	44%	0.437	S	S	*	.	H	α-helix	trans	-79.2	-25.9	-179.5	-69.3	177.9	-175.2	173.9	6.3	113.9	E174 G175 E181 Q182	E174-R178 WeakPolarHBondContact O-CG 3.3Å; E174-R178 PolarHBondContact O-N 3.46Å; G175-R178 PolarHBondContact O-N 3.09Å; R178-E181 PolarHBondContact O-N 2.97Å; R178-Q182 PolarHBondContact O-N 3.3Å
179	A	60	Low	65.5	Low	40 Å²	40	83.7 Å²	83.7	33%	0.331	46%	0.457	S	S	.	.	H	α-helix	trans	-56.8	-44.7	177.8	0	0	0	0	0	114.7	G175	G175-A179 PolarHBondContact O-N 3.31Å
180	P	55.7	Low	63	Low	75 Å²	75	88.7 Å²	88.7	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-70.1	-29.4	177.1	22.1	-31.5	0	0	0	114.6	N176 R177 Q183 A184	N176-P180 WeakPolarHBondContact O-CD 3.41Å; R177-P180 VanDerWaalsContact O-CD 3.31Å; R177-P180 WeakPolarHBondContact O-CD 3.41Å; R177-P180 WeakPolarHBondContact O-CG 3.35Å; P180-Q183 PolarHBondContact O-N 3.46Å; P180-A184 PolarHBondContact O-N 2.84Å
181	E	50.9	Low	60.8	Low	139 Å²	139	91.9 Å²	91.9	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-72.9	-32	-179.8	-68.9	178.4	160.3	0	0	113	R178 S185	R178-E181 PolarHBondContact O-N 2.97Å; E181-S185 PolarHBondContact O-N 2.69Å; E181-S185 PolarHBondContact O-OG 2.95Å
182	Q	49.2	Very low	58.3	Low	141 Å²	141	91.5 Å²	91.5	66%	0.659	53%	0.527	S	S	*	.	H	α-helix	trans	-74.1	-29.3	175.1	-73.2	-178.9	-13.4	0	0	112.6	R178 S185 S186	R178-Q182 PolarHBondContact O-N 3.3Å; Q182-S185 WeakPolarHBondContact CA-OG 3.13Å; Q182-S185 PolarHBondContact O-OG 2.87Å; Q182-S186 WeakPolarHBondContact O-CB 3.5Å; Q182-S186 PolarHBondContact O-N 2.9Å; Q182-S186 PolarHBondContact O-OG 2.73Å
183	Q	47.1	Very low	55.7	Low	97 Å²	97	93 Å²	93	45%	0.453	55%	0.55	S	S	.	.	H	α-helix	trans	-71.8	-42.6	173.1	-80.9	179.2	-6.7	0	0	112	P180 S185 S186 S187	P180-Q183 PolarHBondContact O-N 3.46Å; Q183-S185 VanDerWaalsContact C-N 3.35Å; Q183-S185 PolarHBondContact O-N 3.02Å; Q183-S186 PolarHBondContact O-N 2.97Å; Q183-S186 PolarHBondContact O-OG 3.15Å; Q183-S187 PolarHBondContact O-N 3.47Å; Q183-S187 PolarHBondContact O-OG 3.4Å
184	A	47.3	Very low	53.2	Low	54 Å²	54	98 Å²	98	45%	0.446	59%	0.587	S	S	.	*	H	α-helix	trans	-63.9	-36.4	178	0	0	0	0	0	113.2	P180 S187 L188	P180-A184 PolarHBondContact O-N 2.84Å; A184-S187 PolarHBondContact O-OG 3.25Å; A184-L188 WeakPolarHBondContact O-CD1 3.42Å
185	S	45.3	Very low	50.7	Low	73 Å²	73	99.7 Å²	99.7	51%	0.51	61%	0.606	S	S	.	*	H	α-helix	trans	-75.7	-29	176.4	49.9	0	0	0	0	113.5	E181 Q182 Q183 L188	E181-S185 PolarHBondContact O-N 2.69Å; E181-S185 PolarHBondContact O-OG 2.95Å; Q182-S185 WeakPolarHBondContact CA-OG 3.13Å; Q182-S185 PolarHBondContact O-OG 2.87Å; Q183-S185 VanDerWaalsContact C-N 3.35Å; Q183-S185 PolarHBondContact O-N 3.02Å; S185-L188 PolarHBondContact O-N 3.13Å
186	S	44.8	Very low	48.4	Very low	73 Å²	73	103 Å²	103	51%	0.51	62%	0.623	S	S	.	*	H	α-helix	trans	-74.5	-22.8	174.2	72.2	0	0	0	0	114.2	Q182 Q183 S189	Q182-S186 WeakPolarHBondContact O-CB 3.5Å; Q182-S186 PolarHBondContact O-N 2.9Å; Q182-S186 PolarHBondContact O-OG 2.73Å; Q183-S186 PolarHBondContact O-N 2.97Å; Q183-S186 PolarHBondContact O-OG 3.15Å; S186-S189 PolarHBondContact O-OG 2.69Å
187	S	44	Very low	46.3	Very low	82 Å²	82	105.2 Å²	105.2	57%	0.573	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-14.8	173.9	41.7	0	0	0	0	114.4	Q183 A184	Q183-S187 PolarHBondContact O-N 3.47Å; Q183-S187 PolarHBondContact O-OG 3.4Å; A184-S187 PolarHBondContact O-OG 3.25Å
188	L	44.2	Very low	44.2	Very low	141 Å²	141	108.2 Å²	108.2	74%	0.738	65%	0.654	S	S	*	*	S	Bend	trans	-96.7	-5.7	-178.8	-79.6	152.7	0	0	0	113.8	A184 S185	A184-L188 WeakPolarHBondContact O-CD1 3.42Å; S185-L188 PolarHBondContact O-N 3.13Å
189	S	43.5	Very low	42.3	Very low	100 Å²	100	105.7 Å²	105.7	70%	0.699	66%	0.66	S	S	*	*	S	Bend	trans	-101.5	13.9	-176.2	58	0	0	0	0	115.1	S186	S186-S189 PolarHBondContact O-OG 2.69Å
190	S	42.6	Very low	40.9	Very low	104 Å²	104	115.4 Å²	115.4	73%	0.727	69%	0.688	S	S	*	*			trans	-116.6	29.3	-179.2	62.3	0	0	0	0	115.3
191	S	46.1	Very low	39.9	Very low	103 Å²	103	117.2 Å²	117.2	72%	0.72	70%	0.703	S	S	*	*			trans	-125.3	80	173	62	0	0	0	0	112.9
192	S	36.9	Very low	38.9	Very low	116 Å²	116	116 Å²	116	81%	0.811	71%	0.71	S	S	*	*			trans	-164.6	118.8	152.4	54.3	0	0	0	0	113.6
193	A	35.3	Very low	38.1	Very low	104 Å²	104	114.8 Å²	114.8	86%	0.86	72%	0.717	S	S	*	*			trans	71	130.1	161.2	0	0	0	0	0	117.6
194	S	35.2	Very low	37.6	Very low	122 Å²	122	116.5 Å²	116.5	85%	0.853	74%	0.736	S	S	*	*			cis	-163.4	167.7	24	52.3	0	0	0	0	112.3
195	S	34.7	Very low	36.7	Very low	107 Å²	107	117 Å²	117	75%	0.748	75%	0.746	S	S	*	*			trans	-75.6	141.3	-170.5	51.2	0	0	0	0	117
196	S	32.1	Very low	36.3	Very low	108 Å²	108	120.5 Å²	120.5	76%	0.755	77%	0.765	S	S	*	*				145.3	130.3	111.5	63.4	0	0	0	0	116.6
197	S	31.1	Very low	35.7	Very low	108 Å²	108	122.4 Å²	122.4	76%	0.755	78%	0.779	S	S	*	*			trans	88.4	119.7	150	80.8	0	0	0	0	122.8
198	R	31.7	Very low	35.1	Very low	232 Å²	232	129.9 Å²	129.9	88%	0.875	79%	0.794	S	S	*	*			trans	79.9	102.1	140.5	-70.2	179.1	-179.4	-175.1	1.1	122.1
199	S	31.3	Very low	34.6	Very low	101 Å²	101	128.1 Å²	128.1	71%	0.706	79%	0.794	S	S	*	*				53.1	115.3	128.4	65.2	0	0	0	0	121.1
200	R	29.9	Very low	34.4	Very low	243 Å²	243	132.4 Å²	132.4	92%	0.917	80%	0.803	S	S	*	*				176	146.8	103.6	-94	175.9	180	-177.2	-0.1	111.7
201	S	34.4	Very low	34.1	Very low	113 Å²	113	138 Å²	138	79%	0.79	81%	0.808	S	S	*	*			trans	-63.9	141.3	-177.8	48.9	0	0	0	0	115.9
202	S	30.1	Very low	33.9	Very low	115 Å²	115	140.1 Å²	140.1	80%	0.804	81%	0.807	S	S	*	*			trans	-170.2	124.2	133.6	41	0	0	0	0	112.9
203	S	32.5	Very low	34.7	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	80%	0.795	S	S	*	*			trans	29.9	138.6	155.1	-50.1	0	0	0	0	123.5	G205	S203-G205 PolarHBondContact O-N 2.7Å
204	P	37.2	Very low	35.9	Very low	133 Å²	133	137.1 Å²	137.1	86%	0.864	78%	0.779	S	S	*	*			trans	-81.2	104.5	175.3	32.9	-30.4	0	0	0	111.2
205	G	28.2	Very low	37.7	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	75%	0.748	S	S	*	*			trans	-81.9	118.2	159.2	0	0	0	0	0	109	S203 S207	S203-G205 PolarHBondContact O-N 2.7Å; G205-S207 VanDerWaalsContact C-N 3.3Å; G205-S207 PolarHBondContact O-N 3.04Å
206	T	37.6	Very low	40.1	Very low	147 Å²	147	129.9 Å²	129.9	90%	0.902	73%	0.727	S	S	*	*			trans	-58	88.3	169.5	36.1	0	0	0	0	110.6	R208	T206-R208 VanDerWaalsContact C-N 3.33Å; T206-R208 PolarHBondContact O-N 3.3Å; T206-R208 VanDerWaalsContact O-N 3.09Å
207	S	30.4	Very low	42.7	Very low	114 Å²	114	128.4 Å²	128.4	80%	0.797	72%	0.715	S	S	*	*			trans	-76.2	90.7	164.6	43.2	0	0	0	0	108.1	G205 S209	G205-S207 VanDerWaalsContact C-N 3.3Å; G205-S207 PolarHBondContact O-N 3.04Å; S207-S209 PolarHBondContact O-N 3.26Å
208	R	31.6	Very low	45.5	Very low	238 Å²	238	129.6 Å²	129.6	90%	0.898	71%	0.709	S	S	*	*			trans	-49.2	103.6	163.2	-146.9	173.3	177.1	178.1	-3.2	107	T206 Q210	T206-R208 VanDerWaalsContact C-N 3.33Å; T206-R208 PolarHBondContact O-N 3.3Å; T206-R208 VanDerWaalsContact O-N 3.09Å; R208-Q210 PolarHBondContact O-N 2.82Å; R208-Q210 VanDerWaalsContact O-N 3.1Å
209	S	34.9	Very low	48.3	Very low	105 Å²	105	120.8 Å²	120.8	73%	0.734	68%	0.68	S	S	*	*			trans	-56.1	119	177.2	63.5	0	0	0	0	108.2	S207 R211	S207-S209 PolarHBondContact O-N 3.26Å; S209-R211 PolarHBondContact O-N 3.13Å
210	Q	38.1	Very low	51.2	Low	189 Å²	189	116 Å²	116	88%	0.883	65%	0.647	S	S	*	*			trans	-51.5	110.2	172.6	-73.1	172	-25.1	0	0	108.7	R208 Q212	R208-Q210 PolarHBondContact O-N 2.82Å; R208-Q210 VanDerWaalsContact O-N 3.1Å; Q210-Q212 PolarHBondContact O-N 3.12Å
211	R	36.8	Very low	54.3	Low	221 Å²	221	107.6 Å²	107.6	83%	0.834	62%	0.62	S	S	*	*			trans	-66.4	125.4	164.8	-73.8	-179.6	179.8	179.3	-1.7	106.3	S209 D213	S209-R211 PolarHBondContact O-N 3.13Å; R211-D213 PolarHBondContact O-N 3.39Å
212	Q	42.5	Very low	57.2	Low	149 Å²	149	103.7 Å²	103.7	70%	0.696	59%	0.588	S	S	*	*			trans	-65.8	114.9	171.2	-84.4	-179.9	-14.9	0	0	109	Q210 G214	Q210-Q212 PolarHBondContact O-N 3.12Å; Q212-G214 PolarHBondContact O-N 3.18Å
213	D	53.1	Low	60.3	Low	106 Å²	106	98.2 Å²	98.2	57%	0.567	55%	0.55	S	S	*	.			trans	-73.4	101.1	-178.4	-71.8	-46.2	0	0	0	112.1	Q112 R211	Q112-D213 HydrophobicContact CB-CB 4.44Å; R211-D213 PolarHBondContact O-N 3.39Å
214	G	61.3	Low	63.4	Low	51 Å²	51	93.2 Å²	93.2	53%	0.526	51%	0.513	S	S	.	.			trans	-118.2	166.2	170	0	0	0	0	0	112.4	Q212 S216	Q212-G214 PolarHBondContact O-N 3.18Å; G214-S216 PolarHBondContact O-N 3.34Å
215	V	73.1	Confident	66.3	Low	32 Å²	32	86.9 Å²	86.9	19%	0.194	47%	0.472	C	S	.	.			trans	-57.2	134.3	171	177.6	0	0	0	0	109.4	G115 V119 N176 V219 L220	G115-V215 VanDerWaalsContact C-CG2 3.47Å; G115-V215 WeakPolarHBondContact O-CG2 3.49Å; V119-V215 HydrophobicContact CG2-CB 4.35Å; V119-V215 HydrophobicContact CG2-CG1 3.36Å; V119-V215 HydrophobicContact CG2-CG2 3.98Å; N176-V215 PolarHBondContact ND2-O 2.87Å; V215-V219 HydrophobicContact CG1-CB 4.39Å; V215-V219 HydrophobicContact CG1-CG1 4.42Å; V215-L220 HydrophobicContact CB-CD1 4.36Å; V215-L220 HydrophobicContact CB-CG 4.39Å; V215-L220 HydrophobicContact CG1-CD1 4.28Å; V215-L220 HydrophobicContact CG1-CD2 4.16Å; V215-L220 HydrophobicContact CG1-CG 3.79Å
216	S	84.3	Confident	69.6	Low	45 Å²	45	84 Å²	84	32%	0.315	44%	0.443	S	S	.	.			trans	-54.8	131.3	178.2	137.2	0	0	0	0	110.8	G214 E218 V219 L220	G214-S216 PolarHBondContact O-N 3.34Å; S216-E218 PolarHBondContact O-N 3.35Å; S216-E218 PolarHBondContact OG-N 3.32Å; S216-E218 PolarHBondContact OG-OE2 3.3Å; S216-V219 PolarHBondContact O-N 2.98Å; S216-V219 VanDerWaalsContact O-N 3.12Å; S216-V219 PolarHBondContact OG-N 3.44Å; S216-L220 PolarHBondContact O-N 2.96Å
217	P	87.4	Confident	72.5	Confident	76 Å²	76	77 Å²	77	49%	0.494	40%	0.4	S	S	.	.	H	α-helix	trans	-55.1	-38	175.8	-26.3	35	0	0	0	112.6	V219 L220 D221	P217-V219 VanDerWaalsContact C-N 3.28Å; P217-V219 PolarHBondContact O-N 3.45Å; P217-L220 PolarHBondContact O-N 3.27Å; P217-D221 WeakPolarHBondContact O-CB 3.35Å; P217-D221 PolarHBondContact O-N 2.88Å
218	E	89.7	Confident	75.7	Confident	134 Å²	134	71.6 Å²	71.6	63%	0.626	36%	0.362	S	S	*	.	H	α-helix	trans	-61.9	-36.9	179.4	-57.9	93.5	175.4	0	0	112.3	S216 R222	S216-E218 PolarHBondContact O-N 3.35Å; S216-E218 PolarHBondContact OG-N 3.32Å; S216-E218 PolarHBondContact OG-OE2 3.3Å; E218-R222 WeakPolarHBondContact O-CB 3.37Å; E218-R222 PolarHBondContact O-N 3.19Å
219	V	90.7	Very high	78.9	Confident	46 Å²	46	61.1 Å²	61.1	28%	0.279	32%	0.322	S	S	.	.	H	α-helix	trans	-69.8	-40.4	177.6	175.2	0	0	0	0	111.3	V119 V215 S216 P217 R222 L223	V119-V219 HydrophobicContact CB-CG1 4.41Å; V119-V219 HydrophobicContact CG1-CG1 3.46Å; V119-V219 VanDerWaalsContact CG1-CG1 3.46Å; V119-V219 HydrophobicContact CG2-CG1 4Å; V215-V219 HydrophobicContact CG1-CB 4.39Å; V215-V219 HydrophobicContact CG1-CG1 4.42Å; S216-V219 PolarHBondContact O-N 2.98Å; S216-V219 VanDerWaalsContact O-N 3.12Å; S216-V219 PolarHBondContact OG-N 3.44Å; P217-V219 VanDerWaalsContact C-N 3.28Å; P217-V219 PolarHBondContact O-N 3.45Å; V219-R222 PolarHBondContact O-N 2.9Å; V219-L223 PolarHBondContact O-N 3.43Å
220	L	92.1	Very high	81.8	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-41.4	176.1	-74.3	174.6	0	0	0	111.9	L172 Q173 N176 V215 S216 P217 R222 L223 K224	L172-L220 HydrophobicContact CB-CD1 4.18Å; L172-L220 HydrophobicContact CB-CD2 4.12Å; L172-L220 HydrophobicContact CD1-CD2 4.14Å; Q173-L220 HydrophobicContact CG-CB 4.08Å; N176-L220 WeakPolarHBondContact ND2-CD1 3.32Å; V215-L220 HydrophobicContact CB-CD1 4.36Å; V215-L220 HydrophobicContact CB-CG 4.39Å; V215-L220 HydrophobicContact CG1-CD1 4.28Å; V215-L220 HydrophobicContact CG1-CD2 4.16Å; V215-L220 HydrophobicContact CG1-CG 3.79Å; S216-L220 PolarHBondContact O-N 2.96Å; P217-L220 PolarHBondContact O-N 3.27Å; L220-R222 VanDerWaalsContact C-N 3.34Å; L220-R222 PolarHBondContact O-N 3.09Å; L220-L223 PolarHBondContact O-N 3.33Å; L220-K224 VanDerWaalsContact O-CB 3.31Å; L220-K224 WeakPolarHBondContact O-CB 3.33Å; L220-K224 PolarHBondContact O-N 3.31Å
221	D	94.3	Very high	84.7	Confident	65 Å²	65	47.8 Å²	47.8	35%	0.348	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-40.2	176.7	-71.2	-15.9	0	0	0	111.3	Q173 P217 K224 G225	Q173-D221 PolarHBondContact NE2-OD1 2.96Å; P217-D221 WeakPolarHBondContact O-CB 3.35Å; P217-D221 PolarHBondContact O-N 2.88Å; D221-K224 WeakPolarHBondContact O-CB 3.48Å; D221-K224 PolarHBondContact O-N 3.37Å; D221-G225 PolarHBondContact O-N 3.21Å
222	R	95.8	Very high	87.5	Confident	32 Å²	32	37.2 Å²	37.2	12%	0.121	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-49.3	172.5	-176.1	-174.1	63	84.8	-5	112	Q123 E218 V219 L220 K224 G225 S226 D273	Q123-R222 VanDerWaalsContact OE1-NH1 3.16Å; E218-R222 WeakPolarHBondContact O-CB 3.37Å; E218-R222 PolarHBondContact O-N 3.19Å; V219-R222 PolarHBondContact O-N 2.9Å; L220-R222 VanDerWaalsContact C-N 3.34Å; L220-R222 PolarHBondContact O-N 3.09Å; R222-K224 VanDerWaalsContact C-N 3.27Å; R222-K224 PolarHBondContact O-N 3.4Å; R222-G225 WeakPolarHBondContact O-CA 3.33Å; R222-G225 PolarHBondContact O-N 2.74Å; R222-G225 VanDerWaalsContact O-N 3.07Å; R222-S226 PolarHBondContact O-N 2.7Å; R222-D273 HydrophobicContact CG-CB 3.87Å; R222-D273 IonicContact NH1-OD2 3.56Å; R222-D273 PolarHBondContact NH1-OD2 3.22Å
223	L	95.6	Very high	90	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-38.1	177.8	-78.8	-177.2	0	0	0	111.9	V119 L122 Q123 I126 I169 V219 L220 G225 S226 V227	V119-L223 HydrophobicContact CB-CD1 4.16Å; V119-L223 HydrophobicContact CG1-CD1 3.7Å; V119-L223 HydrophobicContact CG2-CD1 4.28Å; L122-L223 HydrophobicContact CB-CD1 4.19Å; Q123-L223 HydrophobicContact CB-CD2 3.86Å; Q123-L223 HydrophobicContact CG-CD2 4.18Å; I126-L223 HydrophobicContact CD1-CD2 4.28Å; I169-L223 HydrophobicContact CD1-CB 3.97Å; V219-L223 PolarHBondContact O-N 3.43Å; L220-L223 PolarHBondContact O-N 3.33Å; L223-G225 VanDerWaalsContact C-N 3.31Å; L223-S226 PolarHBondContact O-N 2.77Å; L223-V227 PolarHBondContact O-N 2.94Å
224	K	97.3	Very high	91.9	Very high	8 Å²	8	28.7 Å²	28.7	4%	0.035	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-45.3	172.8	-172.2	63.8	176	179.8	0	110.1	Y166 I169 T170 L220 D221 R222 S226 V227 S228 Y267	Y166-K224 HydrophobicContact CD2-CD 4.45Å; Y166-K224 HydrophobicContact CE2-CD 4.39Å; Y166-K224 VanDerWaalsContact CE2-CE 3.47Å; Y166-K224 VanDerWaalsContact CG-NZ 3.26Å; Y166-K224 PolarHBondContact O-NZ 2.97Å; I169-K224 HydrophobicContact CB-CD 4.36Å; I169-K224 HydrophobicContact CG2-CB 3.79Å; I169-K224 HydrophobicContact CG2-CD 3.88Å; I169-K224 HydrophobicContact CG2-CG 4.38Å; T170-K224 PolarHBondContact OG1-NZ 2.89Å; L220-K224 VanDerWaalsContact O-CB 3.31Å; L220-K224 WeakPolarHBondContact O-CB 3.33Å; L220-K224 PolarHBondContact O-N 3.31Å; D221-K224 WeakPolarHBondContact O-CB 3.48Å; D221-K224 PolarHBondContact O-N 3.37Å; R222-K224 VanDerWaalsContact C-N 3.27Å; R222-K224 PolarHBondContact O-N 3.4Å; K224-S226 PolarHBondContact O-N 3.45Å; K224-V227 HydrophobicContact CD-CG1 4.28Å; K224-V227 VanDerWaalsContact O-CG1 3.29Å; K224-V227 WeakPolarHBondContact O-CG1 3.41Å; K224-V227 PolarHBondContact O-N 3.46Å; K224-S228 WeakPolarHBondContact O-CB 3.47Å; K224-S228 PolarHBondContact O-N 3.36Å; K224-S228 PolarHBondContact O-OG 3.05Å; K224-Y267 HydrophobicContact CB-CE1 3.63Å; K224-Y267 HydrophobicContact CG-CD1 4.07Å; K224-Y267 HydrophobicContact CG-CE1 3.32Å
225	G	97.7	Very high	93.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.3	-47.3	173.7	0	0	0	0	0	112.7	D221 R222 L223 V227 S228 F229 A268	D221-G225 PolarHBondContact O-N 3.21Å; R222-G225 WeakPolarHBondContact O-CA 3.33Å; R222-G225 PolarHBondContact O-N 2.74Å; R222-G225 VanDerWaalsContact O-N 3.07Å; L223-G225 VanDerWaalsContact C-N 3.31Å; G225-V227 PolarHBondContact O-N 2.97Å; G225-S228 PolarHBondContact O-N 3.28Å; G225-F229 PolarHBondContact O-N 3.29Å; G225-A268 WeakPolarHBondContact O-CB 3.4Å
226	S	97.6	Very high	94.3	Very high	5 Å²	5	25.1 Å²	25.1	4%	0.035	14%	0.135	C	C	.	.	H	α-helix	trans	-60.1	-47.5	178.6	-178.3	0	0	0	0	112.8	I126 R222 L223 K224 K275	I126-S226 WeakPolarHBondContact CG2-OG 3.25Å; R222-S226 PolarHBondContact O-N 2.7Å; L223-S226 PolarHBondContact O-N 2.77Å; K224-S226 PolarHBondContact O-N 3.45Å; S226-K275 WeakPolarHBondContact O-CD 3.24Å; S226-K275 PolarHBondContact OG-NZ 2.98Å
227	V	98.3	Very high	94.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-73.2	-34.3	-178.4	69.6	0	0	0	0	111.7	I126 Y162 C165 Y166 I169 L223 K224 G225 F229 G230 Y231	I126-V227 HydrophobicContact CD1-CB 3.8Å; I126-V227 HydrophobicContact CD1-CG2 4.45Å; I126-V227 HydrophobicContact CG1-CB 3.98Å; I126-V227 HydrophobicContact CG1-CG2 4.15Å; Y162-V227 HydrophobicContact CD1-CG2 3.98Å; Y162-V227 WeakPolarHBondContact O-CG2 3.37Å; C165-V227 HydrophobicContact CB-CG2 3.73Å; Y166-V227 HydrophobicContact CD2-CG1 4.03Å; I169-V227 HydrophobicContact CD1-CB 4.37Å; I169-V227 HydrophobicContact CD1-CG1 3.83Å; L223-V227 PolarHBondContact O-N 2.94Å; K224-V227 HydrophobicContact CD-CG1 4.28Å; K224-V227 VanDerWaalsContact O-CG1 3.29Å; K224-V227 WeakPolarHBondContact O-CG1 3.41Å; K224-V227 PolarHBondContact O-N 3.46Å; G225-V227 PolarHBondContact O-N 2.97Å; V227-F229 PolarHBondContact O-N 3.43Å; V227-G230 PolarHBondContact O-N 2.9Å; V227-Y231 VanDerWaalsContact O-CB 3.27Å; V227-Y231 WeakPolarHBondContact O-CB 3.25Å; V227-Y231 PolarHBondContact O-N 3.32Å
228	S	98.5	Very high	94.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.9	-29.6	179.3	-69.4	0	0	0	0	112.5	Y166 K224 G225 G232 A264	Y166-S228 WeakPolarHBondContact CE2-OG 3.45Å; K224-S228 WeakPolarHBondContact O-CB 3.47Å; K224-S228 PolarHBondContact O-N 3.36Å; K224-S228 PolarHBondContact O-OG 3.05Å; G225-S228 PolarHBondContact O-N 3.28Å; S228-G232 WeakPolarHBondContact O-CA 3.32Å; S228-G232 PolarHBondContact O-N 3.45Å; S228-A264 VanDerWaalsContact CB-O 3.31Å; S228-A264 WeakPolarHBondContact CB-O 3.4Å
229	F	98.2	Very high	94.1	Very high	17 Å²	17	18.8 Å²	18.8	8%	0.075	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-57.3	174.6	178.8	-113.2	0	0	0	112	G225 V227 G232 L233 L265 A268 K275 L278 A279 A282	G225-F229 PolarHBondContact O-N 3.29Å; V227-F229 PolarHBondContact O-N 3.43Å; F229-G232 PolarHBondContact O-N 3.01Å; F229-L233 HydrophobicContact CD1-CD1 4.28Å; F229-L233 HydrophobicContact CD2-CD1 4.4Å; F229-L233 HydrophobicContact CE1-CD1 3.78Å; F229-L233 HydrophobicContact CE2-CD1 3.9Å; F229-L233 HydrophobicContact CE2-CG 4.31Å; F229-L233 HydrophobicContact CZ-CD1 3.58Å; F229-L233 HydrophobicContact CZ-CG 4.47Å; F229-L233 WeakPolarHBondContact O-CG 3.48Å; F229-L233 PolarHBondContact O-N 3.01Å; F229-L265 HydrophobicContact CD2-CD2 3.87Å; F229-L265 HydrophobicContact CE2-CD2 4.34Å; F229-A268 HydrophobicContact CB-CB 4.09Å; F229-K275 HydrophobicContact CB-CB 4.05Å; F229-K275 HydrophobicContact CB-CD 3.97Å; F229-K275 HydrophobicContact CD1-CB 4.14Å; F229-K275 HydrophobicContact CD1-CD 3.74Å; F229-K275 HydrophobicContact CD1-CG 4.14Å; F229-K275 HydrophobicContact CG-CB 4.04Å; F229-K275 HydrophobicContact CG-CD 4.17Å; F229-L278 HydrophobicContact CE2-CB 3.93Å; F229-L278 HydrophobicContact CZ-CB 3.77Å; F229-A279 HydrophobicContact CD2-CB 3.73Å; F229-A279 HydrophobicContact CE2-CB 4.22Å; F229-A282 HydrophobicContact CE2-CB 4.44Å
230	G	96.6	Very high	93.6	Very high	3 Å²	3	18.1 Å²	18.1	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-65.1	-45.1	179	0	0	0	0	0	112.2	V227 G232 L233 F234	V227-G230 PolarHBondContact O-N 2.9Å; G230-G232 VanDerWaalsContact C-N 3.34Å; G230-G232 PolarHBondContact O-N 3.29Å; G230-L233 PolarHBondContact O-N 3.07Å; G230-F234 WeakPolarHBondContact O-CD2 3.45Å; G230-F234 PolarHBondContact O-N 3.5Å; G230-F234 VanDerWaalsContact O-N 3.08Å
231	Y	97	Very high	92.9	Very high	11 Å²	11	19.8 Å²	19.8	4%	0.043	11%	0.108	C	C	.	.	H	α-helix	trans	-55.8	-47.3	176.5	-178.2	-95.1	0	0	0	112.2	W159 Y166 V227 F234 H235 Q260 A264	W159-Y231 AromaticContact CH2-CD2 3.69Å; W159-Y231 HydrophobicContact CH2-CD2 3.69Å; W159-Y231 AromaticContact CH2-CE2 3.42Å; W159-Y231 HydrophobicContact CH2-CE2 3.42Å; W159-Y231 VanDerWaalsContact CH2-CE2 3.42Å; W159-Y231 HydrophobicContact CZ2-CE2 4.21Å; W159-Y231 AromaticContact CZ3-CD2 3.77Å; W159-Y231 HydrophobicContact CZ3-CD2 3.77Å; W159-Y231 HydrophobicContact CZ3-CE2 4.01Å; W159-Y231 HydrophobicContact CZ3-CG 4.43Å; Y166-Y231 HydrophobicContact CD1-CD2 4.47Å; Y166-Y231 HydrophobicContact CD1-CE1 4.29Å; Y166-Y231 HydrophobicContact CD1-CE2 4.18Å; Y166-Y231 AromaticContact CD2-CD1 3.8Å; Y166-Y231 HydrophobicContact CD2-CD1 3.8Å; Y166-Y231 HydrophobicContact CD2-CD2 4.17Å; Y166-Y231 HydrophobicContact CD2-CE1 4.26Å; Y166-Y231 AromaticContact CD2-CG 3.73Å; Y166-Y231 HydrophobicContact CD2-CG 3.73Å; Y166-Y231 HydrophobicContact CE1-CE1 4.04Å; Y166-Y231 AromaticContact CE2-CD1 3.7Å; Y166-Y231 HydrophobicContact CE2-CD1 3.7Å; Y166-Y231 HydrophobicContact CE2-CE1 4.01Å; Y166-Y231 HydrophobicContact CE2-CG 4.14Å; Y166-Y231 HydrophobicContact CG-CD1 4.26Å; Y166-Y231 AromaticContact CG-CD2 3.98Å; Y166-Y231 HydrophobicContact CG-CD2 3.98Å; Y166-Y231 HydrophobicContact CG-CE1 4.41Å; Y166-Y231 HydrophobicContact CG-CE2 4.15Å; Y166-Y231 HydrophobicContact CG-CG 4.03Å; Y166-Y231 AromaticContact CZ-CE1 3.89Å; V227-Y231 VanDerWaalsContact O-CB 3.27Å; V227-Y231 WeakPolarHBondContact O-CB 3.25Å; V227-Y231 PolarHBondContact O-N 3.32Å; Y231-F234 PolarHBondContact O-N 3.37Å; Y231-H235 AromaticContact CD1-CD2 3.92Å; Y231-H235 AromaticContact CE1-CD2 3.53Å; Y231-H235 AromaticContact CE1-NE2 3.72Å; Y231-H235 AromaticContact CE2-NE2 3.81Å; Y231-H235 AromaticContact CZ-CD2 3.59Å; Y231-H235 AromaticContact CZ-NE2 3.31Å; Y231-H235 VanDerWaalsContact CZ-NE2 3.31Å; Y231-H235 PolarHBondContact O-CD2 3.01Å; Y231-H235 PolarHBondContact O-N 3.23Å; Y231-H235 PolarHBondContact OH-NE2 3.46Å; Y231-Q260 HydrophobicContact CE1-CG 3.88Å; Y231-Q260 VanDerWaalsContact OH-CD 3.3Å; Y231-Q260 PolarHBondContact OH-NE2 3.04Å; Y231-Q260 PolarHBondContact OH-OE1 3.11Å; Y231-A264 HydrophobicContact CD1-CB 3.91Å
232	G	96.9	Very high	91.6	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.1	-42.6	179.3	0	0	0	0	0	113.1	S228 F229 G230 F234 H235 L236 G261	S228-G232 WeakPolarHBondContact O-CA 3.32Å; S228-G232 PolarHBondContact O-N 3.45Å; F229-G232 PolarHBondContact O-N 3.01Å; G230-G232 VanDerWaalsContact C-N 3.34Å; G230-G232 PolarHBondContact O-N 3.29Å; G232-F234 VanDerWaalsContact C-N 3.35Å; G232-F234 PolarHBondContact O-N 3.34Å; G232-H235 PolarHBondContact O-N 2.85Å; G232-L236 VanDerWaalsContact O-CB 3.3Å; G232-L236 WeakPolarHBondContact O-CB 3.4Å; G232-L236 PolarHBondContact O-N 3.25Å; G232-G261 WeakPolarHBondContact CA-O 3.48Å; G232-G261 WeakPolarHBondContact O-CA 3.33Å
233	L	95.3	Very high	90.2	Very high	54 Å²	54	21.5 Å²	21.5	28%	0.283	13%	0.127	S	C	.	.	H	α-helix	trans	-60.1	-41.7	175.6	-76.4	-179.6	0	0	0	112.4	F229 G230 L236 C237 L265 A282	F229-L233 HydrophobicContact CD1-CD1 4.28Å; F229-L233 HydrophobicContact CD2-CD1 4.4Å; F229-L233 HydrophobicContact CE1-CD1 3.78Å; F229-L233 HydrophobicContact CE2-CD1 3.9Å; F229-L233 HydrophobicContact CE2-CG 4.31Å; F229-L233 HydrophobicContact CZ-CD1 3.58Å; F229-L233 HydrophobicContact CZ-CG 4.47Å; F229-L233 WeakPolarHBondContact O-CG 3.48Å; F229-L233 PolarHBondContact O-N 3.01Å; G230-L233 PolarHBondContact O-N 3.07Å; L233-L236 PolarHBondContact O-N 2.87Å; L233-C237 WeakPolarHBondContact O-CB 3.16Å; L233-C237 PolarHBondContact O-N 3.12Å; L233-C237 PolarHBondContact O-SG 3.06Å; L233-L265 HydrophobicContact CD2-CD1 4.37Å; L233-L265 HydrophobicContact CD2-CD2 4.14Å; L233-L265 HydrophobicContact CG-CD2 4.09Å; L233-A282 HydrophobicContact CD2-CB 4.17Å
234	F	93.1	Very high	88.7	Confident	21 Å²	21	28 Å²	28	9%	0.092	16%	0.157	C	C	.	.	H	α-helix	trans	-61.2	-51.6	176.5	-93.5	-88.1	0	0	0	111.4	V133 L155 A158 W159 Y162 G230 Y231 G232 L236 C237 I238	V133-F234 HydrophobicContact CG2-CE2 3.7Å; V133-F234 HydrophobicContact CG2-CZ 4.08Å; L155-F234 HydrophobicContact CB-CE1 4.15Å; L155-F234 HydrophobicContact CB-CZ 4.23Å; L155-F234 HydrophobicContact CD2-CE1 4.25Å; L155-F234 HydrophobicContact CD2-CZ 3.79Å; A158-F234 HydrophobicContact CB-CE2 4.36Å; A158-F234 HydrophobicContact CB-CZ 4.1Å; W159-F234 HydrophobicContact CB-CD1 4.08Å; W159-F234 HydrophobicContact CB-CE1 3.89Å; W159-F234 HydrophobicContact CB-CZ 4.2Å; W159-F234 HydrophobicContact CE3-CB 3.38Å; W159-F234 AromaticContact CE3-CD1 3.99Å; W159-F234 HydrophobicContact CE3-CD1 3.99Å; W159-F234 HydrophobicContact CE3-CD2 4.18Å; W159-F234 AromaticContact CE3-CG 3.6Å; W159-F234 HydrophobicContact CE3-CG 3.6Å; W159-F234 HydrophobicContact CZ3-CB 3.58Å; W159-F234 HydrophobicContact CZ3-CG 4.29Å; Y162-F234 HydrophobicContact CD2-CD2 4.01Å; Y162-F234 AromaticContact CD2-CE2 3.77Å; Y162-F234 HydrophobicContact CD2-CE2 3.77Å; Y162-F234 HydrophobicContact CE2-CD2 4.22Å; Y162-F234 AromaticContact CE2-CE2 3.74Å; Y162-F234 HydrophobicContact CE2-CE2 3.74Å; G230-F234 WeakPolarHBondContact O-CD2 3.45Å; G230-F234 PolarHBondContact O-N 3.5Å; G230-F234 VanDerWaalsContact O-N 3.08Å; Y231-F234 PolarHBondContact O-N 3.37Å; G232-F234 VanDerWaalsContact C-N 3.35Å; G232-F234 PolarHBondContact O-N 3.34Å; F234-L236 VanDerWaalsContact C-N 3.33Å; F234-L236 PolarHBondContact O-N 3.46Å; F234-C237 PolarHBondContact O-N 3.07Å; F234-I238 WeakPolarHBondContact O-CB 3.38Å; F234-I238 VanDerWaalsContact O-CG1 3.25Å; F234-I238 WeakPolarHBondContact O-CG1 3.47Å; F234-I238 PolarHBondContact O-N 2.69Å
235	H	92.7	Very high	87.2	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-56	-47.7	177.9	-94.7	-70.2	0	0	0	112.3	W159 Y231 G232 S239 D257 Q260	W159-H235 AromaticContact CH2-CD2 3.51Å; W159-H235 AromaticContact CH2-NE2 3.23Å; W159-H235 WeakPolarHBondContact CH2-NE2 3.47Å; W159-H235 AromaticContact CZ3-CD2 3.83Å; Y231-H235 AromaticContact CD1-CD2 3.92Å; Y231-H235 AromaticContact CE1-CD2 3.53Å; Y231-H235 AromaticContact CE1-NE2 3.72Å; Y231-H235 AromaticContact CE2-NE2 3.81Å; Y231-H235 AromaticContact CZ-CD2 3.59Å; Y231-H235 AromaticContact CZ-NE2 3.31Å; Y231-H235 VanDerWaalsContact CZ-NE2 3.31Å; Y231-H235 PolarHBondContact O-CD2 3.01Å; Y231-H235 PolarHBondContact O-N 3.23Å; Y231-H235 PolarHBondContact OH-NE2 3.46Å; G232-H235 PolarHBondContact O-N 2.85Å; H235-S239 WeakPolarHBondContact O-CB 3.47Å; H235-S239 PolarHBondContact O-N 3.23Å; H235-D257 WeakPolarHBondContact CB-O 3.27Å; H235-D257 PolarHBondContact ND1-N 2.97Å; H235-D257 VanDerWaalsContact ND1-N 3.18Å; H235-Q260 PolarHBondContact CE1-OE1 3.33Å; H235-Q260 PolarHBondContact NE2-OE1 3.01Å; H235-Q260 VanDerWaalsContact NE2-OE1 3.08Å
236	L	91.6	Very high	85.6	Confident	7 Å²	7	33.9 Å²	33.9	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-53.3	179.8	-173.8	59.8	0	0	0	111.5	G232 L233 F234 I238 S239 M240 R258 L262 L265 Y286	G232-L236 VanDerWaalsContact O-CB 3.3Å; G232-L236 WeakPolarHBondContact O-CB 3.4Å; G232-L236 PolarHBondContact O-N 3.25Å; L233-L236 PolarHBondContact O-N 2.87Å; F234-L236 VanDerWaalsContact C-N 3.33Å; F234-L236 PolarHBondContact O-N 3.46Å; L236-I238 VanDerWaalsContact C-N 3.33Å; L236-I238 PolarHBondContact O-N 3.39Å; L236-S239 PolarHBondContact O-N 2.96Å; L236-S239 VanDerWaalsContact O-N 3.17Å; L236-S239 PolarHBondContact O-OG 2.75Å; L236-M240 HydrophobicContact CG-CE 4.28Å; L236-M240 WeakPolarHBondContact O-CG 3.48Å; L236-M240 PolarHBondContact O-N 3.44Å; L236-R258 HydrophobicContact CD1-CG 4.08Å; L236-L262 HydrophobicContact CD1-CD2 4.01Å; L236-L262 HydrophobicContact CD1-CG 4.23Å; L236-L262 HydrophobicContact CD2-CD2 4.19Å; L236-L265 HydrophobicContact CD2-CD1 3.64Å; L236-Y286 HydrophobicContact CD1-CD2 3.85Å; L236-Y286 HydrophobicContact CD1-CE2 3.62Å; L236-Y286 HydrophobicContact CD1-CG 4.49Å; L236-Y286 HydrophobicContact CD2-CD2 3.86Å; L236-Y286 HydrophobicContact CD2-CE2 4.49Å; L236-Y286 HydrophobicContact CD2-CG 4.07Å; L236-Y286 HydrophobicContact CG-CD2 4.18Å; L236-Y286 HydrophobicContact CG-CE2 4.4Å
237	C	89.1	Confident	84	Confident	67 Å²	67	41.9 Å²	41.9	45%	0.453	22%	0.222	S	C	.	.	H	α-helix	trans	-58.2	-42.4	-179.4	-72.5	0	0	0	0	112.7	L233 F234 M240	L233-C237 WeakPolarHBondContact O-CB 3.16Å; L233-C237 PolarHBondContact O-N 3.12Å; L233-C237 PolarHBondContact O-SG 3.06Å; F234-C237 PolarHBondContact O-N 3.07Å; C237-M240 HydrophobicContact CB-CE 4.41Å; C237-M240 PolarHBondContact O-N 3.07Å
238	I	84.6	Confident	82.3	Confident	31 Å²	31	47.2 Å²	47.2	16%	0.159	25%	0.25	C	C	.	.	H	α-helix	trans	-69.5	-36.9	178.5	-62.8	-52	0	0	0	111.9	F234 L236 M240 V241 V249	F234-I238 WeakPolarHBondContact O-CB 3.38Å; F234-I238 VanDerWaalsContact O-CG1 3.25Å; F234-I238 WeakPolarHBondContact O-CG1 3.47Å; F234-I238 PolarHBondContact O-N 2.69Å; L236-I238 VanDerWaalsContact C-N 3.33Å; L236-I238 PolarHBondContact O-N 3.39Å; I238-M240 PolarHBondContact O-N 3.01Å; I238-V241 WeakPolarHBondContact O-CB 3.25Å; I238-V241 PolarHBondContact O-N 3.12Å; I238-V249 HydrophobicContact CD1-CG1 3.85Å; I238-V249 HydrophobicContact CG1-CG1 4.43Å; I238-V249 HydrophobicContact CG2-CG1 3.7Å
239	S	84.1	Confident	80.7	Confident	24 Å²	24	48.1 Å²	48.1	17%	0.168	26%	0.255	C	S	.	.	H	α-helix	trans	-61.4	-15.7	176.2	82.2	0	0	0	0	113.9	H235 L236 R258	H235-S239 WeakPolarHBondContact O-CB 3.47Å; H235-S239 PolarHBondContact O-N 3.23Å; L236-S239 PolarHBondContact O-N 2.96Å; L236-S239 VanDerWaalsContact O-N 3.17Å; L236-S239 PolarHBondContact O-OG 2.75Å; S239-R258 PolarHBondContact O-NH2 3.03Å; S239-R258 PolarHBondContact OG-NE 3.03Å
240	M	79.6	Confident	79.2	Confident	32 Å²	32	52.5 Å²	52.5	16%	0.158	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-6	-179.7	-59.4	-176.4	-70.1	0	0	112.8	L236 C237 I238 P242 Y286 V290 L296	L236-M240 HydrophobicContact CG-CE 4.28Å; L236-M240 WeakPolarHBondContact O-CG 3.48Å; L236-M240 PolarHBondContact O-N 3.44Å; C237-M240 HydrophobicContact CB-CE 4.41Å; C237-M240 PolarHBondContact O-N 3.07Å; I238-M240 PolarHBondContact O-N 3.01Å; M240-P242 WeakPolarHBondContact O-CD 2.99Å; M240-Y286 HydrophobicContact SD-CD2 4.35Å; M240-Y286 HydrophobicContact SD-CE2 4.22Å; M240-V290 HydrophobicContact CE-CG1 4.44Å; M240-V290 HydrophobicContact SD-CB 4.43Å; M240-V290 HydrophobicContact SD-CG1 3.17Å; M240-V290 WeakPolarHBondContact SD-CG1 3.25Å; M240-L296 HydrophobicContact CB-CD1 4.21Å; M240-L296 HydrophobicContact CG-CD1 3.77Å
241	V	76.3	Confident	77.6	Confident	38 Å²	38	59 Å²	59	23%	0.23	31%	0.313	C	S	.	.	S	Bend	trans	-73	126.9	179.5	177.1	0	0	0	0	109.3	I238 L245 L246 V249	I238-V241 WeakPolarHBondContact O-CB 3.25Å; I238-V241 PolarHBondContact O-N 3.12Å; V241-L245 HydrophobicContact CG1-CB 3.62Å; V241-L246 HydrophobicContact CB-CD2 4.02Å; V241-L246 HydrophobicContact CG1-CD2 4.15Å; V241-V249 HydrophobicContact CG1-CG2 3.95Å; V241-V249 HydrophobicContact CG2-CG2 4.44Å
242	P	67.1	Low	76.1	Confident	49 Å²	49	60.8 Å²	60.8	32%	0.318	32%	0.323	S	S	.	.			trans	-54.5	143.9	179	-29.5	35.5	0	0	0	113.5	M240 H244 L245 L246	M240-P242 WeakPolarHBondContact O-CD 2.99Å; P242-H244 VanDerWaalsContact C-N 3.25Å; P242-H244 WeakPolarHBondContact CB-CE1 3.47Å; P242-H244 PolarHBondContact O-N 3.27Å; P242-H244 VanDerWaalsContact O-N 3.08Å; P242-L245 PolarHBondContact O-N 3.15Å; P242-L246 PolarHBondContact O-N 3.26Å
243	P	66.5	Low	74.7	Confident	84 Å²	84	63 Å²	63	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-54	-35.1	-175	-29.8	35.1	0	0	0	115.5	L245 L246	P243-L245 PolarHBondContact O-N 3.01Å; P243-L246 HydrophobicContact CB-CD1 4.45Å; P243-L246 WeakPolarHBondContact O-CB 3.28Å; P243-L246 PolarHBondContact O-N 2.92Å
244	H	63.9	Low	73.5	Confident	137 Å²	137	61 Å²	61	63%	0.634	33%	0.334	S	S	*	.	H	α-helix	trans	-67.9	-22.6	178.6	65	-87.3	0	0	0	113.2	P242	P242-H244 VanDerWaalsContact C-N 3.25Å; P242-H244 WeakPolarHBondContact CB-CE1 3.47Å; P242-H244 PolarHBondContact O-N 3.27Å; P242-H244 VanDerWaalsContact O-N 3.08Å
245	L	65.6	Low	72.6	Confident	76 Å²	76	63.4 Å²	63.4	40%	0.398	35%	0.352	S	S	.	.	H	α-helix	trans	-92.2	-14.5	174.5	-59.6	-178	0	0	0	112.8	V241 P242 P243 K247 I248 V249	V241-L245 HydrophobicContact CG1-CB 3.62Å; P242-L245 PolarHBondContact O-N 3.15Å; P243-L245 PolarHBondContact O-N 3.01Å; L245-K247 PolarHBondContact O-N 3.34Å; L245-I248 PolarHBondContact O-N 3.16Å; L245-V249 PolarHBondContact O-N 3.22Å
246	L	64.8	Low	72.2	Confident	54 Å²	54	65.1 Å²	65.1	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-26	-179.6	-69.7	179	0	0	0	113	V241 P242 P243 I248 V249 N250	V241-L246 HydrophobicContact CB-CD2 4.02Å; V241-L246 HydrophobicContact CG1-CD2 4.15Å; P242-L246 PolarHBondContact O-N 3.26Å; P243-L246 HydrophobicContact CB-CD1 4.45Å; P243-L246 WeakPolarHBondContact O-CB 3.28Å; P243-L246 PolarHBondContact O-N 2.92Å; L246-I248 PolarHBondContact O-N 3.25Å; L246-V249 PolarHBondContact O-N 3.48Å; L246-V249 VanDerWaalsContact O-N 3.14Å; L246-N250 VanDerWaalsContact O-CB 3.31Å; L246-N250 WeakPolarHBondContact O-CB 3.47Å; L246-N250 PolarHBondContact O-N 2.89Å; L246-N250 PolarHBondContact O-ND2 2.98Å
247	K	64.7	Low	72.1	Confident	174 Å²	174	68.3 Å²	68.3	76%	0.757	39%	0.387	S	S	*	.	H	α-helix	trans	-58.4	-37	174.4	-67.7	-176.4	-178.2	177.8	0	112.2	L245 L251	L245-K247 PolarHBondContact O-N 3.34Å; K247-L251 PolarHBondContact O-N 2.85Å
248	I	63	Low	72.1	Confident	112 Å²	112	67.7 Å²	67.7	57%	0.574	38%	0.375	S	S	*	.	H	α-helix	trans	-75.4	-37.4	177.8	-60.2	173.2	0	0	0	110.3	L245 L246 L251 L252	L245-I248 PolarHBondContact O-N 3.16Å; L246-I248 PolarHBondContact O-N 3.25Å; I248-L251 WeakPolarHBondContact O-CB 3.49Å; I248-L251 PolarHBondContact O-N 3.47Å; I248-L252 PolarHBondContact O-N 3.43Å
249	V	64.3	Low	72.5	Confident	19 Å²	19	72.1 Å²	72.1	12%	0.115	40%	0.4	C	S	.	.	H	α-helix	trans	-68.7	-43	177.4	179.5	0	0	0	0	111.9	I238 V241 L245 L246 L251 L252 G253	I238-V249 HydrophobicContact CD1-CG1 3.85Å; I238-V249 HydrophobicContact CG1-CG1 4.43Å; I238-V249 HydrophobicContact CG2-CG1 3.7Å; V241-V249 HydrophobicContact CG1-CG2 3.95Å; V241-V249 HydrophobicContact CG2-CG2 4.44Å; L245-V249 PolarHBondContact O-N 3.22Å; L246-V249 PolarHBondContact O-N 3.48Å; L246-V249 VanDerWaalsContact O-N 3.14Å; V249-L251 PolarHBondContact O-N 3.08Å; V249-L252 WeakPolarHBondContact O-CA 3.3Å; V249-L252 WeakPolarHBondContact O-CB 3.16Å; V249-L252 PolarHBondContact O-N 3.4Å; V249-G253 PolarHBondContact O-N 3Å
250	N	66.4	Low	73	Confident	108 Å²	108	74.6 Å²	74.6	58%	0.578	41%	0.408	S	S	*	.	H	α-helix	trans	-62.3	-32	176.9	-71.5	-14.1	0	0	0	111.7	L246 L252 G253	L246-N250 VanDerWaalsContact O-CB 3.31Å; L246-N250 WeakPolarHBondContact O-CB 3.47Å; L246-N250 PolarHBondContact O-N 2.89Å; L246-N250 PolarHBondContact O-ND2 2.98Å; N250-L252 VanDerWaalsContact C-N 3.25Å; N250-L252 PolarHBondContact O-N 2.83Å; N250-G253 WeakPolarHBondContact O-CA 2.93Å; N250-G253 PolarHBondContact O-N 3.48Å; N250-G253 VanDerWaalsContact O-N 3.13Å
