A0A077Z0S0_TRITR Loading...

Frizzled

AlphaFold DB , UniProt , Accession A0A077Z0S0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 566 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	32.7	Very low	64.4	Low	236 Å²	236	99.6 Å²	99.6	100%	1.163	60%	0.597	S	S	*	*				0	78.8	0	-156.4	169.2	-173.2	0	0	105.5
2	F	42.6	Very low	66.9	Low	127 Å²	127	102.6 Å²	102.6	56%	0.557	60%	0.6	S	S	*	*			trans	-88.2	113.1	172.4	-73.9	-80.1	0	0	0	105.1	P27	F2-P27 HydrophobicContact CD1-CG 4.25Å; F2-P27 HydrophobicContact CE1-CG 4.27Å
3	N	39.1	Very low	68.9	Low	155 Å²	155	94.7 Å²	94.7	83%	0.829	55%	0.553	S	S	*	*			trans	-73.1	127.9	-178.5	-136.9	11	0	0	0	107.7	G5	N3-G5 PolarHBondContact O-N 3.4Å
4	D	41.8	Very low	70.5	Confident	169 Å²	169	93.3 Å²	93.3	90%	0.904	55%	0.551	S	S	*	*	S	Bend	trans	-47.8	113.3	168.2	-158.2	11.4	0	0	0	109.4
5	G	48.4	Very low	71.9	Confident	80 Å²	80	88.9 Å²	88.9	83%	0.825	52%	0.524	S	S	*	.			trans	165.4	8.9	-177.4	0	0	0	0	0	121.2	N3	N3-G5 PolarHBondContact O-N 3.4Å
6	G	58.4	Low	73.3	Confident	51 Å²	51	83.4 Å²	83.4	53%	0.526	49%	0.491	S	S	.	.			trans	-155	98.5	173.7	0	0	0	0	0	111.2
7	G	75.7	Confident	74.4	Confident	68 Å²	68	86.2 Å²	86.2	70%	0.701	50%	0.496	S	S	*	.			trans	-58.4	167.1	176.6	0	0	0	0	0	112.5	Q9	G7-Q9 PolarHBondContact O-N 3.35Å
8	C	89.7	Confident	75.2	Confident	33 Å²	33	87.5 Å²	87.5	22%	0.223	50%	0.501	C	S	.	.			trans	-56.9	128	178	-59.2	0	0	0	0	111	Y23 T24 C69 T70	C8-Y23 HydrophobicContact CB-CD1 4.35Å; C8-T24 CarbonylContact C-O 3.58Å; C8-T24 WeakPolarHBondContact CA-O 3.38Å; C8-C69 WeakPolarHBondContact CA-SG 3.42Å; C8-C69 HydrophobicContact CB-CB 3.76Å; C8-C69 WeakPolarHBondContact CB-SG 3.34Å; C8-C69 WeakPolarHBondContact SG-CB 3.33Å; C8-C69 CovalentContact SG-SG 2.04Å; C8-C69 PolarHBondContact SG-SG 3Å; C8-T70 PolarHBondContact SG-N 3.14Å; C8-T70 VanDerWaalsContact SG-N 3.38Å
9	Q	91.9	Very high	76.1	Confident	68 Å²	68	83.8 Å²	83.8	32%	0.318	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	156.4	178.5	60.7	-178.9	11.8	0	0	110.8	G7 Y23 T24 Q35	G7-Q9 PolarHBondContact O-N 3.35Å; Q9-Y23 CarbonylContact O-C 3.59Å; Q9-Y23 VanDerWaalsContact O-CA 3.28Å; Q9-Y23 WeakPolarHBondContact O-CA 3.35Å; Q9-T24 HydrophobicContact CG-CG2 3.88Å; Q9-T24 WeakPolarHBondContact CG-O 3.21Å; Q9-T24 PolarHBondContact N-O 3.14Å; Q9-T24 PolarHBondContact O-N 2.87Å; Q9-Q35 VanDerWaalsContact CD-NE2 3.35Å