251	L	63.7	Low	73.8	Confident	141 Å²	141	73.1 Å²	73.1	74%	0.738	40%	0.401	S	S	*	.	H	α-helix	trans	-62.7	-31.7	172.3	-171.1	71.5	0	0	0	112.4	K247 I248 V249	K247-L251 PolarHBondContact O-N 2.85Å; I248-L251 WeakPolarHBondContact O-CB 3.49Å; I248-L251 PolarHBondContact O-N 3.47Å; V249-L251 PolarHBondContact O-N 3.08Å
252	L	65.8	Low	74.7	Confident	48 Å²	48	72.7 Å²	72.7	25%	0.251	40%	0.397	S	S	.	.	H	α-helix	trans	-78.6	-24.1	174.9	-61.7	173.5	0	0	0	112.2	R156 I248 V249 N250 F254	R156-L252 VanDerWaalsContact CZ-O 3.32Å; R156-L252 PolarHBondContact NE-O 3.49Å; R156-L252 PolarHBondContact NH2-O 3.42Å; I248-L252 PolarHBondContact O-N 3.43Å; V249-L252 WeakPolarHBondContact O-CA 3.3Å; V249-L252 WeakPolarHBondContact O-CB 3.16Å; V249-L252 PolarHBondContact O-N 3.4Å; N250-L252 VanDerWaalsContact C-N 3.25Å; N250-L252 PolarHBondContact O-N 2.83Å; L252-F254 HydrophobicContact CB-CD2 4.11Å; L252-F254 HydrophobicContact CB-CE2 3.94Å
253	G	65.8	Low	76.2	Confident	46 Å²	46	74.1 Å²	74.1	47%	0.474	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	40.1	167.1	0	0	0	0	0	115.1	V249 N250	V249-G253 PolarHBondContact O-N 3Å; N250-G253 WeakPolarHBondContact O-CA 2.93Å; N250-G253 PolarHBondContact O-N 3.48Å; N250-G253 VanDerWaalsContact O-N 3.13Å
254	F	71.1	Confident	77.7	Confident	12 Å²	12	70.2 Å²	70.2	5%	0.053	38%	0.383	C	S	.	.			trans	-117.4	128.1	176.1	-53.5	-48.5	0	0	0	112.9	R156 W159 K160 L252	R156-F254 HydrophobicContact CB-CE2 3.69Å; R156-F254 HydrophobicContact CB-CZ 3.54Å; R156-F254 HydrophobicContact CG-CE1 4.14Å; R156-F254 HydrophobicContact CG-CE2 3.54Å; R156-F254 HydrophobicContact CG-CZ 3.08Å; R156-F254 VanDerWaalsContact O-CZ 3.23Å; R156-F254 WeakPolarHBondContact O-CZ 3.23Å; W159-F254 HydrophobicContact CB-CD1 3.55Å; W159-F254 HydrophobicContact CB-CE1 3.45Å; W159-F254 VanDerWaalsContact CB-CE1 3.45Å; W159-F254 HydrophobicContact CB-CE2 4.4Å; W159-F254 HydrophobicContact CB-CG 4.08Å; W159-F254 HydrophobicContact CB-CZ 3.84Å; W159-F254 AromaticContact CD1-CD1 2.87Å; W159-F254 AromaticContact CD1-CE1 3Å; W159-F254 AromaticContact CD2-CD1 3.84Å; W159-F254 HydrophobicContact CD2-CD1 3.84Å; W159-F254 HydrophobicContact CD2-CE1 4.48Å; W159-F254 HydrophobicContact CD2-CG 4.37Å; W159-F254 AromaticContact CE2-CD1 3.99Å; W159-F254 HydrophobicContact CG-CB 4.42Å; W159-F254 AromaticContact CG-CD1 3.05Å; W159-F254 HydrophobicContact CG-CD1 3.05Å; W159-F254 AromaticContact CG-CE1 3.32Å; W159-F254 HydrophobicContact CG-CE1 3.32Å; W159-F254 AromaticContact CG-CG 3.8Å; W159-F254 HydrophobicContact CG-CG 3.8Å; W159-F254 HydrophobicContact CG-CZ 4.18Å; W159-F254 AromaticContact NE1-CD1 3.35Å; W159-F254 VanDerWaalsContact NE1-CD1 3.35Å; W159-F254 AromaticContact NE1-CE1 3.86Å; K160-F254 HydrophobicContact CG-CE1 4.41Å; L252-F254 HydrophobicContact CB-CD2 4.11Å; L252-F254 HydrophobicContact CB-CE2 3.94Å
255	P	74.1	Confident	79.3	Confident	71 Å²	71	63.7 Å²	63.7	46%	0.461	35%	0.353	S	S	.	.			trans	-71.3	140.2	173.7	31	-32.9	0	0	0	110.1	W159	W159-P255 HydrophobicContact CH2-CG 4.38Å; W159-P255 HydrophobicContact CZ2-CG 3.74Å
256	G	83.8	Confident	80.9	Confident	38 Å²	38	62.9 Å²	62.9	39%	0.392	35%	0.351	S	S	.	.			trans	-111.9	121.6	166.2	0	0	0	0	0	109
257	D	89.5	Confident	82.5	Confident	73 Å²	73	64 Å²	64	39%	0.39	35%	0.352	S	S	.	.			trans	-139.4	116.7	177.3	-179.2	-40.9	0	0	0	106.6	H235 D259 Q260 G261	H235-D257 WeakPolarHBondContact CB-O 3.27Å; H235-D257 PolarHBondContact ND1-N 2.97Å; H235-D257 VanDerWaalsContact ND1-N 3.18Å; D257-D259 PolarHBondContact OD1-N 3.29Å; D257-Q260 HydrophobicContact CB-CB 3.87Å; D257-Q260 PolarHBondContact OD1-N 3.49Å; D257-G261 PolarHBondContact O-N 2.59Å
258	R	90.2	Very high	84.1	Confident	54 Å²	54	55.8 Å²	55.8	20%	0.204	32%	0.316	C	S	.	.	H	α-helix	trans	-68.3	-43.9	-172.1	-172.7	173.3	-65.1	137.5	2.4	111.8	L236 S239 G261 L262 Y286 D297	L236-R258 HydrophobicContact CD1-CG 4.08Å; S239-R258 PolarHBondContact O-NH2 3.03Å; S239-R258 PolarHBondContact OG-NE 3.03Å; R258-G261 WeakPolarHBondContact O-CA 3.33Å; R258-G261 PolarHBondContact O-N 3.06Å; R258-L262 HydrophobicContact CG-CD1 4.19Å; R258-L262 WeakPolarHBondContact O-CG 3.29Å; R258-L262 PolarHBondContact O-N 2.8Å; R258-Y286 WeakPolarHBondContact CD-OH 3.32Å; R258-D297 IonicContact CZ-OD2 2.82Å; R258-D297 IonicContact NH1-OD2 2.74Å; R258-D297 PolarHBondContact NH1-OD2 3.06Å; R258-D297 IonicContact NH2-OD2 3.26Å
259	D	92.3	Very high	85.8	Confident	125 Å²	125	50.9 Å²	50.9	67%	0.668	29%	0.292	S	S	*	.	H	α-helix	trans	-70.2	-41	-175.7	-64.8	-24.8	0	0	0	110.3	D257 G261 L262 S263	D257-D259 PolarHBondContact OD1-N 3.29Å; D259-G261 VanDerWaalsContact C-N 3.3Å; D259-G261 PolarHBondContact O-N 3.13Å; D259-L262 PolarHBondContact O-N 3.49Å; D259-S263 VanDerWaalsContact O-CB 3.25Å; D259-S263 WeakPolarHBondContact O-CB 3.35Å; D259-S263 PolarHBondContact O-N 2.84Å
260	Q	95.4	Very high	87.3	Confident	76 Å²	76	56.4 Å²	56.4	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-39.8	171.5	-175	161.1	55.9	0	0	111.7	Y231 H235 D257 A264	Y231-Q260 HydrophobicContact CE1-CG 3.88Å; Y231-Q260 VanDerWaalsContact OH-CD 3.3Å; Y231-Q260 PolarHBondContact OH-NE2 3.04Å; Y231-Q260 PolarHBondContact OH-OE1 3.11Å; H235-Q260 PolarHBondContact CE1-OE1 3.33Å; H235-Q260 PolarHBondContact NE2-OE1 3.01Å; H235-Q260 VanDerWaalsContact NE2-OE1 3.08Å; D257-Q260 HydrophobicContact CB-CB 3.87Å; D257-Q260 PolarHBondContact OD1-N 3.49Å; Q260-A264 WeakPolarHBondContact O-CB 3.28Å; Q260-A264 PolarHBondContact O-N 2.68Å
261	G	95.7	Very high	88.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-50.7	175.6	0	0	0	0	0	112.8	G232 D257 R258 D259 L265	G232-G261 WeakPolarHBondContact CA-O 3.48Å; G232-G261 WeakPolarHBondContact O-CA 3.33Å; D257-G261 PolarHBondContact O-N 2.59Å; R258-G261 WeakPolarHBondContact O-CA 3.33Å; R258-G261 PolarHBondContact O-N 3.06Å; D259-G261 VanDerWaalsContact C-N 3.3Å; D259-G261 PolarHBondContact O-N 3.13Å; G261-L265 WeakPolarHBondContact O-CG 3.4Å; G261-L265 PolarHBondContact O-N 3.09Å; G261-L265 VanDerWaalsContact O-N 3.09Å
262	L	95.9	Very high	90.3	Very high	30 Å²	30	53.3 Å²	53.3	16%	0.157	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-44.5	178.9	-67.1	174.1	0	0	0	111.8	L236 R258 D259 A264 L265 T266 L283 Y286	L236-L262 HydrophobicContact CD1-CD2 4.01Å; L236-L262 HydrophobicContact CD1-CG 4.23Å; L236-L262 HydrophobicContact CD2-CD2 4.19Å; R258-L262 HydrophobicContact CG-CD1 4.19Å; R258-L262 WeakPolarHBondContact O-CG 3.29Å; R258-L262 PolarHBondContact O-N 2.8Å; D259-L262 PolarHBondContact O-N 3.49Å; L262-A264 VanDerWaalsContact C-N 3.35Å; L262-A264 PolarHBondContact O-N 3.1Å; L262-L265 PolarHBondContact O-N 3.25Å; L262-T266 PolarHBondContact O-N 3.36Å; L262-T266 PolarHBondContact O-OG1 3.34Å; L262-T266 VanDerWaalsContact O-OG1 3.09Å; L262-L283 HydrophobicContact CD2-CD2 3.98Å; L262-Y286 HydrophobicContact CD1-CE1 3.9Å; L262-Y286 HydrophobicContact CD2-CD1 3.59Å; L262-Y286 HydrophobicContact CD2-CE1 3.65Å; L262-Y286 HydrophobicContact CD2-CG 4.21Å; L262-Y286 HydrophobicContact CG-CE1 4.37Å
263	S	97.8	Very high	91.8	Very high	79 Å²	79	51.1 Å²	51.1	55%	0.552	28%	0.283	S	S	*	.	H	α-helix	trans	-59.1	-44	177.7	-178.1	0	0	0	0	112.3	D259 T266 Y267	D259-S263 VanDerWaalsContact O-CB 3.25Å; D259-S263 WeakPolarHBondContact O-CB 3.35Å; D259-S263 PolarHBondContact O-N 2.84Å; S263-T266 PolarHBondContact O-N 2.65Å; S263-Y267 PolarHBondContact O-N 2.81Å
264	A	98.3	Very high	93.2	Very high	1 Å²	1	49 Å²	49	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-39.9	176.9	0	0	0	0	0	112.3	S228 Y231 Q260 L262 Y267 A268	S228-A264 VanDerWaalsContact CB-O 3.31Å; S228-A264 WeakPolarHBondContact CB-O 3.4Å; Y231-A264 HydrophobicContact CD1-CB 3.91Å; Q260-A264 WeakPolarHBondContact O-CB 3.28Å; Q260-A264 PolarHBondContact O-N 2.68Å; L262-A264 VanDerWaalsContact C-N 3.35Å; L262-A264 PolarHBondContact O-N 3.1Å; A264-Y267 PolarHBondContact O-N 2.96Å; A264-A268 WeakPolarHBondContact O-CB 3.33Å; A264-A268 PolarHBondContact O-N 3.31Å
265	L	98.4	Very high	94.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.8	-41.1	175.4	-73.6	170.1	0	0	0	112.3	F229 L233 L236 G261 L262 A268 S269 A279 A282 L283	F229-L265 HydrophobicContact CD2-CD2 3.87Å; F229-L265 HydrophobicContact CE2-CD2 4.34Å; L233-L265 HydrophobicContact CD2-CD1 4.37Å; L233-L265 HydrophobicContact CD2-CD2 4.14Å; L233-L265 HydrophobicContact CG-CD2 4.09Å; L236-L265 HydrophobicContact CD2-CD1 3.64Å; G261-L265 WeakPolarHBondContact O-CG 3.4Å; G261-L265 PolarHBondContact O-N 3.09Å; G261-L265 VanDerWaalsContact O-N 3.09Å; L262-L265 PolarHBondContact O-N 3.25Å; L265-A268 PolarHBondContact O-N 2.75Å; L265-S269 WeakPolarHBondContact O-CB 3.32Å; L265-S269 PolarHBondContact O-N 2.84Å; L265-A279 HydrophobicContact CD2-CB 4.45Å; L265-A282 HydrophobicContact CD2-CB 4.5Å; L265-L283 HydrophobicContact CB-CD1 4.42Å; L265-L283 HydrophobicContact CB-CD2 3.85Å; L265-L283 HydrophobicContact CB-CG 4.07Å; L265-L283 HydrophobicContact CD1-CD2 4.41Å
266	T	98.3	Very high	95.6	Very high	60 Å²	60	45.3 Å²	45.3	37%	0.368	24%	0.239	S	C	.	.	H	α-helix	trans	-59.3	-49	174	-60.8	0	0	0	0	110.5	L262 S263 A268 S269 E270	L262-T266 PolarHBondContact O-N 3.36Å; L262-T266 PolarHBondContact O-OG1 3.34Å; L262-T266 VanDerWaalsContact O-OG1 3.09Å; S263-T266 PolarHBondContact O-N 2.65Å; T266-A268 VanDerWaalsContact C-N 3.32Å; T266-A268 PolarHBondContact O-N 3.39Å; T266-S269 WeakPolarHBondContact O-CB 3.42Å; T266-S269 PolarHBondContact O-N 3.47Å; T266-S269 VanDerWaalsContact O-N 3.07Å; T266-S269 PolarHBondContact O-OG 3.28Å; T266-E270 PolarHBondContact O-N 3.39Å
267	Y	98.3	Very high	96.2	Very high	78 Å²	78	43.7 Å²	43.7	31%	0.306	22%	0.221	S	C	.	.	H	α-helix	trans	-57.1	-45.2	175.1	-175.1	-80.5	0	0	0	112	Q173 K224 S263 A264 S269 E270 S271	Q173-Y267 PolarHBondContact NE2-OH 2.82Å; K224-Y267 HydrophobicContact CB-CE1 3.63Å; K224-Y267 HydrophobicContact CG-CD1 4.07Å; K224-Y267 HydrophobicContact CG-CE1 3.32Å; S263-Y267 PolarHBondContact O-N 2.81Å; A264-Y267 PolarHBondContact O-N 2.96Å; Y267-S269 VanDerWaalsContact C-N 3.29Å; Y267-S269 PolarHBondContact O-N 3.5Å; Y267-E270 PolarHBondContact O-N 2.99Å; Y267-S271 PolarHBondContact O-N 2.98Å
268	A	98.6	Very high	96.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-40.6	177.1	0	0	0	0	0	111.7	G225 F229 A264 L265 T266 E270 S271 A276 A279	G225-A268 WeakPolarHBondContact O-CB 3.4Å; F229-A268 HydrophobicContact CB-CB 4.09Å; A264-A268 WeakPolarHBondContact O-CB 3.33Å; A264-A268 PolarHBondContact O-N 3.31Å; L265-A268 PolarHBondContact O-N 2.75Å; T266-A268 VanDerWaalsContact C-N 3.32Å; T266-A268 PolarHBondContact O-N 3.39Å; A268-E270 VanDerWaalsContact C-N 3.27Å; A268-E270 PolarHBondContact O-N 3.36Å; A268-S271 WeakPolarHBondContact O-CB 3.48Å; A268-S271 PolarHBondContact O-N 3.3Å; A268-S271 PolarHBondContact O-OG 2.75Å; A268-A276 VanDerWaalsContact O-CA 3.26Å; A268-A276 WeakPolarHBondContact O-CA 3.39Å; A268-A276 WeakPolarHBondContact O-CB 3.31Å; A268-A279 HydrophobicContact CB-CB 3.77Å
269	S	98.1	Very high	97	Very high	10 Å²	10	38.6 Å²	38.6	7%	0.07	20%	0.198	C	C	.	.	H	α-helix	trans	-65.4	-26.9	-179.1	84.5	0	0	0	0	114	L265 T266 Y267 R315	L265-S269 WeakPolarHBondContact O-CB 3.32Å; L265-S269 PolarHBondContact O-N 2.84Å; T266-S269 WeakPolarHBondContact O-CB 3.42Å; T266-S269 PolarHBondContact O-N 3.47Å; T266-S269 VanDerWaalsContact O-N 3.07Å; T266-S269 PolarHBondContact O-OG 3.28Å; Y267-S269 VanDerWaalsContact C-N 3.29Å; Y267-S269 PolarHBondContact O-N 3.5Å; S269-R315 PolarHBondContact O-NH2 2.91Å
270	E	96.8	Very high	97.3	Very high	134 Å²	134	32.8 Å²	32.8	63%	0.626	17%	0.167	S	C	*	.	H	α-helix	trans	-90.5	-8.8	179.2	-65.2	-179.6	154.7	0	0	112.8	T266 Y267 A268	T266-E270 PolarHBondContact O-N 3.39Å; Y267-E270 PolarHBondContact O-N 2.99Å; A268-E270 VanDerWaalsContact C-N 3.27Å; A268-E270 PolarHBondContact O-N 3.36Å
271	S	96.4	Very high	97.4	Very high	21 Å²	21	30.5 Å²	30.5	15%	0.147	16%	0.157	C	C	.	.	S	Bend	trans	-75	168.7	-179.3	79	0	0	0	0	113.1	Y267 A268 D273 A276	Y267-S271 PolarHBondContact O-N 2.98Å; A268-S271 WeakPolarHBondContact O-CB 3.48Å; A268-S271 PolarHBondContact O-N 3.3Å; A268-S271 PolarHBondContact O-OG 2.75Å; S271-D273 VanDerWaalsContact C-N 3.31Å; S271-D273 PolarHBondContact OG-N 2.62Å; S271-A276 VanDerWaalsContact O-CB 3.22Å; S271-A276 WeakPolarHBondContact O-CB 3.34Å
272	K	95.4	Very high	97.4	Very high	164 Å²	164	31.4 Å²	31.4	71%	0.713	17%	0.165	S	C	*	.	S	Bend	trans	-95.1	21.5	171.7	-60.5	-177.1	-179.5	178.7	0	112.6
273	D	97.1	Very high	97.5	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	16%	0.158	C	C	.	.	S	Bend	trans	-87	152.8	177.1	-169.7	-101.3	0	0	0	111.4	R222 S271 K275 A276	R222-D273 HydrophobicContact CG-CB 3.87Å; R222-D273 IonicContact NH1-OD2 3.56Å; R222-D273 PolarHBondContact NH1-OD2 3.22Å; S271-D273 VanDerWaalsContact C-N 3.31Å; S271-D273 PolarHBondContact OG-N 2.62Å; D273-K275 PolarHBondContact O-N 2.89Å; D273-K275 WeakPolarHBondContact OD1-CB 3.22Å; D273-K275 WeakPolarHBondContact OD1-CG 3.09Å; D273-K275 PolarHBondContact OD1-N 3.43Å; D273-A276 VanDerWaalsContact O-CB 3.27Å; D273-A276 WeakPolarHBondContact O-CB 3.5Å; D273-A276 PolarHBondContact O-N 3.13Å
274	M	96.5	Very high	97.5	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-22.2	176.6	71	174.5	-61	0	0	113.8	A26 I30 F45 L54 F57 P277	A26-M274 HydrophobicContact CB-CB 3.94Å; A26-M274 HydrophobicContact CB-CE 4.39Å; A26-M274 HydrophobicContact CB-CG 4.45Å; A26-M274 HydrophobicContact CB-SD 3.95Å; I30-M274 HydrophobicContact CD1-CE 3.8Å; I30-M274 HydrophobicContact CG1-CB 4.03Å; I30-M274 HydrophobicContact CG1-CE 3.67Å; F45-M274 HydrophobicContact CE1-CE 4.4Å; F45-M274 HydrophobicContact CZ-CE 4.13Å; L54-M274 HydrophobicContact CD1-SD 3.67Å; L54-M274 HydrophobicContact CG-SD 4.48Å; F57-M274 HydrophobicContact CD1-CE 4.34Å; F57-M274 HydrophobicContact CD1-SD 3.86Å; F57-M274 HydrophobicContact CE1-CE 4.35Å; F57-M274 HydrophobicContact CE1-SD 4.03Å; M274-P277 WeakPolarHBondContact O-CD 3.41Å
275	K	97.1	Very high	97.4	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-11.9	177.1	-64.2	174.7	174.9	81.4	0	113.9	D130 S226 F229 D273 L278 A279	D130-K275 VanDerWaalsContact OD1-CE 3.31Å; D130-K275 WeakPolarHBondContact OD1-CE 3.28Å; D130-K275 IonicContact OD1-NZ 3.62Å; D130-K275 WeakPolarHBondContact OD2-CE 3.28Å; D130-K275 IonicContact OD2-NZ 3.88Å; D130-K275 PolarHBondContact OD2-NZ 3.01Å; S226-K275 WeakPolarHBondContact O-CD 3.24Å; S226-K275 PolarHBondContact OG-NZ 2.98Å; F229-K275 HydrophobicContact CB-CB 4.05Å; F229-K275 HydrophobicContact CB-CD 3.97Å; F229-K275 HydrophobicContact CD1-CB 4.14Å; F229-K275 HydrophobicContact CD1-CD 3.74Å; F229-K275 HydrophobicContact CD1-CG 4.14Å; F229-K275 HydrophobicContact CG-CB 4.04Å; F229-K275 HydrophobicContact CG-CD 4.17Å; D273-K275 PolarHBondContact O-N 2.89Å; D273-K275 WeakPolarHBondContact OD1-CB 3.22Å; D273-K275 WeakPolarHBondContact OD1-CG 3.09Å; D273-K275 PolarHBondContact OD1-N 3.43Å; K275-L278 WeakPolarHBondContact O-CB 3.49Å; K275-L278 PolarHBondContact O-N 3.01Å; K275-A279 PolarHBondContact O-N 3.27Å
276	A	97.9	Very high	97.2	Very high	5 Å²	5	33.3 Å²	33.3	4%	0.041	16%	0.158	C	C	.	.	H	α-helix	trans	-58.3	-43.2	-177.9	0	0	0	0	0	113.7	A268 S271 D273 L278 A279 T280	A268-A276 VanDerWaalsContact O-CA 3.26Å; A268-A276 WeakPolarHBondContact O-CA 3.39Å; A268-A276 WeakPolarHBondContact O-CB 3.31Å; S271-A276 VanDerWaalsContact O-CB 3.22Å; S271-A276 WeakPolarHBondContact O-CB 3.34Å; D273-A276 VanDerWaalsContact O-CB 3.27Å; D273-A276 WeakPolarHBondContact O-CB 3.5Å; D273-A276 PolarHBondContact O-N 3.13Å; A276-L278 VanDerWaalsContact C-N 3.31Å; A276-L278 PolarHBondContact O-N 3.36Å; A276-A279 PolarHBondContact O-N 3.1Å; A276-T280 PolarHBondContact O-N 3.48Å; A276-T280 VanDerWaalsContact O-N 3.07Å; A276-T280 PolarHBondContact O-OG1 3.37Å; A276-T280 VanDerWaalsContact O-OG1 3.06Å
277	P	97.4	Very high	96.9	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.019	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-36.8	172.9	-24.5	37.2	0	0	0	113.2	L27 I30 L34 M274 T280 L281 Y319	L27-P277 HydrophobicContact CD1-CG 3.81Å; I30-P277 HydrophobicContact CG2-CB 3.95Å; I30-P277 HydrophobicContact CG2-CG 3.99Å; L34-P277 HydrophobicContact CD1-CB 3.39Å; L34-P277 HydrophobicContact CG-CB 4.4Å; M274-P277 WeakPolarHBondContact O-CD 3.41Å; P277-T280 VanDerWaalsContact O-CB 3.3Å; P277-T280 WeakPolarHBondContact O-CB 3.48Å; P277-T280 PolarHBondContact O-N 3.18Å; P277-L281 WeakPolarHBondContact O-CG 3.21Å; P277-L281 PolarHBondContact O-N 2.93Å; P277-Y319 VanDerWaalsContact CB-OH 3.3Å; P277-Y319 WeakPolarHBondContact CB-OH 3.36Å; P277-Y319 WeakPolarHBondContact CG-OH 3.34Å
278	L	97.1	Very high	96.7	Very high	21 Å²	21	27.5 Å²	27.5	11%	0.11	13%	0.13	C	C	.	.	H	α-helix	trans	-69.3	-37.6	178.3	-54.1	175.5	0	0	0	111.9	I30 F61 F229 K275 A276 T280 L281 A282	I30-L278 HydrophobicContact CG2-CD2 4.3Å; I30-L278 HydrophobicContact CG2-CG 4.36Å; F61-L278 HydrophobicContact CE1-CD1 3.66Å; F61-L278 HydrophobicContact CE1-CD2 4.13Å; F61-L278 HydrophobicContact CE2-CD1 4.04Å; F61-L278 HydrophobicContact CZ-CD1 3.29Å; F61-L278 HydrophobicContact CZ-CD2 3.89Å; F61-L278 HydrophobicContact CZ-CG 4.23Å; F229-L278 HydrophobicContact CE2-CB 3.93Å; F229-L278 HydrophobicContact CZ-CB 3.77Å; K275-L278 WeakPolarHBondContact O-CB 3.49Å; K275-L278 PolarHBondContact O-N 3.01Å; A276-L278 VanDerWaalsContact C-N 3.31Å; A276-L278 PolarHBondContact O-N 3.36Å; L278-T280 VanDerWaalsContact C-N 3.3Å; L278-L281 PolarHBondContact O-N 3.04Å; L278-A282 WeakPolarHBondContact O-CB 3.38Å; L278-A282 PolarHBondContact O-N 3.48Å
279	A	98.3	Very high	96.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62	-40.6	172.7	0	0	0	0	0	111.3	F229 L265 A268 K275 A276 A282 L283	F229-A279 HydrophobicContact CD2-CB 3.73Å; F229-A279 HydrophobicContact CE2-CB 4.22Å; L265-A279 HydrophobicContact CD2-CB 4.45Å; A268-A279 HydrophobicContact CB-CB 3.77Å; K275-A279 PolarHBondContact O-N 3.27Å; A276-A279 PolarHBondContact O-N 3.1Å; A279-A282 PolarHBondContact O-N 2.99Å; A279-L283 WeakPolarHBondContact O-CG 3.37Å; A279-L283 PolarHBondContact O-N 3.5Å
280	T	98.3	Very high	95.8	Very high	3 Å²	3	29 Å²	29	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-58.4	-49	173.6	-58	0	0	0	0	111.3	A276 P277 L278 A282 L283 L284 I311 R315 F325	A276-T280 PolarHBondContact O-N 3.48Å; A276-T280 VanDerWaalsContact O-N 3.07Å; A276-T280 PolarHBondContact O-OG1 3.37Å; A276-T280 VanDerWaalsContact O-OG1 3.06Å; P277-T280 VanDerWaalsContact O-CB 3.3Å; P277-T280 WeakPolarHBondContact O-CB 3.48Å; P277-T280 PolarHBondContact O-N 3.18Å; L278-T280 VanDerWaalsContact C-N 3.3Å; T280-A282 VanDerWaalsContact C-N 3.34Å; T280-A282 PolarHBondContact O-N 3.46Å; T280-L283 PolarHBondContact O-N 3.44Å; T280-L284 HydrophobicContact CG2-CD1 4.41Å; T280-L284 WeakPolarHBondContact O-CG 3.38Å; T280-L284 PolarHBondContact O-N 3.29Å; T280-I311 HydrophobicContact CG2-CG2 3.57Å; T280-R315 HydrophobicContact CG2-CG 4.04Å; T280-F325 HydrophobicContact CG2-CE1 4.07Å; T280-F325 HydrophobicContact CG2-CZ 3.84Å
281	L	97.3	Very high	95.2	Very high	27 Å²	27	23.5 Å²	23.5	14%	0.141	11%	0.112	C	C	.	.	H	α-helix	trans	-64.3	-37.2	177	-65	-175.9	0	0	0	112.4	L34 P277 L278 L284 W285 L324 F325 F328	L34-L281 HydrophobicContact CD1-CD1 3.84Å; L34-L281 HydrophobicContact CD1-CG 4.17Å; L34-L281 HydrophobicContact CD2-CD1 3.64Å; L34-L281 HydrophobicContact CG-CD1 4.42Å; P277-L281 WeakPolarHBondContact O-CG 3.21Å; P277-L281 PolarHBondContact O-N 2.93Å; L278-L281 PolarHBondContact O-N 3.04Å; L281-L284 HydrophobicContact CD2-CD1 4.4Å; L281-L284 PolarHBondContact O-N 3.29Å; L281-W285 WeakPolarHBondContact O-CB 3.14Å; L281-W285 PolarHBondContact O-N 3.39Å; L281-L324 HydrophobicContact CD1-CD1 4.05Å; L281-L324 HydrophobicContact CD2-CB 4.49Å; L281-F325 HydrophobicContact CD2-CD2 4.31Å; L281-F325 HydrophobicContact CD2-CE2 3.78Å; L281-F325 HydrophobicContact CD2-CZ 4.16Å; L281-F328 HydrophobicContact CD2-CD2 4.26Å; L281-F328 HydrophobicContact CD2-CE2 3.97Å
282	A	97.3	Very high	94.6	Very high	20 Å²	20	24.4 Å²	24.4	17%	0.165	12%	0.118	C	C	.	.	H	α-helix	trans	-62.6	-42.3	176.5	0	0	0	0	0	111.8	F229 L233 L265 L278 A279 T280 W285 Y286	F229-A282 HydrophobicContact CE2-CB 4.44Å; L233-A282 HydrophobicContact CD2-CB 4.17Å; L265-A282 HydrophobicContact CD2-CB 4.5Å; L278-A282 WeakPolarHBondContact O-CB 3.38Å; L278-A282 PolarHBondContact O-N 3.48Å; A279-A282 PolarHBondContact O-N 2.99Å; T280-A282 VanDerWaalsContact C-N 3.34Å; T280-A282 PolarHBondContact O-N 3.46Å; A282-W285 PolarHBondContact O-N 3.41Å; A282-Y286 WeakPolarHBondContact O-CB 3.3Å; A282-Y286 PolarHBondContact O-N 3.4Å
283	L	97.8	Very high	93.7	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-64.5	-46.6	174.4	-70.7	168	0	0	0	111.7	L262 L265 A279 T280 W285 Y286 H287 I311	L262-L283 HydrophobicContact CD2-CD2 3.98Å; L265-L283 HydrophobicContact CB-CD1 4.42Å; L265-L283 HydrophobicContact CB-CD2 3.85Å; L265-L283 HydrophobicContact CB-CG 4.07Å; L265-L283 HydrophobicContact CD1-CD2 4.41Å; A279-L283 WeakPolarHBondContact O-CG 3.37Å; A279-L283 PolarHBondContact O-N 3.5Å; T280-L283 PolarHBondContact O-N 3.44Å; L283-W285 VanDerWaalsContact C-N 3.31Å; L283-W285 PolarHBondContact O-N 3.12Å; L283-Y286 PolarHBondContact O-N 3.27Å; L283-H287 PolarHBondContact O-CD2 3.31Å; L283-H287 PolarHBondContact O-N 3.05Å; L283-I311 HydrophobicContact CB-CD1 3.74Å; L283-I311 HydrophobicContact CD1-CD1 4.31Å
284	L	97.6	Very high	92.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-44.2	175.7	-73.9	172.1	0	0	0	111.6	T280 L281 T288 A308 I311 L312 F325 F328	T280-L284 HydrophobicContact CG2-CD1 4.41Å; T280-L284 WeakPolarHBondContact O-CG 3.38Å; T280-L284 PolarHBondContact O-N 3.29Å; L281-L284 HydrophobicContact CD2-CD1 4.4Å; L281-L284 PolarHBondContact O-N 3.29Å; L284-T288 WeakPolarHBondContact O-CB 3.42Å; L284-T288 WeakPolarHBondContact O-CG2 3.13Å; L284-T288 PolarHBondContact O-N 3.29Å; L284-T288 PolarHBondContact O-OG1 2.84Å; L284-A308 HydrophobicContact CD2-CB 4.21Å; L284-I311 HydrophobicContact CD1-CG2 4.18Å; L284-I311 HydrophobicContact CD2-CB 4.01Å; L284-I311 HydrophobicContact CD2-CG2 3.79Å; L284-I311 HydrophobicContact CG-CG2 3.84Å; L284-L312 HydrophobicContact CD1-CD2 4.01Å; L284-L312 HydrophobicContact CD2-CD2 4.03Å; L284-L312 HydrophobicContact CD2-CG 3.88Å; L284-F325 HydrophobicContact CD1-CD1 4.31Å; L284-F325 HydrophobicContact CD1-CE1 4.01Å; L284-F325 HydrophobicContact CD1-CZ 4.48Å; L284-F328 HydrophobicContact CB-CD1 3.87Å; L284-F328 HydrophobicContact CB-CD2 4.06Å; L284-F328 HydrophobicContact CB-CE1 4.03Å; L284-F328 HydrophobicContact CB-CE2 4.22Å; L284-F328 HydrophobicContact CB-CG 3.9Å; L284-F328 HydrophobicContact CB-CZ 4.2Å; L284-F328 HydrophobicContact CD1-CB 4.15Å; L284-F328 HydrophobicContact CD1-CD2 3.89Å; L284-F328 HydrophobicContact CD1-CG 4.06Å; L284-F328 HydrophobicContact CG-CG 4.47Å
285	W	95.3	Very high	90.5	Very high	135 Å²	135	27.7 Å²	27.7	51%	0.511	14%	0.138	S	C	.	.	H	α-helix	trans	-65.4	-42.5	177.5	-168.6	83.1	0	0	0	112	L281 A282 L283 V289 V290 F328	L281-W285 WeakPolarHBondContact O-CB 3.14Å; L281-W285 PolarHBondContact O-N 3.39Å; A282-W285 PolarHBondContact O-N 3.41Å; L283-W285 VanDerWaalsContact C-N 3.31Å; L283-W285 PolarHBondContact O-N 3.12Å; W285-V289 HydrophobicContact CD2-CB 4.31Å; W285-V289 HydrophobicContact CG-CB 4.34Å; W285-V289 HydrophobicContact CG-CG2 4.33Å; W285-V289 HydrophobicContact CZ2-CB 4.47Å; W285-V289 HydrophobicContact CZ2-CG1 3.99Å; W285-V289 WeakPolarHBondContact O-CA 3.38Å; W285-V289 VanDerWaalsContact O-CB 3.24Å; W285-V289 WeakPolarHBondContact O-CB 3.43Å; W285-V289 PolarHBondContact O-N 3.44Å; W285-V290 HydrophobicContact CD2-CG2 4.05Å; W285-V290 HydrophobicContact CE3-CG2 3.23Å; W285-V290 HydrophobicContact CH2-CG2 3.37Å; W285-V290 HydrophobicContact CZ2-CG2 4.15Å; W285-V290 HydrophobicContact CZ3-CB 4.38Å; W285-V290 HydrophobicContact CZ3-CG2 2.87Å; W285-V290 PolarHBondContact O-N 3.39Å; W285-F328 HydrophobicContact CB-CE1 4.26Å; W285-F328 HydrophobicContact CB-CZ 4.1Å
286	Y	93.6	Very high	88.3	Confident	10 Å²	10	29 Å²	29	4%	0.039	15%	0.146	C	C	.	.	I	π-helix	trans	-58	-54.4	175.6	174	-102.6	0	0	0	111.5	L236 M240 R258 L262 A282 L283 T288 V290 Q291	L236-Y286 HydrophobicContact CD1-CD2 3.85Å; L236-Y286 HydrophobicContact CD1-CE2 3.62Å; L236-Y286 HydrophobicContact CD1-CG 4.49Å; L236-Y286 HydrophobicContact CD2-CD2 3.86Å; L236-Y286 HydrophobicContact CD2-CE2 4.49Å; L236-Y286 HydrophobicContact CD2-CG 4.07Å; L236-Y286 HydrophobicContact CG-CD2 4.18Å; L236-Y286 HydrophobicContact CG-CE2 4.4Å; M240-Y286 HydrophobicContact SD-CD2 4.35Å; M240-Y286 HydrophobicContact SD-CE2 4.22Å; R258-Y286 WeakPolarHBondContact CD-OH 3.32Å; L262-Y286 HydrophobicContact CD1-CE1 3.9Å; L262-Y286 HydrophobicContact CD2-CD1 3.59Å; L262-Y286 HydrophobicContact CD2-CE1 3.65Å; L262-Y286 HydrophobicContact CD2-CG 4.21Å; L262-Y286 HydrophobicContact CG-CE1 4.37Å; A282-Y286 WeakPolarHBondContact O-CB 3.3Å; A282-Y286 PolarHBondContact O-N 3.4Å; L283-Y286 PolarHBondContact O-N 3.27Å; Y286-T288 PolarHBondContact O-N 3.2Å; Y286-V290 HydrophobicContact CD2-CB 3.95Å; Y286-V290 HydrophobicContact CD2-CG1 3.85Å; Y286-V290 HydrophobicContact CD2-CG2 4.45Å; Y286-V290 HydrophobicContact CE2-CB 4.48Å; Y286-V290 HydrophobicContact CE2-CG1 3.99Å; Y286-V290 WeakPolarHBondContact O-CB 3.16Å; Y286-V290 PolarHBondContact O-N 2.59Å; Y286-Q291 WeakPolarHBondContact O-CB 3.29Å; Y286-Q291 PolarHBondContact O-N 3.13Å
287	H	93.5	Very high	85.8	Confident	17 Å²	17	33.6 Å²	33.6	8%	0.079	17%	0.169	C	C	.	.	I	π-helix	trans	-70.8	-31.4	-175.4	-70.5	-53.1	0	0	0	113.9	L283 Q291 P292 G304 A308	L283-H287 PolarHBondContact O-CD2 3.31Å; L283-H287 PolarHBondContact O-N 3.05Å; H287-Q291 PolarHBondContact ND1-OE1 2.87Å; H287-P292 WeakPolarHBondContact O-CD 3.47Å; H287-G304 WeakPolarHBondContact CB-O 3.48Å; H287-A308 HydrophobicContact CB-CB 4.05Å
288	T	93.9	Very high	83.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-103.2	-12.2	-174.5	68	0	0	0	0	114.9	L284 Y286 A308 F328 R331 V332 L335	L284-T288 WeakPolarHBondContact O-CB 3.42Å; L284-T288 WeakPolarHBondContact O-CG2 3.13Å; L284-T288 PolarHBondContact O-N 3.29Å; L284-T288 PolarHBondContact O-OG1 2.84Å; Y286-T288 PolarHBondContact O-N 3.2Å; T288-A308 HydrophobicContact CG2-CB 3.57Å; T288-F328 WeakPolarHBondContact OG1-CD1 3.4Å; T288-R331 HydrophobicContact CG2-CB 4.48Å; T288-R331 PolarHBondContact O-NH2 3.12Å; T288-V332 HydrophobicContact CG2-CG2 3.95Å; T288-L335 HydrophobicContact CG2-CD1 4.45Å
289	V	90.4	Very high	81.3	Confident	39 Å²	39	37 Å²	37	24%	0.236	20%	0.203	C	C	.	.	I	π-helix	trans	-125.3	-59	-178.1	-175.2	0	0	0	0	111	W285 F293	W285-V289 HydrophobicContact CD2-CB 4.31Å; W285-V289 HydrophobicContact CG-CB 4.34Å; W285-V289 HydrophobicContact CG-CG2 4.33Å; W285-V289 HydrophobicContact CZ2-CB 4.47Å; W285-V289 HydrophobicContact CZ2-CG1 3.99Å; W285-V289 WeakPolarHBondContact O-CA 3.38Å; W285-V289 VanDerWaalsContact O-CB 3.24Å; W285-V289 WeakPolarHBondContact O-CB 3.43Å; W285-V289 PolarHBondContact O-N 3.44Å; V289-F293 WeakPolarHBondContact O-CB 3.46Å; V289-F293 PolarHBondContact O-N 2.63Å; V289-F293 VanDerWaalsContact O-N 3.13Å
290	V	87.1	Confident	79.4	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	23%	0.228	C	C	.	.	I	π-helix	trans	-65.9	-57.4	-173.9	174	0	0	0	0	111.9	M240 W285 Y286 F293 F294	M240-V290 HydrophobicContact CE-CG1 4.44Å; M240-V290 HydrophobicContact SD-CB 4.43Å; M240-V290 HydrophobicContact SD-CG1 3.17Å; M240-V290 WeakPolarHBondContact SD-CG1 3.25Å; W285-V290 HydrophobicContact CD2-CG2 4.05Å; W285-V290 HydrophobicContact CE3-CG2 3.23Å; W285-V290 HydrophobicContact CH2-CG2 3.37Å; W285-V290 HydrophobicContact CZ2-CG2 4.15Å; W285-V290 HydrophobicContact CZ3-CB 4.38Å; W285-V290 HydrophobicContact CZ3-CG2 2.87Å; W285-V290 PolarHBondContact O-N 3.39Å; Y286-V290 HydrophobicContact CD2-CB 3.95Å; Y286-V290 HydrophobicContact CD2-CG1 3.85Å; Y286-V290 HydrophobicContact CD2-CG2 4.45Å; Y286-V290 HydrophobicContact CE2-CB 4.48Å; Y286-V290 HydrophobicContact CE2-CG1 3.99Å; Y286-V290 WeakPolarHBondContact O-CB 3.16Å; Y286-V290 PolarHBondContact O-N 2.59Å; V290-F293 PolarHBondContact O-N 2.68Å; V290-F294 HydrophobicContact CG1-CD2 3.74Å; V290-F294 HydrophobicContact CG1-CE2 4.18Å; V290-F294 WeakPolarHBondContact O-CD2 3.3Å; V290-F294 PolarHBondContact O-N 3.24Å
291	Q	84.2	Confident	78.2	Confident	17 Å²	17	45.4 Å²	45.4	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-46.3	-172.5	179.8	-177.7	6.1	0	0	110.7	Y286 H287 F293 A295	Y286-Q291 WeakPolarHBondContact O-CB 3.29Å; Y286-Q291 PolarHBondContact O-N 3.13Å; H287-Q291 PolarHBondContact ND1-OE1 2.87Å; Q291-F293 VanDerWaalsContact C-N 3.34Å; Q291-F293 PolarHBondContact O-N 3.03Å; Q291-A295 PolarHBondContact O-N 3.3Å
292	P	82.7	Confident	77.4	Confident	40 Å²	40	48.8 Å²	48.8	26%	0.26	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-34.4	172.9	-24.1	34.9	0	0	0	114.4	H287 L335	H287-P292 WeakPolarHBondContact O-CD 3.47Å; P292-L335 HydrophobicContact CB-CD2 4.01Å; P292-L335 HydrophobicContact CG-CD1 4.02Å; P292-L335 HydrophobicContact CG-CD2 3.94Å
293	F	76.8	Confident	76.9	Confident	121 Å²	121	50.1 Å²	50.1	53%	0.531	28%	0.277	S	S	.	.	H	α-helix	trans	-73.4	-47.6	-176.8	-175.7	-94.2	0	0	0	112.6	V289 V290 Q291	V289-F293 WeakPolarHBondContact O-CB 3.46Å; V289-F293 PolarHBondContact O-N 2.63Å; V289-F293 VanDerWaalsContact O-N 3.13Å; V290-F293 PolarHBondContact O-N 2.68Å; Q291-F293 VanDerWaalsContact C-N 3.34Å; Q291-F293 PolarHBondContact O-N 3.03Å
294	F	66.6	Low	76.5	Confident	83 Å²	83	50 Å²	50	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-85.3	-23.5	-175.6	-70.9	-76.8	0	0	0	113.1	V290 L296	V290-F294 HydrophobicContact CG1-CD2 3.74Å; V290-F294 HydrophobicContact CG1-CE2 4.18Å; V290-F294 WeakPolarHBondContact O-CD2 3.3Å; V290-F294 PolarHBondContact O-N 3.24Å; F294-L296 HydrophobicContact CB-CD1 4.12Å; F294-L296 HydrophobicContact CB-CD2 3.69Å; F294-L296 HydrophobicContact CB-CG 3.51Å; F294-L296 HydrophobicContact CG-CD2 4.34Å; F294-L296 HydrophobicContact CG-CG 4.44Å; F294-L296 PolarHBondContact O-N 3.36Å
295	A	61	Low	76.2	Confident	32 Å²	32	50.5 Å²	50.5	26%	0.264	28%	0.279	S	S	.	.			trans	44.6	38.2	-175.2	0	0	0	0	0	111.9	Q291 D297 G298	Q291-A295 PolarHBondContact O-N 3.3Å; A295-D297 PolarHBondContact O-N 3.15Å; A295-G298 PolarHBondContact O-N 2.99Å
296	L	51.3	Low	76.1	Confident	30 Å²	30	48.6 Å²	48.6	16%	0.157	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-52.5	104.8	-175.4	-61.3	164.8	0	0	0	106.5	M240 F294 S299	M240-L296 HydrophobicContact CB-CD1 4.21Å; M240-L296 HydrophobicContact CG-CD1 3.77Å; F294-L296 HydrophobicContact CB-CD1 4.12Å; F294-L296 HydrophobicContact CB-CD2 3.69Å; F294-L296 HydrophobicContact CB-CG 3.51Å; F294-L296 HydrophobicContact CG-CD2 4.34Å; F294-L296 HydrophobicContact CG-CG 4.44Å; F294-L296 PolarHBondContact O-N 3.36Å; L296-S299 PolarHBondContact O-OG 3.03Å; L296-S299 VanDerWaalsContact O-OG 3.05Å
297	D	43.9	Very low	76.2	Confident	101 Å²	101	53.1 Å²	53.1	54%	0.54	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	83.4	12.8	167.4	-29.9	-38.2	0	0	0	115.6	R258 A295 S299	R258-D297 IonicContact CZ-OD2 2.82Å; R258-D297 IonicContact NH1-OD2 2.74Å; R258-D297 PolarHBondContact NH1-OD2 3.06Å; R258-D297 IonicContact NH2-OD2 3.26Å; A295-D297 PolarHBondContact O-N 3.15Å; D297-S299 PolarHBondContact O-N 2.73Å
298	G	49.1	Very low	76.3	Confident	51 Å²	51	52.3 Å²	52.3	53%	0.526	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	65	20.7	-177.3	0	0	0	0	0	113.2	A295	A295-G298 PolarHBondContact O-N 2.99Å
299	S	50.8	Low	76.5	Confident	44 Å²	44	55.9 Å²	55.9	31%	0.308	31%	0.31	S	S	.	.			trans	-57.1	144.5	177.8	49.5	0	0	0	0	111.7	L296 D297 T301	L296-S299 PolarHBondContact O-OG 3.03Å; L296-S299 VanDerWaalsContact O-OG 3.05Å; D297-S299 PolarHBondContact O-N 2.73Å; S299-T301 PolarHBondContact O-N 3.42Å
300	D	59.9	Low	76.8	Confident	98 Å²	98	56.7 Å²	56.7	52%	0.524	32%	0.317	S	S	.	.			trans	-59.9	98.4	-176	-174.2	8.7	0	0	0	110.9	Q302 A303 G304	D300-Q302 PolarHBondContact O-N 2.87Å; D300-Q302 VanDerWaalsContact O-N 3.12Å; D300-Q302 WeakPolarHBondContact OD1-CA 3.34Å; D300-Q302 WeakPolarHBondContact OD1-CB 3.36Å; D300-Q302 PolarHBondContact OD1-N 3.36Å; D300-A303 HydrophobicContact CB-CB 4.05Å; D300-A303 PolarHBondContact O-N 2.93Å; D300-G304 PolarHBondContact O-N 3.49Å
301	T	71.6	Confident	77.3	Confident	82 Å²	82	57.3 Å²	57.3	50%	0.503	32%	0.32	S	S	.	.	H	α-helix	trans	-58.3	-23.2	174.6	48	0	0	0	0	111.3	S299 L305	S299-T301 PolarHBondContact O-N 3.42Å; T301-L305 VanDerWaalsContact O-CB 3.3Å; T301-L305 WeakPolarHBondContact O-CB 3.38Å; T301-L305 PolarHBondContact O-N 3.02Å
302	Q	81.7	Confident	78	Confident	98 Å²	98	57.7 Å²	57.7	46%	0.458	32%	0.323	S	S	.	.	H	α-helix	trans	-70	-42.5	175.6	-165.7	63.3	14.9	0	0	111.6	D300 L305 M306	D300-Q302 PolarHBondContact O-N 2.87Å; D300-Q302 VanDerWaalsContact O-N 3.12Å; D300-Q302 WeakPolarHBondContact OD1-CA 3.34Å; D300-Q302 WeakPolarHBondContact OD1-CB 3.36Å; D300-Q302 PolarHBondContact OD1-N 3.36Å; Q302-L305 WeakPolarHBondContact O-CB 3.47Å; Q302-L305 PolarHBondContact O-N 3.5Å; Q302-M306 VanDerWaalsContact O-CG 3.29Å; Q302-M306 WeakPolarHBondContact O-CG 3.41Å; Q302-M306 PolarHBondContact O-N 3.38Å
303	A	86	Confident	78.7	Confident	48 Å²	48	63.6 Å²	63.6	40%	0.397	34%	0.344	S	S	.	.	H	α-helix	trans	-60.2	-48	176.7	0	0	0	0	0	111.1	D300 L305 M306 E307	D300-A303 HydrophobicContact CB-CB 4.05Å; D300-A303 PolarHBondContact O-N 2.93Å; A303-L305 VanDerWaalsContact C-N 3.33Å; A303-L305 PolarHBondContact O-N 3.46Å; A303-M306 PolarHBondContact O-N 3.03Å; A303-M306 VanDerWaalsContact O-N 3.15Å; A303-E307 WeakPolarHBondContact O-CG 3.32Å; A303-E307 PolarHBondContact O-N 3.3Å
304	G	88.8	Confident	79.6	Confident	2 Å²	2	63.3 Å²	63.3	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-59.6	-42.3	175.8	0	0	0	0	0	112.9	H287 D300 M306 E307 A308	H287-G304 WeakPolarHBondContact CB-O 3.48Å; D300-G304 PolarHBondContact O-N 3.49Å; G304-M306 VanDerWaalsContact C-N 3.34Å; G304-M306 PolarHBondContact O-N 2.98Å; G304-E307 PolarHBondContact O-N 2.96Å; G304-A308 PolarHBondContact O-N 3.35Å
305	L	91.3	Very high	81.1	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.052	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-40.2	175.5	-178.3	62.5	0	0	0	112.4	T301 Q302 A303 A308 K309 V332 L335 E336	T301-L305 VanDerWaalsContact O-CB 3.3Å; T301-L305 WeakPolarHBondContact O-CB 3.38Å; T301-L305 PolarHBondContact O-N 3.02Å; Q302-L305 WeakPolarHBondContact O-CB 3.47Å; Q302-L305 PolarHBondContact O-N 3.5Å; A303-L305 VanDerWaalsContact C-N 3.33Å; A303-L305 PolarHBondContact O-N 3.46Å; L305-A308 PolarHBondContact O-N 3.32Å; L305-K309 HydrophobicContact CG-CD 4.43Å; L305-K309 WeakPolarHBondContact O-CG 3.3Å; L305-K309 PolarHBondContact O-N 3Å; L305-V332 HydrophobicContact CD1-CB 4.18Å; L305-V332 HydrophobicContact CD1-CG1 3.8Å; L305-V332 HydrophobicContact CD1-CG2 4.16Å; L305-L335 HydrophobicContact CD1-CB 3.99Å; L305-L335 HydrophobicContact CD1-CD1 4.18Å; L305-E336 HydrophobicContact CD1-CG 4.49Å; L305-E336 HydrophobicContact CD2-CG 3.73Å
306	M	93.7	Very high	82.7	Confident	95 Å²	95	66.1 Å²	66.1	47%	0.468	35%	0.351	S	S	.	.	H	α-helix	trans	-66.3	-40.4	176.7	-71.6	-56.8	-60.8	0	0	112.2	Q302 A303 G304 K309 C310	Q302-M306 VanDerWaalsContact O-CG 3.29Å; Q302-M306 WeakPolarHBondContact O-CG 3.41Å; Q302-M306 PolarHBondContact O-N 3.38Å; A303-M306 PolarHBondContact O-N 3.03Å; A303-M306 VanDerWaalsContact O-N 3.15Å; G304-M306 VanDerWaalsContact C-N 3.34Å; G304-M306 PolarHBondContact O-N 2.98Å; M306-K309 PolarHBondContact O-N 2.66Å; M306-K309 HydrophobicContact SD-CD 4.28Å; M306-C310 PolarHBondContact O-N 3.14Å
307	E	95	Very high	84.8	Confident	104 Å²	104	69.3 Å²	69.3	49%	0.486	38%	0.382	S	S	.	.	H	α-helix	trans	-59	-48.4	172.8	-71.5	-59.8	153.1	0	0	111.2	A303 G304 K309 C310 I311	A303-E307 WeakPolarHBondContact O-CG 3.32Å; A303-E307 PolarHBondContact O-N 3.3Å; G304-E307 PolarHBondContact O-N 2.96Å; E307-K309 VanDerWaalsContact C-N 3.3Å; E307-K309 PolarHBondContact O-N 3.37Å; E307-C310 WeakPolarHBondContact O-CB 3.36Å; E307-C310 PolarHBondContact O-N 2.97Å; E307-C310 VanDerWaalsContact O-N 3.13Å; E307-I311 WeakPolarHBondContact O-CG1 3.29Å; E307-I311 PolarHBondContact O-N 3.19Å
308	A	96.8	Very high	87.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-58.3	-41.5	177.1	0	0	0	0	0	112.4	L284 H287 T288 G304 L305 I311 L312 V332	L284-A308 HydrophobicContact CD2-CB 4.21Å; H287-A308 HydrophobicContact CB-CB 4.05Å; T288-A308 HydrophobicContact CG2-CB 3.57Å; G304-A308 PolarHBondContact O-N 3.35Å; L305-A308 PolarHBondContact O-N 3.32Å; A308-I311 PolarHBondContact O-N 2.99Å; A308-L312 WeakPolarHBondContact O-CG 3.39Å; A308-L312 PolarHBondContact O-N 3.46Å; A308-V332 HydrophobicContact CB-CG2 3.93Å
309	K	97.4	Very high	89.5	Confident	75 Å²	75	65.8 Å²	65.8	33%	0.326	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-41.7	175.8	-73.6	171.1	72.5	167.3	0	112.3	L305 M306 E307 L312 K313 V332 E336	L305-K309 HydrophobicContact CG-CD 4.43Å; L305-K309 WeakPolarHBondContact O-CG 3.3Å; L305-K309 PolarHBondContact O-N 3Å; M306-K309 PolarHBondContact O-N 2.66Å; M306-K309 HydrophobicContact SD-CD 4.28Å; E307-K309 VanDerWaalsContact C-N 3.3Å; E307-K309 PolarHBondContact O-N 3.37Å; K309-L312 PolarHBondContact O-N 3.41Å; K309-K313 WeakPolarHBondContact O-CB 3.5Å; K309-K313 PolarHBondContact O-N 3.45Å; K309-V332 HydrophobicContact CD-CG1 3.92Å; K309-V332 HydrophobicContact CG-CG1 3.5Å; K309-V332 HydrophobicContact CG-CG2 4.44Å; K309-E336 IonicContact NZ-OE1 3.09Å; K309-E336 PolarHBondContact NZ-OE1 3.03Å
310	C	97.6	Very high	91.5	Very high	56 Å²	56	67.4 Å²	67.4	38%	0.378	36%	0.362	S	S	.	.	H	α-helix	trans	-61	-48.8	176.8	-169	0	0	0	0	110.7	M306 E307 L312 K313 Q314	M306-C310 PolarHBondContact O-N 3.14Å; E307-C310 WeakPolarHBondContact O-CB 3.36Å; E307-C310 PolarHBondContact O-N 2.97Å; E307-C310 VanDerWaalsContact O-N 3.13Å; C310-L312 PolarHBondContact O-N 2.92Å; C310-K313 PolarHBondContact O-N 3.14Å; C310-Q314 WeakPolarHBondContact O-CB 3.17Å; C310-Q314 VanDerWaalsContact O-CG 3.31Å; C310-Q314 WeakPolarHBondContact O-CG 3.48Å; C310-Q314 PolarHBondContact O-N 2.93Å; C310-Q314 PolarHBondContact SG-NE2 3.45Å; C310-Q314 VanDerWaalsContact SG-NE2 3.41Å
311	I	97.9	Very high	93.1	Very high	16 Å²	16	67.6 Å²	67.6	8%	0.082	36%	0.363	C	S	.	.	H	α-helix	trans	-58	-50	177.6	-66.9	166.3	0	0	0	110.8	T280 L283 L284 E307 A308 K313 Q314 R315	T280-I311 HydrophobicContact CG2-CG2 3.57Å; L283-I311 HydrophobicContact CB-CD1 3.74Å; L283-I311 HydrophobicContact CD1-CD1 4.31Å; L284-I311 HydrophobicContact CD1-CG2 4.18Å; L284-I311 HydrophobicContact CD2-CB 4.01Å; L284-I311 HydrophobicContact CD2-CG2 3.79Å; L284-I311 HydrophobicContact CG-CG2 3.84Å; E307-I311 WeakPolarHBondContact O-CG1 3.29Å; E307-I311 PolarHBondContact O-N 3.19Å; A308-I311 PolarHBondContact O-N 2.99Å; I311-K313 VanDerWaalsContact C-N 3.34Å; I311-K313 PolarHBondContact O-N 3.25Å; I311-Q314 PolarHBondContact O-N 3.46Å; I311-R315 HydrophobicContact CG2-CG 4.38Å; I311-R315 WeakPolarHBondContact O-CB 3.29Å; I311-R315 WeakPolarHBondContact O-CG 3.37Å; I311-R315 PolarHBondContact O-N 3.23Å; I311-R315 VanDerWaalsContact O-N 3.1Å
312	L	97.8	Very high	94.3	Very high	25 Å²	25	63.7 Å²	63.7	13%	0.131	34%	0.339	C	S	.	.	H	α-helix	trans	-58.5	-45.7	179.5	-72.5	173.1	0	0	0	111.8	L284 A308 K309 C310 Q314 R315 E316 F325 F328 K329 V332	L284-L312 HydrophobicContact CD1-CD2 4.01Å; L284-L312 HydrophobicContact CD2-CD2 4.03Å; L284-L312 HydrophobicContact CD2-CG 3.88Å; A308-L312 WeakPolarHBondContact O-CG 3.39Å; A308-L312 PolarHBondContact O-N 3.46Å; K309-L312 PolarHBondContact O-N 3.41Å; C310-L312 PolarHBondContact O-N 2.92Å; L312-Q314 PolarHBondContact O-N 3.23Å; L312-R315 PolarHBondContact O-N 2.92Å; L312-E316 PolarHBondContact O-N 3.23Å; L312-F325 HydrophobicContact CD2-CD1 3.88Å; L312-F328 HydrophobicContact CD2-CB 4.03Å; L312-K329 HydrophobicContact CD1-CB 4.23Å; L312-V332 HydrophobicContact CD1-CB 4.49Å; L312-V332 HydrophobicContact CD1-CG2 3.84Å
313	K	97.4	Very high	95	Very high	165 Å²	165	59 Å²	59	72%	0.717	32%	0.317	S	S	*	.	H	α-helix	trans	-63.3	-42.6	178.9	-174.3	179.1	-179	-178.7	0	112.4	K309 C310 I311 R315	K309-K313 WeakPolarHBondContact O-CB 3.5Å; K309-K313 PolarHBondContact O-N 3.45Å; C310-K313 PolarHBondContact O-N 3.14Å; I311-K313 VanDerWaalsContact C-N 3.34Å; I311-K313 PolarHBondContact O-N 3.25Å; K313-R315 PolarHBondContact O-N 3.07Å
314	Q	96.7	Very high	95.5	Very high	114 Å²	114	58.3 Å²	58.3	53%	0.533	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-29.2	178.9	-74.1	176.8	-3.1	0	0	112.8	C310 I311 L312	C310-Q314 WeakPolarHBondContact O-CB 3.17Å; C310-Q314 VanDerWaalsContact O-CG 3.31Å; C310-Q314 WeakPolarHBondContact O-CG 3.48Å; C310-Q314 PolarHBondContact O-N 2.93Å; C310-Q314 PolarHBondContact SG-NE2 3.45Å; C310-Q314 VanDerWaalsContact SG-NE2 3.41Å; I311-Q314 PolarHBondContact O-N 3.46Å; L312-Q314 PolarHBondContact O-N 3.23Å
315	R	96.6	Very high	95.9	Very high	53 Å²	53	58.7 Å²	58.7	20%	0.2	31%	0.308	C	S	.	.	H	α-helix	trans	-103.1	-2.2	-173.2	-56.3	-60.5	-179.4	178.4	4.6	113.8	S269 T280 I311 L312 K313 A317 T318 Y319 F325	S269-R315 PolarHBondContact O-NH2 2.91Å; T280-R315 HydrophobicContact CG2-CG 4.04Å; I311-R315 HydrophobicContact CG2-CG 4.38Å; I311-R315 WeakPolarHBondContact O-CB 3.29Å; I311-R315 WeakPolarHBondContact O-CG 3.37Å; I311-R315 PolarHBondContact O-N 3.23Å; I311-R315 VanDerWaalsContact O-N 3.1Å; L312-R315 PolarHBondContact O-N 2.92Å; K313-R315 PolarHBondContact O-N 3.07Å; R315-A317 VanDerWaalsContact C-N 3.31Å; R315-A317 PolarHBondContact O-N 3.29Å; R315-T318 PolarHBondContact O-N 3.08Å; R315-Y319 HydrophobicContact CB-CD2 3.89Å; R315-Y319 HydrophobicContact CB-CE2 4.17Å; R315-Y319 WeakPolarHBondContact O-CD2 3.28Å; R315-Y319 PolarHBondContact O-N 3.44Å; R315-F325 HydrophobicContact CB-CD1 4.3Å; R315-F325 HydrophobicContact CB-CE1 3.59Å; R315-F325 HydrophobicContact CB-CZ 4.27Å; R315-F325 HydrophobicContact CG-CE1 4.2Å
316	E	94.9	Very high	96.2	Very high	121 Å²	121	58.7 Å²	58.7	57%	0.565	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-44.2	-178.9	-175.5	172	-159.1	0	0	112.6	L312 T318 Y319 P320	L312-E316 PolarHBondContact O-N 3.23Å; E316-T318 VanDerWaalsContact C-N 3.28Å; E316-T318 PolarHBondContact O-N 2.93Å; E316-Y319 CarbonylContact O-C 3.51Å; E316-Y319 PolarHBondContact O-N 3.11Å; E316-P320 WeakPolarHBondContact O-CA 3.4Å; E316-P320 WeakPolarHBondContact O-CD 3.47Å; E316-P320 VanDerWaalsContact O-N 3.17Å
317	A	95.7	Very high	96.5	Very high	98 Å²	98	55 Å²	55	81%	0.81	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-27.1	178.3	0	0	0	0	0	113.4	R315	R315-A317 VanDerWaalsContact C-N 3.31Å; R315-A317 PolarHBondContact O-N 3.29Å
318	T	95.4	Very high	96.6	Very high	66 Å²	66	50.7 Å²	50.7	41%	0.405	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-30.6	178.9	-50.6	0	0	0	0	112.1	N35 R315 E316 P320	N35-T318 PolarHBondContact ND2-O 3.12Å; R315-T318 PolarHBondContact O-N 3.08Å; E316-T318 VanDerWaalsContact C-N 3.28Å; E316-T318 PolarHBondContact O-N 2.93Å; T318-P320 VanDerWaalsContact C-CD 3.46Å
319	Y	96.5	Very high	96.7	Very high	12 Å²	12	55.4 Å²	55.4	5%	0.047	29%	0.29	C	S	.	.			trans	-132.2	53.8	-174.2	-51.8	-75.4	0	0	0	113.7	N31 L34 N35 P277 R315 E316 N321 S322 F325	N31-Y319 PolarHBondContact OD1-OH 2.94Å; L34-Y319 HydrophobicContact CB-CD1 4.16Å; L34-Y319 HydrophobicContact CB-CE1 3.86Å; L34-Y319 HydrophobicContact CD1-CE1 4.14Å; N35-Y319 WeakPolarHBondContact ND2-CD1 3.46Å; N35-Y319 WeakPolarHBondContact OD1-CA 3.42Å; P277-Y319 VanDerWaalsContact CB-OH 3.3Å; P277-Y319 WeakPolarHBondContact CB-OH 3.36Å; P277-Y319 WeakPolarHBondContact CG-OH 3.34Å; R315-Y319 HydrophobicContact CB-CD2 3.89Å; R315-Y319 HydrophobicContact CB-CE2 4.17Å; R315-Y319 WeakPolarHBondContact O-CD2 3.28Å; R315-Y319 PolarHBondContact O-N 3.44Å; E316-Y319 CarbonylContact O-C 3.51Å; E316-Y319 PolarHBondContact O-N 3.11Å; Y319-N321 VanDerWaalsContact C-N 3.31Å; Y319-N321 PolarHBondContact O-N 3.39Å; Y319-S322 PolarHBondContact O-N 3.31Å; Y319-F325 HydrophobicContact CD1-CD2 4.18Å; Y319-F325 AromaticContact CD1-CE2 3.88Å; Y319-F325 HydrophobicContact CD1-CE2 3.88Å; Y319-F325 HydrophobicContact CD2-CD1 4.09Å; Y319-F325 AromaticContact CD2-CD2 3.86Å; Y319-F325 HydrophobicContact CD2-CD2 3.86Å; Y319-F325 AromaticContact CD2-CE1 3.62Å; Y319-F325 HydrophobicContact CD2-CE1 3.62Å; Y319-F325 AromaticContact CD2-CE2 3.33Å; Y319-F325 HydrophobicContact CD2-CE2 3.33Å; Y319-F325 HydrophobicContact CD2-CG 4.22Å; Y319-F325 AromaticContact CD2-CZ 3.2Å; Y319-F325 HydrophobicContact CD2-CZ 3.2Å; Y319-F325 HydrophobicContact CE1-CE2 4.19Å; Y319-F325 HydrophobicContact CE2-CE1 4.12Å; Y319-F325 AromaticContact CE2-CE2 3.68Å; Y319-F325 HydrophobicContact CE2-CE2 3.68Å; Y319-F325 AromaticContact CE2-CZ 3.39Å; Y319-F325 HydrophobicContact CE2-CZ 3.39Å; Y319-F325 HydrophobicContact CG-CD1 4.44Å; Y319-F325 AromaticContact CG-CD2 3.61Å; Y319-F325 HydrophobicContact CG-CD2 3.61Å; Y319-F325 HydrophobicContact CG-CE1 4.33Å; Y319-F325 AromaticContact CG-CE2 3.44Å; Y319-F325 HydrophobicContact CG-CE2 3.44Å; Y319-F325 VanDerWaalsContact CG-CE2 3.44Å; Y319-F325 HydrophobicContact CG-CG 4.13Å; Y319-F325 AromaticContact CG-CZ 3.84Å; Y319-F325 HydrophobicContact CG-CZ 3.84Å
320	P	93.6	Very high	96.7	Very high	78 Å²	78	51.9 Å²	51.9	51%	0.506	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-33.5	-171.7	25.5	-35	0	0	0	113.5	E316 T318	E316-P320 WeakPolarHBondContact O-CA 3.4Å; E316-P320 WeakPolarHBondContact O-CD 3.47Å; E316-P320 VanDerWaalsContact O-N 3.17Å; T318-P320 VanDerWaalsContact C-CD 3.46Å
321	N	93.1	Very high	96.7	Very high	101 Å²	101	50 Å²	50	54%	0.54	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	18.8	-177.9	-62.6	-31	0	0	0	112.3	N36 Y319 S323	N36-N321 PolarHBondContact ND2-O 3.5Å; Y319-N321 VanDerWaalsContact C-N 3.31Å; Y319-N321 PolarHBondContact O-N 3.39Å; N321-S323 PolarHBondContact O-N 2.86Å
322	S	96.6	Very high	96.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.258	C	S	.	.			trans	-70.5	123.2	178.3	170.3	0	0	0	0	110.1	L34 Y319 L324 F325 I326	L34-S322 WeakPolarHBondContact O-CB 3.4Å; L34-S322 PolarHBondContact O-OG 3.21Å; Y319-S322 PolarHBondContact O-N 3.31Å; S322-L324 PolarHBondContact O-N 3.4Å; S322-L324 PolarHBondContact OG-N 3.21Å; S322-F325 PolarHBondContact O-N 3.05Å; S322-F325 PolarHBondContact OG-N 3.24Å; S322-I326 WeakPolarHBondContact O-CG1 3.49Å; S322-I326 PolarHBondContact O-N 2.87Å
323	S	96.9	Very high	96.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-37.3	176	53.1	0	0	0	0	111.8	N36 N321 F327 A349	N36-S323 WeakPolarHBondContact OD1-CB 3.22Å; N36-S323 PolarHBondContact OD1-N 3.09Å; N36-S323 PolarHBondContact OD1-OG 3.46Å; N321-S323 PolarHBondContact O-N 2.86Å; S323-F327 VanDerWaalsContact O-CB 3.25Å; S323-F327 WeakPolarHBondContact O-CB 3.27Å; S323-F327 PolarHBondContact O-N 2.94Å; S323-A349 WeakPolarHBondContact CB-O 3.45Å; S323-A349 VanDerWaalsContact O-CB 3.32Å; S323-A349 WeakPolarHBondContact O-CB 3.41Å
324	L	95.9	Very high	96.5	Very high	33 Å²	33	43.4 Å²	43.4	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-68.8	-42.9	177.4	-70.3	169.9	0	0	0	112.9	L34 L281 S322 F327 F328 I359	L34-L324 HydrophobicContact CD2-CD1 3.93Å; L281-L324 HydrophobicContact CD1-CD1 4.05Å; L281-L324 HydrophobicContact CD2-CB 4.49Å; S322-L324 PolarHBondContact O-N 3.4Å; S322-L324 PolarHBondContact OG-N 3.21Å; L324-F327 WeakPolarHBondContact O-CB 3.19Å; L324-F327 PolarHBondContact O-N 3.05Å; L324-F328 WeakPolarHBondContact O-CD2 3.38Å; L324-F328 PolarHBondContact O-N 3.41Å; L324-I359 HydrophobicContact CD1-CD1 4.38Å; L324-I359 HydrophobicContact CD2-CD1 4.19Å; L324-I359 HydrophobicContact CD2-CG1 4.3Å; L324-I359 HydrophobicContact CD2-CG2 4.46Å; L324-I359 HydrophobicContact CG-CD1 4.11Å
325	F	97.4	Very high	96.2	Very high	10 Å²	10	40.4 Å²	40.4	4%	0.044	22%	0.216	C	C	.	.	H	α-helix	trans	-69.9	-37.6	178.6	-82.2	-102.2	0	0	0	111.8	L34 T280 L281 L284 L312 R315 Y319 S322 F327 F328 K329	L34-F325 HydrophobicContact CD1-CE2 4.41Å; T280-F325 HydrophobicContact CG2-CE1 4.07Å; T280-F325 HydrophobicContact CG2-CZ 3.84Å; L281-F325 HydrophobicContact CD2-CD2 4.31Å; L281-F325 HydrophobicContact CD2-CE2 3.78Å; L281-F325 HydrophobicContact CD2-CZ 4.16Å; L284-F325 HydrophobicContact CD1-CD1 4.31Å; L284-F325 HydrophobicContact CD1-CE1 4.01Å; L284-F325 HydrophobicContact CD1-CZ 4.48Å; L312-F325 HydrophobicContact CD2-CD1 3.88Å; R315-F325 HydrophobicContact CB-CD1 4.3Å; R315-F325 HydrophobicContact CB-CE1 3.59Å; R315-F325 HydrophobicContact CB-CZ 4.27Å; R315-F325 HydrophobicContact CG-CE1 4.2Å; Y319-F325 HydrophobicContact CD1-CD2 4.18Å; Y319-F325 AromaticContact CD1-CE2 3.88Å; Y319-F325 HydrophobicContact CD1-CE2 3.88Å; Y319-F325 HydrophobicContact CD2-CD1 4.09Å; Y319-F325 AromaticContact CD2-CD2 3.86Å; Y319-F325 HydrophobicContact CD2-CD2 3.86Å; Y319-F325 AromaticContact CD2-CE1 3.62Å; Y319-F325 HydrophobicContact CD2-CE1 3.62Å; Y319-F325 AromaticContact CD2-CE2 3.33Å; Y319-F325 HydrophobicContact CD2-CE2 3.33Å; Y319-F325 HydrophobicContact CD2-CG 4.22Å; Y319-F325 AromaticContact CD2-CZ 3.2Å; Y319-F325 HydrophobicContact CD2-CZ 3.2Å; Y319-F325 HydrophobicContact CE1-CE2 4.19Å; Y319-F325 HydrophobicContact CE2-CE1 4.12Å; Y319-F325 AromaticContact CE2-CE2 3.68Å; Y319-F325 HydrophobicContact CE2-CE2 3.68Å; Y319-F325 AromaticContact CE2-CZ 3.39Å; Y319-F325 HydrophobicContact CE2-CZ 3.39Å; Y319-F325 HydrophobicContact CG-CD1 4.44Å; Y319-F325 AromaticContact CG-CD2 3.61Å; Y319-F325 HydrophobicContact CG-CD2 3.61Å; Y319-F325 HydrophobicContact CG-CE1 4.33Å; Y319-F325 AromaticContact CG-CE2 3.44Å; Y319-F325 HydrophobicContact CG-CE2 3.44Å; Y319-F325 VanDerWaalsContact CG-CE2 3.44Å; Y319-F325 HydrophobicContact CG-CG 4.13Å; Y319-F325 AromaticContact CG-CZ 3.84Å; Y319-F325 HydrophobicContact CG-CZ 3.84Å; S322-F325 PolarHBondContact O-N 3.05Å; S322-F325 PolarHBondContact OG-N 3.24Å; F325-F327 VanDerWaalsContact C-N 3.35Å; F325-F328 PolarHBondContact O-N 3.04Å; F325-K329 PolarHBondContact O-N 3.41Å
326	I	98.2	Very high	96.1	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-40.2	173.3	-66.9	164.7	0	0	0	110.5	S322 F328 K329 G330 C345 E348 A349 L352	S322-I326 WeakPolarHBondContact O-CG1 3.49Å; S322-I326 PolarHBondContact O-N 2.87Å; I326-F328 PolarHBondContact O-N 2.91Å; I326-K329 WeakPolarHBondContact O-CB 3.39Å; I326-K329 PolarHBondContact O-N 3.27Å; I326-G330 PolarHBondContact O-N 2.9Å; I326-C345 HydrophobicContact CG2-CB 4.12Å; I326-C345 VanDerWaalsContact CG2-O 3.25Å; I326-C345 WeakPolarHBondContact CG2-O 3.45Å; I326-E348 HydrophobicContact CD1-CG 4.26Å; I326-E348 HydrophobicContact CG2-CB 4.14Å; I326-E348 HydrophobicContact CG2-CG 4.17Å; I326-A349 HydrophobicContact CB-CB 4.29Å; I326-A349 HydrophobicContact CG2-CB 4.02Å; I326-L352 HydrophobicContact CD1-CD1 3.23Å
327	F	98.4	Very high	96	Very high	19 Å²	19	37.8 Å²	37.8	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-56.3	-48.7	171	172	-90.8	0	0	0	111.5	S323 L324 F325 K329 G330 R331 F346 A349 V362 E366	S323-F327 VanDerWaalsContact O-CB 3.25Å; S323-F327 WeakPolarHBondContact O-CB 3.27Å; S323-F327 PolarHBondContact O-N 2.94Å; L324-F327 WeakPolarHBondContact O-CB 3.19Å; L324-F327 PolarHBondContact O-N 3.05Å; F325-F327 VanDerWaalsContact C-N 3.35Å; F327-K329 VanDerWaalsContact C-N 3.32Å; F327-K329 PolarHBondContact O-N 3.13Å; F327-G330 CarbonylContact O-C 3.49Å; F327-G330 WeakPolarHBondContact O-CA 3.33Å; F327-G330 PolarHBondContact O-N 3.41Å; F327-G330 VanDerWaalsContact O-N 3.09Å; F327-R331 HydrophobicContact CD1-CG 4.01Å; F327-R331 HydrophobicContact CE1-CG 3.59Å; F327-R331 HydrophobicContact CZ-CG 3.96Å; F327-R331 WeakPolarHBondContact O-CG 3.46Å; F327-R331 PolarHBondContact O-N 2.91Å; F327-F346 AromaticContact CD2-CD1 3.77Å; F327-F346 HydrophobicContact CD2-CD1 3.77Å; F327-F346 AromaticContact CD2-CE1 3.86Å; F327-F346 HydrophobicContact CD2-CE1 3.86Å; F327-F346 HydrophobicContact CE2-CD1 4.16Å; F327-F346 AromaticContact CE2-CE1 3.98Å; F327-F346 HydrophobicContact CE2-CE1 3.98Å; F327-F346 HydrophobicContact CG-CE1 4.42Å; F327-F346 VanDerWaalsContact O-CE1 3.32Å; F327-F346 WeakPolarHBondContact O-CE1 3.32Å; F327-A349 HydrophobicContact CB-CB 4.14Å; F327-V362 HydrophobicContact CD2-CG2 4.41Å; F327-V362 HydrophobicContact CE2-CB 4.25Å; F327-V362 HydrophobicContact CE2-CG2 4.16Å; F327-V362 WeakPolarHBondContact CE2-O 3.38Å; F327-V362 HydrophobicContact CZ-CB 4.39Å; F327-V362 HydrophobicContact CZ-CG2 4.46Å; F327-E366 HydrophobicContact CE2-CB 4.3Å; F327-E366 HydrophobicContact CE2-CG 3.56Å; F327-E366 HydrophobicContact CZ-CG 3.86Å
328	F	98.3	Very high	96.1	Very high	12 Å²	12	37.3 Å²	37.3	5%	0.053	19%	0.193	C	C	.	.	H	α-helix	trans	-66.8	-30.5	178.4	-78.4	-63.8	0	0	0	113.4	L281 L284 W285 T288 L312 L324 F325 I326 R331 V332	L281-F328 HydrophobicContact CD2-CD2 4.26Å; L281-F328 HydrophobicContact CD2-CE2 3.97Å; L284-F328 HydrophobicContact CB-CD1 3.87Å; L284-F328 HydrophobicContact CB-CD2 4.06Å; L284-F328 HydrophobicContact CB-CE1 4.03Å; L284-F328 HydrophobicContact CB-CE2 4.22Å; L284-F328 HydrophobicContact CB-CG 3.9Å; L284-F328 HydrophobicContact CB-CZ 4.2Å; L284-F328 HydrophobicContact CD1-CB 4.15Å; L284-F328 HydrophobicContact CD1-CD2 3.89Å; L284-F328 HydrophobicContact CD1-CG 4.06Å; L284-F328 HydrophobicContact CG-CG 4.47Å; W285-F328 HydrophobicContact CB-CE1 4.26Å; W285-F328 HydrophobicContact CB-CZ 4.1Å; T288-F328 WeakPolarHBondContact OG1-CD1 3.4Å; L312-F328 HydrophobicContact CD2-CB 4.03Å; L324-F328 WeakPolarHBondContact O-CD2 3.38Å; L324-F328 PolarHBondContact O-N 3.41Å; F325-F328 PolarHBondContact O-N 3.04Å; I326-F328 PolarHBondContact O-N 2.91Å; F328-R331 HydrophobicContact CD1-CG 4.28Å; F328-R331 WeakPolarHBondContact O-CB 3.36Å; F328-R331 PolarHBondContact O-N 3.01Å; F328-V332 PolarHBondContact O-N 2.93Å
329	K	98.1	Very high	96.1	Very high	100 Å²	100	34.4 Å²	34.4	44%	0.435	18%	0.175	S	C	.	.	H	α-helix	trans	-61.1	-44.9	168.4	-176.5	-176.4	177.2	-178.2	0	111.2	L312 F325 I326 F327 R331 V332 Q333	L312-K329 HydrophobicContact CD1-CB 4.23Å; F325-K329 PolarHBondContact O-N 3.41Å; I326-K329 WeakPolarHBondContact O-CB 3.39Å; I326-K329 PolarHBondContact O-N 3.27Å; F327-K329 VanDerWaalsContact C-N 3.32Å; F327-K329 PolarHBondContact O-N 3.13Å; K329-R331 VanDerWaalsContact C-N 3.32Å; K329-R331 PolarHBondContact O-N 2.94Å; K329-V332 PolarHBondContact O-N 3.47Å; K329-Q333 WeakPolarHBondContact O-CG 3.4Å; K329-Q333 PolarHBondContact O-N 2.96Å
330	G	98.1	Very high	96.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-39.2	172.5	0	0	0	0	0	112.7	I326 F327 V332 Q333 R334 A342 F346	I326-G330 PolarHBondContact O-N 2.9Å; F327-G330 CarbonylContact O-C 3.49Å; F327-G330 WeakPolarHBondContact O-CA 3.33Å; F327-G330 PolarHBondContact O-N 3.41Å; F327-G330 VanDerWaalsContact O-N 3.09Å; G330-V332 PolarHBondContact O-N 3.03Å; G330-Q333 PolarHBondContact O-N 3.01Å; G330-R334 WeakPolarHBondContact O-CB 3.42Å; G330-R334 PolarHBondContact O-N 3.47Å; G330-A342 WeakPolarHBondContact O-CB 3.48Å; G330-F346 WeakPolarHBondContact O-CZ 3.24Å
331	R	96.9	Very high	96.4	Very high	18 Å²	18	36.1 Å²	36.1	7%	0.068	19%	0.191	C	C	.	.	H	α-helix	trans	-59.6	-46.6	174.9	-69.9	-64.3	-55.5	154.7	-1.1	112.4	T288 F327 F328 K329 R334 L335 F346 E366	T288-R331 HydrophobicContact CG2-CB 4.48Å; T288-R331 PolarHBondContact O-NH2 3.12Å; F327-R331 HydrophobicContact CD1-CG 4.01Å; F327-R331 HydrophobicContact CE1-CG 3.59Å; F327-R331 HydrophobicContact CZ-CG 3.96Å; F327-R331 WeakPolarHBondContact O-CG 3.46Å; F327-R331 PolarHBondContact O-N 2.91Å; F328-R331 HydrophobicContact CD1-CG 4.28Å; F328-R331 WeakPolarHBondContact O-CB 3.36Å; F328-R331 PolarHBondContact O-N 3.01Å; K329-R331 VanDerWaalsContact C-N 3.32Å; K329-R331 PolarHBondContact O-N 2.94Å; R331-R334 PolarHBondContact O-N 3.43Å; R331-L335 WeakPolarHBondContact O-CG 3.31Å; R331-L335 PolarHBondContact O-N 2.94Å; R331-F346 HydrophobicContact CG-CE1 4.18Å; R331-F346 HydrophobicContact CG-CZ 4.38Å; R331-E366 IonicContact CZ-OE1 3.96Å; R331-E366 IonicContact CZ-OE2 3.64Å; R331-E366 IonicContact NE-OE1 3.4Å; R331-E366 IonicContact NH1-OE1 3.15Å; R331-E366 PolarHBondContact NH1-OE1 3.32Å; R331-E366 IonicContact NH1-OE2 2.66Å; R331-E366 PolarHBondContact NH1-OE2 3.04Å
332	V	96.6	Very high	96.7	Very high	8 Å²	8	31.3 Å²	31.3	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-58.6	-48.9	175	164.2	0	0	0	0	110.6	T288 L305 A308 K309 L312 F328 K329 G330 R334 L335 E336	T288-V332 HydrophobicContact CG2-CG2 3.95Å; L305-V332 HydrophobicContact CD1-CB 4.18Å; L305-V332 HydrophobicContact CD1-CG1 3.8Å; L305-V332 HydrophobicContact CD1-CG2 4.16Å; A308-V332 HydrophobicContact CB-CG2 3.93Å; K309-V332 HydrophobicContact CD-CG1 3.92Å; K309-V332 HydrophobicContact CG-CG1 3.5Å; K309-V332 HydrophobicContact CG-CG2 4.44Å; L312-V332 HydrophobicContact CD1-CB 4.49Å; L312-V332 HydrophobicContact CD1-CG2 3.84Å; F328-V332 PolarHBondContact O-N 2.93Å; K329-V332 PolarHBondContact O-N 3.47Å; G330-V332 PolarHBondContact O-N 3.03Å; V332-R334 VanDerWaalsContact C-N 3.31Å; V332-R334 PolarHBondContact O-N 3.5Å; V332-L335 PolarHBondContact O-N 3.13Å; V332-L335 VanDerWaalsContact O-N 3.12Å; V332-E336 PolarHBondContact O-N 3.41Å
333	Q	97.1	Very high	96.8	Very high	29 Å²	29	32.8 Å²	32.8	14%	0.136	17%	0.173	C	C	.	.	H	α-helix	trans	-62.1	-37.9	179.4	-71.5	171.4	-20.6	0	0	112.5	K329 G330 E336 C337 Q338 S341 A342 C345	K329-Q333 WeakPolarHBondContact O-CG 3.4Å; K329-Q333 PolarHBondContact O-N 2.96Å; G330-Q333 PolarHBondContact O-N 3.01Å; Q333-E336 CarbonylContact O-C 3.57Å; Q333-E336 PolarHBondContact O-N 3.26Å; Q333-C337 PolarHBondContact O-N 3.27Å; Q333-Q338 HydrophobicContact CB-CB 4.25Å; Q333-Q338 PolarHBondContact O-N 3.05Å; Q333-S341 PolarHBondContact OE1-O 3.39Å; Q333-A342 HydrophobicContact CB-CB 3.9Å; Q333-C345 PolarHBondContact OE1-SG 3.35Å
334	R	94.8	Very high	96.8	Very high	30 Å²	30	37.2 Å²	37.2	11%	0.113	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-42.6	174.4	-177.2	-175.7	163.5	-159	-6.9	111.4	G330 R331 V332 E336 C337 I339 A342 E366 N470	G330-R334 WeakPolarHBondContact O-CB 3.42Å; G330-R334 PolarHBondContact O-N 3.47Å; R331-R334 PolarHBondContact O-N 3.43Å; V332-R334 VanDerWaalsContact C-N 3.31Å; V332-R334 PolarHBondContact O-N 3.5Å; R334-E336 VanDerWaalsContact C-N 3.27Å; R334-E336 PolarHBondContact O-N 3.4Å; R334-C337 WeakPolarHBondContact O-CA 3.49Å; R334-C337 PolarHBondContact O-N 2.93Å; R334-I339 HydrophobicContact CG-CD1 4.17Å; R334-A342 HydrophobicContact CB-CB 4.03Å; R334-E366 VanDerWaalsContact CD-OE2 3.25Å; R334-E366 WeakPolarHBondContact CD-OE2 3.42Å; R334-E366 IonicContact CZ-OE2 2.75Å; R334-E366 IonicContact NE-OE2 3.88Å; R334-E366 IonicContact NH1-OE1 2.82Å; R334-E366 PolarHBondContact NH1-OE1 2.85Å; R334-E366 IonicContact NH1-OE2 3.51Å; R334-E366 PolarHBondContact NH1-OE2 3.39Å; R334-N470 PolarHBondContact O-ND2 2.7Å
335	L	92.3	Very high	97	Very high	51 Å²	51	36 Å²	36	27%	0.267	19%	0.194	S	C	.	.	H	α-helix	trans	-66.7	-29.1	176.5	-68.2	171.8	0	0	0	112.3	T288 P292 L305 R331 V332 C337	T288-L335 HydrophobicContact CG2-CD1 4.45Å; P292-L335 HydrophobicContact CB-CD2 4.01Å; P292-L335 HydrophobicContact CG-CD1 4.02Å; P292-L335 HydrophobicContact CG-CD2 3.94Å; L305-L335 HydrophobicContact CD1-CB 3.99Å; L305-L335 HydrophobicContact CD1-CD1 4.18Å; R331-L335 WeakPolarHBondContact O-CG 3.31Å; R331-L335 PolarHBondContact O-N 2.94Å; V332-L335 PolarHBondContact O-N 3.13Å; V332-L335 VanDerWaalsContact O-N 3.12Å; L335-C337 PolarHBondContact O-N 3.34Å
336	E	92.9	Very high	97	Very high	57 Å²	57	35.5 Å²	35.5	27%	0.266	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	5.1	170	-68.1	-178.1	147.1	0	0	113.5	L305 K309 V332 Q333 R334 Q338	L305-E336 HydrophobicContact CD1-CG 4.49Å; L305-E336 HydrophobicContact CD2-CG 3.73Å; K309-E336 IonicContact NZ-OE1 3.09Å; K309-E336 PolarHBondContact NZ-OE1 3.03Å; V332-E336 PolarHBondContact O-N 3.41Å; Q333-E336 CarbonylContact O-C 3.57Å; Q333-E336 PolarHBondContact O-N 3.26Å; R334-E336 VanDerWaalsContact C-N 3.27Å; R334-E336 PolarHBondContact O-N 3.4Å; E336-Q338 HydrophobicContact CB-CG 4.16Å; E336-Q338 PolarHBondContact O-N 2.97Å; E336-Q338 VanDerWaalsContact O-N 3.16Å; E336-Q338 PolarHBondContact OE2-NE2 3.46Å
337	C	93.6	Very high	97	Very high	61 Å²	61	38 Å²	38	41%	0.412	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	21.7	-174.8	-55.9	0	0	0	0	114.2	Q333 R334 L335 I339 N470	Q333-C337 PolarHBondContact O-N 3.27Å; R334-C337 WeakPolarHBondContact O-CA 3.49Å; R334-C337 PolarHBondContact O-N 2.93Å; L335-C337 PolarHBondContact O-N 3.34Å; C337-I339 VanDerWaalsContact C-N 3.27Å; C337-I339 PolarHBondContact O-N 3.15Å; C337-I339 VanDerWaalsContact O-N 3.12Å; C337-N470 PolarHBondContact SG-ND2 2.53Å
338	Q	96.6	Very high	97	Very high	88 Å²	88	40.9 Å²	40.9	41%	0.411	22%	0.219	S	C	.	.			trans	-86.5	66	172.4	-62.8	176.5	22.8	0	0	109.9	Q333 E336 S340 S341 A342	Q333-Q338 HydrophobicContact CB-CB 4.25Å; Q333-Q338 PolarHBondContact O-N 3.05Å; E336-Q338 HydrophobicContact CB-CG 4.16Å; E336-Q338 PolarHBondContact O-N 2.97Å; E336-Q338 VanDerWaalsContact O-N 3.16Å; E336-Q338 PolarHBondContact OE2-NE2 3.46Å; Q338-S340 PolarHBondContact O-N 3.39Å; Q338-S341 PolarHBondContact O-N 3.28Å; Q338-A342 PolarHBondContact O-N 3.12Å
339	I	97.4	Very high	97	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-40.6	-166.1	-51.8	-57.7	0	0	0	112.8	R334 C337 S341 A342 L343 C370 I373 E374 N470	R334-I339 HydrophobicContact CG-CD1 4.17Å; C337-I339 VanDerWaalsContact C-N 3.27Å; C337-I339 PolarHBondContact O-N 3.15Å; C337-I339 VanDerWaalsContact O-N 3.12Å; I339-S341 PolarHBondContact O-N 3.06Å; I339-A342 WeakPolarHBondContact O-CB 3.41Å; I339-A342 PolarHBondContact O-N 2.89Å; I339-L343 HydrophobicContact CG2-CD1 4.46Å; I339-L343 PolarHBondContact O-N 2.94Å; I339-C370 HydrophobicContact CG2-CB 3.79Å; I339-I373 HydrophobicContact CD1-CG2 4.19Å; I339-I373 HydrophobicContact CG1-CG2 3.85Å; I339-I373 HydrophobicContact CG2-CG2 4.22Å; I339-E374 HydrophobicContact CB-CG 4.34Å; I339-E374 HydrophobicContact CG2-CG 3.72Å; I339-N470 HydrophobicContact CD1-CB 4.12Å
340	S	97.1	Very high	97	Very high	77 Å²	77	36.6 Å²	36.6	54%	0.538	20%	0.201	S	C	.	.	H	α-helix	trans	-62	-43.4	176.4	-51	0	0	0	0	112.5	Q338 A342 L343 T344	Q338-S340 PolarHBondContact O-N 3.39Å; S340-A342 VanDerWaalsContact C-N 3.34Å; S340-L343 PolarHBondContact O-N 2.86Å; S340-T344 PolarHBondContact O-N 3.41Å; S340-T344 VanDerWaalsContact O-N 3.12Å; S340-T344 PolarHBondContact O-OG1 3.21Å
341	S	98.3	Very high	97	Very high	50 Å²	50	41.8 Å²	41.8	35%	0.35	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-41.6	176.5	-54.7	0	0	0	0	111.3	Q333 Q338 I339 L343 T344 C345	Q333-S341 PolarHBondContact OE1-O 3.39Å; Q338-S341 PolarHBondContact O-N 3.28Å; I339-S341 PolarHBondContact O-N 3.06Å; S341-L343 PolarHBondContact O-N 3.07Å; S341-T344 WeakPolarHBondContact O-CB 3.26Å; S341-T344 PolarHBondContact O-N 3.19Å; S341-C345 PolarHBondContact O-N 3.17Å; S341-C345 VanDerWaalsContact O-N 3.08Å
342	A	98.6	Very high	97	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-44.7	177	0	0	0	0	0	111.4	G330 Q333 R334 Q338 I339 S340 T344 C345 F346	G330-A342 WeakPolarHBondContact O-CB 3.48Å; Q333-A342 HydrophobicContact CB-CB 3.9Å; R334-A342 HydrophobicContact CB-CB 4.03Å; Q338-A342 PolarHBondContact O-N 3.12Å; I339-A342 WeakPolarHBondContact O-CB 3.41Å; I339-A342 PolarHBondContact O-N 2.89Å; S340-A342 VanDerWaalsContact C-N 3.34Å; A342-T344 VanDerWaalsContact C-N 3.33Å; A342-T344 PolarHBondContact O-N 3.11Å; A342-C345 PolarHBondContact O-N 2.94Å; A342-F346 HydrophobicContact CB-CD2 4.32Å; A342-F346 HydrophobicContact CB-CE2 3.81Å; A342-F346 WeakPolarHBondContact O-CD2 3.5Å; A342-F346 VanDerWaalsContact O-CG 3.29Å; A342-F346 WeakPolarHBondContact O-CG 3.3Å; A342-F346 PolarHBondContact O-N 3.12Å
343	L	98.7	Very high	96.8	Very high	31 Å²	31	43.4 Å²	43.4	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-42.3	174.4	-79.7	168.6	0	0	0	112.1	I339 S340 S341 F346 N347 I367 C370 E374	I339-L343 HydrophobicContact CG2-CD1 4.46Å; I339-L343 PolarHBondContact O-N 2.94Å; S340-L343 PolarHBondContact O-N 2.86Å; S341-L343 PolarHBondContact O-N 3.07Å; L343-F346 PolarHBondContact O-N 2.87Å; L343-N347 WeakPolarHBondContact O-CB 3.41Å; L343-N347 PolarHBondContact O-N 3Å; L343-N347 PolarHBondContact O-ND2 3.36Å; L343-I367 HydrophobicContact CD2-CB 4.46Å; L343-I367 HydrophobicContact CD2-CG2 4.22Å; L343-C370 HydrophobicContact CD1-CB 4.24Å; L343-C370 HydrophobicContact CD2-CB 3.51Å; L343-C370 HydrophobicContact CG-CB 3.66Å; L343-E374 HydrophobicContact CD1-CG 4.38Å
344	T	98.6	Very high	96.3	Very high	93 Å²	93	48.1 Å²	48.1	57%	0.571	26%	0.264	S	S	*	.	H	α-helix	trans	-58.3	-49.3	174.7	-57.4	0	0	0	0	111	S340 S341 A342 F346 N347 E348	S340-T344 PolarHBondContact O-N 3.41Å; S340-T344 VanDerWaalsContact O-N 3.12Å; S340-T344 PolarHBondContact O-OG1 3.21Å; S341-T344 WeakPolarHBondContact O-CB 3.26Å; S341-T344 PolarHBondContact O-N 3.19Å; A342-T344 VanDerWaalsContact C-N 3.33Å; A342-T344 PolarHBondContact O-N 3.11Å; T344-F346 PolarHBondContact O-N 3.26Å; T344-N347 PolarHBondContact O-N 3.41Å; T344-E348 WeakPolarHBondContact O-CB 3.43Å; T344-E348 PolarHBondContact O-N 3.37Å
345	C	98.6	Very high	95.8	Very high	6 Å²	6	52 Å²	52	4%	0.041	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-41.7	178.5	-65.6	0	0	0	0	112.2	I326 Q333 S341 A342 E348 A349	I326-C345 HydrophobicContact CG2-CB 4.12Å; I326-C345 VanDerWaalsContact CG2-O 3.25Å; I326-C345 WeakPolarHBondContact CG2-O 3.45Å; Q333-C345 PolarHBondContact OE1-SG 3.35Å; S341-C345 PolarHBondContact O-N 3.17Å; S341-C345 VanDerWaalsContact O-N 3.08Å; A342-C345 PolarHBondContact O-N 2.94Å; C345-E348 PolarHBondContact O-N 3.36Å; C345-A349 WeakPolarHBondContact O-CB 3.36Å; C345-A349 PolarHBondContact O-N 3.33Å
346	F	98.8	Very high	95.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.3	-35.3	-179.7	-62.1	-48	0	0	0	112.9	F327 G330 R331 A342 L343 T344 L350 E366 I367	F327-F346 AromaticContact CD2-CD1 3.77Å; F327-F346 HydrophobicContact CD2-CD1 3.77Å; F327-F346 AromaticContact CD2-CE1 3.86Å; F327-F346 HydrophobicContact CD2-CE1 3.86Å; F327-F346 HydrophobicContact CE2-CD1 4.16Å; F327-F346 AromaticContact CE2-CE1 3.98Å; F327-F346 HydrophobicContact CE2-CE1 3.98Å; F327-F346 HydrophobicContact CG-CE1 4.42Å; F327-F346 VanDerWaalsContact O-CE1 3.32Å; F327-F346 WeakPolarHBondContact O-CE1 3.32Å; G330-F346 WeakPolarHBondContact O-CZ 3.24Å; R331-F346 HydrophobicContact CG-CE1 4.18Å; R331-F346 HydrophobicContact CG-CZ 4.38Å; A342-F346 HydrophobicContact CB-CD2 4.32Å; A342-F346 HydrophobicContact CB-CE2 3.81Å; A342-F346 WeakPolarHBondContact O-CD2 3.5Å; A342-F346 VanDerWaalsContact O-CG 3.29Å; A342-F346 WeakPolarHBondContact O-CG 3.3Å; A342-F346 PolarHBondContact O-N 3.12Å; L343-F346 PolarHBondContact O-N 2.87Å; T344-F346 PolarHBondContact O-N 3.26Å; F346-L350 VanDerWaalsContact O-CB 3.31Å; F346-L350 WeakPolarHBondContact O-CB 3.37Å; F346-L350 PolarHBondContact O-N 3.12Å; F346-E366 HydrophobicContact CD1-CB 3.94Å; F346-E366 HydrophobicContact CD1-CG 4.45Å; F346-E366 HydrophobicContact CD2-CB 3.73Å; F346-E366 HydrophobicContact CE1-CB 3.83Å; F346-E366 HydrophobicContact CE1-CG 3.95Å; F346-E366 HydrophobicContact CE2-CB 3.62Å; F346-E366 HydrophobicContact CE2-CG 4.33Å; F346-E366 HydrophobicContact CG-CB 3.9Å; F346-E366 HydrophobicContact CZ-CB 3.67Å; F346-E366 HydrophobicContact CZ-CG 3.9Å; F346-I367 HydrophobicContact CB-CD1 4.22Å; F346-I367 HydrophobicContact CB-CG1 3.64Å
347	N	98.4	Very high	95.5	Very high	63 Å²	63	54.3 Å²	54.3	34%	0.337	29%	0.292	S	S	.	.	H	α-helix	trans	-68.5	-42.6	172.9	-76.7	-68.4	0	0	0	111.4	L343 T344 A349 L350 D351	L343-N347 WeakPolarHBondContact O-CB 3.41Å; L343-N347 PolarHBondContact O-N 3Å; L343-N347 PolarHBondContact O-ND2 3.36Å; T344-N347 PolarHBondContact O-N 3.41Å; N347-A349 PolarHBondContact O-N 3.23Å; N347-L350 WeakPolarHBondContact O-CB 3.17Å; N347-L350 PolarHBondContact O-N 2.85Å; N347-D351 PolarHBondContact O-N 2.92Å
348	E	98.3	Very high	95.3	Very high	80 Å²	80	53.1 Å²	53.1	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-44.1	174.4	-176.6	-177.9	178.4	0	0	111.8	I326 T344 C345 L350 D351 L352	I326-E348 HydrophobicContact CD1-CG 4.26Å; I326-E348 HydrophobicContact CG2-CB 4.14Å; I326-E348 HydrophobicContact CG2-CG 4.17Å; T344-E348 WeakPolarHBondContact O-CB 3.43Å; T344-E348 PolarHBondContact O-N 3.37Å; C345-E348 PolarHBondContact O-N 3.36Å; E348-L350 VanDerWaalsContact C-N 3.33Å; E348-L350 PolarHBondContact O-N 2.9Å; E348-D351 PolarHBondContact O-N 3.46Å; E348-L352 HydrophobicContact CG-CD1 4.08Å; E348-L352 WeakPolarHBondContact O-CG 3.43Å; E348-L352 PolarHBondContact O-N 3.16Å
349	A	98.3	Very high	95.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-39.2	174.9	0	0	0	0	0	112.4	S323 I326 F327 C345 N347 L352 A353	S323-A349 WeakPolarHBondContact CB-O 3.45Å; S323-A349 VanDerWaalsContact O-CB 3.32Å; S323-A349 WeakPolarHBondContact O-CB 3.41Å; I326-A349 HydrophobicContact CB-CB 4.29Å; I326-A349 HydrophobicContact CG2-CB 4.02Å; F327-A349 HydrophobicContact CB-CB 4.14Å; C345-A349 WeakPolarHBondContact O-CB 3.36Å; C345-A349 PolarHBondContact O-N 3.33Å; N347-A349 PolarHBondContact O-N 3.23Å; A349-L352 PolarHBondContact O-N 3.31Å; A349-A353 VanDerWaalsContact O-CB 3.28Å; A349-A353 WeakPolarHBondContact O-CB 3.2Å; A349-A353 PolarHBondContact O-N 2.86Å; A349-A353 VanDerWaalsContact O-N 3.13Å