10	H	93.9	Very high	76.8	Confident	99 Å²	99	85.2 Å²	85.2	46%	0.458	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	146.6	-178.8	-149.8	-80.3	0	0	0	111	E12 N22 Q35	H10-E12 PolarHBondContact O-N 3.38Å; H10-N22 CarbonylContact C-O 3.09Å; H10-N22 WeakPolarHBondContact CA-O 3.44Å; H10-Q35 PolarHBondContact O-NE2 3.44Å
11	V	94.7	Very high	77.6	Confident	10 Å²	10	81.8 Å²	81.8	6%	0.061	47%	0.47	C	S	.	.			trans	-68.3	117.5	175.7	175.7	0	0	0	0	109.9	C16 N22 T24 V66	V11-C16 HydrophobicContact CG1-CB 4.28Å; V11-N22 PolarHBondContact N-O 3.06Å; V11-T24 HydrophobicContact CG2-CG2 4.27Å; V11-V66 HydrophobicContact CB-CG1 4.37Å; V11-V66 HydrophobicContact CG1-CG1 3.93Å; V11-V66 HydrophobicContact CG2-CG1 3.73Å
12	E	93.5	Very high	80.5	Confident	135 Å²	135	74.7 Å²	74.7	63%	0.631	44%	0.437	S	S	*	.			trans	-104.3	-25.5	179.9	-66.5	-172.4	169.2	0	0	112.7	H10 S14 K17	H10-E12 PolarHBondContact O-N 3.38Å; E12-S14 PolarHBondContact O-N 2.77Å; E12-K17 WeakPolarHBondContact O-CE 3.29Å; E12-K17 PolarHBondContact O-NZ 3.32Å
13	V	93.2	Very high	82.9	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	43%	0.433	C	S	.	.			trans	-58.9	117.3	-178.5	-179.7	0	0	0	0	111.1	M15 C16 K17 Q35 E39 L42 V66	V13-M15 VanDerWaalsContact C-N 3.34Å; V13-M15 HydrophobicContact CG1-CG 4.1Å; V13-M15 PolarHBondContact O-N 2.79Å; V13-C16 HydrophobicContact CB-CB 4.38Å; V13-C16 HydrophobicContact CG1-CB 4.39Å; V13-C16 PolarHBondContact O-N 2.94Å; V13-K17 WeakPolarHBondContact O-CG 3.4Å; V13-K17 PolarHBondContact O-N 3.35Å; V13-Q35 HydrophobicContact CG2-CB 4.06Å; V13-Q35 HydrophobicContact CG2-CG 4.47Å; V13-E39 HydrophobicContact CG1-CB 3.97Å; V13-E39 HydrophobicContact CG1-CG 4.07Å; V13-E39 HydrophobicContact CG2-CB 4.2Å; V13-L42 HydrophobicContact CG1-CD1 3.87Å; V13-V66 HydrophobicContact CB-CG2 4.14Å; V13-V66 HydrophobicContact CG2-CG2 3.72Å
14	S	92	Very high	85.5	Confident	75 Å²	75	67.1 Å²	67.1	52%	0.524	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-56.1	-42.4	-168.6	59.2	0	0	0	0	114.2	E12 C16 E39	E12-S14 PolarHBondContact O-N 2.77Å; S14-C16 VanDerWaalsContact C-N 3.27Å; S14-C16 PolarHBondContact O-N 3.19Å; S14-E39 VanDerWaalsContact CB-OE1 3.24Å; S14-E39 WeakPolarHBondContact CB-OE1 3.34Å; S14-E39 PolarHBondContact N-OE1 3.29Å; S14-E39 PolarHBondContact OG-OE1 2.77Å