350	L	97.9	Very high	95.1	Very high	21 Å²	21	50 Å²	50	11%	0.11	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-45.1	174.8	178	65.5	0	0	0	111.2	F346 N347 E348 L352 A353 Q360 C363 L364 I367	F346-L350 VanDerWaalsContact O-CB 3.31Å; F346-L350 WeakPolarHBondContact O-CB 3.37Å; F346-L350 PolarHBondContact O-N 3.12Å; N347-L350 WeakPolarHBondContact O-CB 3.17Å; N347-L350 PolarHBondContact O-N 2.85Å; E348-L350 VanDerWaalsContact C-N 3.33Å; E348-L350 PolarHBondContact O-N 2.9Å; L350-L352 VanDerWaalsContact C-N 3.33Å; L350-L352 PolarHBondContact O-N 2.65Å; L350-A353 PolarHBondContact O-N 3.29Å; L350-Q360 HydrophobicContact CD1-CB 3.47Å; L350-Q360 VanDerWaalsContact CD1-CB 3.47Å; L350-Q360 HydrophobicContact CD1-CG 3.75Å; L350-C363 HydrophobicContact CB-CB 3.98Å; L350-C363 HydrophobicContact CD1-CB 4.29Å; L350-L364 HydrophobicContact CD1-CD2 4.44Å; L350-L364 HydrophobicContact CD1-CG 4.08Å; L350-L364 HydrophobicContact CD2-CD2 3.93Å; L350-L364 HydrophobicContact CD2-CG 4.41Å; L350-I367 HydrophobicContact CB-CD1 4.42Å; L350-I367 HydrophobicContact CD2-CD1 3.83Å
351	D	96.9	Very high	95	Very high	110 Å²	110	47.3 Å²	47.3	59%	0.588	24%	0.244	S	C	*	.	H	α-helix	trans	-68.2	-30.2	179	-71	-19.9	0	0	0	112.6	N347 E348 A353 L354	N347-D351 PolarHBondContact O-N 2.92Å; E348-D351 PolarHBondContact O-N 3.46Å; D351-A353 VanDerWaalsContact C-N 3.33Å; D351-L354 VanDerWaalsContact O-CG 3.25Å; D351-L354 WeakPolarHBondContact O-CG 3.44Å
352	L	96.7	Very high	94.8	Very high	58 Å²	58	48 Å²	48	30%	0.304	25%	0.246	S	C	.	.	H	α-helix	trans	-79.4	-17.5	174.5	-71.8	165.6	0	0	0	113	I326 E348 A349 L350	I326-L352 HydrophobicContact CD1-CD1 3.23Å; E348-L352 HydrophobicContact CG-CD1 4.08Å; E348-L352 WeakPolarHBondContact O-CG 3.43Å; E348-L352 PolarHBondContact O-N 3.16Å; A349-L352 PolarHBondContact O-N 3.31Å; L350-L352 VanDerWaalsContact C-N 3.33Å; L350-L352 PolarHBondContact O-N 2.65Å
353	A	94.3	Very high	94.8	Very high	2 Å²	2	48 Å²	48	2%	0.017	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	25.7	-177.1	0	0	0	0	0	113.6	A349 L350 D351 D355 Q356 I359 Q360	A349-A353 VanDerWaalsContact O-CB 3.28Å; A349-A353 WeakPolarHBondContact O-CB 3.2Å; A349-A353 PolarHBondContact O-N 2.86Å; A349-A353 VanDerWaalsContact O-N 3.13Å; L350-A353 PolarHBondContact O-N 3.29Å; D351-A353 VanDerWaalsContact C-N 3.33Å; A353-D355 PolarHBondContact O-N 3.28Å; A353-D355 VanDerWaalsContact O-N 3.1Å; A353-Q356 CarbonylContact O-C 3.55Å; A353-Q356 PolarHBondContact O-N 3.3Å; A353-I359 HydrophobicContact CB-CB 3.9Å; A353-I359 HydrophobicContact CB-CG2 3.62Å; A353-Q360 HydrophobicContact CB-CG 3.87Å; A353-Q360 WeakPolarHBondContact O-CG 3.37Å; A353-Q360 PolarHBondContact O-NE2 2.78Å; A353-Q360 VanDerWaalsContact O-NE2 3.07Å
354	L	86.3	Confident	94.8	Very high	127 Å²	127	47 Å²	47	67%	0.665	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-43.1	-174	-66.3	175.7	0	0	0	114.1	D351 Q360	D351-L354 VanDerWaalsContact O-CG 3.25Å; D351-L354 WeakPolarHBondContact O-CG 3.44Å; L354-Q360 VanDerWaalsContact CA-NE2 3.31Å; L354-Q360 PolarHBondContact O-NE2 3.01Å
355	D	83.8	Confident	94.7	Very high	113 Å²	113	45.8 Å²	45.8	60%	0.604	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	3	-177.1	-81.1	-11.7	0	0	0	113.7	K39 A353	K39-D355 IonicContact NZ-OD1 3.31Å; K39-D355 IonicContact NZ-OD2 3.29Å; K39-D355 PolarHBondContact NZ-OD2 3Å; A353-D355 PolarHBondContact O-N 3.28Å; A353-D355 VanDerWaalsContact O-N 3.1Å
356	Q	88	Confident	94.7	Very high	33 Å²	33	46.1 Å²	46.1	15%	0.154	23%	0.228	C	C	.	.			trans	-130.6	83.9	-172.7	-64.1	-60.5	-54.8	0	0	112	F38 A353 E358 I359 Q360	F38-Q356 VanDerWaalsContact CB-NE2 3.3Å; F38-Q356 VanDerWaalsContact CD1-CD 3.41Å; F38-Q356 HydrophobicContact CD1-CG 4.06Å; F38-Q356 VanDerWaalsContact CD1-OE1 3.24Å; F38-Q356 VanDerWaalsContact CD2-CD 3.41Å; F38-Q356 HydrophobicContact CD2-CG 3.26Å; F38-Q356 HydrophobicContact CE1-CG 4.1Å; F38-Q356 HydrophobicContact CE2-CB 4.41Å; F38-Q356 HydrophobicContact CE2-CG 3.31Å; F38-Q356 HydrophobicContact CG-CG 3.7Å; F38-Q356 VanDerWaalsContact CG-NE2 3.28Å; F38-Q356 HydrophobicContact CZ-CG 3.77Å; A353-Q356 CarbonylContact O-C 3.55Å; A353-Q356 PolarHBondContact O-N 3.3Å; Q356-E358 PolarHBondContact O-N 3.39Å; Q356-E358 VanDerWaalsContact O-N 3.13Å; Q356-I359 HydrophobicContact CB-CB 4.16Å; Q356-I359 HydrophobicContact CB-CD1 4.05Å; Q356-I359 HydrophobicContact CB-CG1 4.19Å; Q356-I359 HydrophobicContact CG-CD1 4.38Å; Q356-I359 PolarHBondContact O-N 3.34Å; Q356-Q360 WeakPolarHBondContact O-CG 3.27Å; Q356-Q360 PolarHBondContact O-N 3.04Å
357	R	91.2	Very high	94.7	Very high	123 Å²	123	46.5 Å²	46.5	46%	0.464	23%	0.23	S	C	.	.	H	α-helix	trans	-50.8	-41.1	-177.5	-174.7	-172.1	-60.8	143.5	-0	112.9	I359 Q360 H361	R357-I359 VanDerWaalsContact C-N 3.34Å; R357-I359 PolarHBondContact O-N 3.29Å; R357-Q360 WeakPolarHBondContact O-CB 3.49Å; R357-Q360 PolarHBondContact O-N 3.47Å; R357-H361 WeakPolarHBondContact CG-NE2 3.36Å; R357-H361 PolarHBondContact O-CD2 3.37Å; R357-H361 VanDerWaalsContact O-CD2 3.28Å; R357-H361 VanDerWaalsContact O-CG 3.3Å; R357-H361 PolarHBondContact O-N 3.04Å
358	E	89.6	Confident	94.7	Very high	35 Å²	35	43.5 Å²	43.5	16%	0.164	21%	0.213	C	C	.	.	H	α-helix	trans	-71.7	-31.9	-174.7	-64.6	74.1	-157.6	0	0	111.9	M69 T70 Q356 H361 V362	M69-E358 HydrophobicContact CB-CB 3.96Å; M69-E358 HydrophobicContact CB-CG 3.8Å; M69-E358 WeakPolarHBondContact O-CG 3.39Å; T70-E358 WeakPolarHBondContact CG2-OE1 3.23Å; Q356-E358 PolarHBondContact O-N 3.39Å; Q356-E358 VanDerWaalsContact O-N 3.13Å; E358-H361 PolarHBondContact O-N 3.23Å; E358-V362 PolarHBondContact O-N 3.33Å
359	I	92.5	Very high	94.7	Very high	10 Å²	10	39.7 Å²	39.7	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-70.9	-40.2	170.8	-61.7	178.1	0	0	0	110.2	F38 L324 A353 Q356 R357 H361 V362 C363	F38-I359 HydrophobicContact CE1-CD1 4.3Å; F38-I359 HydrophobicContact CE2-CD1 4.06Å; F38-I359 HydrophobicContact CZ-CD1 3.46Å; F38-I359 VanDerWaalsContact CZ-CD1 3.46Å; L324-I359 HydrophobicContact CD1-CD1 4.38Å; L324-I359 HydrophobicContact CD2-CD1 4.19Å; L324-I359 HydrophobicContact CD2-CG1 4.3Å; L324-I359 HydrophobicContact CD2-CG2 4.46Å; L324-I359 HydrophobicContact CG-CD1 4.11Å; A353-I359 HydrophobicContact CB-CB 3.9Å; A353-I359 HydrophobicContact CB-CG2 3.62Å; Q356-I359 HydrophobicContact CB-CB 4.16Å; Q356-I359 HydrophobicContact CB-CD1 4.05Å; Q356-I359 HydrophobicContact CB-CG1 4.19Å; Q356-I359 HydrophobicContact CG-CD1 4.38Å; Q356-I359 PolarHBondContact O-N 3.34Å; R357-I359 VanDerWaalsContact C-N 3.34Å; R357-I359 PolarHBondContact O-N 3.29Å; I359-H361 VanDerWaalsContact C-N 3.26Å; I359-H361 PolarHBondContact O-N 3.45Å; I359-V362 WeakPolarHBondContact O-CG2 3.44Å; I359-V362 PolarHBondContact O-N 2.98Å; I359-C363 PolarHBondContact O-N 3.09Å; I359-C363 VanDerWaalsContact O-N 3.09Å; I359-C363 PolarHBondContact O-SG 3.37Å
360	Q	95.8	Very high	94.7	Very high	18 Å²	18	39.7 Å²	39.7	8%	0.084	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-41	173.2	-61.9	179.1	-24.4	0	0	111.4	L350 A353 L354 Q356 R357 C363 L364	L350-Q360 HydrophobicContact CD1-CB 3.47Å; L350-Q360 VanDerWaalsContact CD1-CB 3.47Å; L350-Q360 HydrophobicContact CD1-CG 3.75Å; A353-Q360 HydrophobicContact CB-CG 3.87Å; A353-Q360 WeakPolarHBondContact O-CG 3.37Å; A353-Q360 PolarHBondContact O-NE2 2.78Å; A353-Q360 VanDerWaalsContact O-NE2 3.07Å; L354-Q360 VanDerWaalsContact CA-NE2 3.31Å; L354-Q360 PolarHBondContact O-NE2 3.01Å; Q356-Q360 WeakPolarHBondContact O-CG 3.27Å; Q356-Q360 PolarHBondContact O-N 3.04Å; R357-Q360 WeakPolarHBondContact O-CB 3.49Å; R357-Q360 PolarHBondContact O-N 3.47Å; Q360-C363 PolarHBondContact O-N 3.38Å; Q360-L364 WeakPolarHBondContact O-CB 3.49Å; Q360-L364 VanDerWaalsContact O-CG 3.25Å; Q360-L364 WeakPolarHBondContact O-CG 3.35Å; Q360-L364 PolarHBondContact O-N 3.21Å
361	H	95.5	Very high	94.8	Very high	20 Å²	20	38.9 Å²	38.9	9%	0.093	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-42.6	179.2	-70.5	-179.7	0	0	0	112.7	R357 E358 I359 C363 L364 Y365 L387 E390	R357-H361 WeakPolarHBondContact CG-NE2 3.36Å; R357-H361 PolarHBondContact O-CD2 3.37Å; R357-H361 VanDerWaalsContact O-CD2 3.28Å; R357-H361 VanDerWaalsContact O-CG 3.3Å; R357-H361 PolarHBondContact O-N 3.04Å; E358-H361 PolarHBondContact O-N 3.23Å; I359-H361 VanDerWaalsContact C-N 3.26Å; I359-H361 PolarHBondContact O-N 3.45Å; H361-C363 VanDerWaalsContact C-N 3.3Å; H361-C363 PolarHBondContact O-N 3.29Å; H361-L364 PolarHBondContact O-N 2.9Å; H361-Y365 WeakPolarHBondContact O-CB 3.26Å; H361-Y365 PolarHBondContact O-N 3.35Å; H361-L387 HydrophobicContact CB-CD2 3.72Å; H361-E390 IonicContact CD2-OE2 2.62Å; H361-E390 IonicContact CE1-OE2 2.75Å; H361-E390 VanDerWaalsContact NE2-CB 3.3Å; H361-E390 WeakPolarHBondContact NE2-CB 3.33Å; H361-E390 IonicContact NE2-OE2 3.06Å; H361-E390 PolarHBondContact NE2-OE2 3.46Å
362	V	94.9	Very high	94.9	Very high	65 Å²	65	33.6 Å²	33.6	39%	0.394	16%	0.164	S	C	.	.	H	α-helix	trans	-66.7	-33.8	175.5	-60	0	0	0	0	112	F327 E358 I359 E366	F327-V362 HydrophobicContact CD2-CG2 4.41Å; F327-V362 HydrophobicContact CE2-CB 4.25Å; F327-V362 HydrophobicContact CE2-CG2 4.16Å; F327-V362 WeakPolarHBondContact CE2-O 3.38Å; F327-V362 HydrophobicContact CZ-CB 4.39Å; F327-V362 HydrophobicContact CZ-CG2 4.46Å; E358-V362 PolarHBondContact O-N 3.33Å; I359-V362 WeakPolarHBondContact O-CG2 3.44Å; I359-V362 PolarHBondContact O-N 2.98Å; V362-E366 PolarHBondContact O-N 3.37Å
363	C	98	Very high	95	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.7	-48.3	173.7	-61.8	0	0	0	0	111.5	L350 I359 Q360 H361 Y365 E366 I367	L350-C363 HydrophobicContact CB-CB 3.98Å; L350-C363 HydrophobicContact CD1-CB 4.29Å; I359-C363 PolarHBondContact O-N 3.09Å; I359-C363 VanDerWaalsContact O-N 3.09Å; I359-C363 PolarHBondContact O-SG 3.37Å; Q360-C363 PolarHBondContact O-N 3.38Å; H361-C363 VanDerWaalsContact C-N 3.3Å; H361-C363 PolarHBondContact O-N 3.29Å; C363-Y365 PolarHBondContact O-N 3.4Å; C363-E366 PolarHBondContact O-N 3.06Å; C363-E366 VanDerWaalsContact O-N 3.11Å; C363-I367 WeakPolarHBondContact O-CG1 3.49Å; C363-I367 PolarHBondContact O-N 2.85Å
364	L	98.2	Very high	95.1	Very high	11 Å²	11	32.8 Å²	32.8	6%	0.058	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-36.6	177.1	-72.8	165.6	0	0	0	112.1	L350 Q360 H361 I367 G368 A383 R386 L387	L350-L364 HydrophobicContact CD1-CD2 4.44Å; L350-L364 HydrophobicContact CD1-CG 4.08Å; L350-L364 HydrophobicContact CD2-CD2 3.93Å; L350-L364 HydrophobicContact CD2-CG 4.41Å; Q360-L364 WeakPolarHBondContact O-CB 3.49Å; Q360-L364 VanDerWaalsContact O-CG 3.25Å; Q360-L364 WeakPolarHBondContact O-CG 3.35Å; Q360-L364 PolarHBondContact O-N 3.21Å; H361-L364 PolarHBondContact O-N 2.9Å; L364-I367 PolarHBondContact O-N 2.8Å; L364-G368 PolarHBondContact O-N 3.01Å; L364-A383 HydrophobicContact CD2-CB 4.25Å; L364-R386 HydrophobicContact CD1-CB 4.27Å; L364-R386 HydrophobicContact CD1-CG 3.97Å; L364-L387 HydrophobicContact CB-CD1 4.12Å; L364-L387 HydrophobicContact CB-CD2 4.21Å; L364-L387 HydrophobicContact CB-CG 4.01Å
365	Y	97.7	Very high	95.7	Very high	67 Å²	67	28.1 Å²	28.1	26%	0.263	13%	0.134	S	C	.	.	H	α-helix	trans	-58.8	-52.3	174.6	176.9	-94.7	0	0	0	110.4	H361 C363 G368 W369 Y398	H361-Y365 WeakPolarHBondContact O-CB 3.26Å; H361-Y365 PolarHBondContact O-N 3.35Å; C363-Y365 PolarHBondContact O-N 3.4Å; Y365-G368 PolarHBondContact O-N 3.35Å; Y365-W369 AromaticContact CD1-CD1 3.84Å; Y365-W369 AromaticContact CD2-CD1 3.97Å; Y365-W369 AromaticContact CD2-NE1 3.83Å; Y365-W369 AromaticContact CE1-CD1 3.53Å; Y365-W369 AromaticContact CE1-NE1 3.62Å; Y365-W369 AromaticContact CE2-CD1 3.69Å; Y365-W369 AromaticContact CE2-NE1 3.14Å; Y365-W369 AromaticContact CZ-CD1 3.46Å; Y365-W369 VanDerWaalsContact CZ-CD1 3.46Å; Y365-W369 AromaticContact CZ-NE1 3.01Å; Y365-W369 PolarHBondContact O-N 2.95Å; Y365-W369 VanDerWaalsContact O-N 3.1Å; Y365-W369 PolarHBondContact OH-NE1 3.2Å; Y365-W369 VanDerWaalsContact OH-NE1 3.13Å; Y365-Y398 AromaticContact CD2-CE1 3.95Å; Y365-Y398 HydrophobicContact CD2-CE1 3.95Å; Y365-Y398 HydrophobicContact CE2-CE1 4.33Å
366	E	98.1	Very high	96.4	Very high	12 Å²	12	26 Å²	26	6%	0.056	12%	0.122	C	C	.	.	H	α-helix	trans	-65.2	-39.5	178.8	-69.5	-64.8	151.3	0	0	112.8	F327 R331 R334 F346 V362 C363 G368 W369 C370	F327-E366 HydrophobicContact CE2-CB 4.3Å; F327-E366 HydrophobicContact CE2-CG 3.56Å; F327-E366 HydrophobicContact CZ-CG 3.86Å; R331-E366 IonicContact CZ-OE1 3.96Å; R331-E366 IonicContact CZ-OE2 3.64Å; R331-E366 IonicContact NE-OE1 3.4Å; R331-E366 IonicContact NH1-OE1 3.15Å; R331-E366 PolarHBondContact NH1-OE1 3.32Å; R331-E366 IonicContact NH1-OE2 2.66Å; R331-E366 PolarHBondContact NH1-OE2 3.04Å; R334-E366 VanDerWaalsContact CD-OE2 3.25Å; R334-E366 WeakPolarHBondContact CD-OE2 3.42Å; R334-E366 IonicContact CZ-OE2 2.75Å; R334-E366 IonicContact NE-OE2 3.88Å; R334-E366 IonicContact NH1-OE1 2.82Å; R334-E366 PolarHBondContact NH1-OE1 2.85Å; R334-E366 IonicContact NH1-OE2 3.51Å; R334-E366 PolarHBondContact NH1-OE2 3.39Å; F346-E366 HydrophobicContact CD1-CB 3.94Å; F346-E366 HydrophobicContact CD1-CG 4.45Å; F346-E366 HydrophobicContact CD2-CB 3.73Å; F346-E366 HydrophobicContact CE1-CB 3.83Å; F346-E366 HydrophobicContact CE1-CG 3.95Å; F346-E366 HydrophobicContact CE2-CB 3.62Å; F346-E366 HydrophobicContact CE2-CG 4.33Å; F346-E366 HydrophobicContact CG-CB 3.9Å; F346-E366 HydrophobicContact CZ-CB 3.67Å; F346-E366 HydrophobicContact CZ-CG 3.9Å; V362-E366 PolarHBondContact O-N 3.37Å; C363-E366 PolarHBondContact O-N 3.06Å; C363-E366 VanDerWaalsContact O-N 3.11Å; E366-G368 VanDerWaalsContact C-N 3.35Å; E366-G368 PolarHBondContact O-N 3.29Å; E366-W369 PolarHBondContact O-N 3.47Å; E366-C370 WeakPolarHBondContact O-CB 3.31Å; E366-C370 PolarHBondContact O-N 3.49Å
367	I	98.8	Very high	96.9	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.041	12%	0.12	C	C	.	.	H	α-helix	trans	-58.4	-46.7	174.1	-69	163.8	0	0	0	110.7	L343 F346 L350 C363 L364 W369 C370 S371 A383	L343-I367 HydrophobicContact CD2-CB 4.46Å; L343-I367 HydrophobicContact CD2-CG2 4.22Å; F346-I367 HydrophobicContact CB-CD1 4.22Å; F346-I367 HydrophobicContact CB-CG1 3.64Å; L350-I367 HydrophobicContact CB-CD1 4.42Å; L350-I367 HydrophobicContact CD2-CD1 3.83Å; C363-I367 WeakPolarHBondContact O-CG1 3.49Å; C363-I367 PolarHBondContact O-N 2.85Å; L364-I367 PolarHBondContact O-N 2.8Å; I367-W369 PolarHBondContact O-N 2.82Å; I367-C370 PolarHBondContact O-N 3.13Å; I367-S371 WeakPolarHBondContact O-CB 3.48Å; I367-S371 PolarHBondContact O-N 3.03Å; I367-S371 PolarHBondContact O-OG 3.35Å; I367-A383 HydrophobicContact CG2-CB 4.26Å
368	G	98.6	Very high	97.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-44.9	178.7	0	0	0	0	0	112.3	L364 Y365 E366 S371 M372	L364-G368 PolarHBondContact O-N 3.01Å; Y365-G368 PolarHBondContact O-N 3.35Å; E366-G368 VanDerWaalsContact C-N 3.35Å; E366-G368 PolarHBondContact O-N 3.29Å; G368-S371 PolarHBondContact O-N 3.16Å; G368-M372 WeakPolarHBondContact O-CG 3.48Å; G368-M372 PolarHBondContact O-N 2.89Å
369	W	98.3	Very high	97.7	Very high	1 Å²	1	24.3 Å²	24.3	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-65.8	-47.5	177.1	-82.8	100	0	0	0	113.1	Y365 E366 I367 S371 M372 I373 I461 L462 W465 A467	Y365-W369 AromaticContact CD1-CD1 3.84Å; Y365-W369 AromaticContact CD2-CD1 3.97Å; Y365-W369 AromaticContact CD2-NE1 3.83Å; Y365-W369 AromaticContact CE1-CD1 3.53Å; Y365-W369 AromaticContact CE1-NE1 3.62Å; Y365-W369 AromaticContact CE2-CD1 3.69Å; Y365-W369 AromaticContact CE2-NE1 3.14Å; Y365-W369 AromaticContact CZ-CD1 3.46Å; Y365-W369 VanDerWaalsContact CZ-CD1 3.46Å; Y365-W369 AromaticContact CZ-NE1 3.01Å; Y365-W369 PolarHBondContact O-N 2.95Å; Y365-W369 VanDerWaalsContact O-N 3.1Å; Y365-W369 PolarHBondContact OH-NE1 3.2Å; Y365-W369 VanDerWaalsContact OH-NE1 3.13Å; E366-W369 PolarHBondContact O-N 3.47Å; I367-W369 PolarHBondContact O-N 2.82Å; W369-S371 VanDerWaalsContact C-N 3.25Å; W369-S371 PolarHBondContact O-N 3Å; W369-M372 HydrophobicContact CD2-CE 3.72Å; W369-M372 HydrophobicContact CE3-CE 3.51Å; W369-M372 HydrophobicContact CG-CE 4.3Å; W369-M372 HydrophobicContact CH2-CE 4.32Å; W369-M372 HydrophobicContact CZ3-CE 3.83Å; W369-M372 PolarHBondContact O-N 3.42Å; W369-I373 WeakPolarHBondContact O-CG1 3.24Å; W369-I373 PolarHBondContact O-N 2.95Å; W369-I461 HydrophobicContact CH2-CG2 3.38Å; W369-I461 HydrophobicContact CZ2-CG2 4.21Å; W369-I461 HydrophobicContact CZ3-CG2 3.81Å; W369-L462 HydrophobicContact CE3-CD2 4.12Å; W369-L462 HydrophobicContact CZ3-CD2 4.11Å; W369-W465 HydrophobicContact CH2-CB 3.42Å; W369-W465 VanDerWaalsContact CH2-CB 3.42Å; W369-W465 AromaticContact CH2-CD1 3.65Å; W369-W465 AromaticContact CH2-CD2 3.72Å; W369-W465 HydrophobicContact CH2-CD2 3.72Å; W369-W465 HydrophobicContact CH2-CE3 4.29Å; W369-W465 AromaticContact CH2-CG 3.32Å; W369-W465 HydrophobicContact CH2-CG 3.32Å; W369-W465 HydrophobicContact CZ2-CB 4.31Å; W369-W465 AromaticContact CZ2-CD1 3.73Å; W369-W465 HydrophobicContact CZ2-CD2 4.29Å; W369-W465 AromaticContact CZ2-CG 3.89Å; W369-W465 HydrophobicContact CZ2-CG 3.89Å; W369-W465 HydrophobicContact CZ3-CB 3.78Å; W369-W465 HydrophobicContact CZ3-CG 4.19Å; W369-A467 HydrophobicContact CE3-CB 4.43Å; W369-A467 HydrophobicContact CZ3-CB 4.33Å
370	C	98.7	Very high	98	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.2	-35.4	176.4	-76.4	0	0	0	0	111.8	I339 L343 E366 I367 I373 E374	I339-C370 HydrophobicContact CG2-CB 3.79Å; L343-C370 HydrophobicContact CD1-CB 4.24Å; L343-C370 HydrophobicContact CD2-CB 3.51Å; L343-C370 HydrophobicContact CG-CB 3.66Å; E366-C370 WeakPolarHBondContact O-CB 3.31Å; E366-C370 PolarHBondContact O-N 3.49Å; I367-C370 PolarHBondContact O-N 3.13Å; C370-I373 WeakPolarHBondContact O-CB 3.48Å; C370-I373 PolarHBondContact O-N 3.05Å; C370-E374 PolarHBondContact O-N 3.29Å
371	S	98.8	Very high	98.1	Very high	3 Å²	3	25 Å²	25	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-67.8	-39.8	175.7	-60.8	0	0	0	0	112.3	I367 G368 W369 I373 E374 L375 N376	I367-S371 WeakPolarHBondContact O-CB 3.48Å; I367-S371 PolarHBondContact O-N 3.03Å; I367-S371 PolarHBondContact O-OG 3.35Å; G368-S371 PolarHBondContact O-N 3.16Å; W369-S371 VanDerWaalsContact C-N 3.25Å; W369-S371 PolarHBondContact O-N 3Å; S371-I373 VanDerWaalsContact C-N 3.35Å; S371-E374 CarbonylContact O-C 3.57Å; S371-E374 PolarHBondContact O-N 3.4Å; S371-L375 PolarHBondContact O-N 2.87Å; S371-L375 VanDerWaalsContact O-N 3.14Å; S371-N376 WeakPolarHBondContact CB-O 3.48Å; S371-N376 PolarHBondContact O-N 3.27Å
372	M	98.7	Very high	98.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.9	-40.9	171	-71.3	-167.5	-61.1	0	0	112.1	G368 W369 E374 L375 A380 F384 V458 I461 L462	G368-M372 WeakPolarHBondContact O-CG 3.48Å; G368-M372 PolarHBondContact O-N 2.89Å; W369-M372 HydrophobicContact CD2-CE 3.72Å; W369-M372 HydrophobicContact CE3-CE 3.51Å; W369-M372 HydrophobicContact CG-CE 4.3Å; W369-M372 HydrophobicContact CH2-CE 4.32Å; W369-M372 HydrophobicContact CZ3-CE 3.83Å; W369-M372 PolarHBondContact O-N 3.42Å; M372-E374 VanDerWaalsContact C-N 3.3Å; M372-E374 PolarHBondContact O-N 3.06Å; M372-L375 PolarHBondContact O-N 3.07Å; M372-A380 HydrophobicContact CG-CB 3.78Å; M372-F384 HydrophobicContact CE-CE2 3.92Å; M372-F384 HydrophobicContact CE-CZ 3.87Å; M372-F384 HydrophobicContact CG-CE2 4.17Å; M372-F384 HydrophobicContact SD-CE2 3.92Å; M372-F384 HydrophobicContact SD-CZ 4.49Å; M372-V458 HydrophobicContact CB-CG1 4.1Å; M372-V458 HydrophobicContact CG-CG1 4.08Å; M372-V458 HydrophobicContact SD-CG1 3.9Å; M372-I461 HydrophobicContact CE-CG2 4.22Å; M372-L462 HydrophobicContact CB-CD2 4.11Å; M372-L462 HydrophobicContact CE-CD2 4.49Å
373	I	98.4	Very high	98.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61	-39.9	176.2	-70	162.5	0	0	0	111	I339 W369 C370 S371 L375 L462 A467 N470 C471	I339-I373 HydrophobicContact CD1-CG2 4.19Å; I339-I373 HydrophobicContact CG1-CG2 3.85Å; I339-I373 HydrophobicContact CG2-CG2 4.22Å; W369-I373 WeakPolarHBondContact O-CG1 3.24Å; W369-I373 PolarHBondContact O-N 2.95Å; C370-I373 WeakPolarHBondContact O-CB 3.48Å; C370-I373 PolarHBondContact O-N 3.05Å; S371-I373 VanDerWaalsContact C-N 3.35Å; I373-L375 PolarHBondContact O-N 2.94Å; I373-L462 HydrophobicContact CG1-CD2 3.9Å; I373-A467 HydrophobicContact CD1-CB 4.39Å; I373-A467 HydrophobicContact CG1-CB 4.47Å; I373-N470 HydrophobicContact CD1-CB 3.88Å; I373-N470 HydrophobicContact CG1-CB 4.47Å; I373-N470 HydrophobicContact CG2-CB 4.24Å; I373-N470 WeakPolarHBondContact CG2-O 3Å; I373-C471 HydrophobicContact CG2-CB 4.45Å
374	E	98.3	Very high	98.4	Very high	42 Å²	42	27.9 Å²	27.9	20%	0.196	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	0	175.7	-77.2	-58.3	141.7	0	0	114.4	I339 L343 C370 S371 M372 N376 K475	I339-E374 HydrophobicContact CB-CG 4.34Å; I339-E374 HydrophobicContact CG2-CG 3.72Å; L343-E374 HydrophobicContact CD1-CG 4.38Å; C370-E374 PolarHBondContact O-N 3.29Å; S371-E374 CarbonylContact O-C 3.57Å; S371-E374 PolarHBondContact O-N 3.4Å; M372-E374 VanDerWaalsContact C-N 3.3Å; M372-E374 PolarHBondContact O-N 3.06Å; E374-N376 PolarHBondContact O-N 2.88Å; E374-K475 WeakPolarHBondContact O-CE 3.43Å; E374-K475 PolarHBondContact O-NZ 2.98Å; E374-K475 WeakPolarHBondContact OE2-CE 3.37Å; E374-K475 IonicContact OE2-NZ 3.63Å
375	L	98.3	Very high	98.4	Very high	30 Å²	30	30.8 Å²	30.8	16%	0.157	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	22.7	-171.7	-50.8	-177.9	0	0	0	113.5	S371 M372 I373 Y377 K475 T478 M479	S371-L375 PolarHBondContact O-N 2.87Å; S371-L375 VanDerWaalsContact O-N 3.14Å; M372-L375 PolarHBondContact O-N 3.07Å; I373-L375 PolarHBondContact O-N 2.94Å; L375-Y377 HydrophobicContact CD2-CE1 4.21Å; L375-Y377 WeakPolarHBondContact CD2-OH 3.45Å; L375-Y377 PolarHBondContact O-N 3.47Å; L375-K475 HydrophobicContact CB-CD 4.38Å; L375-K475 HydrophobicContact CD1-CB 4.12Å; L375-K475 HydrophobicContact CD1-CD 3.87Å; L375-K475 HydrophobicContact CG-CB 4.28Å; L375-K475 HydrophobicContact CG-CD 3.93Å; L375-T478 HydrophobicContact CD1-CG2 3.79Å; L375-M479 HydrophobicContact CD1-CG 4.45Å; L375-M479 HydrophobicContact CD2-CE 3.27Å; L375-M479 HydrophobicContact CD2-CG 4.13Å; L375-M479 HydrophobicContact CG-CE 4.27Å
376	N	98.4	Very high	98.4	Very high	69 Å²	69	31.2 Å²	31.2	37%	0.369	14%	0.142	S	C	.	.			trans	-87.5	77	172.6	-172.4	-9.4	0	0	0	109.8	S371 E374 T378 E379 A380	S371-N376 WeakPolarHBondContact CB-O 3.48Å; S371-N376 PolarHBondContact O-N 3.27Å; E374-N376 PolarHBondContact O-N 2.88Å; N376-T378 PolarHBondContact O-N 3.34Å; N376-E379 VanDerWaalsContact ND2-CG 3.29Å; N376-E379 WeakPolarHBondContact ND2-CG 3.34Å; N376-E379 PolarHBondContact O-N 3.01Å; N376-E379 PolarHBondContact OD1-N 2.79Å; N376-A380 PolarHBondContact O-N 3Å; N376-A380 VanDerWaalsContact O-N 3.15Å
377	Y	98.6	Very high	98.3	Very high	26 Å²	26	30.7 Å²	30.7	10%	0.102	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-26.8	-174.8	-52.8	-54	0	0	0	113.5	L375 Y381 A408 I455 V458	L375-Y377 HydrophobicContact CD2-CE1 4.21Å; L375-Y377 WeakPolarHBondContact CD2-OH 3.45Å; L375-Y377 PolarHBondContact O-N 3.47Å; Y377-Y381 WeakPolarHBondContact O-CB 3.48Å; Y377-Y381 PolarHBondContact O-N 2.98Å; Y377-A408 HydrophobicContact CD1-CB 4Å; Y377-A408 HydrophobicContact CD2-CB 3.62Å; Y377-A408 WeakPolarHBondContact CD2-O 3.41Å; Y377-A408 HydrophobicContact CE1-CB 4.32Å; Y377-A408 HydrophobicContact CE2-CB 3.96Å; Y377-A408 HydrophobicContact CG-CB 3.64Å; Y377-I455 HydrophobicContact CE2-CD1 4.17Å; Y377-I455 HydrophobicContact CE2-CG1 3.89Å; Y377-I455 WeakPolarHBondContact OH-CG2 3.27Å; Y377-V458 HydrophobicContact CD1-CG2 4.48Å; Y377-V458 HydrophobicContact CE1-CB 4.34Å; Y377-V458 HydrophobicContact CE1-CG1 3.91Å; Y377-V458 HydrophobicContact CE1-CG2 4.33Å
378	T	98.4	Very high	98.2	Very high	58 Å²	58	31.9 Å²	31.9	36%	0.356	15%	0.145	S	C	.	.	H	α-helix	trans	-64.7	-49.7	178.2	-55.3	0	0	0	0	111.4	N376 Y381 R382	N376-T378 PolarHBondContact O-N 3.34Å; T378-Y381 PolarHBondContact O-N 3.03Å; T378-R382 WeakPolarHBondContact O-CG 3.49Å; T378-R382 PolarHBondContact O-N 3.44Å; T378-R382 VanDerWaalsContact O-N 3.11Å
379	E	98.4	Very high	98.1	Very high	71 Å²	71	35.5 Å²	35.5	33%	0.332	18%	0.175	S	C	.	.	H	α-helix	trans	-69.2	-37.3	178.2	-68.3	-57.9	105	0	0	111.5	N376 R382 A383	N376-E379 VanDerWaalsContact ND2-CG 3.29Å; N376-E379 WeakPolarHBondContact ND2-CG 3.34Å; N376-E379 PolarHBondContact O-N 3.01Å; N376-E379 PolarHBondContact OD1-N 2.79Å; E379-R382 PolarHBondContact O-N 2.86Å; E379-R382 IonicContact OE1-CZ 3.7Å; E379-R382 IonicContact OE1-NH1 2.7Å; E379-R382 PolarHBondContact OE1-NH1 3.07Å; E379-A383 WeakPolarHBondContact O-CB 3.37Å; E379-A383 PolarHBondContact O-N 2.7Å
380	A	98.8	Very high	97.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-49.4	174.2	0	0	0	0	0	111.8	M372 N376 R382 A383 F384 C405	M372-A380 HydrophobicContact CG-CB 3.78Å; N376-A380 PolarHBondContact O-N 3Å; N376-A380 VanDerWaalsContact O-N 3.15Å; A380-R382 PolarHBondContact O-N 3.25Å; A380-A383 PolarHBondContact O-N 2.78Å; A380-F384 HydrophobicContact CB-CD2 4.45Å; A380-F384 HydrophobicContact CB-CE2 4.22Å; A380-F384 WeakPolarHBondContact O-CD2 3.39Å; A380-F384 WeakPolarHBondContact O-CG 3.42Å; A380-F384 PolarHBondContact O-N 3.5Å; A380-C405 HydrophobicContact CB-CB 4.27Å
381	Y	97.4	Very high	97.4	Very high	43 Å²	43	39.1 Å²	39.1	17%	0.169	19%	0.192	C	C	.	.	H	α-helix	trans	-56.5	-49.5	177.5	154	-116.1	0	0	0	111.7	Y377 T378 A383 F384 E385 T402 Q406	Y377-Y381 WeakPolarHBondContact O-CB 3.48Å; Y377-Y381 PolarHBondContact O-N 2.98Å; T378-Y381 PolarHBondContact O-N 3.03Å; Y381-A383 PolarHBondContact O-N 2.89Å; Y381-F384 PolarHBondContact O-N 3.33Å; Y381-E385 HydrophobicContact CD2-CB 4.5Å; Y381-E385 HydrophobicContact CE2-CB 4.11Å; Y381-E385 HydrophobicContact CE2-CG 4.42Å; Y381-E385 VanDerWaalsContact O-CB 3.32Å; Y381-E385 WeakPolarHBondContact O-CB 3.49Å; Y381-E385 PolarHBondContact O-N 2.87Å; Y381-E385 VanDerWaalsContact OH-CD 3.26Å; Y381-E385 PolarHBondContact OH-OE1 3.07Å; Y381-E385 PolarHBondContact OH-OE2 2.83Å; Y381-T402 HydrophobicContact CD2-CG2 3.47Å; Y381-T402 VanDerWaalsContact CD2-CG2 3.47Å; Y381-T402 HydrophobicContact CE2-CG2 3.5Å; Y381-T402 VanDerWaalsContact CE2-CG2 3.5Å; Y381-Q406 HydrophobicContact CD2-CB 3.7Å; Y381-Q406 HydrophobicContact CD2-CG 4.2Å; Y381-Q406 HydrophobicContact CE2-CB 4.08Å; Y381-Q406 HydrophobicContact CE2-CG 4.12Å; Y381-Q406 HydrophobicContact CG-CB 4.1Å
382	R	98.3	Very high	96.7	Very high	140 Å²	140	45 Å²	45	53%	0.528	21%	0.214	S	C	.	.	H	α-helix	trans	-60.1	-44	179.4	-72.5	171.6	177.9	165.1	-3.7	112.5	T378 E379 A380 E385 R386	T378-R382 WeakPolarHBondContact O-CG 3.49Å; T378-R382 PolarHBondContact O-N 3.44Å; T378-R382 VanDerWaalsContact O-N 3.11Å; E379-R382 PolarHBondContact O-N 2.86Å; E379-R382 IonicContact OE1-CZ 3.7Å; E379-R382 IonicContact OE1-NH1 2.7Å; E379-R382 PolarHBondContact OE1-NH1 3.07Å; A380-R382 PolarHBondContact O-N 3.25Å; R382-E385 PolarHBondContact O-N 3.05Å; R382-R386 PolarHBondContact O-N 3.22Å
383	A	98.5	Very high	96	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.033	23%	0.232	C	C	.	.	H	α-helix	trans	-63.3	-46.2	178.9	0	0	0	0	0	111.6	L364 I367 E379 A380 Y381 R386 L387	L364-A383 HydrophobicContact CD2-CB 4.25Å; I367-A383 HydrophobicContact CG2-CB 4.26Å; E379-A383 WeakPolarHBondContact O-CB 3.37Å; E379-A383 PolarHBondContact O-N 2.7Å; A380-A383 PolarHBondContact O-N 2.78Å; Y381-A383 PolarHBondContact O-N 2.89Å; A383-R386 PolarHBondContact O-N 3.48Å; A383-L387 WeakPolarHBondContact O-CG 3.4Å; A383-L387 PolarHBondContact O-N 2.99Å; A383-L387 VanDerWaalsContact O-N 3.16Å
384	F	98.6	Very high	95.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-71.4	-30.8	178.8	-64.5	-48.4	0	0	0	113.4	M372 A380 Y381 R386 L387 K388 Y398 L401 T402	M372-F384 HydrophobicContact CE-CE2 3.92Å; M372-F384 HydrophobicContact CE-CZ 3.87Å; M372-F384 HydrophobicContact CG-CE2 4.17Å; M372-F384 HydrophobicContact SD-CE2 3.92Å; M372-F384 HydrophobicContact SD-CZ 4.49Å; A380-F384 HydrophobicContact CB-CD2 4.45Å; A380-F384 HydrophobicContact CB-CE2 4.22Å; A380-F384 WeakPolarHBondContact O-CD2 3.39Å; A380-F384 WeakPolarHBondContact O-CG 3.42Å; A380-F384 PolarHBondContact O-N 3.5Å; Y381-F384 PolarHBondContact O-N 3.33Å; F384-R386 VanDerWaalsContact C-N 3.35Å; F384-L387 HydrophobicContact CD1-CD1 4.01Å; F384-L387 PolarHBondContact O-N 3.3Å; F384-K388 WeakPolarHBondContact O-CB 3.39Å; F384-K388 PolarHBondContact O-N 3.19Å; F384-Y398 HydrophobicContact CD1-CD1 4.28Å; F384-L401 HydrophobicContact CB-CB 4.15Å; F384-L401 HydrophobicContact CD1-CB 4.21Å; F384-L401 HydrophobicContact CD1-CD1 3.79Å; F384-L401 HydrophobicContact CD2-CB 3.65Å; F384-L401 HydrophobicContact CD2-CD1 4.28Å; F384-L401 HydrophobicContact CE1-CD1 3.56Å; F384-L401 HydrophobicContact CE2-CB 4.06Å; F384-L401 HydrophobicContact CE2-CD1 4.06Å; F384-L401 HydrophobicContact CG-CB 3.74Å; F384-L401 HydrophobicContact CG-CD1 4.17Å; F384-L401 HydrophobicContact CZ-CD1 3.7Å; F384-T402 WeakPolarHBondContact CB-OG1 3.33Å; F384-T402 PolarHBondContact O-OG1 3.28Å
385	E	98.2	Very high	95.2	Very high	73 Å²	73	51.8 Å²	51.8	34%	0.341	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-44	175	-177.2	173.6	-116.6	0	0	111	Y381 R382 K388 A389 T402	Y381-E385 HydrophobicContact CD2-CB 4.5Å; Y381-E385 HydrophobicContact CE2-CB 4.11Å; Y381-E385 HydrophobicContact CE2-CG 4.42Å; Y381-E385 VanDerWaalsContact O-CB 3.32Å; Y381-E385 WeakPolarHBondContact O-CB 3.49Å; Y381-E385 PolarHBondContact O-N 2.87Å; Y381-E385 VanDerWaalsContact OH-CD 3.26Å; Y381-E385 PolarHBondContact OH-OE1 3.07Å; Y381-E385 PolarHBondContact OH-OE2 2.83Å; R382-E385 PolarHBondContact O-N 3.05Å; E385-K388 WeakPolarHBondContact O-CB 3.37Å; E385-K388 PolarHBondContact O-N 3.32Å; E385-A389 PolarHBondContact O-N 2.97Å; E385-T402 HydrophobicContact CB-CG2 3.93Å; E385-T402 HydrophobicContact CG-CG2 4.42Å; E385-T402 PolarHBondContact N-OG1 3.24Å
386	R	97.3	Very high	95.1	Very high	76 Å²	76	50.4 Å²	50.4	29%	0.287	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-42.9	175.6	-169.7	172.2	170.8	-146.2	-14.7	111.5	L364 R382 A383 F384 K388 A389 E390	L364-R386 HydrophobicContact CD1-CB 4.27Å; L364-R386 HydrophobicContact CD1-CG 3.97Å; R382-R386 PolarHBondContact O-N 3.22Å; A383-R386 PolarHBondContact O-N 3.48Å; F384-R386 VanDerWaalsContact C-N 3.35Å; R386-K388 PolarHBondContact O-N 3.39Å; R386-A389 PolarHBondContact O-N 3.48Å; R386-E390 HydrophobicContact CG-CG 4.29Å; R386-E390 VanDerWaalsContact CG-OE1 3.23Å; R386-E390 WeakPolarHBondContact CG-OE1 3.4Å; R386-E390 IonicContact CZ-OE1 3.51Å; R386-E390 IonicContact CZ-OE2 3.07Å; R386-E390 IonicContact NE-OE1 3.5Å; R386-E390 PolarHBondContact NE-OE1 3.48Å; R386-E390 IonicContact NE-OE2 3.71Å; R386-E390 PolarHBondContact NE-OE2 3.24Å; R386-E390 IonicContact NH2-OE1 2.82Å; R386-E390 IonicContact NH2-OE2 2.83Å; R386-E390 PolarHBondContact NH2-OE2 3.39Å; R386-E390 WeakPolarHBondContact O-CB 3.44Å; R386-E390 WeakPolarHBondContact O-CG 3.32Å; R386-E390 PolarHBondContact O-N 3.23Å
387	L	97.1	Very high	95	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-40.3	173.4	-73.2	170.3	0	0	0	112.7	H361 L364 A383 F384 A389 S391 Y398	H361-L387 HydrophobicContact CB-CD2 3.72Å; L364-L387 HydrophobicContact CB-CD1 4.12Å; L364-L387 HydrophobicContact CB-CD2 4.21Å; L364-L387 HydrophobicContact CB-CG 4.01Å; A383-L387 WeakPolarHBondContact O-CG 3.4Å; A383-L387 PolarHBondContact O-N 2.99Å; A383-L387 VanDerWaalsContact O-N 3.16Å; F384-L387 HydrophobicContact CD1-CD1 4.01Å; F384-L387 PolarHBondContact O-N 3.3Å; L387-A389 VanDerWaalsContact C-N 3.29Å; L387-A389 PolarHBondContact O-N 3.02Å; L387-S391 WeakPolarHBondContact O-CA 3.41Å; L387-S391 WeakPolarHBondContact O-CB 3.28Å; L387-S391 PolarHBondContact O-N 3.15Å; L387-Y398 HydrophobicContact CB-CD1 4.18Å; L387-Y398 HydrophobicContact CB-CD2 3.76Å; L387-Y398 HydrophobicContact CB-CE2 4.08Å; L387-Y398 HydrophobicContact CB-CG 3.82Å; L387-Y398 HydrophobicContact CD1-CD1 4.22Å; L387-Y398 HydrophobicContact CD1-CE1 4.02Å
388	K	96.4	Very high	95	Very high	33 Å²	33	47.5 Å²	47.5	14%	0.143	22%	0.222	C	C	.	.	H	α-helix	trans	-58.1	-43.9	174.9	-176.3	-167	75.8	159.3	0	110.7	F384 E385 R386 A399 D421 L425	F384-K388 WeakPolarHBondContact O-CB 3.39Å; F384-K388 PolarHBondContact O-N 3.19Å; E385-K388 WeakPolarHBondContact O-CB 3.37Å; E385-K388 PolarHBondContact O-N 3.32Å; R386-K388 PolarHBondContact O-N 3.39Å; K388-A399 HydrophobicContact CD-CB 3.61Å; K388-A399 HydrophobicContact CG-CB 3.85Å; K388-D421 IonicContact NZ-OD2 2.92Å; K388-D421 PolarHBondContact NZ-OD2 2.83Å; K388-L425 HydrophobicContact CD-CD1 4.46Å; K388-L425 HydrophobicContact CG-CD1 4.11Å
389	A	95.3	Very high	94.9	Very high	76 Å²	76	44.8 Å²	44.8	63%	0.628	21%	0.205	S	C	*	.	H	α-helix	trans	-76.4	-41.8	-176.1	0	0	0	0	0	113.1	E385 R386 L387	E385-A389 PolarHBondContact O-N 2.97Å; R386-A389 PolarHBondContact O-N 3.48Å; L387-A389 VanDerWaalsContact C-N 3.29Å; L387-A389 PolarHBondContact O-N 3.02Å
390	E	93.3	Very high	94.9	Very high	72 Å²	72	41.4 Å²	41.4	34%	0.336	19%	0.19	S	C	.	.	H	α-helix	trans	-102.8	-30.1	-168	-62.4	178.2	-167.6	0	0	114.1	H361 R386	H361-E390 IonicContact CD2-OE2 2.62Å; H361-E390 IonicContact CE1-OE2 2.75Å; H361-E390 VanDerWaalsContact NE2-CB 3.3Å; H361-E390 WeakPolarHBondContact NE2-CB 3.33Å; H361-E390 IonicContact NE2-OE2 3.06Å; H361-E390 PolarHBondContact NE2-OE2 3.46Å; R386-E390 HydrophobicContact CG-CG 4.29Å; R386-E390 VanDerWaalsContact CG-OE1 3.23Å; R386-E390 WeakPolarHBondContact CG-OE1 3.4Å; R386-E390 IonicContact CZ-OE1 3.51Å; R386-E390 IonicContact CZ-OE2 3.07Å; R386-E390 IonicContact NE-OE1 3.5Å; R386-E390 PolarHBondContact NE-OE1 3.48Å; R386-E390 IonicContact NE-OE2 3.71Å; R386-E390 PolarHBondContact NE-OE2 3.24Å; R386-E390 IonicContact NH2-OE1 2.82Å; R386-E390 IonicContact NH2-OE2 2.83Å; R386-E390 PolarHBondContact NH2-OE2 3.39Å; R386-E390 WeakPolarHBondContact O-CB 3.44Å; R386-E390 WeakPolarHBondContact O-CG 3.32Å; R386-E390 PolarHBondContact O-N 3.23Å
391	S	89.8	Confident	94.9	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.028	19%	0.19	C	C	.	.			trans	-75.2	143.7	-174.5	-167.2	0	0	0	0	111.2	L387 W393 Q395	L387-S391 WeakPolarHBondContact O-CA 3.41Å; L387-S391 WeakPolarHBondContact O-CB 3.28Å; L387-S391 PolarHBondContact O-N 3.15Å; S391-W393 VanDerWaalsContact C-N 3.35Å; S391-W393 PolarHBondContact OG-N 3.17Å; S391-W393 VanDerWaalsContact OG-N 3.15Å; S391-W393 PolarHBondContact OG-O 2.89Å; S391-Q395 VanDerWaalsContact O-CD 3.24Å; S391-Q395 WeakPolarHBondContact O-CG 3.34Å; S391-Q395 PolarHBondContact O-NE2 3.01Å
392	R	84.9	Confident	95	Very high	128 Å²	128	39.3 Å²	39.3	48%	0.483	18%	0.182	S	C	.	.	S	Bend	trans	-89.2	-6	168.1	-61.4	-170.7	-175.2	-155.2	-4.4	112.9	T70 F71 E72	T70-R392 VanDerWaalsContact O-CD 3.28Å; T70-R392 WeakPolarHBondContact O-CD 3.33Å; F71-R392 PolarHBondContact O-NH1 2.82Å; E72-R392 VanDerWaalsContact CG-NH1 3.3Å; E72-R392 IonicContact OE1-NH2 3.93Å