15	M	90.6	Very high	87.8	Confident	28 Å²	28	59.7 Å²	59.7	14%	0.138	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-75.6	-12	-178.2	73.4	168.9	70	0	0	114.5	V13 L42 L46 I49 K58	V13-M15 VanDerWaalsContact C-N 3.34Å; V13-M15 HydrophobicContact CG1-CG 4.1Å; V13-M15 PolarHBondContact O-N 2.79Å; M15-L42 HydrophobicContact CE-CB 3.89Å; M15-L42 HydrophobicContact SD-CB 3.84Å; M15-L42 HydrophobicContact SD-CD1 4.33Å; M15-L42 HydrophobicContact SD-CD2 4.2Å; M15-L42 HydrophobicContact SD-CG 4.37Å; M15-L46 HydrophobicContact CE-CD1 4.46Å; M15-L46 HydrophobicContact CE-CD2 3.59Å; M15-L46 HydrophobicContact CE-CG 3.91Å; M15-I49 HydrophobicContact SD-CD1 4.06Å; M15-K58 WeakPolarHBondContact O-CE 3.45Å; M15-K58 PolarHBondContact O-NZ 2.93Å
16	C	94.5	Very high	89.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-113	11.8	-176.2	-59	0	0	0	0	112.5	V11 V13 S14 D18 L19 C62 V66	V11-C16 HydrophobicContact CG1-CB 4.28Å; V13-C16 HydrophobicContact CB-CB 4.38Å; V13-C16 HydrophobicContact CG1-CB 4.39Å; V13-C16 PolarHBondContact O-N 2.94Å; S14-C16 VanDerWaalsContact C-N 3.27Å; S14-C16 PolarHBondContact O-N 3.19Å; C16-D18 PolarHBondContact O-N 2.98Å; C16-L19 HydrophobicContact CB-CD1 3.78Å; C16-L19 HydrophobicContact CB-CG 4.27Å; C16-L19 WeakPolarHBondContact O-CD1 3.47Å; C16-L19 WeakPolarHBondContact O-CG 3.3Å; C16-L19 PolarHBondContact O-N 3.44Å; C16-C62 VanDerWaalsContact CA-SG 3.58Å; C16-C62 HydrophobicContact CB-CB 3.84Å; C16-C62 WeakPolarHBondContact CB-SG 3.41Å; C16-C62 VanDerWaalsContact SG-CA 3.59Å; C16-C62 WeakPolarHBondContact SG-CB 3.44Å; C16-C62 CovalentContact SG-SG 2.05Å; C16-C62 PolarHBondContact SG-SG 3.47Å; C16-V66 HydrophobicContact CB-CG2 4.48Å
17	K	91.7	Very high	91.3	Very high	132 Å²	132	57.9 Å²	57.9	57%	0.574	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-18.7	179.2	-67.8	-172	176.8	177.3	0	113.9	E12 V13 L19	E12-K17 WeakPolarHBondContact O-CE 3.29Å; E12-K17 PolarHBondContact O-NZ 3.32Å; V13-K17 WeakPolarHBondContact O-CG 3.4Å; V13-K17 PolarHBondContact O-N 3.35Å; K17-L19 VanDerWaalsContact C-N 3.29Å
18	D	89.8	Confident	92	Very high	109 Å²	109	55 Å²	55	58%	0.583	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	19.7	179.3	61.1	-50.9	0	0	0	113.5	C16 K58	C16-D18 PolarHBondContact O-N 2.98Å; D18-K58 IonicContact OD1-NZ 3.74Å; D18-K58 PolarHBondContact OD1-NZ 3.29Å; D18-K58 IonicContact OD2-NZ 2.71Å; D18-K58 PolarHBondContact OD2-NZ 3.03Å
19	L	91.4	Very high	92.1	Very high	18 Å²	18	56.8 Å²	56.8	9%	0.094	29%	0.292	C	S	.	.	S	Bend	trans	-72.3	157.5	174.2	-73.3	170.2	0	0	0	112	C16 K17 Y21 F59 C62	C16-L19 HydrophobicContact CB-CD1 3.78Å; C16-L19 HydrophobicContact CB-CG 4.27Å; C16-L19 WeakPolarHBondContact O-CD1 3.47Å; C16-L19 WeakPolarHBondContact O-CG 3.3Å; C16-L19 PolarHBondContact O-N 3.44Å; K17-L19 VanDerWaalsContact C-N 3.29Å; L19-Y21 HydrophobicContact CB-CD1 4.38Å; L19-Y21 HydrophobicContact CB-CE1 4.24Å; L19-Y21 HydrophobicContact CD1-CD2 4.5Å; L19-Y21 HydrophobicContact CD1-CE1 4.18Å; L19-Y21 HydrophobicContact CD1-CE2 3.73Å; L19-Y21 WeakPolarHBondContact CD1-OH 3.49Å; L19-Y21 HydrophobicContact CD2-CE1 4.28Å; L19-Y21 HydrophobicContact CG-CE1 4.49Å; L19-Y21 PolarHBondContact O-N 2.94Å; L19-Y21 VanDerWaalsContact O-N 3.11Å; L19-F59 HydrophobicContact CD2-CD2 4.02Å; L19-F59 HydrophobicContact CD2-CE2 4.24Å; L19-C62 HydrophobicContact CD1-CB 4.03Å; L19-C62 HydrophobicContact CD2-CB 3.87Å; L19-C62 HydrophobicContact CG-CB 4.31Å
20	P	91.2	Very high	92	Very high	110 Å²	110	55.5 Å²	55.5	71%	0.714	29%	0.289	S	S	*	.	S	Bend	trans	-72.3	3.1	175.3	29.8	-34.4	0	0	0	113.9	F59	P20-F59 HydrophobicContact CG-CE2 4.07Å
21	Y	92	Very high	91.9	Very high	14 Å²	14	53 Å²	53	6%	0.055	29%	0.29	C	S	.	.			trans	-137.6	152.5	176.4	57	-91.8	0	0	0	110.1	L19 Y23 V66 M68 M122	L19-Y21 HydrophobicContact CB-CD1 4.38Å; L19-Y21 HydrophobicContact CB-CE1 4.24Å; L19-Y21 HydrophobicContact CD1-CD2 4.5Å; L19-Y21 HydrophobicContact CD1-CE1 4.18Å; L19-Y21 HydrophobicContact CD1-CE2 3.73Å; L19-Y21 WeakPolarHBondContact CD1-OH 3.49Å; L19-Y21 HydrophobicContact CD2-CE1 4.28Å; L19-Y21 HydrophobicContact CG-CE1 4.49Å; L19-Y21 PolarHBondContact O-N 2.94Å; L19-Y21 VanDerWaalsContact O-N 3.11Å; Y21-Y23 WeakPolarHBondContact CD2-O 3.41Å; Y21-V66 WeakPolarHBondContact CE2-O 3.44Å; Y21-V66 PolarHBondContact OH-O 3.36Å; Y21-M68 HydrophobicContact CD1-CB 3.88Å; Y21-M68 HydrophobicContact CD1-CG 4.07Å; Y21-M68 HydrophobicContact CD1-SD 4.14Å; Y21-M68 HydrophobicContact CD2-CB 3.79Å; Y21-M68 HydrophobicContact CD2-CG 4Å; Y21-M68 HydrophobicContact CE1-CB 3.95Å; Y21-M68 HydrophobicContact CE2-CB 3.84Å; Y21-M68 HydrophobicContact CG-CB 3.8Å; Y21-M68 HydrophobicContact CG-CG 3.73Å; Y21-M68 HydrophobicContact CG-SD 4.17Å; Y21-M122 HydrophobicContact CD1-SD 4.05Å; Y21-M122 HydrophobicContact CE1-CE 3.9Å; Y21-M122 HydrophobicContact CE1-SD 3.55Å; Y21-M122 VanDerWaalsContact CE1-SD 3.55Å
22	N	93.6	Very high	91.7	Very high	87 Å²	87	52.7 Å²	52.7	47%	0.465	29%	0.288	S	S	.	.			trans	-109.2	-7.6	-172.7	-64.2	-13.2	0	0	0	113.8	H10 V11	H10-N22 CarbonylContact C-O 3.09Å; H10-N22 WeakPolarHBondContact CA-O 3.44Å; V11-N22 PolarHBondContact N-O 3.06Å
23	Y	93.7	Very high	91.6	Very high	122 Å²	122	53.7 Å²	53.7	48%	0.478	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.1	-173.2	-67.2	-86.2	0	0	0	112.1	C8 Q9 Y21 C69	C8-Y23 HydrophobicContact CB-CD1 4.35Å; Q9-Y23 CarbonylContact O-C 3.59Å; Q9-Y23 VanDerWaalsContact O-CA 3.28Å; Q9-Y23 WeakPolarHBondContact O-CA 3.35Å; Y21-Y23 WeakPolarHBondContact CD2-O 3.41Å; Y23-C69 PolarHBondContact O-N 3.47Å