393	W	82.4	Confident	95	Very high	98 Å²	98	32.7 Å²	32.7	37%	0.371	16%	0.156	S	C	.	.	S	Bend	trans	-102.9	138.8	-178.2	-58.6	92	0	0	0	109.9	F71 S391 Q395 Y398	F71-W393 HydrophobicContact CB-CZ2 4.3Å; F71-W393 AromaticContact CD2-CH2 3.5Å; F71-W393 HydrophobicContact CD2-CH2 3.5Å; F71-W393 AromaticContact CD2-CZ2 3.31Å; F71-W393 HydrophobicContact CD2-CZ2 3.31Å; F71-W393 HydrophobicContact CD2-CZ3 4.41Å; F71-W393 AromaticContact CE2-CH2 3.48Å; F71-W393 HydrophobicContact CE2-CH2 3.48Å; F71-W393 VanDerWaalsContact CE2-CH2 3.48Å; F71-W393 AromaticContact CE2-CZ2 3.83Å; F71-W393 HydrophobicContact CE2-CZ2 3.83Å; F71-W393 HydrophobicContact CE2-CZ3 4.14Å; F71-W393 HydrophobicContact CG-CZ2 4.1Å; S391-W393 VanDerWaalsContact C-N 3.35Å; S391-W393 PolarHBondContact OG-N 3.17Å; S391-W393 VanDerWaalsContact OG-N 3.15Å; S391-W393 PolarHBondContact OG-O 2.89Å; W393-Q395 PolarHBondContact O-N 2.66Å; W393-Y398 WeakPolarHBondContact O-CD2 3.41Å; W393-Y398 WeakPolarHBondContact O-CE2 3.35Å
394	S	86.8	Confident	95	Very high	37 Å²	37	32.5 Å²	32.5	26%	0.259	16%	0.155	S	C	.	.	S	Bend	trans	49	30.5	167.7	-56.8	0	0	0	0	115.8	C396 Y397 Y398	S394-C396 PolarHBondContact O-N 3.25Å; S394-C396 VanDerWaalsContact O-N 3.17Å; S394-Y397 WeakPolarHBondContact O-CA 3.45Å; S394-Y397 WeakPolarHBondContact O-CB 3.49Å; S394-Y397 PolarHBondContact O-N 3.47Å; S394-Y398 PolarHBondContact O-N 3Å
395	Q	93.7	Very high	95	Very high	49 Å²	49	32.5 Å²	32.5	23%	0.229	16%	0.155	C	C	.	.	H	α-helix	trans	-53.1	-41.5	-176.1	-71	-177.4	-39.5	0	0	112.8	S391 W393 Y397 Y398 A399 L425	S391-Q395 VanDerWaalsContact O-CD 3.24Å; S391-Q395 WeakPolarHBondContact O-CG 3.34Å; S391-Q395 PolarHBondContact O-NE2 3.01Å; W393-Q395 PolarHBondContact O-N 2.66Å; Q395-Y397 VanDerWaalsContact C-N 3.32Å; Q395-Y397 PolarHBondContact O-N 2.75Å; Q395-Y398 PolarHBondContact O-N 2.85Å; Q395-A399 WeakPolarHBondContact O-CB 3.35Å; Q395-A399 PolarHBondContact O-N 3.38Å; Q395-L425 HydrophobicContact CB-CD1 4.39Å; Q395-L425 HydrophobicContact CB-CD2 4.25Å
396	C	96.2	Very high	95	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-59.3	-41.8	175.6	175.9	0	0	0	0	112.2	S394 A399 Y400 L425 E434	S394-C396 PolarHBondContact O-N 3.25Å; S394-C396 VanDerWaalsContact O-N 3.17Å; C396-A399 PolarHBondContact O-N 3.14Å; C396-Y400 PolarHBondContact O-N 3.19Å; C396-L425 HydrophobicContact CB-CB 4.11Å; C396-E434 HydrophobicContact CB-CG 3.96Å
397	Y	96.6	Very high	95	Very high	9 Å²	9	26 Å²	26	4%	0.035	13%	0.128	C	C	.	.	H	α-helix	trans	-69.4	-43.7	176.8	-176.5	-123.7	0	0	0	111.6	S394 Q395 A399 Y400 L401 I433 S437 W465	S394-Y397 WeakPolarHBondContact O-CA 3.45Å; S394-Y397 WeakPolarHBondContact O-CB 3.49Å; S394-Y397 PolarHBondContact O-N 3.47Å; Q395-Y397 VanDerWaalsContact C-N 3.32Å; Q395-Y397 PolarHBondContact O-N 2.75Å; Y397-A399 VanDerWaalsContact C-N 3.28Å; Y397-A399 PolarHBondContact O-N 3.39Å; Y397-Y400 HydrophobicContact CD2-CD1 4.41Å; Y397-Y400 HydrophobicContact CE2-CD1 4.4Å; Y397-Y400 WeakPolarHBondContact O-CB 3.39Å; Y397-Y400 PolarHBondContact O-N 3.24Å; Y397-Y400 VanDerWaalsContact O-N 3.08Å; Y397-L401 HydrophobicContact CD1-CD1 4.05Å; Y397-L401 HydrophobicContact CD1-CG 4.41Å; Y397-L401 HydrophobicContact CD2-CG 4.46Å; Y397-L401 HydrophobicContact CE1-CD1 3.59Å; Y397-L401 HydrophobicContact CE1-CD2 4.42Å; Y397-L401 HydrophobicContact CE1-CG 4.09Å; Y397-L401 HydrophobicContact CE2-CD2 4Å; Y397-L401 HydrophobicContact CE2-CG 4.15Å; Y397-L401 WeakPolarHBondContact O-CG 3.46Å; Y397-L401 PolarHBondContact O-N 3Å; Y397-I433 HydrophobicContact CD1-CG2 4.14Å; Y397-I433 HydrophobicContact CD2-CG2 3.35Å; Y397-I433 HydrophobicContact CE2-CG2 3.89Å; Y397-I433 HydrophobicContact CG-CG2 3.49Å; Y397-I433 VanDerWaalsContact CG-CG2 3.49Å; Y397-S437 WeakPolarHBondContact CD2-OG 3.49Å; Y397-W465 HydrophobicContact CE1-CZ2 4.37Å; Y397-W465 AromaticContact CE2-CH2 3.88Å; Y397-W465 HydrophobicContact CE2-CH2 3.88Å; Y397-W465 AromaticContact CE2-CZ2 3.82Å; Y397-W465 HydrophobicContact CE2-CZ2 3.82Å; Y397-W465 AromaticContact CZ-CH2 3.94Å; Y397-W465 AromaticContact CZ-CZ2 3.51Å; Y397-W465 VanDerWaalsContact OH-CE2 3.32Å; Y397-W465 WeakPolarHBondContact OH-CH2 3.49Å; Y397-W465 WeakPolarHBondContact OH-CZ2 3.42Å
398	Y	97.9	Very high	95.1	Very high	25 Å²	25	26 Å²	26	10%	0.098	13%	0.128	C	C	.	.	H	α-helix	trans	-62.9	-35.6	175.4	-62.1	-41.7	0	0	0	112.1	Y365 F384 L387 W393 S394 Q395 Y400 L401 T402	Y365-Y398 AromaticContact CD2-CE1 3.95Å; Y365-Y398 HydrophobicContact CD2-CE1 3.95Å; Y365-Y398 HydrophobicContact CE2-CE1 4.33Å; F384-Y398 HydrophobicContact CD1-CD1 4.28Å; L387-Y398 HydrophobicContact CB-CD1 4.18Å; L387-Y398 HydrophobicContact CB-CD2 3.76Å; L387-Y398 HydrophobicContact CB-CE2 4.08Å; L387-Y398 HydrophobicContact CB-CG 3.82Å; L387-Y398 HydrophobicContact CD1-CD1 4.22Å; L387-Y398 HydrophobicContact CD1-CE1 4.02Å; W393-Y398 WeakPolarHBondContact O-CD2 3.41Å; W393-Y398 WeakPolarHBondContact O-CE2 3.35Å; S394-Y398 PolarHBondContact O-N 3Å; Q395-Y398 PolarHBondContact O-N 2.85Å; Y398-Y400 VanDerWaalsContact C-N 3.35Å; Y398-L401 HydrophobicContact CD1-CD1 4.37Å; Y398-L401 PolarHBondContact O-N 3.19Å; Y398-T402 VanDerWaalsContact O-CB 3.29Å; Y398-T402 WeakPolarHBondContact O-CB 3.41Å; Y398-T402 PolarHBondContact O-N 3.07Å; Y398-T402 PolarHBondContact O-OG1 2.8Å
399	A	98.1	Very high	95.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-43.2	170.8	0	0	0	0	0	112	K388 Q395 C396 Y397 T402 G403 T418 V422 L425	K388-A399 HydrophobicContact CD-CB 3.61Å; K388-A399 HydrophobicContact CG-CB 3.85Å; Q395-A399 WeakPolarHBondContact O-CB 3.35Å; Q395-A399 PolarHBondContact O-N 3.38Å; C396-A399 PolarHBondContact O-N 3.14Å; Y397-A399 VanDerWaalsContact C-N 3.28Å; Y397-A399 PolarHBondContact O-N 3.39Å; A399-T402 WeakPolarHBondContact O-CB 3.2Å; A399-T402 PolarHBondContact O-N 2.92Å; A399-G403 PolarHBondContact O-N 2.86Å; A399-T418 WeakPolarHBondContact O-CG2 3.4Å; A399-V422 HydrophobicContact CB-CG2 3.76Å; A399-L425 HydrophobicContact CB-CD1 3.77Å
400	Y	98.2	Very high	95.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.5	-47.8	176.7	174.4	-116.2	0	0	0	111.8	C396 Y397 Y398 T402 G403 V404 F419 F436 R440 A441 L444 I461	C396-Y400 PolarHBondContact O-N 3.19Å; Y397-Y400 HydrophobicContact CD2-CD1 4.41Å; Y397-Y400 HydrophobicContact CE2-CD1 4.4Å; Y397-Y400 WeakPolarHBondContact O-CB 3.39Å; Y397-Y400 PolarHBondContact O-N 3.24Å; Y397-Y400 VanDerWaalsContact O-N 3.08Å; Y398-Y400 VanDerWaalsContact C-N 3.35Å; Y400-T402 VanDerWaalsContact C-N 3.3Å; Y400-T402 PolarHBondContact O-N 3.22Å; Y400-G403 PolarHBondContact O-N 3.11Å; Y400-V404 HydrophobicContact CD2-CG1 4.01Å; Y400-V404 HydrophobicContact CE1-CG1 4.47Å; Y400-V404 HydrophobicContact CE2-CG1 3.49Å; Y400-V404 VanDerWaalsContact CE2-CG1 3.49Å; Y400-V404 WeakPolarHBondContact O-CG2 3.3Å; Y400-V404 PolarHBondContact O-N 2.93Å; Y400-F419 HydrophobicContact CD2-CE1 4.19Å; Y400-F419 HydrophobicContact CE2-CE1 4.44Å; Y400-F436 AromaticContact CE1-CE1 3.99Å; Y400-F436 HydrophobicContact CE1-CE1 3.99Å; Y400-R440 HydrophobicContact CD2-CB 4.46Å; Y400-R440 HydrophobicContact CE1-CB 4.48Å; Y400-R440 HydrophobicContact CE2-CB 3.55Å; Y400-R440 WeakPolarHBondContact OH-CB 3.3Å; Y400-A441 HydrophobicContact CD2-CB 4.25Å; Y400-L444 HydrophobicContact CE2-CD1 4.25Å; Y400-I461 HydrophobicContact CD1-CD1 4.39Å; Y400-I461 HydrophobicContact CE1-CD1 3.73Å; Y400-I461 HydrophobicContact CE1-CG1 4.15Å
401	L	98.6	Very high	95.4	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.2	-41.7	175.3	-66	-174.3	0	0	0	112.4	F384 Y397 Y398 V404 C405 I461	F384-L401 HydrophobicContact CB-CB 4.15Å; F384-L401 HydrophobicContact CD1-CB 4.21Å; F384-L401 HydrophobicContact CD1-CD1 3.79Å; F384-L401 HydrophobicContact CD2-CB 3.65Å; F384-L401 HydrophobicContact CD2-CD1 4.28Å; F384-L401 HydrophobicContact CE1-CD1 3.56Å; F384-L401 HydrophobicContact CE2-CB 4.06Å; F384-L401 HydrophobicContact CE2-CD1 4.06Å; F384-L401 HydrophobicContact CG-CB 3.74Å; F384-L401 HydrophobicContact CG-CD1 4.17Å; F384-L401 HydrophobicContact CZ-CD1 3.7Å; Y397-L401 HydrophobicContact CD1-CD1 4.05Å; Y397-L401 HydrophobicContact CD1-CG 4.41Å; Y397-L401 HydrophobicContact CD2-CG 4.46Å; Y397-L401 HydrophobicContact CE1-CD1 3.59Å; Y397-L401 HydrophobicContact CE1-CD2 4.42Å; Y397-L401 HydrophobicContact CE1-CG 4.09Å; Y397-L401 HydrophobicContact CE2-CD2 4Å; Y397-L401 HydrophobicContact CE2-CG 4.15Å; Y397-L401 WeakPolarHBondContact O-CG 3.46Å; Y397-L401 PolarHBondContact O-N 3Å; Y398-L401 HydrophobicContact CD1-CD1 4.37Å; Y398-L401 PolarHBondContact O-N 3.19Å; L401-V404 WeakPolarHBondContact O-CG2 3.26Å; L401-C405 WeakPolarHBondContact O-CB 3.42Å; L401-C405 PolarHBondContact O-N 3.05Å; L401-C405 PolarHBondContact O-SG 3.38Å; L401-I461 HydrophobicContact CD2-CD1 3.49Å; L401-I461 VanDerWaalsContact CD2-CD1 3.49Å; L401-I461 HydrophobicContact CD2-CG1 4.25Å; L401-I461 HydrophobicContact CD2-CG2 3.99Å
402	T	98.6	Very high	95.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.2	-52	175	-58.4	0	0	0	0	110.1	Y381 F384 E385 Y398 A399 Y400 C405 Q406 T418	Y381-T402 HydrophobicContact CD2-CG2 3.47Å; Y381-T402 VanDerWaalsContact CD2-CG2 3.47Å; Y381-T402 HydrophobicContact CE2-CG2 3.5Å; Y381-T402 VanDerWaalsContact CE2-CG2 3.5Å; F384-T402 WeakPolarHBondContact CB-OG1 3.33Å; F384-T402 PolarHBondContact O-OG1 3.28Å; E385-T402 HydrophobicContact CB-CG2 3.93Å; E385-T402 HydrophobicContact CG-CG2 4.42Å; E385-T402 PolarHBondContact N-OG1 3.24Å; Y398-T402 VanDerWaalsContact O-CB 3.29Å; Y398-T402 WeakPolarHBondContact O-CB 3.41Å; Y398-T402 PolarHBondContact O-N 3.07Å; Y398-T402 PolarHBondContact O-OG1 2.8Å; A399-T402 WeakPolarHBondContact O-CB 3.2Å; A399-T402 PolarHBondContact O-N 2.92Å; Y400-T402 VanDerWaalsContact C-N 3.3Å; Y400-T402 PolarHBondContact O-N 3.22Å; T402-C405 PolarHBondContact O-N 3.11Å; T402-Q406 WeakPolarHBondContact O-CB 3.17Å; T402-Q406 PolarHBondContact O-N 3.15Å; T402-T418 HydrophobicContact CG2-CG2 3.9Å
403	G	98.1	Very high	96.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-43.9	-176.4	0	0	0	0	0	113.3	A399 Y400 Q406 G407 A415	A399-G403 PolarHBondContact O-N 2.86Å; Y400-G403 PolarHBondContact O-N 3.11Å; G403-Q406 PolarHBondContact O-N 3.26Å; G403-G407 PolarHBondContact O-N 3.45Å; G403-A415 WeakPolarHBondContact O-CB 3.41Å
404	V	98.3	Very high	96.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.5	-38.5	178.2	-59.4	0	0	0	0	112	Y400 L401 A408 F419 L444 C454 V458 I461	Y400-V404 HydrophobicContact CD2-CG1 4.01Å; Y400-V404 HydrophobicContact CE1-CG1 4.47Å; Y400-V404 HydrophobicContact CE2-CG1 3.49Å; Y400-V404 VanDerWaalsContact CE2-CG1 3.49Å; Y400-V404 WeakPolarHBondContact O-CG2 3.3Å; Y400-V404 PolarHBondContact O-N 2.93Å; L401-V404 WeakPolarHBondContact O-CG2 3.26Å; V404-A408 VanDerWaalsContact O-CB 3.24Å; V404-A408 WeakPolarHBondContact O-CB 3.5Å; V404-A408 PolarHBondContact O-N 2.77Å; V404-F419 HydrophobicContact CG1-CE1 3.92Å; V404-F419 HydrophobicContact CG1-CZ 4Å; V404-L444 HydrophobicContact CG1-CD1 3.99Å; V404-C454 WeakPolarHBondContact O-CB 3.44Å; V404-V458 HydrophobicContact CB-CG2 4.25Å; V404-V458 HydrophobicContact CG2-CG2 3.93Å; V404-I461 HydrophobicContact CG2-CD1 3.88Å
405	C	98.8	Very high	97.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.6	-43.2	176.1	-66.4	0	0	0	0	110.9	A380 L401 T402 G407 A408 T409	A380-C405 HydrophobicContact CB-CB 4.27Å; L401-C405 WeakPolarHBondContact O-CB 3.42Å; L401-C405 PolarHBondContact O-N 3.05Å; L401-C405 PolarHBondContact O-SG 3.38Å; T402-C405 PolarHBondContact O-N 3.11Å; C405-G407 PolarHBondContact O-N 3.11Å; C405-A408 PolarHBondContact O-N 2.96Å; C405-T409 WeakPolarHBondContact O-CG2 3.41Å; C405-T409 PolarHBondContact O-N 3.18Å; C405-T409 VanDerWaalsContact O-N 3.13Å
406	Q	98.3	Very high	97.3	Very high	13 Å²	13	22.8 Å²	22.8	6%	0.061	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-48.8	176.2	-171.7	170.7	16.7	0	0	110.9	Y381 T402 G403 A408 T409 D411 G414 T418	Y381-Q406 HydrophobicContact CD2-CB 3.7Å; Y381-Q406 HydrophobicContact CD2-CG 4.2Å; Y381-Q406 HydrophobicContact CE2-CB 4.08Å; Y381-Q406 HydrophobicContact CE2-CG 4.12Å; Y381-Q406 HydrophobicContact CG-CB 4.1Å; T402-Q406 WeakPolarHBondContact O-CB 3.17Å; T402-Q406 PolarHBondContact O-N 3.15Å; G403-Q406 PolarHBondContact O-N 3.26Å; Q406-A408 VanDerWaalsContact C-N 3.31Å; Q406-A408 PolarHBondContact O-N 2.9Å; Q406-T409 WeakPolarHBondContact O-CB 3.43Å; Q406-T409 PolarHBondContact O-N 3.09Å; Q406-T409 PolarHBondContact O-OG1 3.31Å; Q406-D411 HydrophobicContact CG-CB 4.04Å; Q406-D411 PolarHBondContact NE2-OD2 3.45Å; Q406-D411 PolarHBondContact O-N 3.39Å; Q406-G414 PolarHBondContact OE1-O 2.91Å; Q406-T418 PolarHBondContact OE1-OG1 3.27Å; Q406-T418 VanDerWaalsContact OE1-OG1 3.09Å
407	G	97.9	Very high	97.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-35.3	176.9	0	0	0	0	0	113.1	G403 C405 T409 G410	G403-G407 PolarHBondContact O-N 3.45Å; C405-G407 PolarHBondContact O-N 3.11Å; G407-T409 PolarHBondContact O-N 2.92Å; G407-G410 WeakPolarHBondContact O-CA 3.43Å; G407-G410 PolarHBondContact O-N 3.35Å
408	A	98.4	Very high	97.2	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-66.5	-19.8	174.7	0	0	0	0	0	113.4	Y377 V404 C405 Q406 G410 K451 C454 I455	Y377-A408 HydrophobicContact CD1-CB 4Å; Y377-A408 HydrophobicContact CD2-CB 3.62Å; Y377-A408 WeakPolarHBondContact CD2-O 3.41Å; Y377-A408 HydrophobicContact CE1-CB 4.32Å; Y377-A408 HydrophobicContact CE2-CB 3.96Å; Y377-A408 HydrophobicContact CG-CB 3.64Å; V404-A408 VanDerWaalsContact O-CB 3.24Å; V404-A408 WeakPolarHBondContact O-CB 3.5Å; V404-A408 PolarHBondContact O-N 2.77Å; C405-A408 PolarHBondContact O-N 2.96Å; Q406-A408 VanDerWaalsContact C-N 3.31Å; Q406-A408 PolarHBondContact O-N 2.9Å; A408-G410 VanDerWaalsContact C-N 3.3Å; A408-K451 WeakPolarHBondContact O-CE 3.31Å; A408-C454 HydrophobicContact CB-CB 4.13Å; A408-I455 HydrophobicContact CB-CG1 3.75Å
409	T	98.2	Very high	97.2	Very high	51 Å²	51	25.6 Å²	25.6	31%	0.313	15%	0.151	S	C	.	.	H	α-helix	trans	-74.8	-21.8	169.1	72.3	0	0	0	0	112.4	C405 Q406 G407	C405-T409 WeakPolarHBondContact O-CG2 3.41Å; C405-T409 PolarHBondContact O-N 3.18Å; C405-T409 VanDerWaalsContact O-N 3.13Å; Q406-T409 WeakPolarHBondContact O-CB 3.43Å; Q406-T409 PolarHBondContact O-N 3.09Å; Q406-T409 PolarHBondContact O-OG1 3.31Å; G407-T409 PolarHBondContact O-N 2.92Å
410	G	96.8	Very high	97	Very high	42 Å²	42	30.7 Å²	30.7	43%	0.433	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	111.2	-9.2	-174.1	0	0	0	0	0	114	G407 A408 L412	G407-G410 WeakPolarHBondContact O-CA 3.43Å; G407-G410 PolarHBondContact O-N 3.35Å; A408-G410 VanDerWaalsContact C-N 3.3Å; G410-L412 VanDerWaalsContact C-N 3.32Å; G410-L412 PolarHBondContact O-N 2.92Å
411	D	97.3	Very high	96.9	Very high	68 Å²	68	32.3 Å²	32.3	36%	0.364	18%	0.181	S	C	.	.			trans	-79.4	79.1	174	179.4	15.2	0	0	0	111.2	Q406 G414 A415	Q406-D411 HydrophobicContact CG-CB 4.04Å; Q406-D411 PolarHBondContact NE2-OD2 3.45Å; Q406-D411 PolarHBondContact O-N 3.39Å; D411-G414 PolarHBondContact OD1-N 3.42Å; D411-A415 WeakPolarHBondContact O-CB 3.49Å; D411-A415 PolarHBondContact O-N 3.27Å; D411-A415 VanDerWaalsContact O-N 3.14Å
412	L	96.3	Very high	96.8	Very high	56 Å²	56	32.3 Å²	32.3	29%	0.293	18%	0.181	S	C	.	.	H	α-helix	trans	-72.9	-33.2	-178.1	-54.9	-176.2	0	0	0	112.3	G410 A415 V416 L449	G410-L412 VanDerWaalsContact C-N 3.32Å; G410-L412 PolarHBondContact O-N 2.92Å; L412-A415 PolarHBondContact O-N 3.37Å; L412-V416 WeakPolarHBondContact O-CG2 3.43Å; L412-V416 PolarHBondContact O-N 3.11Å; L412-L449 HydrophobicContact CB-CD2 4.3Å; L412-L449 HydrophobicContact CD2-CD2 4.47Å; L412-L449 HydrophobicContact CD2-CG 4.34Å
413	E	94.5	Very high	96.5	Very high	165 Å²	165	37 Å²	37	77%	0.771	20%	0.203	S	C	*	.	H	α-helix	trans	-66.8	-46.8	179	-66.4	-174.4	178.9	0	0	110.9	A415 V416 V417	E413-A415 VanDerWaalsContact C-N 3.35Å; E413-A415 PolarHBondContact O-N 2.98Å; E413-V416 PolarHBondContact O-N 2.94Å; E413-V417 PolarHBondContact O-N 3.42Å
414	G	95.4	Very high	96.3	Very high	14 Å²	14	44 Å²	44	14%	0.144	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-42.4	173.6	0	0	0	0	0	112.3	Q406 D411 V416 V417 T418	Q406-G414 PolarHBondContact OE1-O 2.91Å; D411-G414 PolarHBondContact OD1-N 3.42Å; G414-V416 PolarHBondContact O-N 3Å; G414-V417 WeakPolarHBondContact O-CB 3.46Å; G414-V417 PolarHBondContact O-N 2.77Å; G414-V417 VanDerWaalsContact O-N 3.16Å; G414-T418 PolarHBondContact O-N 3.47Å; G414-T418 PolarHBondContact O-OG1 2.93Å
415	A	96.7	Very high	96.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.3	-44.3	175.3	0	0	0	0	0	112.5	G403 D411 L412 E413 V417 T418 F419 L449	G403-A415 WeakPolarHBondContact O-CB 3.41Å; D411-A415 WeakPolarHBondContact O-CB 3.49Å; D411-A415 PolarHBondContact O-N 3.27Å; D411-A415 VanDerWaalsContact O-N 3.14Å; L412-A415 PolarHBondContact O-N 3.37Å; E413-A415 VanDerWaalsContact C-N 3.35Å; E413-A415 PolarHBondContact O-N 2.98Å; A415-V417 VanDerWaalsContact C-N 3.31Å; A415-V417 PolarHBondContact O-N 3.09Å; A415-T418 PolarHBondContact O-N 2.84Å; A415-T418 VanDerWaalsContact O-N 3.17Å; A415-F419 HydrophobicContact CB-CE2 4.07Å; A415-F419 WeakPolarHBondContact O-CD2 3.11Å; A415-F419 VanDerWaalsContact O-CG 3.29Å; A415-F419 WeakPolarHBondContact O-CG 3.22Å; A415-F419 PolarHBondContact O-N 2.84Å; A415-L449 HydrophobicContact CB-CD2 4.28Å
416	V	95	Very high	95.9	Very high	34 Å²	34	48 Å²	48	21%	0.206	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-39.7	176.6	169	0	0	0	0	111.8	L412 E413 G414 F419 K420 L449	L412-V416 WeakPolarHBondContact O-CG2 3.43Å; L412-V416 PolarHBondContact O-N 3.11Å; E413-V416 PolarHBondContact O-N 2.94Å; G414-V416 PolarHBondContact O-N 3Å; V416-F419 PolarHBondContact O-N 2.88Å; V416-K420 PolarHBondContact O-N 3.04Å; V416-L449 HydrophobicContact CG2-CD2 3.6Å
417	V	94.8	Very high	95.5	Very high	85 Å²	85	54.6 Å²	54.6	52%	0.515	28%	0.281	S	S	.	.	H	α-helix	trans	-62.8	-47.8	174.7	175.2	0	0	0	0	110.1	E413 G414 A415 F419 K420 D421	E413-V417 PolarHBondContact O-N 3.42Å; G414-V417 WeakPolarHBondContact O-CB 3.46Å; G414-V417 PolarHBondContact O-N 2.77Å; G414-V417 VanDerWaalsContact O-N 3.16Å; A415-V417 VanDerWaalsContact C-N 3.31Å; A415-V417 PolarHBondContact O-N 3.09Å; V417-F419 VanDerWaalsContact C-N 3.33Å; V417-F419 PolarHBondContact O-N 3.37Å; V417-K420 WeakPolarHBondContact O-CB 3.28Å; V417-K420 PolarHBondContact O-N 2.89Å; V417-D421 PolarHBondContact O-N 2.94Å
418	T	96.4	Very high	94.8	Very high	8 Å²	8	58.5 Å²	58.5	5%	0.049	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-36.9	179.3	-62.3	0	0	0	0	112.4	A399 T402 Q406 G414 A415 K420 D421 V422	A399-T418 WeakPolarHBondContact O-CG2 3.4Å; T402-T418 HydrophobicContact CG2-CG2 3.9Å; Q406-T418 PolarHBondContact OE1-OG1 3.27Å; Q406-T418 VanDerWaalsContact OE1-OG1 3.09Å; G414-T418 PolarHBondContact O-N 3.47Å; G414-T418 PolarHBondContact O-OG1 2.93Å; A415-T418 PolarHBondContact O-N 2.84Å; A415-T418 VanDerWaalsContact O-N 3.17Å; T418-K420 PolarHBondContact O-N 3.34Å; T418-D421 WeakPolarHBondContact O-CA 3.48Å; T418-D421 WeakPolarHBondContact O-CB 3.31Å; T418-D421 PolarHBondContact O-N 3.3Å; T418-V422 PolarHBondContact O-N 3.26Å; T418-V422 VanDerWaalsContact O-N 3.17Å
419	F	96.3	Very high	94	Very high	1 Å²	1	66.6 Å²	66.6	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-21.8	174.3	-65.1	-39.8	0	0	0	113.8	Y400 V404 A415 V416 V417 A441 L444 R445 L449	Y400-F419 HydrophobicContact CD2-CE1 4.19Å; Y400-F419 HydrophobicContact CE2-CE1 4.44Å; V404-F419 HydrophobicContact CG1-CE1 3.92Å; V404-F419 HydrophobicContact CG1-CZ 4Å; A415-F419 HydrophobicContact CB-CE2 4.07Å; A415-F419 WeakPolarHBondContact O-CD2 3.11Å; A415-F419 VanDerWaalsContact O-CG 3.29Å; A415-F419 WeakPolarHBondContact O-CG 3.22Å; A415-F419 PolarHBondContact O-N 2.84Å; V416-F419 PolarHBondContact O-N 2.88Å; V417-F419 VanDerWaalsContact C-N 3.33Å; V417-F419 PolarHBondContact O-N 3.37Å; F419-A441 HydrophobicContact CB-CB 4.13Å; F419-A441 HydrophobicContact CD1-CB 3.83Å; F419-A441 HydrophobicContact CG-CB 4.23Å; F419-L444 HydrophobicContact CD2-CB 4.13Å; F419-L444 HydrophobicContact CE1-CD1 4.15Å; F419-L444 HydrophobicContact CE2-CB 3.74Å; F419-L444 HydrophobicContact CE2-CD1 4.18Å; F419-L444 HydrophobicContact CZ-CB 4.09Å; F419-L444 HydrophobicContact CZ-CD1 3.67Å; F419-R445 PolarHBondContact O-NH2 3.21Å; F419-R445 VanDerWaalsContact O-NH2 3.11Å; F419-L449 HydrophobicContact CE2-CD1 4.16Å; F419-L449 HydrophobicContact CE2-CD2 4.09Å
420	K	94.6	Very high	93.2	Very high	106 Å²	106	72 Å²	72	46%	0.461	36%	0.358	S	S	.	.	H	α-helix	trans	-73.2	-34	168.4	-65.8	172.7	-178	174.1	0	111.2	V416 V417 T418 V422 Q423 K424	V416-K420 PolarHBondContact O-N 3.04Å; V417-K420 WeakPolarHBondContact O-CB 3.28Å; V417-K420 PolarHBondContact O-N 2.89Å; T418-K420 PolarHBondContact O-N 3.34Å; K420-V422 VanDerWaalsContact C-N 3.33Å; K420-Q423 PolarHBondContact O-N 3.31Å; K420-K424 PolarHBondContact O-N 3.14Å
421	D	95.4	Very high	92.6	Very high	34 Å²	34	72 Å²	72	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-66.7	-34.5	175.9	-68.8	-15.1	0	0	0	112.2	K388 V417 T418 Q423 K424 L425	K388-D421 IonicContact NZ-OD2 2.92Å; K388-D421 PolarHBondContact NZ-OD2 2.83Å; V417-D421 PolarHBondContact O-N 2.94Å; T418-D421 WeakPolarHBondContact O-CA 3.48Å; T418-D421 WeakPolarHBondContact O-CB 3.31Å; T418-D421 PolarHBondContact O-N 3.3Å; D421-Q423 PolarHBondContact O-N 3.06Å; D421-K424 PolarHBondContact O-N 3.11Å; D421-K424 IonicContact OD1-NZ 2.87Å; D421-K424 PolarHBondContact OD1-NZ 3.02Å; D421-L425 HydrophobicContact CB-CD1 4.38Å; D421-L425 WeakPolarHBondContact O-CB 3.46Å; D421-L425 VanDerWaalsContact O-CG 3.31Å; D421-L425 WeakPolarHBondContact O-CG 3.44Å; D421-L425 PolarHBondContact O-N 3.48Å
422	V	96.4	Very high	92.2	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-51.8	-46.3	172.7	178.8	0	0	0	0	110.8	A399 T418 K420 K424 L425 F426 A441	A399-V422 HydrophobicContact CB-CG2 3.76Å; T418-V422 PolarHBondContact O-N 3.26Å; T418-V422 VanDerWaalsContact O-N 3.17Å; K420-V422 VanDerWaalsContact C-N 3.33Å; V422-K424 PolarHBondContact O-N 2.97Å; V422-L425 PolarHBondContact O-N 3.48Å; V422-F426 PolarHBondContact O-N 3.46Å; V422-A441 HydrophobicContact CB-CB 3.94Å; V422-A441 HydrophobicContact CG1-CB 3.84Å; V422-A441 HydrophobicContact CG2-CB 4.04Å
423	Q	92.4	Very high	91.9	Very high	99 Å²	99	72.2 Å²	72.2	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-39	178.3	-174.3	176.4	1.7	0	0	112.8	K420 D421 L425 L438 R445	K420-Q423 PolarHBondContact O-N 3.31Å; D421-Q423 PolarHBondContact O-N 3.06Å; Q423-L425 VanDerWaalsContact C-N 3.34Å; Q423-L438 HydrophobicContact CB-CD1 3.97Å; Q423-L438 HydrophobicContact CG-CD1 4.14Å; Q423-R445 VanDerWaalsContact OE1-NH2 3.15Å
424	K	94.3	Very high	91.8	Very high	148 Å²	148	64.7 Å²	64.7	64%	0.643	31%	0.311	S	S	*	.	H	α-helix	trans	-68.4	-34.2	176.6	-62	174.1	-164.7	155.6	0	112.4	K420 D421 V422	K420-K424 PolarHBondContact O-N 3.14Å; D421-K424 PolarHBondContact O-N 3.11Å; D421-K424 IonicContact OD1-NZ 2.87Å; D421-K424 PolarHBondContact OD1-NZ 3.02Å; V422-K424 PolarHBondContact O-N 2.97Å
425	L	94.9	Very high	91.7	Very high	38 Å²	38	65.6 Å²	65.6	20%	0.199	31%	0.314	C	S	.	.	H	α-helix	trans	-88.1	-12.4	-176.2	-68.1	169.3	0	0	0	113	K388 Q395 C396 A399 D421 V422 Q423 K427	K388-L425 HydrophobicContact CD-CD1 4.46Å; K388-L425 HydrophobicContact CG-CD1 4.11Å; Q395-L425 HydrophobicContact CB-CD1 4.39Å; Q395-L425 HydrophobicContact CB-CD2 4.25Å; C396-L425 HydrophobicContact CB-CB 4.11Å; A399-L425 HydrophobicContact CB-CD1 3.77Å; D421-L425 HydrophobicContact CB-CD1 4.38Å; D421-L425 WeakPolarHBondContact O-CB 3.46Å; D421-L425 VanDerWaalsContact O-CG 3.31Å; D421-L425 WeakPolarHBondContact O-CG 3.44Å; D421-L425 PolarHBondContact O-N 3.48Å; V422-L425 PolarHBondContact O-N 3.48Å; Q423-L425 VanDerWaalsContact C-N 3.34Å; L425-K427 PolarHBondContact O-N 3.34Å; L425-K427 VanDerWaalsContact O-N 3.16Å
426	F	93.9	Very high	91.5	Very high	46 Å²	46	65.6 Å²	65.6	20%	0.202	31%	0.314	C	S	.	.			trans	-64.5	110.7	172.9	177.9	-106	0	0	0	110.5	V422 K429 E434 V435 L438	V422-F426 PolarHBondContact O-N 3.46Å; F426-K429 HydrophobicContact CE1-CG 3.98Å; F426-K429 HydrophobicContact CZ-CB 4.44Å; F426-K429 HydrophobicContact CZ-CG 3.98Å; F426-E434 HydrophobicContact CD2-CB 3.84Å; F426-E434 HydrophobicContact CE2-CB 3.98Å; F426-V435 HydrophobicContact CE2-CG2 3.91Å; F426-V435 HydrophobicContact CZ-CG2 4.13Å; F426-L438 HydrophobicContact CB-CD1 4.47Å; F426-L438 HydrophobicContact CD1-CD2 3.82Å; F426-L438 HydrophobicContact CD2-CB 4.22Å; F426-L438 HydrophobicContact CD2-CD2 4.1Å; F426-L438 HydrophobicContact CE1-CD2 3.96Å; F426-L438 HydrophobicContact CE2-CD2 4.27Å; F426-L438 HydrophobicContact CG-CD2 3.88Å; F426-L438 HydrophobicContact CZ-CD2 4.18Å
427	K	89.1	Confident	91.5	Very high	151 Å²	151	64 Å²	64	66%	0.657	30%	0.304	S	S	*	.			trans	-121.3	-30.2	-177.3	-69.5	175.6	-177	174.6	0	112.1	L425 E434	L425-K427 PolarHBondContact O-N 3.34Å; L425-K427 VanDerWaalsContact O-N 3.16Å; K427-E434 PolarHBondContact N-OE2 3.01Å; K427-E434 VanDerWaalsContact N-OE2 3.12Å
428	R	83	Confident	91.5	Very high	82 Å²	82	61.1 Å²	61.1	31%	0.309	29%	0.286	S	S	.	.			trans	-112.4	95	-167.3	-59.4	177.7	-178.1	157.6	-4.1	111.6	N430 N431 E434	R428-N430 PolarHBondContact O-N 3.43Å; R428-N430 VanDerWaalsContact O-N 3.15Å; R428-N431 HydrophobicContact CB-CB 3.77Å; R428-N431 WeakPolarHBondContact O-CB 3.5Å; R428-N431 PolarHBondContact O-N 3.45Å; R428-E434 WeakPolarHBondContact CD-OE1 3.46Å; R428-E434 PolarHBondContact N-OE2 2.71Å
429	K	83.2	Confident	91.3	Very high	171 Å²	171	64.9 Å²	64.9	74%	0.743	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.1	179.2	-63.8	-175.2	-179.6	-177.9	0	114.7	F426 V435	F426-K429 HydrophobicContact CE1-CG 3.98Å; F426-K429 HydrophobicContact CZ-CB 4.44Å; F426-K429 HydrophobicContact CZ-CG 3.98Å; K429-V435 WeakPolarHBondContact O-CG2 3.34Å
430	N	80.4	Confident	91	Very high	165 Å²	165	65.9 Å²	65.9	88%	0.882	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-2.9	179.4	-60.8	-11.9	0	0	0	112.9	R428	R428-N430 PolarHBondContact O-N 3.43Å; R428-N430 VanDerWaalsContact O-N 3.15Å
431	N	85.2	Confident	91	Very high	41 Å²	41	60.9 Å²	60.9	22%	0.219	28%	0.283	C	S	.	.			trans	-90.7	108.9	178.1	-175.2	-29.7	0	0	0	110	R428 I433 E434 V435	R428-N431 HydrophobicContact CB-CB 3.77Å; R428-N431 WeakPolarHBondContact O-CB 3.5Å; R428-N431 PolarHBondContact O-N 3.45Å; N431-I433 VanDerWaalsContact C-N 3.25Å; N431-I433 PolarHBondContact O-N 3.17Å; N431-I433 WeakPolarHBondContact OD1-CB 3.4Å; N431-I433 PolarHBondContact OD1-N 3.05Å; N431-E434 HydrophobicContact CB-CB 4.17Å; N431-E434 HydrophobicContact CB-CG 4.14Å; N431-E434 PolarHBondContact O-N 3.42Å; N431-E434 VanDerWaalsContact O-N 3.16Å; N431-E434 PolarHBondContact OD1-N 2.72Å; N431-V435 WeakPolarHBondContact O-CG2 3.41Å; N431-V435 PolarHBondContact O-N 3.36Å
432	Q	87.4	Confident	90.8	Very high	76 Å²	76	63.5 Å²	63.5	36%	0.355	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-34.2	-177.5	-66.3	-171.5	19.2	0	0	113.4	F436 F570	Q432-F436 VanDerWaalsContact O-CB 3.22Å; Q432-F436 WeakPolarHBondContact O-CB 3.4Å; Q432-F436 PolarHBondContact O-N 3.34Å; Q432-F570 VanDerWaalsContact OE1-N 3.17Å
433	I	91.3	Very high	90.4	Very high	52 Å²	52	68.5 Å²	68.5	27%	0.267	32%	0.316	S	S	.	.	H	α-helix	trans	-68.8	-43	179.6	-62.2	173.9	0	0	0	110.3	Y397 N431 F436 S437 F570	Y397-I433 HydrophobicContact CD1-CG2 4.14Å; Y397-I433 HydrophobicContact CD2-CG2 3.35Å; Y397-I433 HydrophobicContact CE2-CG2 3.89Å; Y397-I433 HydrophobicContact CG-CG2 3.49Å; Y397-I433 VanDerWaalsContact CG-CG2 3.49Å; N431-I433 VanDerWaalsContact C-N 3.25Å; N431-I433 PolarHBondContact O-N 3.17Å; N431-I433 WeakPolarHBondContact OD1-CB 3.4Å; N431-I433 PolarHBondContact OD1-N 3.05Å; I433-F436 PolarHBondContact O-N 2.88Å; I433-S437 WeakPolarHBondContact O-CB 3.44Å; I433-S437 PolarHBondContact O-N 3.32Å; I433-S437 PolarHBondContact O-OG 3.21Å; I433-F570 HydrophobicContact CG1-CE1 4.18Å
434	E	92.9	Very high	90.2	Very high	8 Å²	8	64.5 Å²	64.5	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-41.4	177.5	-69.2	-169.7	-148.9	0	0	111.5	C396 F426 K427 R428 N431 S437 L438	C396-E434 HydrophobicContact CB-CG 3.96Å; F426-E434 HydrophobicContact CD2-CB 3.84Å; F426-E434 HydrophobicContact CE2-CB 3.98Å; K427-E434 PolarHBondContact N-OE2 3.01Å; K427-E434 VanDerWaalsContact N-OE2 3.12Å; R428-E434 WeakPolarHBondContact CD-OE1 3.46Å; R428-E434 PolarHBondContact N-OE2 2.71Å; N431-E434 HydrophobicContact CB-CB 4.17Å; N431-E434 HydrophobicContact CB-CG 4.14Å; N431-E434 PolarHBondContact O-N 3.42Å; N431-E434 VanDerWaalsContact O-N 3.16Å; N431-E434 PolarHBondContact OD1-N 2.72Å; E434-S437 PolarHBondContact O-N 3.2Å; E434-L438 WeakPolarHBondContact O-CB 3.37Å; E434-L438 PolarHBondContact O-N 3.4Å
435	V	91.8	Very high	89.4	Confident	33 Å²	33	61 Å²	61	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-46.2	176.2	172.5	0	0	0	0	110.9	F426 K429 N431 L438 K439	F426-V435 HydrophobicContact CE2-CG2 3.91Å; F426-V435 HydrophobicContact CZ-CG2 4.13Å; K429-V435 WeakPolarHBondContact O-CG2 3.34Å; N431-V435 WeakPolarHBondContact O-CG2 3.41Å; N431-V435 PolarHBondContact O-N 3.36Å; V435-L438 PolarHBondContact O-N 3.07Å; V435-K439 HydrophobicContact CG1-CD 4.18Å; V435-K439 WeakPolarHBondContact O-CG 3.42Å; V435-K439 PolarHBondContact O-N 3.24Å
436	F	92.5	Very high	88	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.5	-48.2	174.9	172.1	-96.6	0	0	0	111.6	Y400 Q432 I433 L438 K439 R440 E460 L464 W465 Y531 D569 F570	Y400-F436 AromaticContact CE1-CE1 3.99Å; Y400-F436 HydrophobicContact CE1-CE1 3.99Å; Q432-F436 VanDerWaalsContact O-CB 3.22Å; Q432-F436 WeakPolarHBondContact O-CB 3.4Å; Q432-F436 PolarHBondContact O-N 3.34Å; I433-F436 PolarHBondContact O-N 2.88Å; F436-L438 VanDerWaalsContact C-N 3.34Å; F436-L438 PolarHBondContact O-N 2.88Å; F436-K439 PolarHBondContact O-N 2.92Å; F436-R440 HydrophobicContact CD1-CG 4.42Å; F436-R440 HydrophobicContact CD2-CG 4.21Å; F436-R440 HydrophobicContact CE1-CG 4.06Å; F436-R440 HydrophobicContact CE2-CG 3.83Å; F436-R440 HydrophobicContact CG-CG 4.5Å; F436-R440 HydrophobicContact CZ-CG 3.75Å; F436-R440 WeakPolarHBondContact O-CB 3.44Å; F436-R440 WeakPolarHBondContact O-CG 3.48Å; F436-R440 PolarHBondContact O-N 3.2Å; F436-E460 WeakPolarHBondContact CE2-OE1 3.37Å; F436-E460 HydrophobicContact CZ-CG 4.42Å; F436-E460 WeakPolarHBondContact CZ-OE1 3.16Å; F436-L464 HydrophobicContact CE1-CD1 4.31Å; F436-L464 HydrophobicContact CE2-CD1 3.95Å; F436-L464 HydrophobicContact CZ-CD1 3.63Å; F436-W465 HydrophobicContact CE1-CH2 4.41Å; F436-Y531 HydrophobicContact CE2-CE1 4.4Å; F436-D569 HydrophobicContact CD2-CB 4.44Å; F436-F570 HydrophobicContact CB-CE2 4.23Å; F436-F570 HydrophobicContact CB-CZ 4.04Å; F436-F570 HydrophobicContact CD1-CE2 4.25Å; F436-F570 HydrophobicContact CD1-CZ 4.08Å; F436-F570 AromaticContact CD2-CE2 3.6Å; F436-F570 HydrophobicContact CD2-CE2 3.6Å; F436-F570 HydrophobicContact CD2-CZ 4.17Å; F436-F570 AromaticContact CE2-CE2 3.94Å; F436-F570 HydrophobicContact CE2-CE2 3.94Å; F436-F570 AromaticContact CG-CE2 3.76Å; F436-F570 HydrophobicContact CG-CE2 3.76Å; F436-F570 AromaticContact CG-CZ 3.83Å; F436-F570 HydrophobicContact CG-CZ 3.83Å; F436-F570 HydrophobicContact CZ-CE2 4.41Å
437	S	95.4	Very high	86.6	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.5	-45	179.7	-57.5	0	0	0	0	111.9	Y397 I433 E434 A441	Y397-S437 WeakPolarHBondContact CD2-OG 3.49Å; I433-S437 WeakPolarHBondContact O-CB 3.44Å; I433-S437 PolarHBondContact O-N 3.32Å; I433-S437 PolarHBondContact O-OG 3.21Å; E434-S437 PolarHBondContact O-N 3.2Å; S437-A441 VanDerWaalsContact O-CB 3.23Å; S437-A441 WeakPolarHBondContact O-CB 3.09Å; S437-A441 PolarHBondContact O-N 3.42Å
438	L	94.4	Very high	86.2	Confident	24 Å²	24	63.1 Å²	63.1	13%	0.126	33%	0.33	C	S	.	.	H	α-helix	trans	-62.4	-53.5	178	-180	68	0	0	0	111.4	Q423 F426 E434 V435 F436 R440 A441 E442	Q423-L438 HydrophobicContact CB-CD1 3.97Å; Q423-L438 HydrophobicContact CG-CD1 4.14Å; F426-L438 HydrophobicContact CB-CD1 4.47Å; F426-L438 HydrophobicContact CD1-CD2 3.82Å; F426-L438 HydrophobicContact CD2-CB 4.22Å; F426-L438 HydrophobicContact CD2-CD2 4.1Å; F426-L438 HydrophobicContact CE1-CD2 3.96Å; F426-L438 HydrophobicContact CE2-CD2 4.27Å; F426-L438 HydrophobicContact CG-CD2 3.88Å; F426-L438 HydrophobicContact CZ-CD2 4.18Å; E434-L438 WeakPolarHBondContact O-CB 3.37Å; E434-L438 PolarHBondContact O-N 3.4Å; V435-L438 PolarHBondContact O-N 3.07Å; F436-L438 VanDerWaalsContact C-N 3.34Å; F436-L438 PolarHBondContact O-N 2.88Å; L438-R440 VanDerWaalsContact C-N 3.27Å; L438-R440 PolarHBondContact O-N 3.36Å; L438-A441 PolarHBondContact O-N 2.88Å; L438-E442 HydrophobicContact CD1-CG 4.42Å; L438-E442 WeakPolarHBondContact O-CG 3.28Å; L438-E442 PolarHBondContact O-N 3.18Å
439	K	91.6	Very high	86.6	Confident	88 Å²	88	60.5 Å²	60.5	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-56	-42.5	-180	-71.7	173.3	-178.5	172	0	111.6	V435 F436 K443 D569	V435-K439 HydrophobicContact CG1-CD 4.18Å; V435-K439 WeakPolarHBondContact O-CG 3.42Å; V435-K439 PolarHBondContact O-N 3.24Å; F436-K439 PolarHBondContact O-N 2.92Å; K439-K443 WeakPolarHBondContact O-CG 3.4Å; K439-K443 PolarHBondContact O-N 2.95Å; K439-D569 IonicContact NZ-OD1 3.28Å; K439-D569 PolarHBondContact NZ-OD1 3.41Å; K439-D569 IonicContact NZ-OD2 3.75Å; K439-D569 PolarHBondContact NZ-OD2 2.86Å
440	R	91.8	Very high	87.1	Confident	22 Å²	22	53.9 Å²	53.9	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-69.4	-45.5	179	-70.9	-67.6	-177.4	-150.9	-1.9	112.2	Y400 F436 L438 E442 K443 L444 E460 N529	Y400-R440 HydrophobicContact CD2-CB 4.46Å; Y400-R440 HydrophobicContact CE1-CB 4.48Å; Y400-R440 HydrophobicContact CE2-CB 3.55Å; Y400-R440 WeakPolarHBondContact OH-CB 3.3Å; F436-R440 HydrophobicContact CD1-CG 4.42Å; F436-R440 HydrophobicContact CD2-CG 4.21Å; F436-R440 HydrophobicContact CE1-CG 4.06Å; F436-R440 HydrophobicContact CE2-CG 3.83Å; F436-R440 HydrophobicContact CG-CG 4.5Å; F436-R440 HydrophobicContact CZ-CG 3.75Å; F436-R440 WeakPolarHBondContact O-CB 3.44Å; F436-R440 WeakPolarHBondContact O-CG 3.48Å; F436-R440 PolarHBondContact O-N 3.2Å; L438-R440 VanDerWaalsContact C-N 3.27Å; L438-R440 PolarHBondContact O-N 3.36Å; R440-E442 VanDerWaalsContact C-N 3.25Å; R440-E442 PolarHBondContact O-N 2.77Å; R440-K443 PolarHBondContact O-N 2.99Å; R440-L444 WeakPolarHBondContact O-CG 3.18Å; R440-L444 PolarHBondContact O-N 2.87Å; R440-E460 IonicContact CZ-OE1 3.16Å; R440-E460 IonicContact CZ-OE2 2.63Å; R440-E460 IonicContact NE-OE1 3.71Å; R440-E460 PolarHBondContact NE-OE1 3.09Å; R440-E460 IonicContact NE-OE2 3.63Å; R440-E460 PolarHBondContact NE-OE2 3.43Å; R440-E460 IonicContact NH2-OE1 3.68Å; R440-E460 PolarHBondContact NH2-OE1 2.57Å; R440-E460 IonicContact NH2-OE2 3.61Å; R440-N529 VanDerWaalsContact CZ-OD1 3.27Å; R440-N529 PolarHBondContact NH1-OD1 3.4Å; R440-N529 PolarHBondContact NH2-OD1 3.09Å
441	A	94.4	Very high	87.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-32.7	176.3	0	0	0	0	0	112.8	Y400 F419 V422 S437 L438 R445	Y400-A441 HydrophobicContact CD2-CB 4.25Å; F419-A441 HydrophobicContact CB-CB 4.13Å; F419-A441 HydrophobicContact CD1-CB 3.83Å; F419-A441 HydrophobicContact CG-CB 4.23Å; V422-A441 HydrophobicContact CB-CB 3.94Å; V422-A441 HydrophobicContact CG1-CB 3.84Å; V422-A441 HydrophobicContact CG2-CB 4.04Å; S437-A441 VanDerWaalsContact O-CB 3.23Å; S437-A441 WeakPolarHBondContact O-CB 3.09Å; S437-A441 PolarHBondContact O-N 3.42Å; L438-A441 PolarHBondContact O-N 2.88Å; A441-R445 PolarHBondContact O-N 3.18Å
442	E	91.4	Very high	88.4	Confident	89 Å²	89	52.1 Å²	52.1	42%	0.416	28%	0.28	S	S	.	.	H	α-helix	trans	-69.3	-40.4	174.3	-74.9	176.7	167.9	0	0	112.4	L438 R440 L444 R445	L438-E442 HydrophobicContact CD1-CG 4.42Å; L438-E442 WeakPolarHBondContact O-CG 3.28Å; L438-E442 PolarHBondContact O-N 3.18Å; R440-E442 VanDerWaalsContact C-N 3.25Å; R440-E442 PolarHBondContact O-N 2.77Å; E442-L444 VanDerWaalsContact C-N 3.34Å; E442-R445 WeakPolarHBondContact O-CB 3.39Å; E442-R445 PolarHBondContact O-N 3.15Å; E442-R445 VanDerWaalsContact O-N 3.17Å
443	K	87.1	Confident	88.8	Confident	105 Å²	105	49.6 Å²	49.6	46%	0.457	27%	0.269	S	S	.	.	H	α-helix	trans	-67.5	-33.7	175.5	-72.5	-177.2	-178.5	-174.4	0	113.4	K439 R440 R445 C528	K439-K443 WeakPolarHBondContact O-CG 3.4Å; K439-K443 PolarHBondContact O-N 2.95Å; R440-K443 PolarHBondContact O-N 2.99Å; K443-R445 PolarHBondContact O-N 3.27Å; K443-C528 PolarHBondContact NZ-O 2.83Å
444	L	88.2	Confident	89.1	Confident	15 Å²	15	47.1 Å²	47.1	8%	0.079	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	5.2	175.4	-67.5	172.8	0	0	0	112.4	Y400 V404 F419 R440 E442 L449 L453	Y400-L444 HydrophobicContact CE2-CD1 4.25Å; V404-L444 HydrophobicContact CG1-CD1 3.99Å; F419-L444 HydrophobicContact CD2-CB 4.13Å; F419-L444 HydrophobicContact CE1-CD1 4.15Å; F419-L444 HydrophobicContact CE2-CB 3.74Å; F419-L444 HydrophobicContact CE2-CD1 4.18Å; F419-L444 HydrophobicContact CZ-CB 4.09Å; F419-L444 HydrophobicContact CZ-CD1 3.67Å; R440-L444 WeakPolarHBondContact O-CG 3.18Å; R440-L444 PolarHBondContact O-N 2.87Å; E442-L444 VanDerWaalsContact C-N 3.34Å; L444-L449 HydrophobicContact CB-CD1 3.97Å; L444-L449 HydrophobicContact CD2-CD1 3.91Å; L444-L449 HydrophobicContact CG-CD1 4.47Å; L444-L449 WeakPolarHBondContact O-CD1 3.28Å; L444-L453 HydrophobicContact CD2-CB 4.13Å
445	R	77.9	Confident	89.3	Confident	76 Å²	76	47.2 Å²	47.2	29%	0.287	26%	0.257	S	S	.	.	S	Bend	trans	-87.3	131	176.9	-158.6	173.3	-70.8	175.1	-4.8	109.8	F419 Q423 A441 E442 K443	F419-R445 PolarHBondContact O-NH2 3.21Å; F419-R445 VanDerWaalsContact O-NH2 3.11Å; Q423-R445 VanDerWaalsContact OE1-NH2 3.15Å; A441-R445 PolarHBondContact O-N 3.18Å; E442-R445 WeakPolarHBondContact O-CB 3.39Å; E442-R445 PolarHBondContact O-N 3.15Å; E442-R445 VanDerWaalsContact O-N 3.17Å; K443-R445 PolarHBondContact O-N 3.27Å
446	S	64.6	Low	89.6	Confident	87 Å²	87	45.9 Å²	45.9	61%	0.608	25%	0.249	S	C	*	.	S	Bend	trans	-35.9	144.5	179.2	-176.8	0	0	0	0	115.8
447	P	64.5	Low	89.9	Confident	133 Å²	133	46.1 Å²	46.1	86%	0.864	25%	0.251	S	S	*	.	S	Bend	cis	-92.5	137	6	33.4	-30.6	0	0	0	113.3
448	G	80.4	Confident	90	Very high	59 Å²	59	46.1 Å²	46.1	61%	0.608	25%	0.251	S	S	*	.	S	Bend	trans	130.4	-1.2	173.7	0	0	0	0	0	116.3	S450 L453	G448-S450 PolarHBondContact O-N 3.46Å; G448-L453 VanDerWaalsContact O-CD1 3.29Å; G448-L453 WeakPolarHBondContact O-CD1 3.3Å
449	L	91.9	Very high	90.2	Very high	26 Å²	26	45 Å²	45	14%	0.136	25%	0.245	C	C	.	.			trans	-60.5	128.2	175.8	-175.2	63	0	0	0	110.8	L412 A415 V416 F419 L444 C454	L412-L449 HydrophobicContact CB-CD2 4.3Å; L412-L449 HydrophobicContact CD2-CD2 4.47Å; L412-L449 HydrophobicContact CD2-CG 4.34Å; A415-L449 HydrophobicContact CB-CD2 4.28Å; V416-L449 HydrophobicContact CG2-CD2 3.6Å; F419-L449 HydrophobicContact CE2-CD1 4.16Å; F419-L449 HydrophobicContact CE2-CD2 4.09Å; L444-L449 HydrophobicContact CB-CD1 3.97Å; L444-L449 HydrophobicContact CD2-CD1 3.91Å; L444-L449 HydrophobicContact CG-CD1 4.47Å; L444-L449 WeakPolarHBondContact O-CD1 3.28Å; L449-C454 VanDerWaalsContact CD1-SG 3.54Å
450	S	94.4	Very high	90.5	Very high	32 Å²	32	40.9 Å²	40.9	22%	0.224	23%	0.227	C	C	.	.			trans	-131.3	166.5	172.6	81.7	0	0	0	0	111.4	G448 E452 L453 C454	G448-S450 PolarHBondContact O-N 3.46Å; S450-E452 VanDerWaalsContact C-N 3.29Å; S450-E452 WeakPolarHBondContact CB-OE2 3.44Å; S450-E452 PolarHBondContact O-N 2.96Å; S450-E452 PolarHBondContact OG-N 3.13Å; S450-E452 PolarHBondContact OG-OE2 3.3Å; S450-L453 PolarHBondContact O-N 3.29Å; S450-L453 PolarHBondContact OG-N 3.15Å; S450-L453 VanDerWaalsContact OG-N 3.12Å; S450-C454 PolarHBondContact O-N 3.46Å; S450-C454 PolarHBondContact O-SG 3.24Å
451	K	96.1	Very high	90.8	Very high	88 Å²	88	39.8 Å²	39.8	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-61.5	-41.7	174.1	178.8	177.9	175.1	172.5	0	110.8	A408 L453 C454 I455	A408-K451 WeakPolarHBondContact O-CE 3.31Å; K451-L453 PolarHBondContact O-N 3.02Å; K451-C454 WeakPolarHBondContact O-CB 3.48Å; K451-C454 PolarHBondContact O-N 3.28Å; K451-I455 HydrophobicContact CG-CD1 4.01Å; K451-I455 WeakPolarHBondContact O-CG1 3.31Å; K451-I455 PolarHBondContact O-N 3.46Å
452	E	96.6	Very high	90.9	Very high	81 Å²	81	39.8 Å²	39.8	38%	0.379	22%	0.223	S	C	.	.	H	α-helix	trans	-65.6	-39.1	-178.5	-62.4	66.6	-144.6	0	0	111.2	S450 I455 L456 V482 I486	S450-E452 VanDerWaalsContact C-N 3.29Å; S450-E452 WeakPolarHBondContact CB-OE2 3.44Å; S450-E452 PolarHBondContact O-N 2.96Å; S450-E452 PolarHBondContact OG-N 3.13Å; S450-E452 PolarHBondContact OG-OE2 3.3Å; E452-I455 PolarHBondContact O-N 2.95Å; E452-L456 WeakPolarHBondContact O-CB 3.47Å; E452-L456 PolarHBondContact O-N 2.8Å; E452-V482 HydrophobicContact CB-CG1 4.13Å; E452-V482 HydrophobicContact CG-CG1 4.22Å; E452-I486 HydrophobicContact CB-CD1 4.11Å; E452-I486 HydrophobicContact CB-CG1 3.79Å
453	L	95.5	Very high	91.2	Very high	23 Å²	23	36 Å²	36	12%	0.12	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-38	174.1	-70.6	179.5	0	0	0	112.1	L444 G448 S450 K451 L456 S457 I486	L444-L453 HydrophobicContact CD2-CB 4.13Å; G448-L453 VanDerWaalsContact O-CD1 3.29Å; G448-L453 WeakPolarHBondContact O-CD1 3.3Å; S450-L453 PolarHBondContact O-N 3.29Å; S450-L453 PolarHBondContact OG-N 3.15Å; S450-L453 VanDerWaalsContact OG-N 3.12Å; K451-L453 PolarHBondContact O-N 3.02Å; L453-L456 WeakPolarHBondContact O-CB 2.94Å; L453-L456 PolarHBondContact O-N 3.46Å; L453-S457 PolarHBondContact O-N 3.47Å; L453-S457 PolarHBondContact O-OG 2.78Å; L453-I486 HydrophobicContact CD2-CG2 4.22Å
454	C	97.4	Very high	91.4	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-42.1	173.5	-64.7	0	0	0	0	111.6	V404 A408 L449 S450 K451 S457 V458	V404-C454 WeakPolarHBondContact O-CB 3.44Å; A408-C454 HydrophobicContact CB-CB 4.13Å; L449-C454 VanDerWaalsContact CD1-SG 3.54Å; S450-C454 PolarHBondContact O-N 3.46Å; S450-C454 PolarHBondContact O-SG 3.24Å; K451-C454 WeakPolarHBondContact O-CB 3.48Å; K451-C454 PolarHBondContact O-N 3.28Å; C454-S457 WeakPolarHBondContact O-CB 3.16Å; C454-S457 PolarHBondContact O-N 3.09Å; C454-V458 WeakPolarHBondContact O-CG2 3.43Å; C454-V458 PolarHBondContact O-N 3.27Å
455	I	98.4	Very high	91.5	Very high	10 Å²	10	32.1 Å²	32.1	5%	0.051	19%	0.186	C	C	.	.	H	α-helix	trans	-63.2	-42.8	174.6	-67.2	167.8	0	0	0	110.6	Y377 A408 K451 E452 S457 V458 I459 V482	Y377-I455 HydrophobicContact CE2-CD1 4.17Å; Y377-I455 HydrophobicContact CE2-CG1 3.89Å; Y377-I455 WeakPolarHBondContact OH-CG2 3.27Å; A408-I455 HydrophobicContact CB-CG1 3.75Å; K451-I455 HydrophobicContact CG-CD1 4.01Å; K451-I455 WeakPolarHBondContact O-CG1 3.31Å; K451-I455 PolarHBondContact O-N 3.46Å; E452-I455 PolarHBondContact O-N 2.95Å; I455-S457 VanDerWaalsContact C-N 3.28Å; I455-S457 PolarHBondContact O-N 3.19Å; I455-V458 WeakPolarHBondContact O-CB 3.44Å; I455-V458 PolarHBondContact O-N 2.96Å; I455-V458 VanDerWaalsContact O-N 3.1Å; I455-I459 HydrophobicContact CG2-CD1 3.8Å; I455-I459 HydrophobicContact CG2-CG1 4.32Å; I455-I459 VanDerWaalsContact O-CG1 3.29Å; I455-I459 WeakPolarHBondContact O-CG1 3.19Å; I455-I459 PolarHBondContact O-N 3.23Å; I455-V482 HydrophobicContact CB-CG1 3.99Å; I455-V482 HydrophobicContact CD1-CG1 4.17Å; I455-V482 HydrophobicContact CD1-CG2 4.38Å; I455-V482 HydrophobicContact CG2-CB 4.22Å; I455-V482 HydrophobicContact CG2-CG1 3.7Å; I455-V482 HydrophobicContact CG2-CG2 4.38Å
456	L	97.7	Very high	92.2	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-56.3	-43.6	173.7	178	154.3	0	0	0	111	E452 L453 I459 E460 L483 I486 C491 L494 L498	E452-L456 WeakPolarHBondContact O-CB 3.47Å; E452-L456 PolarHBondContact O-N 2.8Å; L453-L456 WeakPolarHBondContact O-CB 2.94Å; L453-L456 PolarHBondContact O-N 3.46Å; L456-I459 PolarHBondContact O-N 2.88Å; L456-E460 WeakPolarHBondContact O-CB 3.47Å; L456-E460 PolarHBondContact O-N 3.43Å; L456-L483 HydrophobicContact CB-CD2 4.09Å; L456-L483 HydrophobicContact CD1-CD2 3.97Å; L456-L483 HydrophobicContact CG-CD2 3.95Å; L456-I486 HydrophobicContact CB-CD1 3.79Å; L456-I486 HydrophobicContact CD1-CD1 3.6Å; L456-I486 HydrophobicContact CG-CD1 4.33Å; L456-C491 HydrophobicContact CD1-CB 4.25Å; L456-L494 HydrophobicContact CD2-CD2 3.68Å; L456-L494 HydrophobicContact CD2-CG 4.26Å; L456-L498 HydrophobicContact CG-CD1 4.26Å
457	S	97.6	Very high	93.5	Very high	5 Å²	5	28.5 Å²	28.5	4%	0.035	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-38.1	175.2	-61.3	0	0	0	0	113	L453 C454 I455 E460 I461	L453-S457 PolarHBondContact O-N 3.47Å; L453-S457 PolarHBondContact O-OG 2.78Å; C454-S457 WeakPolarHBondContact O-CB 3.16Å; C454-S457 PolarHBondContact O-N 3.09Å; I455-S457 VanDerWaalsContact C-N 3.28Å; I455-S457 PolarHBondContact O-N 3.19Å; S457-E460 WeakPolarHBondContact O-CB 3.31Å; S457-E460 PolarHBondContact O-N 2.97Å; S457-I461 VanDerWaalsContact O-CD1 3.3Å; S457-I461 WeakPolarHBondContact O-CD1 3.41Å; S457-I461 VanDerWaalsContact O-CG1 3.28Å; S457-I461 WeakPolarHBondContact O-CG1 3.49Å; S457-I461 PolarHBondContact O-N 3.33Å
458	V	98.7	Very high	95	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-44.3	172.4	174.2	0	0	0	0	110.8	M372 Y377 V404 C454 I455 E460 I461 L462	M372-V458 HydrophobicContact CB-CG1 4.1Å; M372-V458 HydrophobicContact CG-CG1 4.08Å; M372-V458 HydrophobicContact SD-CG1 3.9Å; Y377-V458 HydrophobicContact CD1-CG2 4.48Å; Y377-V458 HydrophobicContact CE1-CB 4.34Å; Y377-V458 HydrophobicContact CE1-CG1 3.91Å; Y377-V458 HydrophobicContact CE1-CG2 4.33Å; V404-V458 HydrophobicContact CB-CG2 4.25Å; V404-V458 HydrophobicContact CG2-CG2 3.93Å; C454-V458 WeakPolarHBondContact O-CG2 3.43Å; C454-V458 PolarHBondContact O-N 3.27Å; I455-V458 WeakPolarHBondContact O-CB 3.44Å; I455-V458 PolarHBondContact O-N 2.96Å; I455-V458 VanDerWaalsContact O-N 3.1Å; V458-E460 VanDerWaalsContact C-N 3.33Å; V458-E460 PolarHBondContact O-N 2.89Å; V458-I461 WeakPolarHBondContact O-CB 3.34Å; V458-I461 PolarHBondContact O-N 3.46Å; V458-L462 HydrophobicContact CG1-CD1 4.3Å; V458-L462 HydrophobicContact CG1-CG 4.47Å; V458-L462 WeakPolarHBondContact O-CG 3.27Å; V458-L462 PolarHBondContact O-N 2.88Å
459	I	98.7	Very high	95.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.7	-38.9	177.5	-60.8	163	0	0	0	110.9	I455 L456 I461 L462 Y463 L468 M479 L483 L498 I502	I455-I459 HydrophobicContact CG2-CD1 3.8Å; I455-I459 HydrophobicContact CG2-CG1 4.32Å; I455-I459 VanDerWaalsContact O-CG1 3.29Å; I455-I459 WeakPolarHBondContact O-CG1 3.19Å; I455-I459 PolarHBondContact O-N 3.23Å; L456-I459 PolarHBondContact O-N 2.88Å; I459-I461 VanDerWaalsContact C-N 3.33Å; I459-I461 PolarHBondContact O-N 2.89Å; I459-L462 PolarHBondContact O-N 3.49Å; I459-Y463 WeakPolarHBondContact O-CB 3.39Å; I459-Y463 PolarHBondContact O-N 3.21Å; I459-L468 HydrophobicContact CG2-CD2 4.26Å; I459-M479 HydrophobicContact CD1-CB 3.69Å; I459-M479 HydrophobicContact CD1-CG 3.86Å; I459-M479 HydrophobicContact CG1-CB 4.19Å; I459-M479 HydrophobicContact CG1-CG 3.88Å; I459-M479 HydrophobicContact CG1-SD 4.05Å; I459-L483 HydrophobicContact CD1-CD1 4.2Å; I459-L483 HydrophobicContact CD1-CD2 3.97Å; I459-L483 HydrophobicContact CD1-CG 3.89Å; I459-L483 HydrophobicContact CG2-CD1 4.42Å; I459-L498 HydrophobicContact CB-CD1 4.22Å; I459-L498 HydrophobicContact CG2-CB 4.14Å; I459-L498 HydrophobicContact CG2-CD1 3.95Å; I459-L498 HydrophobicContact CG2-CD2 4.26Å; I459-L498 HydrophobicContact CG2-CG 4.32Å; I459-I502 HydrophobicContact CG2-CD1 4.06Å
460	E	97.8	Very high	95.7	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-57.5	-45.3	173	-177.4	-174.4	-172.7	0	0	111.3	F436 R440 L456 S457 V458 Y463 L464 L494 L498 Y531	F436-E460 WeakPolarHBondContact CE2-OE1 3.37Å; F436-E460 HydrophobicContact CZ-CG 4.42Å; F436-E460 WeakPolarHBondContact CZ-OE1 3.16Å; R440-E460 IonicContact CZ-OE1 3.16Å; R440-E460 IonicContact CZ-OE2 2.63Å; R440-E460 IonicContact NE-OE1 3.71Å; R440-E460 PolarHBondContact NE-OE1 3.09Å; R440-E460 IonicContact NE-OE2 3.63Å; R440-E460 PolarHBondContact NE-OE2 3.43Å; R440-E460 IonicContact NH2-OE1 3.68Å; R440-E460 PolarHBondContact NH2-OE1 2.57Å; R440-E460 IonicContact NH2-OE2 3.61Å; L456-E460 WeakPolarHBondContact O-CB 3.47Å; L456-E460 PolarHBondContact O-N 3.43Å; S457-E460 WeakPolarHBondContact O-CB 3.31Å; S457-E460 PolarHBondContact O-N 2.97Å; V458-E460 VanDerWaalsContact C-N 3.33Å; V458-E460 PolarHBondContact O-N 2.89Å; E460-Y463 PolarHBondContact O-N 3.26Å; E460-L464 HydrophobicContact CG-CD1 3.92Å; E460-L464 HydrophobicContact CG-CG 4.45Å; E460-L464 WeakPolarHBondContact O-CB 3.37Å; E460-L464 WeakPolarHBondContact O-CG 3.3Å; E460-L464 PolarHBondContact O-N 3.48Å; E460-L494 HydrophobicContact CG-CD1 4.14Å; E460-L494 HydrophobicContact CG-CD2 4.29Å; E460-L498 HydrophobicContact CB-CD1 4.28Å; E460-Y531 VanDerWaalsContact CG-OH 3.3Å; E460-Y531 WeakPolarHBondContact CG-OH 3.37Å; E460-Y531 PolarHBondContact OE1-OH 3.2Å
461	I	97.4	Very high	95.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.1	-43.1	175.4	-66.3	154.1	0	0	0	110.9	W369 M372 Y400 L401 V404 S457 V458 I459 Y463 W465	W369-I461 HydrophobicContact CH2-CG2 3.38Å; W369-I461 HydrophobicContact CZ2-CG2 4.21Å; W369-I461 HydrophobicContact CZ3-CG2 3.81Å; M372-I461 HydrophobicContact CE-CG2 4.22Å; Y400-I461 HydrophobicContact CD1-CD1 4.39Å; Y400-I461 HydrophobicContact CE1-CD1 3.73Å; Y400-I461 HydrophobicContact CE1-CG1 4.15Å; L401-I461 HydrophobicContact CD2-CD1 3.49Å; L401-I461 VanDerWaalsContact CD2-CD1 3.49Å; L401-I461 HydrophobicContact CD2-CG1 4.25Å; L401-I461 HydrophobicContact CD2-CG2 3.99Å; V404-I461 HydrophobicContact CG2-CD1 3.88Å; S457-I461 VanDerWaalsContact O-CD1 3.3Å; S457-I461 WeakPolarHBondContact O-CD1 3.41Å; S457-I461 VanDerWaalsContact O-CG1 3.28Å; S457-I461 WeakPolarHBondContact O-CG1 3.49Å; S457-I461 PolarHBondContact O-N 3.33Å; V458-I461 WeakPolarHBondContact O-CB 3.34Å; V458-I461 PolarHBondContact O-N 3.46Å; I459-I461 VanDerWaalsContact C-N 3.33Å; I459-I461 PolarHBondContact O-N 2.89Å; I461-Y463 VanDerWaalsContact C-N 3.29Å; I461-Y463 PolarHBondContact O-N 3.34Å; I461-W465 HydrophobicContact CB-CE3 4.42Å; I461-W465 HydrophobicContact CB-CZ3 4.33Å; I461-W465 HydrophobicContact CG1-CZ3 4.36Å; I461-W465 HydrophobicContact CG2-CD2 4.48Å; I461-W465 HydrophobicContact CG2-CE3 3.97Å; I461-W465 HydrophobicContact CG2-CZ3 4.13Å; I461-W465 PolarHBondContact O-N 3.3Å; I461-W465 VanDerWaalsContact O-N 3.12Å
462	L	97.8	Very high	95.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-38.2	176.3	-67.2	175.9	0	0	0	111.7	W369 M372 I373 V458 I459 K466 A467 L468 M479	W369-L462 HydrophobicContact CE3-CD2 4.12Å; W369-L462 HydrophobicContact CZ3-CD2 4.11Å; M372-L462 HydrophobicContact CB-CD2 4.11Å; M372-L462 HydrophobicContact CE-CD2 4.49Å; I373-L462 HydrophobicContact CG1-CD2 3.9Å; V458-L462 HydrophobicContact CG1-CD1 4.3Å; V458-L462 HydrophobicContact CG1-CG 4.47Å; V458-L462 WeakPolarHBondContact O-CG 3.27Å; V458-L462 PolarHBondContact O-N 2.88Å; I459-L462 PolarHBondContact O-N 3.49Å; L462-K466 PolarHBondContact O-N 3.38Å; L462-A467 HydrophobicContact CB-CB 4.35Å; L462-A467 HydrophobicContact CD2-CB 3.76Å; L462-A467 PolarHBondContact O-N 3.03Å; L462-L468 HydrophobicContact CB-CD2 3.82Å; L462-L468 HydrophobicContact CB-CG 4.25Å; L462-L468 PolarHBondContact O-N 3.38Å; L462-M479 HydrophobicContact CD1-CE 3.53Å
463	Y	96.2	Very high	95.8	Very high	8 Å²	8	20.4 Å²	20.4	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-56	176.2	169.9	-104.9	0	0	0	112	I459 E460 I461 W465 K466 L468 L497 L498 A501 Y535 E539	I459-Y463 WeakPolarHBondContact O-CB 3.39Å; I459-Y463 PolarHBondContact O-N 3.21Å; E460-Y463 PolarHBondContact O-N 3.26Å; I461-Y463 VanDerWaalsContact C-N 3.29Å; I461-Y463 PolarHBondContact O-N 3.34Å; Y463-W465 PolarHBondContact O-N 3.05Å; Y463-K466 PolarHBondContact O-N 3.14Å; Y463-L468 HydrophobicContact CD2-CD1 4.06Å; Y463-L468 HydrophobicContact CG-CD1 4.49Å; Y463-L497 HydrophobicContact CD1-CD2 4.45Å; Y463-L497 HydrophobicContact CE1-CD1 4.36Å; Y463-L497 HydrophobicContact CE1-CD2 3.79Å; Y463-L497 HydrophobicContact CE1-CG 4.16Å; Y463-L498 VanDerWaalsContact CB-CD2 3.47Å; Y463-L498 HydrophobicContact CD1-CD2 4.02Å; Y463-L498 HydrophobicContact CG-CD2 3.74Å; Y463-A501 HydrophobicContact CD2-CB 3.54Å; Y463-A501 HydrophobicContact CE2-CB 3.69Å; Y463-Y535 AromaticContact CE1-CD1 3.91Å; Y463-Y535 HydrophobicContact CE1-CD1 3.91Å; Y463-Y535 WeakPolarHBondContact OH-CD1 3.31Å; Y463-E539 HydrophobicContact CE2-CG 4.27Å; Y463-E539 WeakPolarHBondContact CE2-OE1 3.36Å; Y463-E539 WeakPolarHBondContact OH-CG 3.21Å; Y463-E539 PolarHBondContact OH-OE1 2.79Å
464	L	92.5	Very high	96	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.3	-35.1	-175.8	-79.9	172	0	0	0	110.8	F436 E460 Y531 Y535 F570 R573	F436-L464 HydrophobicContact CE1-CD1 4.31Å; F436-L464 HydrophobicContact CE2-CD1 3.95Å; F436-L464 HydrophobicContact CZ-CD1 3.63Å; E460-L464 HydrophobicContact CG-CD1 3.92Å; E460-L464 HydrophobicContact CG-CG 4.45Å; E460-L464 WeakPolarHBondContact O-CB 3.37Å; E460-L464 WeakPolarHBondContact O-CG 3.3Å; E460-L464 PolarHBondContact O-N 3.48Å; L464-Y531 HydrophobicContact CD2-CD2 4.2Å; L464-Y531 HydrophobicContact CD2-CE2 3.7Å; L464-Y531 HydrophobicContact CG-CE2 4.45Å; L464-Y535 HydrophobicContact CD2-CE1 4.31Å; L464-F570 HydrophobicContact CD1-CD2 4.26Å; L464-F570 HydrophobicContact CD1-CE2 3.77Å; L464-F570 HydrophobicContact CD2-CD2 3.93Å; L464-F570 HydrophobicContact CD2-CE2 4.28Å; L464-R573 PolarHBondContact O-NH1 3.41Å; L464-R573 PolarHBondContact O-NH2 3.45Å; L464-R573 VanDerWaalsContact O-NH2 3.13Å
465	W	90.6	Very high	96	Very high	39 Å²	39	25 Å²	25	15%	0.148	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	11.3	178.5	-75.1	-112.6	0	0	0	114.7	W369 Y397 F436 I461 Y463 A467 F570	W369-W465 HydrophobicContact CH2-CB 3.42Å; W369-W465 VanDerWaalsContact CH2-CB 3.42Å; W369-W465 AromaticContact CH2-CD1 3.65Å; W369-W465 AromaticContact CH2-CD2 3.72Å; W369-W465 HydrophobicContact CH2-CD2 3.72Å; W369-W465 HydrophobicContact CH2-CE3 4.29Å; W369-W465 AromaticContact CH2-CG 3.32Å; W369-W465 HydrophobicContact CH2-CG 3.32Å; W369-W465 HydrophobicContact CZ2-CB 4.31Å; W369-W465 AromaticContact CZ2-CD1 3.73Å; W369-W465 HydrophobicContact CZ2-CD2 4.29Å; W369-W465 AromaticContact CZ2-CG 3.89Å; W369-W465 HydrophobicContact CZ2-CG 3.89Å; W369-W465 HydrophobicContact CZ3-CB 3.78Å; W369-W465 HydrophobicContact CZ3-CG 4.19Å; Y397-W465 HydrophobicContact CE1-CZ2 4.37Å; Y397-W465 AromaticContact CE2-CH2 3.88Å; Y397-W465 HydrophobicContact CE2-CH2 3.88Å; Y397-W465 AromaticContact CE2-CZ2 3.82Å; Y397-W465 HydrophobicContact CE2-CZ2 3.82Å; Y397-W465 AromaticContact CZ-CH2 3.94Å; Y397-W465 AromaticContact CZ-CZ2 3.51Å; Y397-W465 VanDerWaalsContact OH-CE2 3.32Å; Y397-W465 WeakPolarHBondContact OH-CH2 3.49Å; Y397-W465 WeakPolarHBondContact OH-CZ2 3.42Å; F436-W465 HydrophobicContact CE1-CH2 4.41Å; I461-W465 HydrophobicContact CB-CE3 4.42Å; I461-W465 HydrophobicContact CB-CZ3 4.33Å; I461-W465 HydrophobicContact CG1-CZ3 4.36Å; I461-W465 HydrophobicContact CG2-CD2 4.48Å; I461-W465 HydrophobicContact CG2-CE3 3.97Å; I461-W465 HydrophobicContact CG2-CZ3 4.13Å; I461-W465 PolarHBondContact O-N 3.3Å; I461-W465 VanDerWaalsContact O-N 3.12Å; Y463-W465 PolarHBondContact O-N 3.05Å; W465-A467 PolarHBondContact O-N 3.05Å; W465-F570 HydrophobicContact CH2-CE1 4.49Å; W465-F570 AromaticContact CH2-CZ 3.96Å; W465-F570 HydrophobicContact CH2-CZ 3.96Å
466	K	90.7	Very high	96	Very high	87 Å²	87	24.7 Å²	24.7	38%	0.378	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	33.3	-179.5	-61.5	-175.3	173.3	-178.1	0	114	L462 Y463 P469	L462-K466 PolarHBondContact O-N 3.38Å; Y463-K466 PolarHBondContact O-N 3.14Å; K466-P469 WeakPolarHBondContact O-CD 3.21Å
467	A	93.8	Very high	96	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.171	C	C	.	.			trans	-94.4	-12.1	-179.9	0	0	0	0	0	113.9	W369 I373 L462 W465 P469 N470	W369-A467 HydrophobicContact CE3-CB 4.43Å; W369-A467 HydrophobicContact CZ3-CB 4.33Å; I373-A467 HydrophobicContact CD1-CB 4.39Å; I373-A467 HydrophobicContact CG1-CB 4.47Å; L462-A467 HydrophobicContact CB-CB 4.35Å; L462-A467 HydrophobicContact CD2-CB 3.76Å; L462-A467 PolarHBondContact O-N 3.03Å; W465-A467 PolarHBondContact O-N 3.05Å; A467-P469 VanDerWaalsContact C-CD 3.45Å; A467-P469 VanDerWaalsContact C-N 3.35Å; A467-N470 WeakPolarHBondContact O-CB 3.41Å; A467-N470 PolarHBondContact O-N 3.18Å
468	L	95.2	Very high	96.1	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-54.3	-40.6	175.5	-68.7	178	0	0	0	114.1	I459 L462 Y463 N470 C471 L476 M479 A501 I502	I459-L468 HydrophobicContact CG2-CD2 4.26Å; L462-L468 HydrophobicContact CB-CD2 3.82Å; L462-L468 HydrophobicContact CB-CG 4.25Å; L462-L468 PolarHBondContact O-N 3.38Å; Y463-L468 HydrophobicContact CD2-CD1 4.06Å; Y463-L468 HydrophobicContact CG-CD1 4.49Å; L468-N470 PolarHBondContact O-N 3.05Å; L468-N470 VanDerWaalsContact O-N 3.11Å; L468-C471 VanDerWaalsContact O-CB 3.3Å; L468-C471 WeakPolarHBondContact O-CB 3.44Å; L468-C471 PolarHBondContact O-N 3.4Å; L468-L476 HydrophobicContact CD2-CD2 4.38Å; L468-M479 HydrophobicContact CD2-SD 4Å; L468-A501 HydrophobicContact CD1-CB 3.89Å; L468-I502 HydrophobicContact CD1-CG1 4.2Å; L468-I502 HydrophobicContact CD2-CG1 4.42Å
469	P	92.6	Very high	96.1	Very high	82 Å²	82	33.5 Å²	33.5	53%	0.532	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-62.3	-16.4	176.2	-23.6	35.5	0	0	0	114.8	K466 A467 C471	K466-P469 WeakPolarHBondContact O-CD 3.21Å; A467-P469 VanDerWaalsContact C-CD 3.45Å; A467-P469 VanDerWaalsContact C-N 3.35Å; P469-C471 VanDerWaalsContact C-N 3.32Å
470	N	93.5	Very high	96.1	Very high	24 Å²	24	34.7 Å²	34.7	13%	0.128	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-81.2	-12.3	175	-60.1	122.3	0	0	0	113.1	R334 C337 I339 I373 A467 L468	R334-N470 PolarHBondContact O-ND2 2.7Å; C337-N470 PolarHBondContact SG-ND2 2.53Å; I339-N470 HydrophobicContact CD1-CB 4.12Å; I373-N470 HydrophobicContact CD1-CB 3.88Å; I373-N470 HydrophobicContact CG1-CB 4.47Å; I373-N470 HydrophobicContact CG2-CB 4.24Å; I373-N470 WeakPolarHBondContact CG2-O 3Å; A467-N470 WeakPolarHBondContact O-CB 3.41Å; A467-N470 PolarHBondContact O-N 3.18Å; L468-N470 PolarHBondContact O-N 3.05Å; L468-N470 VanDerWaalsContact O-N 3.11Å
471	C	96.3	Very high	96.1	Very high	11 Å²	11	41.4 Å²	41.4	7%	0.074	23%	0.229	C	C	.	.	S	Bend	trans	-79.8	142.2	-180	-57.3	0	0	0	0	110.4	I373 L468 P469 K475 L476	I373-C471 HydrophobicContact CG2-CB 4.45Å; L468-C471 VanDerWaalsContact O-CB 3.3Å; L468-C471 WeakPolarHBondContact O-CB 3.44Å; L468-C471 PolarHBondContact O-N 3.4Å; P469-C471 VanDerWaalsContact C-N 3.32Å; C471-K475 HydrophobicContact CB-CB 4.44Å; C471-L476 HydrophobicContact CB-CD2 3.78Å; C471-L476 HydrophobicContact CB-CG 3.8Å
472	S	96.7	Very high	96.1	Very high	56 Å²	56	42.8 Å²	42.8	39%	0.392	24%	0.237	S	C	.	.			trans	-69.8	156.4	171.2	71.9	0	0	0	0	111.4	A474 K475 L476	S472-A474 PolarHBondContact O-N 3.33Å; S472-A474 VanDerWaalsContact O-N 3.15Å; S472-K475 PolarHBondContact O-N 3.42Å; S472-K475 WeakPolarHBondContact OG-CG 3.31Å; S472-L476 PolarHBondContact O-N 3.08Å
473	S	97.3	Very high	96.1	Very high	73 Å²	73	42.8 Å²	42.8	51%	0.51	24%	0.237	S	C	.	.	H	α-helix	trans	-54.7	-35.9	179.6	-53.6	0	0	0	0	113.1	L476 Q477	S473-L476 PolarHBondContact O-N 3.35Å; S473-Q477 WeakPolarHBondContact O-CB 3.49Å; S473-Q477 VanDerWaalsContact O-CG 3.27Å; S473-Q477 WeakPolarHBondContact O-CG 3.47Å; S473-Q477 PolarHBondContact O-N 3.18Å
474	A	98.3	Very high	96.1	Very high	58 Å²	58	47.7 Å²	47.7	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-40.7	177.2	0	0	0	0	0	112.5	S472 Q477 T478	S472-A474 PolarHBondContact O-N 3.33Å; S472-A474 VanDerWaalsContact O-N 3.15Å; A474-Q477 PolarHBondContact O-N 3.43Å; A474-T478 PolarHBondContact O-N 3.32Å; A474-T478 PolarHBondContact O-OG1 3.4Å
475	K	98.3	Very high	96.3	Very high	60 Å²	60	50.2 Å²	50.2	26%	0.261	29%	0.286	S	S	.	.	H	α-helix	trans	-68.9	-41.2	176.8	-58.8	-65.9	178.8	163.6	0	110.8	E374 L375 C471 S472 Q477 T478 M479	E374-K475 WeakPolarHBondContact O-CE 3.43Å; E374-K475 PolarHBondContact O-NZ 2.98Å; E374-K475 WeakPolarHBondContact OE2-CE 3.37Å; E374-K475 IonicContact OE2-NZ 3.63Å; L375-K475 HydrophobicContact CB-CD 4.38Å; L375-K475 HydrophobicContact CD1-CB 4.12Å; L375-K475 HydrophobicContact CD1-CD 3.87Å; L375-K475 HydrophobicContact CG-CB 4.28Å; L375-K475 HydrophobicContact CG-CD 3.93Å; C471-K475 HydrophobicContact CB-CB 4.44Å; S472-K475 PolarHBondContact O-N 3.42Å; S472-K475 WeakPolarHBondContact OG-CG 3.31Å; K475-Q477 PolarHBondContact O-N 2.87Å; K475-T478 WeakPolarHBondContact O-CB 3.41Å; K475-T478 PolarHBondContact O-N 3.08Å; K475-M479 WeakPolarHBondContact O-CG 3.34Å; K475-M479 PolarHBondContact O-N 3.07Å
476	L	98.6	Very high	96.4	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-59.4	-44	173.4	-71.4	174.4	0	0	0	112.1	L468 C471 S472 S473 T478 M479 T480 I502 C505 L506	L468-L476 HydrophobicContact CD2-CD2 4.38Å; C471-L476 HydrophobicContact CB-CD2 3.78Å; C471-L476 HydrophobicContact CB-CG 3.8Å; S472-L476 PolarHBondContact O-N 3.08Å; S473-L476 PolarHBondContact O-N 3.35Å; L476-T478 VanDerWaalsContact C-N 3.33Å; L476-T478 PolarHBondContact O-N 3Å; L476-M479 HydrophobicContact CD2-SD 4.27Å; L476-M479 WeakPolarHBondContact O-CB 3.14Å; L476-M479 PolarHBondContact O-N 2.92Å; L476-T480 PolarHBondContact O-N 3.41Å; L476-T480 PolarHBondContact O-OG1 3.3Å; L476-I502 HydrophobicContact CB-CG2 3.98Å; L476-I502 HydrophobicContact CD2-CG1 4.2Å; L476-I502 HydrophobicContact CD2-CG2 4.16Å; L476-C505 HydrophobicContact CD1-CB 3.71Å; L476-C505 HydrophobicContact CD2-CB 4.5Å; L476-L506 HydrophobicContact CB-CD1 4.32Å; L476-L506 HydrophobicContact CB-CD2 3.94Å; L476-L506 HydrophobicContact CB-CG 4.15Å; L476-L506 HydrophobicContact CD1-CD2 3.98Å; L476-L506 HydrophobicContact CD1-CG 4.2Å
477	Q	98.5	Very high	96.4	Very high	122 Å²	122	53.5 Å²	53.5	57%	0.57	31%	0.305	S	S	*	.	H	α-helix	trans	-62.9	-38.5	174.4	-74.5	171.4	-6.8	0	0	112.5	S473 A474 K475 T480 H481 L506	S473-Q477 WeakPolarHBondContact O-CB 3.49Å; S473-Q477 VanDerWaalsContact O-CG 3.27Å; S473-Q477 WeakPolarHBondContact O-CG 3.47Å; S473-Q477 PolarHBondContact O-N 3.18Å; A474-Q477 PolarHBondContact O-N 3.43Å; K475-Q477 PolarHBondContact O-N 2.87Å; Q477-T480 WeakPolarHBondContact O-CB 3.32Å; Q477-T480 PolarHBondContact O-N 2.89Å; Q477-H481 PolarHBondContact O-N 3.38Å; Q477-L506 HydrophobicContact CG-CD1 4.33Å
478	T	98.6	Very high	96.1	Very high	73 Å²	73	56.7 Å²	56.7	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-61.3	-45.4	174.5	-55.8	0	0	0	0	110.9	L375 A474 K475 L476 T480 H481 V482	L375-T478 HydrophobicContact CD1-CG2 3.79Å; A474-T478 PolarHBondContact O-N 3.32Å; A474-T478 PolarHBondContact O-OG1 3.4Å; K475-T478 WeakPolarHBondContact O-CB 3.41Å; K475-T478 PolarHBondContact O-N 3.08Å; L476-T478 VanDerWaalsContact C-N 3.33Å; L476-T478 PolarHBondContact O-N 3Å; T478-T480 VanDerWaalsContact C-N 3.35Å; T478-T480 PolarHBondContact O-N 3.25Å; T478-H481 PolarHBondContact O-N 3.3Å; T478-V482 PolarHBondContact O-N 2.99Å; T478-V482 VanDerWaalsContact O-N 3.15Å
479	M	98.6	Very high	95.5	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-44.1	175	-67.5	173	-176.7	0	0	111.6	L375 I459 L462 L468 K475 L476 H481 V482 L483 I502	L375-M479 HydrophobicContact CD1-CG 4.45Å; L375-M479 HydrophobicContact CD2-CE 3.27Å; L375-M479 HydrophobicContact CD2-CG 4.13Å; L375-M479 HydrophobicContact CG-CE 4.27Å; I459-M479 HydrophobicContact CD1-CB 3.69Å; I459-M479 HydrophobicContact CD1-CG 3.86Å; I459-M479 HydrophobicContact CG1-CB 4.19Å; I459-M479 HydrophobicContact CG1-CG 3.88Å; I459-M479 HydrophobicContact CG1-SD 4.05Å; L462-M479 HydrophobicContact CD1-CE 3.53Å; L468-M479 HydrophobicContact CD2-SD 4Å; K475-M479 WeakPolarHBondContact O-CG 3.34Å; K475-M479 PolarHBondContact O-N 3.07Å; L476-M479 HydrophobicContact CD2-SD 4.27Å; L476-M479 WeakPolarHBondContact O-CB 3.14Å; L476-M479 PolarHBondContact O-N 2.92Å; M479-H481 VanDerWaalsContact C-N 3.34Å; M479-H481 PolarHBondContact O-N 3.44Å; M479-V482 PolarHBondContact O-N 2.82Å; M479-L483 WeakPolarHBondContact O-CG 3.46Å; M479-L483 PolarHBondContact O-N 3.34Å; M479-I502 HydrophobicContact CB-CD1 3.75Å; M479-I502 HydrophobicContact SD-CD1 4.45Å
480	T	98.6	Very high	95.1	Very high	24 Å²	24	59.8 Å²	59.8	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-56.1	-46.9	176	-64.2	0	0	0	0	111.9	L476 Q477 T478 V482 L483 Q484 L499 I502	L476-T480 PolarHBondContact O-N 3.41Å; L476-T480 PolarHBondContact O-OG1 3.3Å; Q477-T480 WeakPolarHBondContact O-CB 3.32Å; Q477-T480 PolarHBondContact O-N 2.89Å; T478-T480 VanDerWaalsContact C-N 3.35Å; T478-T480 PolarHBondContact O-N 3.25Å; T480-V482 PolarHBondContact O-N 2.98Å; T480-L483 PolarHBondContact O-N 3.23Å; T480-Q484 HydrophobicContact CG2-CG 4.36Å; T480-Q484 WeakPolarHBondContact O-CB 3.5Å; T480-Q484 VanDerWaalsContact O-CG 3.32Å; T480-Q484 WeakPolarHBondContact O-CG 3.44Å; T480-Q484 PolarHBondContact O-N 3.49Å; T480-L499 HydrophobicContact CG2-CD2 3.87Å; T480-I502 VanDerWaalsContact OG1-CG2 3.28Å; T480-I502 WeakPolarHBondContact OG1-CG2 3.32Å
481	H	98.3	Very high	94.8	Very high	142 Å²	142	59.2 Å²	59.2	66%	0.657	35%	0.348	S	S	*	.	H	α-helix	trans	-61	-45.3	178.9	-175.9	-24.8	0	0	0	111.3	Q477 T478 M479 L483 Q484 G485	Q477-H481 PolarHBondContact O-N 3.38Å; T478-H481 PolarHBondContact O-N 3.3Å; M479-H481 VanDerWaalsContact C-N 3.34Å; M479-H481 PolarHBondContact O-N 3.44Å; H481-L483 PolarHBondContact O-N 2.89Å; H481-Q484 PolarHBondContact O-N 3.32Å; H481-G485 PolarHBondContact O-N 3.47Å; H481-G485 VanDerWaalsContact O-N 3.16Å
482	V	97.9	Very high	94.5	Very high	29 Å²	29	60.6 Å²	60.6	18%	0.176	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-47.7	178.9	176.3	0	0	0	0	110.4	E452 I455 T478 M479 T480 Q484 G485	E452-V482 HydrophobicContact CB-CG1 4.13Å; E452-V482 HydrophobicContact CG-CG1 4.22Å; I455-V482 HydrophobicContact CB-CG1 3.99Å; I455-V482 HydrophobicContact CD1-CG1 4.17Å; I455-V482 HydrophobicContact CD1-CG2 4.38Å; I455-V482 HydrophobicContact CG2-CB 4.22Å; I455-V482 HydrophobicContact CG2-CG1 3.7Å; I455-V482 HydrophobicContact CG2-CG2 4.38Å; T478-V482 PolarHBondContact O-N 2.99Å; T478-V482 VanDerWaalsContact O-N 3.15Å; M479-V482 PolarHBondContact O-N 2.82Å; T480-V482 PolarHBondContact O-N 2.98Å; V482-Q484 VanDerWaalsContact C-N 3.34Å; V482-Q484 PolarHBondContact O-N 3.35Å; V482-G485 PolarHBondContact O-N 3.29Å; V482-G485 VanDerWaalsContact O-N 3.14Å
483	L	97.9	Very high	94.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-43.8	179.1	-70.7	178.5	0	0	0	111.9	L456 I459 M479 T480 H481 G485 I486 K495 L498 L499 I502	L456-L483 HydrophobicContact CB-CD2 4.09Å; L456-L483 HydrophobicContact CD1-CD2 3.97Å; L456-L483 HydrophobicContact CG-CD2 3.95Å; I459-L483 HydrophobicContact CD1-CD1 4.2Å; I459-L483 HydrophobicContact CD1-CD2 3.97Å; I459-L483 HydrophobicContact CD1-CG 3.89Å; I459-L483 HydrophobicContact CG2-CD1 4.42Å; M479-L483 WeakPolarHBondContact O-CG 3.46Å; M479-L483 PolarHBondContact O-N 3.34Å; T480-L483 PolarHBondContact O-N 3.23Å; H481-L483 PolarHBondContact O-N 2.89Å; L483-G485 PolarHBondContact O-N 3.4Å; L483-I486 HydrophobicContact CD2-CD1 4.33Å; L483-I486 PolarHBondContact O-N 3.04Å; L483-I486 VanDerWaalsContact O-N 3.16Å; L483-K495 HydrophobicContact CB-CG 4.26Å; L483-K495 WeakPolarHBondContact O-CD 3.01Å; L483-L498 HydrophobicContact CD1-CB 3.76Å; L483-L498 HydrophobicContact CD2-CD1 4.35Å; L483-L499 HydrophobicContact CB-CD2 3.83Å; L483-L499 HydrophobicContact CB-CG 4.07Å; L483-L499 HydrophobicContact CD1-CD2 3.97Å; L483-L499 HydrophobicContact CD1-CG 3.99Å; L483-I502 HydrophobicContact CD1-CD1 3.74Å
484	Q	96.3	Very high	94.1	Very high	112 Å²	112	54.7 Å²	54.7	52%	0.523	32%	0.315	S	S	.	.	H	α-helix	trans	-63	-28.8	178.3	-74.6	174.3	-19.6	0	0	113.2	T480 H481 V482 I486 L499	T480-Q484 HydrophobicContact CG2-CG 4.36Å; T480-Q484 WeakPolarHBondContact O-CB 3.5Å; T480-Q484 VanDerWaalsContact O-CG 3.32Å; T480-Q484 WeakPolarHBondContact O-CG 3.44Å; T480-Q484 PolarHBondContact O-N 3.49Å; H481-Q484 PolarHBondContact O-N 3.32Å; V482-Q484 VanDerWaalsContact C-N 3.34Å; V482-Q484 PolarHBondContact O-N 3.35Å; Q484-I486 VanDerWaalsContact C-N 3.3Å; Q484-I486 PolarHBondContact O-N 3.12Å; Q484-L499 HydrophobicContact CG-CD1 4.5Å; Q484-L499 HydrophobicContact CG-CD2 4.29Å
485	G	95.3	Very high	94	Very high	52 Å²	52	53.5 Å²	53.5	54%	0.536	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.1	176.7	0	0	0	0	0	115.1	H481 V482 L483 E487	H481-G485 PolarHBondContact O-N 3.47Å; H481-G485 VanDerWaalsContact O-N 3.16Å; V482-G485 PolarHBondContact O-N 3.29Å; V482-G485 VanDerWaalsContact O-N 3.14Å; L483-G485 PolarHBondContact O-N 3.4Å; G485-E487 PolarHBondContact O-N 3.37Å
486	I	94.1	Very high	93.9	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.051	29%	0.291	C	S	.	.			trans	-85.5	115.6	179.9	-63.2	168.1	0	0	0	109.9	E452 L453 L456 L483 Q484 D488 C491 K495	E452-I486 HydrophobicContact CB-CD1 4.11Å; E452-I486 HydrophobicContact CB-CG1 3.79Å; L453-I486 HydrophobicContact CD2-CG2 4.22Å; L456-I486 HydrophobicContact CB-CD1 3.79Å; L456-I486 HydrophobicContact CD1-CD1 3.6Å; L456-I486 HydrophobicContact CG-CD1 4.33Å; L483-I486 HydrophobicContact CD2-CD1 4.33Å; L483-I486 PolarHBondContact O-N 3.04Å; L483-I486 VanDerWaalsContact O-N 3.16Å; Q484-I486 VanDerWaalsContact C-N 3.3Å; Q484-I486 PolarHBondContact O-N 3.12Å; I486-D488 HydrophobicContact CG2-CB 4.09Å; I486-C491 VanDerWaalsContact CG2-SG 3.51Å; I486-K495 PolarHBondContact O-NZ 3.33Å
487	E	90.1	Very high	93.9	Very high	185 Å²	185	51.3 Å²	51.3	86%	0.864	29%	0.29	S	S	*	.			trans	-94.1	-7.2	179.8	-62.1	-176.2	173.1	0	0	113.7	G485 A489	G485-E487 PolarHBondContact O-N 3.37Å; E487-A489 PolarHBondContact O-N 3.02Å; E487-A489 VanDerWaalsContact O-N 3.09Å
488	D	86.4	Confident	93.9	Very high	67 Å²	67	45.5 Å²	45.5	36%	0.358	26%	0.263	S	S	.	.			trans	-63.2	111.9	-178.9	-173.9	-21.5	0	0	0	111.5	I486 S490 C491	I486-D488 HydrophobicContact CG2-CB 4.09Å; D488-S490 VanDerWaalsContact CG-OG 3.26Å; D488-S490 PolarHBondContact O-N 2.82Å; D488-S490 VanDerWaalsContact OD1-CB 3.26Å; D488-S490 WeakPolarHBondContact OD1-CB 3.33Å; D488-S490 PolarHBondContact OD1-N 3.49Å; D488-S490 PolarHBondContact OD1-OG 3.05Å; D488-S490 PolarHBondContact OD2-OG 3.45Å; D488-C491 PolarHBondContact O-N 3.49Å; D488-C491 PolarHBondContact O-SG 2.96Å
489	A	84.6	Confident	93.9	Very high	79 Å²	79	42.2 Å²	42.2	65%	0.653	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.5	-29.7	-177.9	0	0	0	0	0	113.1	E487 C491 T492	E487-A489 PolarHBondContact O-N 3.02Å; E487-A489 VanDerWaalsContact O-N 3.09Å; A489-C491 PolarHBondContact O-N 3.38Å; A489-T492 WeakPolarHBondContact CA-OG1 3.36Å; A489-T492 WeakPolarHBondContact O-CB 2.91Å; A489-T492 PolarHBondContact O-N 2.88Å; A489-T492 PolarHBondContact O-OG1 3.34Å
490	S	82.8	Confident	93.9	Very high	73 Å²	73	42.1 Å²	42.1	51%	0.51	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-69	-13.6	-176.1	74	0	0	0	0	114.3	D488	D488-S490 VanDerWaalsContact CG-OG 3.26Å; D488-S490 PolarHBondContact O-N 2.82Å; D488-S490 VanDerWaalsContact OD1-CB 3.26Å; D488-S490 WeakPolarHBondContact OD1-CB 3.33Å; D488-S490 PolarHBondContact OD1-N 3.49Å; D488-S490 PolarHBondContact OD1-OG 3.05Å; D488-S490 PolarHBondContact OD2-OG 3.45Å
491	C	87.4	Confident	93.8	Very high	11 Å²	11	41.1 Å²	41.1	7%	0.074	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-117.5	12.4	178.8	73.2	0	0	0	0	113.3	L456 I486 D488 A489 D493 L494 K495	L456-C491 HydrophobicContact CD1-CB 4.25Å; I486-C491 VanDerWaalsContact CG2-SG 3.51Å; D488-C491 PolarHBondContact O-N 3.49Å; D488-C491 PolarHBondContact O-SG 2.96Å; A489-C491 PolarHBondContact O-N 3.38Å; C491-D493 PolarHBondContact O-N 2.97Å; C491-L494 PolarHBondContact O-N 3.03Å; C491-K495 VanDerWaalsContact O-CB 3.23Å; C491-K495 WeakPolarHBondContact O-CB 3.35Å; C491-K495 PolarHBondContact O-N 3.27Å
492	T	90.6	Very high	93.9	Very high	41 Å²	41	34.3 Å²	34.3	25%	0.252	21%	0.205	S	C	.	.	H	α-helix	trans	-59.6	-44.3	-175.9	-59.1	0	0	0	0	112.6	A489 K495 N496	A489-T492 WeakPolarHBondContact CA-OG1 3.36Å; A489-T492 WeakPolarHBondContact O-CB 2.91Å; A489-T492 PolarHBondContact O-N 2.88Å; A489-T492 PolarHBondContact O-OG1 3.34Å; T492-K495 PolarHBondContact O-N 3.21Å; T492-N496 WeakPolarHBondContact O-CB 3.23Å; T492-N496 VanDerWaalsContact O-CG 3.28Å; T492-N496 PolarHBondContact O-N 3.46Å; T492-N496 PolarHBondContact O-ND2 3.04Å; T492-N496 VanDerWaalsContact O-ND2 3.14Å
493	D	91.6	Very high	93.9	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-50.9	177.4	62.5	-24.5	0	0	0	111.8	C491 N496 L497 A519 D522 G525 N529 V532	C491-D493 PolarHBondContact O-N 2.97Å; D493-N496 PolarHBondContact O-N 2.91Å; D493-L497 PolarHBondContact O-N 2.95Å; D493-A519 WeakPolarHBondContact O-CB 3.47Å; D493-D522 HydrophobicContact CB-CB 3.92Å; D493-G525 WeakPolarHBondContact OD2-CA 3.14Å; D493-N529 PolarHBondContact OD1-ND2 3.45Å; D493-N529 WeakPolarHBondContact OD2-CB 3.49Å; D493-N529 PolarHBondContact OD2-ND2 3.26Å; D493-V532 HydrophobicContact CB-CG1 3.91Å
494	L	94	Very high	93.7	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-45.3	178.9	177	55.9	0	0	0	110.6	L456 E460 C491 N496 L497 L498 Y531 V532	L456-L494 HydrophobicContact CD2-CD2 3.68Å; L456-L494 HydrophobicContact CD2-CG 4.26Å; E460-L494 HydrophobicContact CG-CD1 4.14Å; E460-L494 HydrophobicContact CG-CD2 4.29Å; C491-L494 PolarHBondContact O-N 3.03Å; L494-N496 VanDerWaalsContact C-N 3.29Å; L494-N496 PolarHBondContact O-N 3.46Å; L494-L497 WeakPolarHBondContact O-CB 3.48Å; L494-L497 PolarHBondContact O-N 3.38Å; L494-L497 VanDerWaalsContact O-N 3.17Å; L494-L498 HydrophobicContact CD1-CD1 4.03Å; L494-L498 HydrophobicContact CD1-CD2 4.28Å; L494-L498 HydrophobicContact CD1-CG 3.97Å; L494-L498 HydrophobicContact CG-CD1 4.08Å; L494-L498 HydrophobicContact CG-CG 4.41Å; L494-L498 VanDerWaalsContact O-CG 3.28Å; L494-L498 WeakPolarHBondContact O-CG 3.41Å; L494-L498 PolarHBondContact O-N 3.42Å; L494-Y531 WeakPolarHBondContact CD1-OH 3.48Å; L494-V532 HydrophobicContact CB-CG2 4.16Å; L494-V532 HydrophobicContact CD1-CG2 4.05Å
495	K	95.5	Very high	93.7	Very high	32 Å²	32	33.4 Å²	33.4	14%	0.139	20%	0.2	C	C	.	.	H	α-helix	trans	-53.5	-48	174.5	175.2	178.5	59.2	178.3	0	110.9	L483 I486 C491 T492 L498 L499	L483-K495 HydrophobicContact CB-CG 4.26Å; L483-K495 WeakPolarHBondContact O-CD 3.01Å; I486-K495 PolarHBondContact O-NZ 3.33Å; C491-K495 VanDerWaalsContact O-CB 3.23Å; C491-K495 WeakPolarHBondContact O-CB 3.35Å; C491-K495 PolarHBondContact O-N 3.27Å; T492-K495 PolarHBondContact O-N 3.21Å; K495-L498 PolarHBondContact O-N 2.69Å; K495-L499 HydrophobicContact CD-CD1 4.44Å; K495-L499 HydrophobicContact CG-CD1 3.84Å; K495-L499 HydrophobicContact CG-CG 4.39Å; K495-L499 WeakPolarHBondContact O-CB 3.48Å; K495-L499 VanDerWaalsContact O-CG 3.31Å; K495-L499 WeakPolarHBondContact O-CG 3.42Å; K495-L499 PolarHBondContact O-N 3.36Å
496	N	97.1	Very high	93.7	Very high	19 Å²	19	33.4 Å²	33.4	10%	0.102	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-42.4	178.5	-73.7	-32.7	0	0	0	111.9	T492 D493 L494 L498 L499 G500 Y515 L518 A519	T492-N496 WeakPolarHBondContact O-CB 3.23Å; T492-N496 VanDerWaalsContact O-CG 3.28Å; T492-N496 PolarHBondContact O-N 3.46Å; T492-N496 PolarHBondContact O-ND2 3.04Å; T492-N496 VanDerWaalsContact O-ND2 3.14Å; D493-N496 PolarHBondContact O-N 2.91Å; L494-N496 VanDerWaalsContact C-N 3.29Å; L494-N496 PolarHBondContact O-N 3.46Å; N496-L498 VanDerWaalsContact C-N 3.33Å; N496-L498 PolarHBondContact O-N 2.96Å; N496-L499 PolarHBondContact O-N 2.64Å; N496-G500 PolarHBondContact O-N 2.72Å; N496-Y515 WeakPolarHBondContact O-CB 3.36Å; N496-L518 HydrophobicContact CB-CB 4.35Å; N496-A519 HydrophobicContact CB-CB 3.84Å
497	L	97.5	Very high	93.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.2	-47	174.2	171.1	62.6	0	0	0	111.7	Y463 D493 L494 G500 A501 F516 A519 Y531 V532 E539	Y463-L497 HydrophobicContact CD1-CD2 4.45Å; Y463-L497 HydrophobicContact CE1-CD1 4.36Å; Y463-L497 HydrophobicContact CE1-CD2 3.79Å; Y463-L497 HydrophobicContact CE1-CG 4.16Å; D493-L497 PolarHBondContact O-N 2.95Å; L494-L497 WeakPolarHBondContact O-CB 3.48Å; L494-L497 PolarHBondContact O-N 3.38Å; L494-L497 VanDerWaalsContact O-N 3.17Å; L497-G500 PolarHBondContact O-N 3.46Å; L497-A501 PolarHBondContact O-N 3.43Å; L497-F516 HydrophobicContact CD1-CD1 4.1Å; L497-F516 HydrophobicContact CD1-CE1 4.01Å; L497-F516 WeakPolarHBondContact O-CE1 3.25Å; L497-A519 HydrophobicContact CB-CB 4.14Å; L497-Y531 HydrophobicContact CD2-CE2 4.12Å; L497-V532 HydrophobicContact CB-CG1 4.04Å; L497-V532 HydrophobicContact CD2-CB 4.32Å; L497-V532 HydrophobicContact CD2-CG1 4.1Å; L497-V532 HydrophobicContact CD2-CG2 4.07Å; L497-E539 HydrophobicContact CD1-CG 4.35Å
498	L	98.4	Very high	94	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-42.3	-178.9	-61.1	177.3	0	0	0	112	L456 I459 E460 Y463 L483 L494 K495 N496 G500 A501 I502	L456-L498 HydrophobicContact CG-CD1 4.26Å; I459-L498 HydrophobicContact CB-CD1 4.22Å; I459-L498 HydrophobicContact CG2-CB 4.14Å; I459-L498 HydrophobicContact CG2-CD1 3.95Å; I459-L498 HydrophobicContact CG2-CD2 4.26Å; I459-L498 HydrophobicContact CG2-CG 4.32Å; E460-L498 HydrophobicContact CB-CD1 4.28Å; Y463-L498 VanDerWaalsContact CB-CD2 3.47Å; Y463-L498 HydrophobicContact CD1-CD2 4.02Å; Y463-L498 HydrophobicContact CG-CD2 3.74Å; L483-L498 HydrophobicContact CD1-CB 3.76Å; L483-L498 HydrophobicContact CD2-CD1 4.35Å; L494-L498 HydrophobicContact CD1-CD1 4.03Å; L494-L498 HydrophobicContact CD1-CD2 4.28Å; L494-L498 HydrophobicContact CD1-CG 3.97Å; L494-L498 HydrophobicContact CG-CD1 4.08Å; L494-L498 HydrophobicContact CG-CG 4.41Å; L494-L498 VanDerWaalsContact O-CG 3.28Å; L494-L498 WeakPolarHBondContact O-CG 3.41Å; L494-L498 PolarHBondContact O-N 3.42Å; K495-L498 PolarHBondContact O-N 2.69Å; N496-L498 VanDerWaalsContact C-N 3.33Å; N496-L498 PolarHBondContact O-N 2.96Å; L498-G500 VanDerWaalsContact C-N 3.31Å; L498-G500 PolarHBondContact O-N 3.25Å; L498-A501 PolarHBondContact O-N 3.5Å; L498-I502 WeakPolarHBondContact O-CG1 3.46Å; L498-I502 PolarHBondContact O-N 3.08Å
499	L	98.6	Very high	94.4	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-40.7	173.6	-76.4	171.7	0	0	0	111.7	T480 L483 Q484 K495 N496 S503 Y515	T480-L499 HydrophobicContact CG2-CD2 3.87Å; L483-L499 HydrophobicContact CB-CD2 3.83Å; L483-L499 HydrophobicContact CB-CG 4.07Å; L483-L499 HydrophobicContact CD1-CD2 3.97Å; L483-L499 HydrophobicContact CD1-CG 3.99Å; Q484-L499 HydrophobicContact CG-CD1 4.5Å; Q484-L499 HydrophobicContact CG-CD2 4.29Å; K495-L499 HydrophobicContact CD-CD1 4.44Å; K495-L499 HydrophobicContact CG-CD1 3.84Å; K495-L499 HydrophobicContact CG-CG 4.39Å; K495-L499 WeakPolarHBondContact O-CB 3.48Å; K495-L499 VanDerWaalsContact O-CG 3.31Å; K495-L499 WeakPolarHBondContact O-CG 3.42Å; K495-L499 PolarHBondContact O-N 3.36Å; N496-L499 PolarHBondContact O-N 2.64Å; L499-S503 VanDerWaalsContact O-CB 3.25Å; L499-S503 WeakPolarHBondContact O-CB 3.43Å; L499-S503 PolarHBondContact O-N 3.17Å; L499-S503 PolarHBondContact O-OG 2.98Å; L499-Y515 HydrophobicContact CB-CD1 3.95Å; L499-Y515 HydrophobicContact CB-CD2 3.81Å; L499-Y515 HydrophobicContact CB-CE1 4.11Å; L499-Y515 HydrophobicContact CB-CE2 3.96Å; L499-Y515 HydrophobicContact CB-CG 3.82Å; L499-Y515 HydrophobicContact CD1-CD1 4.12Å; L499-Y515 HydrophobicContact CD1-CE1 3.62Å; L499-Y515 HydrophobicContact CG-CE1 4.48Å
500	G	98.3	Very high	94.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-43.9	174.8	0	0	0	0	0	112.2	N496 L497 L498 S503 R504 A512 F516	N496-G500 PolarHBondContact O-N 2.72Å; L497-G500 PolarHBondContact O-N 3.46Å; L498-G500 VanDerWaalsContact C-N 3.31Å; L498-G500 PolarHBondContact O-N 3.25Å; G500-S503 PolarHBondContact O-N 3.14Å; G500-R504 PolarHBondContact O-N 3.49Å; G500-A512 WeakPolarHBondContact O-CB 3.42Å; G500-F516 WeakPolarHBondContact O-CZ 3.32Å
501	A	97.9	Very high	95.6	Very high	2 Å²	2	39.2 Å²	39.2	2%	0.017	20%	0.202	C	C	.	.	H	α-helix	trans	-63.9	-44.7	177.9	0	0	0	0	0	112.3	Y463 L468 L497 L498 R504 C505 F516	Y463-A501 HydrophobicContact CD2-CB 3.54Å; Y463-A501 HydrophobicContact CE2-CB 3.69Å; L468-A501 HydrophobicContact CD1-CB 3.89Å; L497-A501 PolarHBondContact O-N 3.43Å; L498-A501 PolarHBondContact O-N 3.5Å; A501-R504 PolarHBondContact O-N 3Å; A501-C505 PolarHBondContact O-N 3.18Å; A501-C505 VanDerWaalsContact O-N 3.07Å; A501-C505 PolarHBondContact O-SG 2.63Å; A501-F516 HydrophobicContact CB-CE1 4.38Å; A501-F516 HydrophobicContact CB-CZ 4.42Å; A501-F516 VanDerWaalsContact N-CE1 3.32Å; A501-F516 VanDerWaalsContact N-CZ 3.32Å
502	I	98.6	Very high	96.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-45.5	175.4	-69.4	164.9	0	0	0	110.7	I459 L468 L476 M479 T480 L483 L498 R504 C505 L506	I459-I502 HydrophobicContact CG2-CD1 4.06Å; L468-I502 HydrophobicContact CD1-CG1 4.2Å; L468-I502 HydrophobicContact CD2-CG1 4.42Å; L476-I502 HydrophobicContact CB-CG2 3.98Å; L476-I502 HydrophobicContact CD2-CG1 4.2Å; L476-I502 HydrophobicContact CD2-CG2 4.16Å; M479-I502 HydrophobicContact CB-CD1 3.75Å; M479-I502 HydrophobicContact SD-CD1 4.45Å; T480-I502 VanDerWaalsContact OG1-CG2 3.28Å; T480-I502 WeakPolarHBondContact OG1-CG2 3.32Å; L483-I502 HydrophobicContact CD1-CD1 3.74Å; L498-I502 WeakPolarHBondContact O-CG1 3.46Å; L498-I502 PolarHBondContact O-N 3.08Å; I502-R504 PolarHBondContact O-N 3.08Å; I502-C505 WeakPolarHBondContact O-CB 3.38Å; I502-C505 PolarHBondContact O-N 3.15Å; I502-L506 HydrophobicContact CG2-CD1 3.92Å; I502-L506 HydrophobicContact CG2-CG 4.43Å; I502-L506 WeakPolarHBondContact O-CG 3.27Å; I502-L506 PolarHBondContact O-N 3.04Å
503	S	98.2	Very high	96.4	Very high	7 Å²	7	37.7 Å²	37.7	5%	0.049	19%	0.192	C	C	.	.	H	α-helix	trans	-58.5	-39.5	177.9	-61.5	0	0	0	0	111.4	L499 G500 L506 L507 N508	L499-S503 VanDerWaalsContact O-CB 3.25Å; L499-S503 WeakPolarHBondContact O-CB 3.43Å; L499-S503 PolarHBondContact O-N 3.17Å; L499-S503 PolarHBondContact O-OG 2.98Å; G500-S503 PolarHBondContact O-N 3.14Å; S503-L506 CarbonylContact O-C 3.48Å; S503-L506 PolarHBondContact O-N 3.48Å; S503-L507 PolarHBondContact O-N 2.79Å; S503-N508 PolarHBondContact O-N 2.95Å
504	R	95.1	Very high	96.6	Very high	76 Å²	76	43 Å²	43	29%	0.287	22%	0.217	S	C	.	.	H	α-helix	trans	-64	-44.2	173.5	-173.3	-179.2	67.4	-174.8	-7.1	112.3	G500 A501 I502 L506 L507 A512 E539 V543	G500-R504 PolarHBondContact O-N 3.49Å; A501-R504 PolarHBondContact O-N 3Å; I502-R504 PolarHBondContact O-N 3.08Å; R504-L506 PolarHBondContact O-N 3.26Å; R504-L507 WeakPolarHBondContact O-CA 3.47Å; R504-L507 PolarHBondContact O-N 3.33Å; R504-A512 HydrophobicContact CB-CB 4.09Å; R504-E539 IonicContact CZ-OE2 2.77Å; R504-E539 IonicContact NH1-OE2 3.97Å; R504-E539 PolarHBondContact NH1-OE2 3.39Å; R504-E539 IonicContact NH2-OE1 3.68Å; R504-E539 IonicContact NH2-OE2 2.7Å; R504-E539 PolarHBondContact NH2-OE2 2.95Å; R504-V543 HydrophobicContact CG-CG2 4.3Å
505	C	95	Very high	96.8	Very high	39 Å²	39	45 Å²	45	26%	0.264	22%	0.224	S	C	.	.	H	α-helix	trans	-60.6	-33	175.3	-71.5	0	0	0	0	112.2	L476 A501 I502 L507	L476-C505 HydrophobicContact CD1-CB 3.71Å; L476-C505 HydrophobicContact CD2-CB 4.5Å; A501-C505 PolarHBondContact O-N 3.18Å; A501-C505 VanDerWaalsContact O-N 3.07Å; A501-C505 PolarHBondContact O-SG 2.63Å; I502-C505 WeakPolarHBondContact O-CB 3.38Å; I502-C505 PolarHBondContact O-N 3.15Å; C505-L507 PolarHBondContact O-N 3.38Å
506	L	96.3	Very high	96.9	Very high	52 Å²	52	43.5 Å²	43.5	27%	0.272	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	6.2	173.8	-67	172.3	0	0	0	113.8	L476 Q477 I502 S503 R504 N508	L476-L506 HydrophobicContact CB-CD1 4.32Å; L476-L506 HydrophobicContact CB-CD2 3.94Å; L476-L506 HydrophobicContact CB-CG 4.15Å; L476-L506 HydrophobicContact CD1-CD2 3.98Å; L476-L506 HydrophobicContact CD1-CG 4.2Å; Q477-L506 HydrophobicContact CG-CD1 4.33Å; I502-L506 HydrophobicContact CG2-CD1 3.92Å; I502-L506 HydrophobicContact CG2-CG 4.43Å; I502-L506 WeakPolarHBondContact O-CG 3.27Å; I502-L506 PolarHBondContact O-N 3.04Å; S503-L506 CarbonylContact O-C 3.48Å; S503-L506 PolarHBondContact O-N 3.48Å; R504-L506 PolarHBondContact O-N 3.26Å; L506-N508 PolarHBondContact O-N 3.05Å
507	L	94.8	Very high	96.9	Very high	154 Å²	154	49.2 Å²	49.2	81%	0.806	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	21.6	-176.7	-51.9	177.3	0	0	0	114.2	S503 R504 C505 T509	S503-L507 PolarHBondContact O-N 2.79Å; R504-L507 WeakPolarHBondContact O-CA 3.47Å; R504-L507 PolarHBondContact O-N 3.33Å; C505-L507 PolarHBondContact O-N 3.38Å; L507-T509 PolarHBondContact O-N 3.47Å
508	N	95.7	Very high	96.8	Very high	62 Å²	62	52.9 Å²	52.9	33%	0.332	26%	0.257	S	S	.	.			trans	-90.7	79.5	173.3	-172.3	-8.2	0	0	0	110.5	S503 L506 K510 D511 A512	S503-N508 PolarHBondContact O-N 2.95Å; L506-N508 PolarHBondContact O-N 3.05Å; N508-K510 VanDerWaalsContact C-N 3.29Å; N508-K510 PolarHBondContact O-N 3.23Å; N508-D511 PolarHBondContact ND2-OD2 3.03Å; N508-D511 PolarHBondContact O-N 2.9Å; N508-D511 PolarHBondContact OD1-N 3.49Å; N508-A512 WeakPolarHBondContact O-CB 3.44Å; N508-A512 PolarHBondContact O-N 3.48Å; N508-A512 VanDerWaalsContact O-N 3.08Å
509	T	94.4	Very high	96.6	Very high	84 Å²	84	52.9 Å²	52.9	52%	0.515	26%	0.257	S	S	.	.	H	α-helix	trans	-59.9	-35.3	-175.6	-54.7	0	0	0	0	113.4	L507 V513 V543	L507-T509 PolarHBondContact O-N 3.47Å; T509-V513 HydrophobicContact CG2-CG2 4.48Å; T509-V513 VanDerWaalsContact O-CG2 3.3Å; T509-V513 WeakPolarHBondContact O-CG2 3.49Å; T509-V513 PolarHBondContact O-N 3.46Å; T509-V543 HydrophobicContact CG2-CG1 3.58Å
510	K	95.6	Very high	96.3	Very high	175 Å²	175	53.7 Å²	53.7	76%	0.761	26%	0.264	S	S	*	.	H	α-helix	trans	-65.6	-51.6	-177.1	-69.6	-176.7	180	178.4	0	111	N508 A512 V513 Q514	N508-K510 VanDerWaalsContact C-N 3.29Å; N508-K510 PolarHBondContact O-N 3.23Å; K510-A512 VanDerWaalsContact C-N 3.34Å; K510-V513 PolarHBondContact O-N 3.5Å; K510-Q514 PolarHBondContact O-N 3.44Å
511	D	96.9	Very high	95.8	Very high	61 Å²	61	57.6 Å²	57.6	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-67.3	-39.3	-179.8	-67	0.4	0	0	0	110.6	N508 V513 Q514 Y515	N508-D511 PolarHBondContact ND2-OD2 3.03Å; N508-D511 PolarHBondContact O-N 2.9Å; N508-D511 PolarHBondContact OD1-N 3.49Å; D511-V513 PolarHBondContact O-N 3.43Å; D511-Q514 PolarHBondContact O-N 2.97Å; D511-Y515 HydrophobicContact CB-CD2 4.19Å; D511-Y515 HydrophobicContact CB-CE2 4.14Å; D511-Y515 WeakPolarHBondContact O-CB 3.36Å; D511-Y515 WeakPolarHBondContact O-CD2 3.5Å; D511-Y515 PolarHBondContact O-N 3.5Å
512	A	97.2	Very high	95.1	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-54.8	-50.8	174.6	0	0	0	0	0	111.8	G500 R504 N508 K510 Q514 Y515 F516	G500-A512 WeakPolarHBondContact O-CB 3.42Å; R504-A512 HydrophobicContact CB-CB 4.09Å; N508-A512 WeakPolarHBondContact O-CB 3.44Å; N508-A512 PolarHBondContact O-N 3.48Å; N508-A512 VanDerWaalsContact O-N 3.08Å; K510-A512 VanDerWaalsContact C-N 3.34Å; A512-Q514 VanDerWaalsContact C-N 3.35Å; A512-Q514 PolarHBondContact O-N 3.29Å; A512-Y515 PolarHBondContact O-N 3.43Å; A512-F516 HydrophobicContact CB-CD2 4.42Å; A512-F516 HydrophobicContact CB-CE2 4.05Å; A512-F516 WeakPolarHBondContact O-CB 3.25Å; A512-F516 WeakPolarHBondContact O-CD2 3.42Å; A512-F516 VanDerWaalsContact O-CG 3.25Å; A512-F516 WeakPolarHBondContact O-CG 3.31Å; A512-F516 PolarHBondContact O-N 2.99Å
513	V	96.9	Very high	93.9	Very high	19 Å²	19	66 Å²	66	12%	0.115	33%	0.332	C	S	.	.	H	α-helix	trans	-60.7	-43.5	177.9	167.2	0	0	0	0	111.7	T509 K510 D511 R517 L540 V543 L544	T509-V513 HydrophobicContact CG2-CG2 4.48Å; T509-V513 VanDerWaalsContact O-CG2 3.3Å; T509-V513 WeakPolarHBondContact O-CG2 3.49Å; T509-V513 PolarHBondContact O-N 3.46Å; K510-V513 PolarHBondContact O-N 3.5Å; D511-V513 PolarHBondContact O-N 3.43Å; V513-R517 WeakPolarHBondContact O-CB 3.36Å; V513-R517 VanDerWaalsContact O-CG 3.28Å; V513-R517 WeakPolarHBondContact O-CG 3.19Å; V513-R517 PolarHBondContact O-N 3.32Å; V513-L540 HydrophobicContact CB-CD1 4.2Å; V513-L540 HydrophobicContact CG1-CD1 3.93Å; V513-L540 HydrophobicContact CG2-CD1 4.02Å; V513-V543 HydrophobicContact CG2-CB 4.46Å; V513-V543 HydrophobicContact CG2-CG1 3.66Å; V513-L544 HydrophobicContact CG2-CD2 4.49Å
514	Q	97.6	Very high	92.4	Very high	114 Å²	114	71.6 Å²	71.6	53%	0.533	37%	0.365	S	S	.	.	H	α-helix	trans	-62.6	-50.6	179.5	179.7	176.1	-12.6	0	0	111.4	K510 D511 A512 R517 L518	K510-Q514 PolarHBondContact O-N 3.44Å; D511-Q514 PolarHBondContact O-N 2.97Å; A512-Q514 VanDerWaalsContact C-N 3.35Å; A512-Q514 PolarHBondContact O-N 3.29Å; Q514-R517 PolarHBondContact O-N 3.14Å; Q514-L518 HydrophobicContact CG-CD1 4.33Å; Q514-L518 WeakPolarHBondContact O-CG 3.26Å; Q514-L518 PolarHBondContact O-N 3.41Å
515	Y	98.1	Very high	90.8	Very high	45 Å²	45	68.2 Å²	68.2	18%	0.176	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-42.2	-179	-77.7	-55.3	0	0	0	112.7	N496 L499 D511 A512 R517 L518 A519	N496-Y515 WeakPolarHBondContact O-CB 3.36Å; L499-Y515 HydrophobicContact CB-CD1 3.95Å; L499-Y515 HydrophobicContact CB-CD2 3.81Å; L499-Y515 HydrophobicContact CB-CE1 4.11Å; L499-Y515 HydrophobicContact CB-CE2 3.96Å; L499-Y515 HydrophobicContact CB-CG 3.82Å; L499-Y515 HydrophobicContact CD1-CD1 4.12Å; L499-Y515 HydrophobicContact CD1-CE1 3.62Å; L499-Y515 HydrophobicContact CG-CE1 4.48Å; D511-Y515 HydrophobicContact CB-CD2 4.19Å; D511-Y515 HydrophobicContact CB-CE2 4.14Å; D511-Y515 WeakPolarHBondContact O-CB 3.36Å; D511-Y515 WeakPolarHBondContact O-CD2 3.5Å; D511-Y515 PolarHBondContact O-N 3.5Å; A512-Y515 PolarHBondContact O-N 3.43Å; Y515-R517 VanDerWaalsContact C-N 3.32Å; Y515-R517 PolarHBondContact O-N 3.29Å; Y515-L518 HydrophobicContact CD1-CD1 4.39Å; Y515-L518 PolarHBondContact O-N 3.26Å; Y515-A519 PolarHBondContact O-N 2.91Å
516	F	97.6	Very high	89.2	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-36.1	175.7	-65	-44.5	0	0	0	112.7	L497 G500 A501 A512 A519 A520 E539 L540 V543	L497-F516 HydrophobicContact CD1-CD1 4.1Å; L497-F516 HydrophobicContact CD1-CE1 4.01Å; L497-F516 WeakPolarHBondContact O-CE1 3.25Å; G500-F516 WeakPolarHBondContact O-CZ 3.32Å; A501-F516 HydrophobicContact CB-CE1 4.38Å; A501-F516 HydrophobicContact CB-CZ 4.42Å; A501-F516 VanDerWaalsContact N-CE1 3.32Å; A501-F516 VanDerWaalsContact N-CZ 3.32Å; A512-F516 HydrophobicContact CB-CD2 4.42Å; A512-F516 HydrophobicContact CB-CE2 4.05Å; A512-F516 WeakPolarHBondContact O-CB 3.25Å; A512-F516 WeakPolarHBondContact O-CD2 3.42Å; A512-F516 VanDerWaalsContact O-CG 3.25Å; A512-F516 WeakPolarHBondContact O-CG 3.31Å; A512-F516 PolarHBondContact O-N 2.99Å; F516-A519 PolarHBondContact O-N 3.27Å; F516-A520 VanDerWaalsContact O-CB 3.27Å; F516-A520 WeakPolarHBondContact O-CB 3.38Å; F516-A520 PolarHBondContact O-N 2.82Å; F516-E539 HydrophobicContact CD1-CB 3.96Å; F516-E539 HydrophobicContact CD2-CB 4.19Å; F516-E539 HydrophobicContact CE1-CB 3.56Å; F516-E539 HydrophobicContact CE1-CG 4.06Å; F516-E539 HydrophobicContact CE2-CB 3.82Å; F516-E539 HydrophobicContact CG-CB 4.26Å; F516-E539 HydrophobicContact CZ-CB 3.49Å; F516-E539 VanDerWaalsContact CZ-CB 3.49Å; F516-E539 HydrophobicContact CZ-CG 4.18Å; F516-L540 HydrophobicContact CB-CB 3.88Å; F516-L540 HydrophobicContact CB-CD1 4.45Å; F516-L540 HydrophobicContact CD2-CB 4.48Å; F516-V543 HydrophobicContact CE2-CG2 4.1Å
517	R	96.2	Very high	87.5	Confident	140 Å²	140	79.4 Å²	79.4	53%	0.528	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-46.2	173.7	-77.3	175.9	-176.4	158.9	4.5	111.5	V513 Q514 Y515 A519 A520 S521 L540	V513-R517 WeakPolarHBondContact O-CB 3.36Å; V513-R517 VanDerWaalsContact O-CG 3.28Å; V513-R517 WeakPolarHBondContact O-CG 3.19Å; V513-R517 PolarHBondContact O-N 3.32Å; Q514-R517 PolarHBondContact O-N 3.14Å; Y515-R517 VanDerWaalsContact C-N 3.32Å; Y515-R517 PolarHBondContact O-N 3.29Å; R517-A519 VanDerWaalsContact C-N 3.34Å; R517-A519 PolarHBondContact O-N 2.95Å; R517-A520 PolarHBondContact O-N 3.13Å; R517-S521 WeakPolarHBondContact O-CB 3.22Å; R517-S521 PolarHBondContact O-N 2.96Å; R517-S521 PolarHBondContact O-OG 3.21Å; R517-L540 HydrophobicContact CG-CD2 3.73Å
518	L	95.1	Very high	86.1	Confident	76 Å²	76	75.3 Å²	75.3	40%	0.398	38%	0.379	S	S	.	.	H	α-helix	trans	-57.8	-47.7	177.1	-70.1	170.5	0	0	0	111.1	N496 Q514 Y515 S521 D522	N496-L518 HydrophobicContact CB-CB 4.35Å; Q514-L518 HydrophobicContact CG-CD1 4.33Å; Q514-L518 WeakPolarHBondContact O-CG 3.26Å; Q514-L518 PolarHBondContact O-N 3.41Å; Y515-L518 HydrophobicContact CD1-CD1 4.39Å; Y515-L518 PolarHBondContact O-N 3.26Å; L518-S521 PolarHBondContact O-N 3.45Å; L518-S521 PolarHBondContact O-OG 3.23Å; L518-D522 PolarHBondContact O-N 3.12Å
519	A	94.4	Very high	85.1	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-65.4	-37.4	178.5	0	0	0	0	0	113.3	D493 N496 L497 Y515 F516 R517 V532 S536	D493-A519 WeakPolarHBondContact O-CB 3.47Å; N496-A519 HydrophobicContact CB-CB 3.84Å; L497-A519 HydrophobicContact CB-CB 4.14Å; Y515-A519 PolarHBondContact O-N 2.91Å; F516-A519 PolarHBondContact O-N 3.27Å; R517-A519 VanDerWaalsContact C-N 3.34Å; R517-A519 PolarHBondContact O-N 2.95Å; A519-V532 HydrophobicContact CB-CG1 4.28Å; A519-S536 WeakPolarHBondContact CB-OG 3.44Å
520	A	91.9	Very high	84.5	Confident	21 Å²	21	70.7 Å²	70.7	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-70	-30.6	177.6	0	0	0	0	0	113	F516 R517	F516-A520 VanDerWaalsContact O-CB 3.27Å; F516-A520 WeakPolarHBondContact O-CB 3.38Å; F516-A520 PolarHBondContact O-N 2.82Å; R517-A520 PolarHBondContact O-N 3.13Å
521	S	88.7	Confident	84.3	Confident	82 Å²	82	62.4 Å²	62.4	57%	0.573	32%	0.318	S	S	*	.	H	α-helix	trans	-86.4	-6.7	-179.3	59.7	0	0	0	0	115.1	R517 L518 E523	R517-S521 WeakPolarHBondContact O-CB 3.22Å; R517-S521 PolarHBondContact O-N 2.96Å; R517-S521 PolarHBondContact O-OG 3.21Å; L518-S521 PolarHBondContact O-N 3.45Å; L518-S521 PolarHBondContact O-OG 3.23Å; S521-E523 PolarHBondContact O-N 2.77Å; S521-E523 VanDerWaalsContact O-N 3.13Å
522	D	82.8	Confident	84.2	Confident	33 Å²	33	59.5 Å²	59.5	18%	0.176	30%	0.303	C	S	.	.			trans	-78.6	98.2	-173.9	-169.5	-33.9	0	0	0	111.6	D493 L518 V524 G525 Q533	D493-D522 HydrophobicContact CB-CB 3.92Å; L518-D522 PolarHBondContact O-N 3.12Å; D522-V524 VanDerWaalsContact C-N 3.31Å; D522-V524 PolarHBondContact O-N 3.17Å; D522-V524 WeakPolarHBondContact OD1-CA 3.48Å; D522-V524 WeakPolarHBondContact OD1-CB 3.42Å; D522-V524 PolarHBondContact OD1-N 3.46Å; D522-G525 PolarHBondContact OD1-N 2.78Å; D522-Q533 PolarHBondContact O-NE2 3.35Å
523	E	72.8	Confident	84	Confident	147 Å²	147	59.8 Å²	59.8	69%	0.687	30%	0.304	S	S	*	.	S	Bend	trans	-70.5	-23	179.8	-62.3	-169.7	163.2	0	0	113.9	S521 R526	S521-E523 PolarHBondContact O-N 2.77Å; S521-E523 VanDerWaalsContact O-N 3.13Å; E523-R526 WeakPolarHBondContact O-CB 3.49Å; E523-R526 PolarHBondContact O-N 3.23Å
524	V	67	Low	83.8	Confident	123 Å²	123	58.9 Å²	58.9	75%	0.745	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-35.8	-179.8	-176.2	0	0	0	0	110.3	D522 R526	D522-V524 VanDerWaalsContact C-N 3.31Å; D522-V524 PolarHBondContact O-N 3.17Å; D522-V524 WeakPolarHBondContact OD1-CA 3.48Å; D522-V524 WeakPolarHBondContact OD1-CB 3.42Å; D522-V524 PolarHBondContact OD1-N 3.46Å; V524-R526 PolarHBondContact O-N 3.34Å
525	G	61.5	Low	83.8	Confident	5 Å²	5	53.5 Å²	53.5	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-23.3	175.8	0	0	0	0	0	115.2	D493 D522 Q527 C528 N529	D493-G525 WeakPolarHBondContact OD2-CA 3.14Å; D522-G525 PolarHBondContact OD1-N 2.78Å; G525-Q527 PolarHBondContact O-N 3.08Å; G525-C528 PolarHBondContact O-N 3.26Å; G525-C528 VanDerWaalsContact O-N 3.08Å; G525-N529 CarbonylContact O-C 3.59Å; G525-N529 PolarHBondContact O-N 3.18Å
526	R	62.1	Low	83.7	Confident	141 Å²	141	51.3 Å²	51.3	53%	0.532	27%	0.265	S	S	.	.	H	α-helix	trans	-58.5	-28.1	-173.1	-166.2	179.8	-75.2	170.4	0.4	113.9	E523 V524	E523-R526 WeakPolarHBondContact O-CB 3.49Å; E523-R526 PolarHBondContact O-N 3.23Å; V524-R526 PolarHBondContact O-N 3.34Å
527	Q	60.4	Low	83.6	Confident	185 Å²	185	51.4 Å²	51.4	86%	0.864	27%	0.265	S	S	*	.	H	α-helix	trans	-91.6	-27.4	-179.9	-66.5	169	14	0	0	113.1	G525	G525-Q527 PolarHBondContact O-N 3.08Å
528	C	64.9	Low	83.6	Confident	69 Å²	69	45.7 Å²	45.7	47%	0.466	24%	0.244	S	C	.	.	H	α-helix	trans	-97.9	-45.3	-175.2	-76.9	0	0	0	0	112.8	K443 G525	K443-C528 PolarHBondContact NZ-O 2.83Å; G525-C528 PolarHBondContact O-N 3.26Å; G525-C528 VanDerWaalsContact O-N 3.08Å
529	N	75.6	Confident	83.6	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.027	23%	0.225	C	C	.	.			trans	-127.1	65	-176.9	-52.9	-54.4	0	0	0	109.7	R440 D493 G525 Y531 V532	R440-N529 VanDerWaalsContact CZ-OD1 3.27Å; R440-N529 PolarHBondContact NH1-OD1 3.4Å; R440-N529 PolarHBondContact NH2-OD1 3.09Å; D493-N529 PolarHBondContact OD1-ND2 3.45Å; D493-N529 WeakPolarHBondContact OD2-CB 3.49Å; D493-N529 PolarHBondContact OD2-ND2 3.26Å; G525-N529 CarbonylContact O-C 3.59Å; G525-N529 PolarHBondContact O-N 3.18Å; N529-Y531 PolarHBondContact O-N 2.55Å; N529-V532 HydrophobicContact CB-CB 4.17Å; N529-V532 HydrophobicContact CB-CG2 3.48Å; N529-V532 VanDerWaalsContact CB-CG2 3.48Å; N529-V532 WeakPolarHBondContact O-CB 3.39Å; N529-V532 PolarHBondContact O-N 3.29Å
530	S	81.8	Confident	83.7	Confident	44 Å²	44	42.6 Å²	42.6	31%	0.308	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.9	-169.3	57.7	0	0	0	0	115.3	P534 Y568	S530-P534 WeakPolarHBondContact O-CD 3.25Å; S530-Y568 WeakPolarHBondContact OG-CB 3.23Å
531	Y	91.1	Very high	83.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-16.2	176.6	82.7	-93.2	0	0	0	114.1	F436 E460 L464 L494 L497 N529 P534 Y535 D569	F436-Y531 HydrophobicContact CE2-CE1 4.4Å; E460-Y531 VanDerWaalsContact CG-OH 3.3Å; E460-Y531 WeakPolarHBondContact CG-OH 3.37Å; E460-Y531 PolarHBondContact OE1-OH 3.2Å; L464-Y531 HydrophobicContact CD2-CD2 4.2Å; L464-Y531 HydrophobicContact CD2-CE2 3.7Å; L464-Y531 HydrophobicContact CG-CE2 4.45Å; L494-Y531 WeakPolarHBondContact CD1-OH 3.48Å; L497-Y531 HydrophobicContact CD2-CE2 4.12Å; N529-Y531 PolarHBondContact O-N 2.55Å; Y531-P534 VanDerWaalsContact O-CD 3.3Å; Y531-P534 WeakPolarHBondContact O-CD 3.2Å; Y531-P534 VanDerWaalsContact O-CG 3.32Å; Y531-P534 WeakPolarHBondContact O-CG 3.38Å; Y531-Y535 AromaticContact CD2-CD2 3.67Å; Y531-Y535 HydrophobicContact CD2-CD2 3.67Å; Y531-Y535 HydrophobicContact CD2-CE2 4.04Å; Y531-Y535 AromaticContact CD2-CG 3.93Å; Y531-Y535 HydrophobicContact CD2-CG 3.93Å; Y531-Y535 HydrophobicContact CG-CD2 4.39Å; Y531-Y535 WeakPolarHBondContact O-CB 3.41Å; Y531-Y535 WeakPolarHBondContact O-CD2 3.36Å; Y531-Y535 PolarHBondContact O-N 3.02Å; Y531-Y535 VanDerWaalsContact O-N 3.1Å; Y531-D569 WeakPolarHBondContact CB-O 3.4Å
532	V	93.7	Very high	84	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-46	-171.4	167.1	0	0	0	0	111.9	D493 L494 L497 A519 N529 Y535 S536	D493-V532 HydrophobicContact CB-CG1 3.91Å; L494-V532 HydrophobicContact CB-CG2 4.16Å; L494-V532 HydrophobicContact CD1-CG2 4.05Å; L497-V532 HydrophobicContact CB-CG1 4.04Å; L497-V532 HydrophobicContact CD2-CB 4.32Å; L497-V532 HydrophobicContact CD2-CG1 4.1Å; L497-V532 HydrophobicContact CD2-CG2 4.07Å; A519-V532 HydrophobicContact CB-CG1 4.28Å; N529-V532 HydrophobicContact CB-CB 4.17Å; N529-V532 HydrophobicContact CB-CG2 3.48Å; N529-V532 VanDerWaalsContact CB-CG2 3.48Å; N529-V532 WeakPolarHBondContact O-CB 3.39Å; N529-V532 PolarHBondContact O-N 3.29Å; V532-Y535 PolarHBondContact O-N 3.5Å; V532-S536 VanDerWaalsContact O-CB 3.29Å; V532-S536 WeakPolarHBondContact O-CB 3.27Å; V532-S536 PolarHBondContact O-N 3.28Å; V532-S536 PolarHBondContact O-OG 2.8Å
533	Q	93.1	Very high	84.4	Confident	7 Å²	7	37.9 Å²	37.9	3%	0.033	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-56.5	177.9	-69.8	-173.8	-26.6	0	0	112.5	D522 Y535 S536 C537 Y565	D522-Q533 PolarHBondContact O-NE2 3.35Å; Q533-Y535 VanDerWaalsContact C-N 3.32Å; Q533-Y535 PolarHBondContact O-N 3.21Å; Q533-S536 WeakPolarHBondContact O-CB 3.46Å; Q533-S536 PolarHBondContact O-N 2.89Å; Q533-S536 VanDerWaalsContact O-N 3.09Å; Q533-C537 PolarHBondContact O-N 2.73Å; Q533-Y565 HydrophobicContact CB-CD1 4.44Å; Q533-Y565 HydrophobicContact CB-CE1 3.66Å
534	P	94.6	Very high	85.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-37.5	-179.2	20.3	-30.6	0	0	0	112.6	S530 Y531 C537 Y538 Y565 Y568 L574	S530-P534 WeakPolarHBondContact O-CD 3.25Å; Y531-P534 VanDerWaalsContact O-CD 3.3Å; Y531-P534 WeakPolarHBondContact O-CD 3.2Å; Y531-P534 VanDerWaalsContact O-CG 3.32Å; Y531-P534 WeakPolarHBondContact O-CG 3.38Å; P534-C537 PolarHBondContact O-N 3.43Å; P534-Y538 PolarHBondContact O-N 3.22Å; P534-Y565 HydrophobicContact CB-CD1 4.26Å; P534-Y565 HydrophobicContact CB-CD2 3.71Å; P534-Y565 HydrophobicContact CB-CE2 4.27Å; P534-Y565 HydrophobicContact CB-CG 3.69Å; P534-Y565 HydrophobicContact CG-CD1 4.19Å; P534-Y565 HydrophobicContact CG-CD2 4.5Å; P534-Y565 HydrophobicContact CG-CG 4.01Å; P534-Y568 HydrophobicContact CB-CE1 4.19Å; P534-Y568 HydrophobicContact CB-CE2 4.31Å; P534-Y568 HydrophobicContact CG-CD1 4Å; P534-Y568 HydrophobicContact CG-CD2 4.04Å; P534-Y568 HydrophobicContact CG-CE1 3.85Å; P534-Y568 HydrophobicContact CG-CE2 3.84Å; P534-Y568 HydrophobicContact CG-CG 4.12Å; P534-L574 HydrophobicContact CB-CD2 3.74Å
535	Y	95.7	Very high	86.4	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.8	-39.1	174.2	-85.8	-112	0	0	0	111.8	Y463 L464 Y531 V532 Q533 Y538 E539 Y568 F570 L574	Y463-Y535 AromaticContact CE1-CD1 3.91Å; Y463-Y535 HydrophobicContact CE1-CD1 3.91Å; Y463-Y535 WeakPolarHBondContact OH-CD1 3.31Å; L464-Y535 HydrophobicContact CD2-CE1 4.31Å; Y531-Y535 AromaticContact CD2-CD2 3.67Å; Y531-Y535 HydrophobicContact CD2-CD2 3.67Å; Y531-Y535 HydrophobicContact CD2-CE2 4.04Å; Y531-Y535 AromaticContact CD2-CG 3.93Å; Y531-Y535 HydrophobicContact CD2-CG 3.93Å; Y531-Y535 HydrophobicContact CG-CD2 4.39Å; Y531-Y535 WeakPolarHBondContact O-CB 3.41Å; Y531-Y535 WeakPolarHBondContact O-CD2 3.36Å; Y531-Y535 PolarHBondContact O-N 3.02Å; Y531-Y535 VanDerWaalsContact O-N 3.1Å; V532-Y535 PolarHBondContact O-N 3.5Å; Q533-Y535 VanDerWaalsContact C-N 3.32Å; Q533-Y535 PolarHBondContact O-N 3.21Å; Y535-Y538 PolarHBondContact O-N 2.73Å; Y535-E539 VanDerWaalsContact O-CG 3.3Å; Y535-E539 WeakPolarHBondContact O-CG 3.23Å; Y535-E539 PolarHBondContact O-N 3.47Å; Y535-Y568 HydrophobicContact CD2-CE2 4.45Å; Y535-Y568 HydrophobicContact CE2-CE2 4.11Å; Y535-F570 VanDerWaalsContact OH-CB 3.31Å; Y535-F570 WeakPolarHBondContact OH-CB 3.38Å; Y535-F570 PolarHBondContact OH-O 3.48Å; Y535-L574 HydrophobicContact CD1-CD1 4.05Å; Y535-L574 HydrophobicContact CD2-CB 4.32Å; Y535-L574 HydrophobicContact CD2-CD1 4.02Å; Y535-L574 HydrophobicContact CD2-CD2 3.71Å; Y535-L574 HydrophobicContact CD2-CG 4.23Å; Y535-L574 HydrophobicContact CE1-CD1 4.08Å; Y535-L574 HydrophobicContact CE2-CB 3.68Å; Y535-L574 HydrophobicContact CE2-CD1 4.06Å; Y535-L574 HydrophobicContact CE2-CD2 3.93Å; Y535-L574 HydrophobicContact CE2-CG 4.09Å; Y535-L574 HydrophobicContact CG-CD1 4.02Å; Y535-L574 HydrophobicContact CG-CD2 4.35Å
536	S	96.4	Very high	87.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-42.2	176.8	-58.3	0	0	0	0	112.1	A519 V532 Q533 Y538 E539 L540	A519-S536 WeakPolarHBondContact CB-OG 3.44Å; V532-S536 VanDerWaalsContact O-CB 3.29Å; V532-S536 WeakPolarHBondContact O-CB 3.27Å; V532-S536 PolarHBondContact O-N 3.28Å; V532-S536 PolarHBondContact O-OG 2.8Å; Q533-S536 WeakPolarHBondContact O-CB 3.46Å; Q533-S536 PolarHBondContact O-N 2.89Å; Q533-S536 VanDerWaalsContact O-N 3.09Å; S536-Y538 VanDerWaalsContact C-N 3.34Å; S536-Y538 PolarHBondContact O-N 3.12Å; S536-E539 PolarHBondContact O-N 3.24Å; S536-L540 VanDerWaalsContact O-CB 3.25Å; S536-L540 WeakPolarHBondContact O-CB 3.19Å; S536-L540 PolarHBondContact O-N 3.43Å
537	C	95.7	Very high	88.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-45.6	173.1	-70.4	0	0	0	0	111.2	Q533 P534 A541 L557 A561	Q533-C537 PolarHBondContact O-N 2.73Å; P534-C537 PolarHBondContact O-N 3.43Å; C537-A541 VanDerWaalsContact O-CB 3.27Å; C537-A541 WeakPolarHBondContact O-CB 3.32Å; C537-A541 PolarHBondContact O-N 3.34Å; C537-L557 HydrophobicContact CB-CD2 4.4Å; C537-A561 HydrophobicContact CB-CB 3.97Å
538	Y	95.7	Very high	90	Very high	21 Å²	21	25.6 Å²	25.6	8%	0.082	15%	0.154	C	C	.	.	H	α-helix	trans	-61.5	-48.6	175.6	168.7	-87.7	0	0	0	112.6	P534 Y535 S536 L540 A541 C542 L558 L574 R577 I578 A581	P534-Y538 PolarHBondContact O-N 3.22Å; Y535-Y538 PolarHBondContact O-N 2.73Å; S536-Y538 VanDerWaalsContact C-N 3.34Å; S536-Y538 PolarHBondContact O-N 3.12Å; Y538-L540 PolarHBondContact O-N 3.31Å; Y538-A541 WeakPolarHBondContact O-CB 3.34Å; Y538-A541 PolarHBondContact O-N 2.98Å; Y538-C542 PolarHBondContact O-N 3.45Å; Y538-C542 PolarHBondContact O-SG 3.47Å; Y538-C542 VanDerWaalsContact O-SG 3.41Å; Y538-L558 HydrophobicContact CD2-CD2 3.65Å; Y538-L558 HydrophobicContact CE2-CD2 4.14Å; Y538-L574 HydrophobicContact CD1-CD1 4.02Å; Y538-L574 HydrophobicContact CD2-CD1 4.14Å; Y538-L574 HydrophobicContact CG-CD1 3.67Å; Y538-R577 HydrophobicContact CE1-CB 4.49Å; Y538-R577 HydrophobicContact CE2-CB 3.77Å; Y538-R577 PolarHBondContact OH-NE 3.27Å; Y538-I578 HydrophobicContact CD2-CG1 3.63Å; Y538-I578 HydrophobicContact CE2-CG1 4.23Å; Y538-A581 HydrophobicContact CE2-CB 4.38Å
539	E	95.9	Very high	91.2	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-67.2	-38.9	-177.3	-62.6	-63.5	-177.6	0	0	111.4	Y463 L497 R504 F516 Y535 S536 C542 V543 R577	Y463-E539 HydrophobicContact CE2-CG 4.27Å; Y463-E539 WeakPolarHBondContact CE2-OE1 3.36Å; Y463-E539 WeakPolarHBondContact OH-CG 3.21Å; Y463-E539 PolarHBondContact OH-OE1 2.79Å; L497-E539 HydrophobicContact CD1-CG 4.35Å; R504-E539 IonicContact CZ-OE2 2.77Å; R504-E539 IonicContact NH1-OE2 3.97Å; R504-E539 PolarHBondContact NH1-OE2 3.39Å; R504-E539 IonicContact NH2-OE1 3.68Å; R504-E539 IonicContact NH2-OE2 2.7Å; R504-E539 PolarHBondContact NH2-OE2 2.95Å; F516-E539 HydrophobicContact CD1-CB 3.96Å; F516-E539 HydrophobicContact CD2-CB 4.19Å; F516-E539 HydrophobicContact CE1-CB 3.56Å; F516-E539 HydrophobicContact CE1-CG 4.06Å; F516-E539 HydrophobicContact CE2-CB 3.82Å; F516-E539 HydrophobicContact CG-CB 4.26Å; F516-E539 HydrophobicContact CZ-CB 3.49Å; F516-E539 VanDerWaalsContact CZ-CB 3.49Å; F516-E539 HydrophobicContact CZ-CG 4.18Å; Y535-E539 VanDerWaalsContact O-CG 3.3Å; Y535-E539 WeakPolarHBondContact O-CG 3.23Å; Y535-E539 PolarHBondContact O-N 3.47Å; S536-E539 PolarHBondContact O-N 3.24Å; E539-C542 PolarHBondContact O-N 3.26Å; E539-V543 WeakPolarHBondContact O-CG2 3.29Å; E539-V543 PolarHBondContact O-N 3.37Å; E539-R577 IonicContact OE1-CZ 3.34Å; E539-R577 IonicContact OE1-NH1 3.73Å; E539-R577 PolarHBondContact OE1-NH1 3.45Å; E539-R577 IonicContact OE1-NH2 3.97Å; E539-R577 PolarHBondContact OE1-NH2 2.91Å; E539-R577 IonicContact OE2-NH2 2.9Å
540	L	96.1	Very high	92	Very high	9 Å²	9	31.6 Å²	31.6	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-44.8	172.2	179.9	57.6	0	0	0	111	V513 F516 R517 S536 Y538 C542 V543 L544 L557	V513-L540 HydrophobicContact CB-CD1 4.2Å; V513-L540 HydrophobicContact CG1-CD1 3.93Å; V513-L540 HydrophobicContact CG2-CD1 4.02Å; F516-L540 HydrophobicContact CB-CB 3.88Å; F516-L540 HydrophobicContact CB-CD1 4.45Å; F516-L540 HydrophobicContact CD2-CB 4.48Å; R517-L540 HydrophobicContact CG-CD2 3.73Å; S536-L540 VanDerWaalsContact O-CB 3.25Å; S536-L540 WeakPolarHBondContact O-CB 3.19Å; S536-L540 PolarHBondContact O-N 3.43Å; Y538-L540 PolarHBondContact O-N 3.31Å; L540-C542 VanDerWaalsContact C-N 3.34Å; L540-C542 PolarHBondContact O-N 3.07Å; L540-V543 PolarHBondContact O-N 3.43Å; L540-V543 VanDerWaalsContact O-N 3.13Å; L540-L544 HydrophobicContact CD1-CD1 4.25Å; L540-L544 HydrophobicContact CD1-CD2 4.47Å; L540-L544 HydrophobicContact CD1-CG 4.16Å; L540-L544 HydrophobicContact CG-CD1 4.15Å; L540-L544 HydrophobicContact CG-CG 4.42Å; L540-L544 WeakPolarHBondContact O-CG 3.31Å; L540-L544 PolarHBondContact O-N 3.45Å; L540-L557 HydrophobicContact CB-CD1 4.16Å; L540-L557 HydrophobicContact CD2-CD1 3.6Å; L540-L557 HydrophobicContact CG-CD1 3.61Å
541	A	95.2	Very high	92.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57	-47.6	176.5	0	0	0	0	0	111.7	C537 Y538 V543 L544 L545 G554 L557 L558	C537-A541 VanDerWaalsContact O-CB 3.27Å; C537-A541 WeakPolarHBondContact O-CB 3.32Å; C537-A541 PolarHBondContact O-N 3.34Å; Y538-A541 WeakPolarHBondContact O-CB 3.34Å; Y538-A541 PolarHBondContact O-N 2.98Å; A541-V543 PolarHBondContact O-N 3.04Å; A541-L544 PolarHBondContact O-N 3.18Å; A541-L544 VanDerWaalsContact O-N 3.12Å; A541-L545 WeakPolarHBondContact O-CB 3.45Å; A541-L545 VanDerWaalsContact O-CG 3.24Å; A541-L545 WeakPolarHBondContact O-CG 3.29Å; A541-L545 PolarHBondContact O-N 3.02Å; A541-G554 VanDerWaalsContact CB-O 3.26Å; A541-G554 WeakPolarHBondContact CB-O 3.43Å; A541-L557 HydrophobicContact CB-CB 3.79Å; A541-L558 HydrophobicContact CB-CD2 3.71Å; A541-L558 HydrophobicContact CB-CG 3.73Å
542	C	91.9	Very high	92.4	Very high	25 Å²	25	35.1 Å²	35.1	17%	0.169	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-36.2	176.8	-71	0	0	0	0	112.8	Y538 E539 L540	Y538-C542 PolarHBondContact O-N 3.45Å; Y538-C542 PolarHBondContact O-SG 3.47Å; Y538-C542 VanDerWaalsContact O-SG 3.41Å; E539-C542 PolarHBondContact O-N 3.26Å; L540-C542 VanDerWaalsContact C-N 3.34Å; L540-C542 PolarHBondContact O-N 3.07Å
543	V	91.6	Very high	92.4	Very high	12 Å²	12	41.8 Å²	41.8	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-69.9	-43.4	175.9	175.9	0	0	0	0	111.5	R504 T509 V513 F516 E539 L540 A541 N546	R504-V543 HydrophobicContact CG-CG2 4.3Å; T509-V543 HydrophobicContact CG2-CG1 3.58Å; V513-V543 HydrophobicContact CG2-CB 4.46Å; V513-V543 HydrophobicContact CG2-CG1 3.66Å; F516-V543 HydrophobicContact CE2-CG2 4.1Å; E539-V543 WeakPolarHBondContact O-CG2 3.29Å; E539-V543 PolarHBondContact O-N 3.37Å; L540-V543 PolarHBondContact O-N 3.43Å; L540-V543 VanDerWaalsContact O-N 3.13Å; A541-V543 PolarHBondContact O-N 3.04Å; V543-N546 WeakPolarHBondContact O-CB 3.43Å; V543-N546 PolarHBondContact O-N 2.99Å
544	L	91.6	Very high	92.4	Very high	15 Å²	15	41.4 Å²	41.4	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-71.9	-28.8	-178.6	-62.4	-177.9	0	0	0	113.1	V513 L540 A541 N546 S547 T550 K553 L557	V513-L544 HydrophobicContact CG2-CD2 4.49Å; L540-L544 HydrophobicContact CD1-CD1 4.25Å; L540-L544 HydrophobicContact CD1-CD2 4.47Å; L540-L544 HydrophobicContact CD1-CG 4.16Å; L540-L544 HydrophobicContact CG-CD1 4.15Å; L540-L544 HydrophobicContact CG-CG 4.42Å; L540-L544 WeakPolarHBondContact O-CG 3.31Å; L540-L544 PolarHBondContact O-N 3.45Å; A541-L544 PolarHBondContact O-N 3.18Å; A541-L544 VanDerWaalsContact O-N 3.12Å; L544-N546 PolarHBondContact O-N 3.2Å; L544-S547 PolarHBondContact O-N 3.41Å; L544-T550 HydrophobicContact CD2-CG2 4.3Å; L544-T550 CarbonylContact O-C 3.59Å; L544-T550 PolarHBondContact O-OG1 3.35Å; L544-K553 HydrophobicContact CD1-CB 4.1Å; L544-L557 HydrophobicContact CD1-CD1 3.84Å
545	L	89.8	Confident	92.4	Very high	41 Å²	41	46 Å²	46	22%	0.215	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.5	176.6	-74.2	168.5	0	0	0	113.3	A541 S547 A551 R555 L558 M585	A541-L545 WeakPolarHBondContact O-CB 3.45Å; A541-L545 VanDerWaalsContact O-CG 3.24Å; A541-L545 WeakPolarHBondContact O-CG 3.29Å; A541-L545 PolarHBondContact O-N 3.02Å; L545-S547 PolarHBondContact O-N 2.93Å; L545-A551 HydrophobicContact CD2-CB 4.44Å; L545-R555 HydrophobicContact CD2-CG 4.19Å; L545-L558 HydrophobicContact CD1-CD1 3.8Å; L545-L558 HydrophobicContact CD1-CG 4.43Å; L545-M585 HydrophobicContact CD1-SD 3.86Å; L545-M585 HydrophobicContact CD2-CE 4.45Å; L545-M585 HydrophobicContact CD2-SD 3.74Å; L545-M585 HydrophobicContact CG-SD 4.47Å
546	N	85.4	Confident	92.3	Very high	140 Å²	140	51.9 Å²	51.9	75%	0.749	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-10.9	177.1	-64.5	-24.7	0	0	0	113.7	V543 L544	V543-N546 WeakPolarHBondContact O-CB 3.43Å; V543-N546 PolarHBondContact O-N 2.99Å; L544-N546 PolarHBondContact O-N 3.2Å
547	S	86.4	Confident	92.3	Very high	32 Å²	32	53.1 Å²	53.1	22%	0.224	27%	0.272	C	S	.	.	S	Bend	trans	-122.9	129.9	178.4	137.3	0	0	0	0	110.6	L544 L545 E549 T550 A551	L544-S547 PolarHBondContact O-N 3.41Å; L545-S547 PolarHBondContact O-N 2.93Å; S547-E549 PolarHBondContact O-N 3.09Å; S547-E549 PolarHBondContact OG-N 3.13Å; S547-E549 PolarHBondContact OG-OE2 3Å; S547-T550 PolarHBondContact O-N 3.05Å; S547-T550 VanDerWaalsContact O-N 3.12Å; S547-T550 PolarHBondContact OG-N 3.34Å; S547-T550 PolarHBondContact OG-OG1 2.94Å; S547-A551 WeakPolarHBondContact O-CB 3.32Å; S547-A551 PolarHBondContact O-N 3.49Å
548	P	87.4	Confident	92.2	Very high	116 Å²	116	53.1 Å²	53.1	75%	0.753	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-35.9	177.6	-26	34.9	0	0	0	113.6	T550	P548-T550 VanDerWaalsContact C-N 3.26Å; P548-T550 PolarHBondContact O-N 3.46Å
549	E	90.6	Very high	92	Very high	160 Å²	160	55.7 Å²	55.7	75%	0.748	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-26.4	-178.6	-53.8	90.1	176.8	0	0	112.9	S547	S547-E549 PolarHBondContact O-N 3.09Å; S547-E549 PolarHBondContact OG-N 3.13Å; S547-E549 PolarHBondContact OG-OE2 3Å
550	T	91.4	Very high	91.9	Very high	39 Å²	39	58.7 Å²	58.7	24%	0.239	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-4	-176.3	60.4	0	0	0	0	113.8	L544 S547 P548 E552 K553 G554	L544-T550 HydrophobicContact CD2-CG2 4.3Å; L544-T550 CarbonylContact O-C 3.59Å; L544-T550 PolarHBondContact O-OG1 3.35Å; S547-T550 PolarHBondContact O-N 3.05Å; S547-T550 VanDerWaalsContact O-N 3.12Å; S547-T550 PolarHBondContact OG-N 3.34Å; S547-T550 PolarHBondContact OG-OG1 2.94Å; P548-T550 VanDerWaalsContact C-N 3.26Å; P548-T550 PolarHBondContact O-N 3.46Å; T550-E552 VanDerWaalsContact C-N 3.32Å; T550-E552 PolarHBondContact O-N 2.89Å; T550-K553 WeakPolarHBondContact O-CB 3.29Å; T550-K553 PolarHBondContact O-N 3.12Å; T550-K553 VanDerWaalsContact O-N 3.11Å; T550-G554 PolarHBondContact O-N 3.24Å
551	A	90.5	Very high	91.7	Very high	13 Å²	13	58.3 Å²	58.3	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-57.1	-38.8	-178.2	0	0	0	0	0	113.6	L545 S547 G554 R555	L545-A551 HydrophobicContact CD2-CB 4.44Å; S547-A551 WeakPolarHBondContact O-CB 3.32Å; S547-A551 PolarHBondContact O-N 3.49Å; A551-G554 WeakPolarHBondContact O-CA 3.48Å; A551-G554 PolarHBondContact O-N 3.18Å; A551-R555 WeakPolarHBondContact O-CG 3.46Å; A551-R555 PolarHBondContact O-N 2.92Å
552	E	92.1	Very high	91.5	Very high	106 Å²	106	62.7 Å²	62.7	50%	0.495	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.7	-174.6	57.4	-152.8	0	0	112	T550 G554 R555 M556	T550-E552 VanDerWaalsContact C-N 3.32Å; T550-E552 PolarHBondContact O-N 2.89Å; E552-G554 VanDerWaalsContact C-N 3.28Å; E552-G554 PolarHBondContact O-N 3.1Å; E552-R555 WeakPolarHBondContact O-CB 3.47Å; E552-R555 PolarHBondContact O-N 3.41Å; E552-R555 VanDerWaalsContact O-N 3.17Å; E552-R555 IonicContact OE2-CZ 2.88Å; E552-R555 IonicContact OE2-NE 3.22Å; E552-R555 PolarHBondContact OE2-NE 3.47Å; E552-R555 IonicContact OE2-NH2 3.95Å; E552-R555 PolarHBondContact OE2-NH2 3.26Å; E552-M556 WeakPolarHBondContact O-CG 3.46Å; E552-M556 PolarHBondContact O-N 2.97Å
553	K	93.9	Very high	91.4	Very high	139 Å²	139	67.3 Å²	67.3	60%	0.604	34%	0.337	S	S	*	.	H	α-helix	trans	-63.1	-38.6	173.9	-64.5	179.3	-179	176	0	111	L544 T550 M556 L557	L544-K553 HydrophobicContact CD1-CB 4.1Å; T550-K553 WeakPolarHBondContact O-CB 3.29Å; T550-K553 PolarHBondContact O-N 3.12Å; T550-K553 VanDerWaalsContact O-N 3.11Å; K553-M556 PolarHBondContact O-N 3.13Å; K553-L557 WeakPolarHBondContact O-CG 3.42Å; K553-L557 PolarHBondContact O-N 2.84Å
554	G	93.3	Very high	91.4	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-58.7	-45	172.7	0	0	0	0	0	112.4	A541 T550 A551 E552 M556 L557 L558	A541-G554 VanDerWaalsContact CB-O 3.26Å; A541-G554 WeakPolarHBondContact CB-O 3.43Å; T550-G554 PolarHBondContact O-N 3.24Å; A551-G554 WeakPolarHBondContact O-CA 3.48Å; A551-G554 PolarHBondContact O-N 3.18Å; E552-G554 VanDerWaalsContact C-N 3.28Å; E552-G554 PolarHBondContact O-N 3.1Å; G554-M556 PolarHBondContact O-N 3.41Å; G554-L557 PolarHBondContact O-N 3.23Å; G554-L558 PolarHBondContact O-N 3.21Å
555	R	93.4	Very high	91.3	Very high	95 Å²	95	72.7 Å²	72.7	36%	0.358	36%	0.363	S	S	.	.	H	α-helix	trans	-60.5	-45.7	176	-72.9	-170.4	-79.7	-88.4	4.8	112.8	L545 A551 E552 L557 L558 L559 M585	L545-R555 HydrophobicContact CD2-CG 4.19Å; A551-R555 WeakPolarHBondContact O-CG 3.46Å; A551-R555 PolarHBondContact O-N 2.92Å; E552-R555 WeakPolarHBondContact O-CB 3.47Å; E552-R555 PolarHBondContact O-N 3.41Å; E552-R555 VanDerWaalsContact O-N 3.17Å; E552-R555 IonicContact OE2-CZ 2.88Å; E552-R555 IonicContact OE2-NE 3.22Å; E552-R555 PolarHBondContact OE2-NE 3.47Å; E552-R555 IonicContact OE2-NH2 3.95Å; E552-R555 PolarHBondContact OE2-NH2 3.26Å; R555-L557 VanDerWaalsContact C-N 3.31Å; R555-L557 PolarHBondContact O-N 3.06Å; R555-L558 PolarHBondContact O-N 3.31Å; R555-L559 PolarHBondContact O-N 3.48Å; R555-L559 VanDerWaalsContact O-N 3.07Å; R555-M585 HydrophobicContact CG-CE 3.49Å; R555-M585 VanDerWaalsContact CG-CE 3.49Å
556	M	94.7	Very high	91.3	Very high	124 Å²	124	74.7 Å²	74.7	61%	0.611	39%	0.385	S	S	*	.	H	α-helix	trans	-59.8	-42.3	176.7	-68.5	-178.6	67.1	0	0	111.8	E552 K553 G554 L559 Q560	E552-M556 WeakPolarHBondContact O-CG 3.46Å; E552-M556 PolarHBondContact O-N 2.97Å; K553-M556 PolarHBondContact O-N 3.13Å; G554-M556 PolarHBondContact O-N 3.41Å; M556-L559 WeakPolarHBondContact O-CB 3.42Å; M556-L559 PolarHBondContact O-N 3.36Å; M556-Q560 WeakPolarHBondContact O-CB 3.39Å; M556-Q560 PolarHBondContact O-N 3.03Å
557	L	95.2	Very high	91.3	Very high	27 Å²	27	71.5 Å²	71.5	14%	0.141	39%	0.385	C	S	.	.	H	α-helix	trans	-67	-35.3	177.5	-73.8	169.8	0	0	0	113.2	C537 L540 A541 L544 K553 G554 R555 L559 Q560 A561	C537-L557 HydrophobicContact CB-CD2 4.4Å; L540-L557 HydrophobicContact CB-CD1 4.16Å; L540-L557 HydrophobicContact CD2-CD1 3.6Å; L540-L557 HydrophobicContact CG-CD1 3.61Å; A541-L557 HydrophobicContact CB-CB 3.79Å; L544-L557 HydrophobicContact CD1-CD1 3.84Å; K553-L557 WeakPolarHBondContact O-CG 3.42Å; K553-L557 PolarHBondContact O-N 2.84Å; G554-L557 PolarHBondContact O-N 3.23Å; R555-L557 VanDerWaalsContact C-N 3.31Å; R555-L557 PolarHBondContact O-N 3.06Å; L557-L559 VanDerWaalsContact C-N 3.33Å; L557-Q560 PolarHBondContact O-N 3.39Å; L557-A561 WeakPolarHBondContact O-CB 3.38Å; L557-A561 PolarHBondContact O-N 3.48Å
558	L	93.1	Very high	91.4	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.4	-41.1	172	-74.8	-176.4	0	0	0	111.6	Y538 A541 L545 G554 R555 K562 I578 A581 F582 M585	Y538-L558 HydrophobicContact CD2-CD2 3.65Å; Y538-L558 HydrophobicContact CE2-CD2 4.14Å; A541-L558 HydrophobicContact CB-CD2 3.71Å; A541-L558 HydrophobicContact CB-CG 3.73Å; L545-L558 HydrophobicContact CD1-CD1 3.8Å; L545-L558 HydrophobicContact CD1-CG 4.43Å; G554-L558 PolarHBondContact O-N 3.21Å; R555-L558 PolarHBondContact O-N 3.31Å; L558-K562 WeakPolarHBondContact O-CB 3.32Å; L558-K562 PolarHBondContact O-N 3.03Å; L558-I578 HydrophobicContact CD2-CG1 4.38Å; L558-A581 HydrophobicContact CD1-CB 3.94Å; L558-A581 HydrophobicContact CD2-CB 4.42Å; L558-F582 HydrophobicContact CB-CE1 4.22Å; L558-F582 HydrophobicContact CB-CE2 4.06Å; L558-F582 HydrophobicContact CB-CZ 3.63Å; L558-F582 HydrophobicContact CD1-CD1 4.3Å; L558-F582 HydrophobicContact CD1-CE1 4.08Å; L558-F582 HydrophobicContact CD1-CE2 4.45Å; L558-F582 HydrophobicContact CD1-CZ 4.16Å; L558-M585 HydrophobicContact CD1-SD 4.22Å
559	L	93.3	Very high	91.4	Very high	75 Å²	75	66.1 Å²	66.1	39%	0.393	35%	0.347	S	S	.	.	H	α-helix	trans	-65.6	-46	176.9	-166.1	67.4	0	0	0	110.6	R555 M556 L557 A561 K562 E563	R555-L559 PolarHBondContact O-N 3.48Å; R555-L559 VanDerWaalsContact O-N 3.07Å; M556-L559 WeakPolarHBondContact O-CB 3.42Å; M556-L559 PolarHBondContact O-N 3.36Å; L557-L559 VanDerWaalsContact C-N 3.33Å; L559-A561 PolarHBondContact O-N 2.91Å; L559-K562 WeakPolarHBondContact O-CB 3.49Å; L559-K562 PolarHBondContact O-N 3.2Å; L559-E563 HydrophobicContact CD1-CG 4.05Å; L559-E563 WeakPolarHBondContact CD1-OE1 3.4Å; L559-E563 HydrophobicContact CG-CG 4.28Å; L559-E563 WeakPolarHBondContact CG-OE2 3.12Å; L559-E563 WeakPolarHBondContact O-CB 3.39Å; L559-E563 PolarHBondContact O-N 3.2Å
560	Q	93.3	Very high	91.3	Very high	65 Å²	65	59.1 Å²	59.1	30%	0.304	31%	0.314	S	S	.	.	H	α-helix	trans	-55.4	-49.8	175	-163.6	-167.6	-9.8	0	0	111.4	M556 L557 K562 E563 D564 Y565	M556-Q560 WeakPolarHBondContact O-CB 3.39Å; M556-Q560 PolarHBondContact O-N 3.03Å; L557-Q560 PolarHBondContact O-N 3.39Å; Q560-K562 PolarHBondContact O-N 3.45Å; Q560-K562 VanDerWaalsContact O-N 3.16Å; Q560-E563 PolarHBondContact O-N 3.42Å; Q560-D564 HydrophobicContact CG-CB 4.15Å; Q560-D564 WeakPolarHBondContact CG-OD2 3.33Å; Q560-D564 WeakPolarHBondContact O-CB 3.31Å; Q560-D564 PolarHBondContact O-N 2.69Å; Q560-Y565 HydrophobicContact CG-CE2 4.22Å; Q560-Y565 PolarHBondContact NE2-OH 3.09Å; Q560-Y565 VanDerWaalsContact O-CD2 3.26Å; Q560-Y565 WeakPolarHBondContact O-CD2 3.32Å; Q560-Y565 WeakPolarHBondContact O-CE2 3.37Å
561	A	92.3	Very high	91.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-27.3	178.3	0	0	0	0	0	113.3	C537 L557 L559 I578	C537-A561 HydrophobicContact CB-CB 3.97Å; L557-A561 WeakPolarHBondContact O-CB 3.38Å; L557-A561 PolarHBondContact O-N 3.48Å; L559-A561 PolarHBondContact O-N 2.91Å; A561-I578 HydrophobicContact CB-CD1 3.9Å
562	K	90.1	Very high	90.9	Very high	93 Å²	93	64 Å²	64	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-87.6	-39.8	-178.6	-175	-174.6	172.7	-166.4	0	113.3	L558 L559 Q560 I578	L558-K562 WeakPolarHBondContact O-CB 3.32Å; L558-K562 PolarHBondContact O-N 3.03Å; L559-K562 WeakPolarHBondContact O-CB 3.49Å; L559-K562 PolarHBondContact O-N 3.2Å; Q560-K562 PolarHBondContact O-N 3.45Å; Q560-K562 VanDerWaalsContact O-N 3.16Å; K562-I578 HydrophobicContact CB-CD1 4.14Å; K562-I578 HydrophobicContact CB-CG2 4.34Å; K562-I578 HydrophobicContact CD-CG2 4.4Å
563	E	90.9	Very high	90.6	Very high	122 Å²	122	61.5 Å²	61.5	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-104	-31.9	-166.6	-62.5	-172.4	165.5	0	0	113.1	L559 Q560	L559-E563 HydrophobicContact CD1-CG 4.05Å; L559-E563 WeakPolarHBondContact CD1-OE1 3.4Å; L559-E563 HydrophobicContact CG-CG 4.28Å; L559-E563 WeakPolarHBondContact CG-OE2 3.12Å; L559-E563 WeakPolarHBondContact O-CB 3.39Å; L559-E563 PolarHBondContact O-N 3.2Å; Q560-E563 PolarHBondContact O-N 3.42Å
564	D	90.9	Very high	90.4	Very high	108 Å²	108	54.9 Å²	54.9	58%	0.578	29%	0.293	S	S	*	.	S	Bend	trans	-91.8	-5.7	-171.2	-64.5	6.5	0	0	0	113.2	Q560	Q560-D564 HydrophobicContact CG-CB 4.15Å; Q560-D564 WeakPolarHBondContact CG-OD2 3.33Å; Q560-D564 WeakPolarHBondContact O-CB 3.31Å; Q560-D564 PolarHBondContact O-N 2.69Å
565	Y	89.8	Confident	90.1	Very high	32 Å²	32	57.5 Å²	57.5	13%	0.125	30%	0.304	C	S	.	.			trans	-130	138.5	-175.8	-53.6	-86.6	0	0	0	111.3	Q533 P534 Q560	Q533-Y565 HydrophobicContact CB-CD1 4.44Å; Q533-Y565 HydrophobicContact CB-CE1 3.66Å; P534-Y565 HydrophobicContact CB-CD1 4.26Å; P534-Y565 HydrophobicContact CB-CD2 3.71Å; P534-Y565 HydrophobicContact CB-CE2 4.27Å; P534-Y565 HydrophobicContact CB-CG 3.69Å; P534-Y565 HydrophobicContact CG-CD1 4.19Å; P534-Y565 HydrophobicContact CG-CD2 4.5Å; P534-Y565 HydrophobicContact CG-CG 4.01Å; Q560-Y565 HydrophobicContact CG-CE2 4.22Å; Q560-Y565 PolarHBondContact NE2-OH 3.09Å; Q560-Y565 VanDerWaalsContact O-CD2 3.26Å; Q560-Y565 WeakPolarHBondContact O-CD2 3.32Å; Q560-Y565 WeakPolarHBondContact O-CE2 3.37Å
566	A	90.1	Very high	89.6	Confident	82 Å²	82	56.1 Å²	56.1	68%	0.678	31%	0.307	S	S	*	.			trans	-152.3	159	175.7	0	0	0	0	0	111.6
567	G	85.6	Confident	89.1	Confident	73 Å²	73	51.2 Å²	51.2	75%	0.753	28%	0.281	S	S	*	.	S	Bend	trans	74.9	23.9	171.4	0	0	0	0	0	114.7	E571	G567-E571 PolarHBondContact N-OE2 3.43Å
568	Y	88.1	Confident	88.8	Confident	12 Å²	12	50 Å²	50	5%	0.047	28%	0.275	C	S	.	.			trans	-103.8	160.4	179	57.2	-91.3	0	0	0	112.5	S530 P534 Y535 F570 E571 L574	S530-Y568 WeakPolarHBondContact OG-CB 3.23Å; P534-Y568 HydrophobicContact CB-CE1 4.19Å; P534-Y568 HydrophobicContact CB-CE2 4.31Å; P534-Y568 HydrophobicContact CG-CD1 4Å; P534-Y568 HydrophobicContact CG-CD2 4.04Å; P534-Y568 HydrophobicContact CG-CE1 3.85Å; P534-Y568 HydrophobicContact CG-CE2 3.84Å; P534-Y568 HydrophobicContact CG-CG 4.12Å; Y535-Y568 HydrophobicContact CD2-CE2 4.45Å; Y535-Y568 HydrophobicContact CE2-CE2 4.11Å; Y568-F570 PolarHBondContact O-N 2.95Å; Y568-E571 HydrophobicContact CD2-CB 3.99Å; Y568-E571 HydrophobicContact CE1-CB 4.23Å; Y568-E571 HydrophobicContact CE1-CG 3.98Å; Y568-E571 VanDerWaalsContact CE2-CA 3.41Å; Y568-E571 HydrophobicContact CE2-CB 3.73Å; Y568-E571 HydrophobicContact CE2-CG 4.16Å; Y568-E571 HydrophobicContact CG-CB 4.37Å; Y568-E571 WeakPolarHBondContact O-CB 3.47Å; Y568-E571 PolarHBondContact O-N 3.06Å; Y568-L574 HydrophobicContact CE2-CB 4.42Å; Y568-L574 HydrophobicContact CE2-CD2 4.13Å; Y568-L574 WeakPolarHBondContact OH-CD2 3.12Å
569	D	86.6	Confident	88.3	Confident	23 Å²	23	55.5 Å²	55.5	12%	0.123	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	135	-179.9	-62	-50.8	0	0	0	110.3	F436 K439 Y531 E571	F436-D569 HydrophobicContact CD2-CB 4.44Å; K439-D569 IonicContact NZ-OD1 3.28Å; K439-D569 PolarHBondContact NZ-OD1 3.41Å; K439-D569 IonicContact NZ-OD2 3.75Å; K439-D569 PolarHBondContact NZ-OD2 2.86Å; Y531-D569 WeakPolarHBondContact CB-O 3.4Å; D569-E571 VanDerWaalsContact C-N 3.32Å; D569-E571 PolarHBondContact O-N 3.43Å
570	F	88.6	Confident	87.7	Confident	13 Å²	13	53.1 Å²	53.1	6%	0.057	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	28.1	-178.2	-47	-74.2	0	0	0	115.8	Q432 I433 F436 L464 W465 Y535 Y568 R573 L574	Q432-F570 VanDerWaalsContact OE1-N 3.17Å; I433-F570 HydrophobicContact CG1-CE1 4.18Å; F436-F570 HydrophobicContact CB-CE2 4.23Å; F436-F570 HydrophobicContact CB-CZ 4.04Å; F436-F570 HydrophobicContact CD1-CE2 4.25Å; F436-F570 HydrophobicContact CD1-CZ 4.08Å; F436-F570 AromaticContact CD2-CE2 3.6Å; F436-F570 HydrophobicContact CD2-CE2 3.6Å; F436-F570 HydrophobicContact CD2-CZ 4.17Å; F436-F570 AromaticContact CE2-CE2 3.94Å; F436-F570 HydrophobicContact CE2-CE2 3.94Å; F436-F570 AromaticContact CG-CE2 3.76Å; F436-F570 HydrophobicContact CG-CE2 3.76Å; F436-F570 AromaticContact CG-CZ 3.83Å; F436-F570 HydrophobicContact CG-CZ 3.83Å; F436-F570 HydrophobicContact CZ-CE2 4.41Å; L464-F570 HydrophobicContact CD1-CD2 4.26Å; L464-F570 HydrophobicContact CD1-CE2 3.77Å; L464-F570 HydrophobicContact CD2-CD2 3.93Å; L464-F570 HydrophobicContact CD2-CE2 4.28Å; W465-F570 HydrophobicContact CH2-CE1 4.49Å; W465-F570 AromaticContact CH2-CZ 3.96Å; W465-F570 HydrophobicContact CH2-CZ 3.96Å; Y535-F570 VanDerWaalsContact OH-CB 3.31Å; Y535-F570 WeakPolarHBondContact OH-CB 3.38Å; Y535-F570 PolarHBondContact OH-O 3.48Å; Y568-F570 PolarHBondContact O-N 2.95Å; F570-R573 HydrophobicContact CB-CB 4.22Å; F570-R573 WeakPolarHBondContact O-CB 3.49Å; F570-R573 PolarHBondContact O-N 3.09Å; F570-L574 PolarHBondContact O-N 3.46Å; F570-L574 VanDerWaalsContact O-N 3.14Å
571	E	89.1	Confident	87.2	Confident	43 Å²	43	50.7 Å²	50.7	20%	0.201	28%	0.281	C	S	.	.	H	α-helix	trans	-53.9	-54.3	175.1	176.8	171.5	-174.8	0	0	112.8	G567 Y568 D569 R573 L574 H575	G567-E571 PolarHBondContact N-OE2 3.43Å; Y568-E571 HydrophobicContact CD2-CB 3.99Å; Y568-E571 HydrophobicContact CE1-CB 4.23Å; Y568-E571 HydrophobicContact CE1-CG 3.98Å; Y568-E571 VanDerWaalsContact CE2-CA 3.41Å; Y568-E571 HydrophobicContact CE2-CB 3.73Å; Y568-E571 HydrophobicContact CE2-CG 4.16Å; Y568-E571 HydrophobicContact CG-CB 4.37Å; Y568-E571 WeakPolarHBondContact O-CB 3.47Å; Y568-E571 PolarHBondContact O-N 3.06Å; D569-E571 VanDerWaalsContact C-N 3.32Å; D569-E571 PolarHBondContact O-N 3.43Å; E571-R573 PolarHBondContact O-N 3.18Å; E571-R573 VanDerWaalsContact O-N 3.08Å; E571-L574 WeakPolarHBondContact O-CA 3.42Å; E571-L574 PolarHBondContact O-N 2.91Å; E571-H575 VanDerWaalsContact CG-CD2 3.46Å; E571-H575 WeakPolarHBondContact CG-CD2 3.43Å; E571-H575 PolarHBondContact O-CD2 3.09Å; E571-H575 VanDerWaalsContact O-CD2 3.29Å; E571-H575 PolarHBondContact O-N 3.1Å; E571-H575 IonicContact OE1-NE2 2.72Å; E571-H575 PolarHBondContact OE1-NE2 3.38Å
572	N	85.3	Confident	86.7	Confident	111 Å²	111	53.5 Å²	53.5	59%	0.594	29%	0.294	S	S	*	.	H	α-helix	trans	-54.3	-35.8	179	-70.5	-26.1	0	0	0	112.7	V576	N572-V576 WeakPolarHBondContact O-CG2 3.47Å; N572-V576 PolarHBondContact O-N 3.02Å; N572-V576 VanDerWaalsContact O-N 3.13Å
573	R	85.9	Confident	86	Confident	55 Å²	55	51.3 Å²	51.3	21%	0.208	29%	0.292	C	S	.	.	H	α-helix	trans	-68.1	-41.2	177.9	-171.3	-179.9	-172.4	165.6	3.5	111.3	L464 F570 E571 R577	L464-R573 PolarHBondContact O-NH1 3.41Å; L464-R573 PolarHBondContact O-NH2 3.45Å; L464-R573 VanDerWaalsContact O-NH2 3.13Å; F570-R573 HydrophobicContact CB-CB 4.22Å; F570-R573 WeakPolarHBondContact O-CB 3.49Å; F570-R573 PolarHBondContact O-N 3.09Å; E571-R573 PolarHBondContact O-N 3.18Å; E571-R573 VanDerWaalsContact O-N 3.08Å; R573-R577 WeakPolarHBondContact O-CG 3.48Å; R573-R577 PolarHBondContact O-N 3.27Å
574	L	88.8	Confident	85.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-43.3	176.1	-169.5	64.1	0	0	0	111.4	P534 Y535 Y538 Y568 F570 E571 V576 R577 I578	P534-L574 HydrophobicContact CB-CD2 3.74Å; Y535-L574 HydrophobicContact CD1-CD1 4.05Å; Y535-L574 HydrophobicContact CD2-CB 4.32Å; Y535-L574 HydrophobicContact CD2-CD1 4.02Å; Y535-L574 HydrophobicContact CD2-CD2 3.71Å; Y535-L574 HydrophobicContact CD2-CG 4.23Å; Y535-L574 HydrophobicContact CE1-CD1 4.08Å; Y535-L574 HydrophobicContact CE2-CB 3.68Å; Y535-L574 HydrophobicContact CE2-CD1 4.06Å; Y535-L574 HydrophobicContact CE2-CD2 3.93Å; Y535-L574 HydrophobicContact CE2-CG 4.09Å; Y535-L574 HydrophobicContact CG-CD1 4.02Å; Y535-L574 HydrophobicContact CG-CD2 4.35Å; Y538-L574 HydrophobicContact CD1-CD1 4.02Å; Y538-L574 HydrophobicContact CD2-CD1 4.14Å; Y538-L574 HydrophobicContact CG-CD1 3.67Å; Y568-L574 HydrophobicContact CE2-CB 4.42Å; Y568-L574 HydrophobicContact CE2-CD2 4.13Å; Y568-L574 WeakPolarHBondContact OH-CD2 3.12Å; F570-L574 PolarHBondContact O-N 3.46Å; F570-L574 VanDerWaalsContact O-N 3.14Å; E571-L574 WeakPolarHBondContact O-CA 3.42Å; E571-L574 PolarHBondContact O-N 2.91Å; L574-V576 VanDerWaalsContact C-N 3.32Å; L574-V576 PolarHBondContact O-N 2.93Å; L574-R577 CarbonylContact O-C 3.57Å; L574-R577 WeakPolarHBondContact O-CA 3.48Å; L574-R577 WeakPolarHBondContact O-CB 3.42Å; L574-R577 PolarHBondContact O-N 3.05Å; L574-I578 HydrophobicContact CD2-CD1 4.24Å; L574-I578 HydrophobicContact CG-CD1 3.88Å; L574-I578 HydrophobicContact CG-CG1 4.31Å; L574-I578 WeakPolarHBondContact O-CG1 3.47Å; L574-I578 PolarHBondContact O-N 3.23Å
575	H	87.6	Confident	84.1	Confident	54 Å²	54	47.8 Å²	47.8	25%	0.25	28%	0.282	C	S	.	.	H	α-helix	trans	-57.8	-42.1	177	-83.4	-91.6	0	0	0	112.5	E571 R577 I578 H579	E571-H575 VanDerWaalsContact CG-CD2 3.46Å; E571-H575 WeakPolarHBondContact CG-CD2 3.43Å; E571-H575 PolarHBondContact O-CD2 3.09Å; E571-H575 VanDerWaalsContact O-CD2 3.29Å; E571-H575 PolarHBondContact O-N 3.1Å; E571-H575 IonicContact OE1-NE2 2.72Å; E571-H575 PolarHBondContact OE1-NE2 3.38Å; H575-R577 VanDerWaalsContact C-N 3.32Å; H575-R577 PolarHBondContact O-N 2.82Å; H575-I578 PolarHBondContact O-N 3.2Å; H575-H579 WeakPolarHBondContact O-CB 3.31Å; H575-H579 PolarHBondContact O-N 2.83Å
576	V	82.1	Confident	82.6	Confident	67 Å²	67	49.9 Å²	49.9	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-61	-41.2	173.8	170.8	0	0	0	0	111.4	N572 L574 H579 S580	N572-V576 WeakPolarHBondContact O-CG2 3.47Å; N572-V576 PolarHBondContact O-N 3.02Å; N572-V576 VanDerWaalsContact O-N 3.13Å; L574-V576 VanDerWaalsContact C-N 3.32Å; L574-V576 PolarHBondContact O-N 2.93Å; V576-H579 PolarHBondContact O-N 3.44Å; V576-S580 WeakPolarHBondContact O-CB 3.43Å; V576-S580 PolarHBondContact O-N 3.37Å; V576-S580 PolarHBondContact O-OG 3.35Å
577	R	85.4	Confident	80.5	Confident	20 Å²	20	51.6 Å²	51.6	8%	0.075	31%	0.306	C	S	.	.	H	α-helix	trans	-66.5	-41.3	176.8	-69.6	177.1	72.7	179.4	6.9	112.4	Y538 E539 R573 L574 H575 S580 A581	Y538-R577 HydrophobicContact CE1-CB 4.49Å; Y538-R577 HydrophobicContact CE2-CB 3.77Å; Y538-R577 PolarHBondContact OH-NE 3.27Å; E539-R577 IonicContact OE1-CZ 3.34Å; E539-R577 IonicContact OE1-NH1 3.73Å; E539-R577 PolarHBondContact OE1-NH1 3.45Å; E539-R577 IonicContact OE1-NH2 3.97Å; E539-R577 PolarHBondContact OE1-NH2 2.91Å; E539-R577 IonicContact OE2-NH2 2.9Å; R573-R577 WeakPolarHBondContact O-CG 3.48Å; R573-R577 PolarHBondContact O-N 3.27Å; L574-R577 CarbonylContact O-C 3.57Å; L574-R577 WeakPolarHBondContact O-CA 3.48Å; L574-R577 WeakPolarHBondContact O-CB 3.42Å; L574-R577 PolarHBondContact O-N 3.05Å; H575-R577 VanDerWaalsContact C-N 3.32Å; H575-R577 PolarHBondContact O-N 2.82Å; R577-S580 PolarHBondContact O-N 3.2Å; R577-A581 PolarHBondContact O-N 2.96Å
578	I	87.7	Confident	78.3	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-47	176.3	-70.1	166.6	0	0	0	110	Y538 L558 A561 K562 L574 H575 S580 A581 F582	Y538-I578 HydrophobicContact CD2-CG1 3.63Å; Y538-I578 HydrophobicContact CE2-CG1 4.23Å; L558-I578 HydrophobicContact CD2-CG1 4.38Å; A561-I578 HydrophobicContact CB-CD1 3.9Å; K562-I578 HydrophobicContact CB-CD1 4.14Å; K562-I578 HydrophobicContact CB-CG2 4.34Å; K562-I578 HydrophobicContact CD-CG2 4.4Å; L574-I578 HydrophobicContact CD2-CD1 4.24Å; L574-I578 HydrophobicContact CG-CD1 3.88Å; L574-I578 HydrophobicContact CG-CG1 4.31Å; L574-I578 WeakPolarHBondContact O-CG1 3.47Å; L574-I578 PolarHBondContact O-N 3.23Å; H575-I578 PolarHBondContact O-N 3.2Å; I578-S580 VanDerWaalsContact C-N 3.31Å; I578-S580 PolarHBondContact O-N 3.21Å; I578-A581 PolarHBondContact O-N 3.27Å; I578-F582 HydrophobicContact CG2-CD2 3.64Å; I578-F582 HydrophobicContact CG2-CE2 3.38Å; I578-F582 HydrophobicContact CG2-CZ 4.5Å; I578-F582 VanDerWaalsContact O-CD2 3.28Å; I578-F582 WeakPolarHBondContact O-CD2 3.45Å; I578-F582 PolarHBondContact O-N 3.3Å
579	H	83.7	Confident	75.4	Confident	116 Å²	116	60.8 Å²	60.8	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-57.5	-44.9	176.1	-178.5	-81.6	0	0	0	111.7	H575 V576 A581 F582 A583	H575-H579 WeakPolarHBondContact O-CB 3.31Å; H575-H579 PolarHBondContact O-N 2.83Å; V576-H579 PolarHBondContact O-N 3.44Å; H579-A581 VanDerWaalsContact C-N 3.35Å; H579-A581 PolarHBondContact O-N 3.21Å; H579-F582 PolarHBondContact O-N 2.85Å; H579-A583 PolarHBondContact O-N 3.34Å
580	S	79	Confident	72.9	Confident	24 Å²	24	69.2 Å²	69.2	17%	0.168	40%	0.402	C	S	.	.	H	α-helix	trans	-62.6	-41.7	177.6	-53.4	0	0	0	0	111.6	V576 R577 I578 F582 A583 C584	V576-S580 WeakPolarHBondContact O-CB 3.43Å; V576-S580 PolarHBondContact O-N 3.37Å; V576-S580 PolarHBondContact O-OG 3.35Å; R577-S580 PolarHBondContact O-N 3.2Å; I578-S580 VanDerWaalsContact C-N 3.31Å; I578-S580 PolarHBondContact O-N 3.21Å; S580-F582 PolarHBondContact O-N 3.29Å; S580-A583 PolarHBondContact O-N 3.43Å; S580-C584 PolarHBondContact O-N 3.33Å; S580-C584 PolarHBondContact O-SG 3.47Å
581	A	82.7	Confident	72.1	Confident	15 Å²	15	72 Å²	72	12%	0.124	42%	0.419	C	S	.	.	H	α-helix	trans	-61.9	-42.2	176	0	0	0	0	0	112.2	Y538 L558 R577 I578 H579 C584 M585	Y538-A581 HydrophobicContact CE2-CB 4.38Å; L558-A581 HydrophobicContact CD1-CB 3.94Å; L558-A581 HydrophobicContact CD2-CB 4.42Å; R577-A581 PolarHBondContact O-N 2.96Å; I578-A581 PolarHBondContact O-N 3.27Å; H579-A581 VanDerWaalsContact C-N 3.35Å; H579-A581 PolarHBondContact O-N 3.21Å; A581-C584 PolarHBondContact O-N 3.19Å; A581-M585 VanDerWaalsContact O-CG 3.31Å; A581-M585 WeakPolarHBondContact O-CG 3.28Å; A581-M585 PolarHBondContact O-N 3.34Å
582	F	82.9	Confident	71.2	Confident	59 Å²	59	73.5 Å²	73.5	26%	0.259	43%	0.43	S	S	.	.	H	α-helix	trans	-65	-37.2	173.9	-78.1	-59.2	0	0	0	113	L558 I578 H579 S580 M585 S586	L558-F582 HydrophobicContact CB-CE1 4.22Å; L558-F582 HydrophobicContact CB-CE2 4.06Å; L558-F582 HydrophobicContact CB-CZ 3.63Å; L558-F582 HydrophobicContact CD1-CD1 4.3Å; L558-F582 HydrophobicContact CD1-CE1 4.08Å; L558-F582 HydrophobicContact CD1-CE2 4.45Å; L558-F582 HydrophobicContact CD1-CZ 4.16Å; I578-F582 HydrophobicContact CG2-CD2 3.64Å; I578-F582 HydrophobicContact CG2-CE2 3.38Å; I578-F582 HydrophobicContact CG2-CZ 4.5Å; I578-F582 VanDerWaalsContact O-CD2 3.28Å; I578-F582 WeakPolarHBondContact O-CD2 3.45Å; I578-F582 PolarHBondContact O-N 3.3Å; H579-F582 PolarHBondContact O-N 2.85Å; S580-F582 PolarHBondContact O-N 3.29Å; F582-M585 HydrophobicContact CD1-CE 4Å; F582-M585 HydrophobicContact CD1-SD 4.36Å; F582-M585 HydrophobicContact CE1-CE 4.41Å; F582-M585 PolarHBondContact O-N 3.49Å; F582-S586 PolarHBondContact O-N 3.45Å; F582-S586 PolarHBondContact O-OG 3.09Å
583	A	74.9	Confident	70.5	Confident	46 Å²	46	71.4 Å²	71.4	38%	0.38	42%	0.421	S	S	.	.	H	α-helix	trans	-63.9	-43.5	177.9	0	0	0	0	0	111.5	H579 S580 M585 S586	H579-A583 PolarHBondContact O-N 3.34Å; S580-A583 PolarHBondContact O-N 3.43Å; A583-M585 PolarHBondContact O-N 3.18Å; A583-M585 VanDerWaalsContact O-N 3.15Å; A583-S586 PolarHBondContact O-N 3.2Å
584	C	71.3	Confident	69.5	Low	86 Å²	86	72.4 Å²	72.4	58%	0.581	43%	0.434	S	S	*	.	H	α-helix	trans	-63.7	-18.6	176.6	-63.9	0	0	0	0	114	S580 A581	S580-C584 PolarHBondContact O-N 3.33Å; S580-C584 PolarHBondContact O-SG 3.47Å; A581-C584 PolarHBondContact O-N 3.19Å
585	M	70.9	Confident	68.3	Low	70 Å²	70	76.9 Å²	76.9	35%	0.345	46%	0.461	S	S	.	.	H	α-helix	trans	-93.3	-18.1	178.7	-67.4	164.5	34.2	0	0	113.6	L545 R555 L558 A581 F582 A583	L545-M585 HydrophobicContact CD1-SD 3.86Å; L545-M585 HydrophobicContact CD2-CE 4.45Å; L545-M585 HydrophobicContact CD2-SD 3.74Å; L545-M585 HydrophobicContact CG-SD 4.47Å; R555-M585 HydrophobicContact CG-CE 3.49Å; R555-M585 VanDerWaalsContact CG-CE 3.49Å; L558-M585 HydrophobicContact CD1-SD 4.22Å; A581-M585 VanDerWaalsContact O-CG 3.31Å; A581-M585 WeakPolarHBondContact O-CG 3.28Å; A581-M585 PolarHBondContact O-N 3.34Å; F582-M585 HydrophobicContact CD1-CE 4Å; F582-M585 HydrophobicContact CD1-SD 4.36Å; F582-M585 HydrophobicContact CE1-CE 4.41Å; F582-M585 PolarHBondContact O-N 3.49Å; A583-M585 PolarHBondContact O-N 3.18Å; A583-M585 VanDerWaalsContact O-N 3.15Å
586	S	59	Low	67.1	Low	77 Å²	77	78.5 Å²	78.5	54%	0.538	48%	0.475	S	S	.	.	S	Bend	trans	-76.4	128.7	178.8	-58.8	0	0	0	0	107.7	F582 A583 A588	F582-S586 PolarHBondContact O-N 3.45Å; F582-S586 PolarHBondContact O-OG 3.09Å; A583-S586 PolarHBondContact O-N 3.2Å; S586-A588 PolarHBondContact O-N 3.2Å
587	P	46	Very low	66	Low	118 Å²	118	79.3 Å²	79.3	77%	0.766	48%	0.48	S	S	*	.			trans	-56.2	131.4	173.8	22.9	-30.4	0	0	0	107.8	Q589	P587-Q589 PolarHBondContact O-N 2.76Å
588	A	38.3	Very low	64.5	Low	96 Å²	96	83.8 Å²	83.8	79%	0.793	51%	0.511	S	S	*	.			trans	-48	115.6	173.1	0	0	0	0	0	107.4	S586	S586-A588 PolarHBondContact O-N 3.2Å
589	Q	28.5	Very low	62.6	Low	182 Å²	182	90.7 Å²	90.7	85%	0.85	55%	0.553	S	S	*	*			trans	-60.4	129	173.1	-80.5	-173.4	-21	0	0	106.7	P587	P587-Q589 PolarHBondContact O-N 2.76Å
590	P	33.4	Very low	60.6	Low	199 Å²	199	88.4 Å²	88.4	100%	1.292	55%	0.554	S	S	*	*			trans	-61.5	0	-176.6	25.4	-34	0	0	0	112.8

Retrieved 590 of 590 residues in 335.4 ms (Link to these results)

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