24	T	93.6	Very high	91.5	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	169.2	-179.9	-165.4	0	0	0	0	111.4	C8 Q9 V11 Q35 V66 P67 C69	C8-T24 CarbonylContact C-O 3.58Å; C8-T24 WeakPolarHBondContact CA-O 3.38Å; Q9-T24 HydrophobicContact CG-CG2 3.88Å; Q9-T24 WeakPolarHBondContact CG-O 3.21Å; Q9-T24 PolarHBondContact N-O 3.14Å; Q9-T24 PolarHBondContact O-N 2.87Å; V11-T24 HydrophobicContact CG2-CG2 4.27Å; T24-Q35 HydrophobicContact CG2-CG 4.26Å; T24-V66 HydrophobicContact CG2-CG1 3.78Å; T24-V66 WeakPolarHBondContact OG1-CA 3.38Å; T24-V66 WeakPolarHBondContact OG1-CG1 3.43Å; T24-P67 WeakPolarHBondContact CA-O 3.17Å; T24-P67 VanDerWaalsContact CB-O 3.28Å; T24-P67 WeakPolarHBondContact CB-O 3.32Å; T24-P67 WeakPolarHBondContact OG1-CD 3.42Å; T24-P67 PolarHBondContact OG1-O 2.75Å; T24-C69 VanDerWaalsContact C-CB 3.44Å
25	S	90.2	Very high	91.6	Very high	13 Å²	13	56.8 Å²	56.8	9%	0.091	30%	0.299	C	S	.	.			trans	-129.5	144.3	173.2	61.6	0	0	0	0	110.2	P76	S25-P76 WeakPolarHBondContact OG-CB 3.42Å
26	V	89.1	Confident	91.7	Very high	36 Å²	36	58.6 Å²	58.6	22%	0.218	31%	0.314	C	S	.	.	S	Bend	trans	-109.6	143.5	166.6	-73	0	0	0	0	108.6	E33 Q35	V26-E33 VanDerWaalsContact CB-O 3.29Å; V26-E33 WeakPolarHBondContact CB-O 3.44Å; V26-E33 VanDerWaalsContact CG2-O 3.24Å; V26-E33 WeakPolarHBondContact CG2-O 3.34Å; V26-Q35 HydrophobicContact CG1-CG 4.44Å
27	P	91.2	Very high	91.6	Very high	58 Å²	58	62.5 Å²	62.5	38%	0.377	33%	0.332	S	S	.	.	S	Bend	cis	-72.8	142.6	2.9	29.8	-34.5	0	0	0	113.1	F2 N32	F2-P27 HydrophobicContact CD1-CG 4.25Å; F2-P27 HydrophobicContact CE1-CG 4.27Å; P27-N32 VanDerWaalsContact CA-O 3.25Å; P27-N32 WeakPolarHBondContact CA-O 3.47Å
28	N	91.6	Very high	91.6	Very high	7 Å²	7	56.2 Å²	56.2	4%	0.037	31%	0.305	C	S	.	.			trans	-75.6	-178.4	176.2	69.6	17.6	0	0	0	111.8	V30 G31 N32 Y65 P67	N28-V30 PolarHBondContact O-N 3.06Å; N28-V30 VanDerWaalsContact O-N 3.15Å; N28-V30 WeakPolarHBondContact OD1-CA 3.49Å; N28-V30 WeakPolarHBondContact OD1-CB 3.45Å; N28-V30 PolarHBondContact OD1-N 2.84Å; N28-G31 PolarHBondContact O-N 3.32Å; N28-G31 VanDerWaalsContact O-N 3.13Å; N28-G31 PolarHBondContact OD1-N 3.46Å; N28-N32 PolarHBondContact N-O 3.32Å; N28-N32 WeakPolarHBondContact ND2-CB 3.31Å; N28-N32 PolarHBondContact ND2-OD1 3.06Å; N28-N32 PolarHBondContact OD1-N 2.79Å; N28-Y65 WeakPolarHBondContact CB-O 3.15Å; N28-Y65 PolarHBondContact ND2-O 3.25Å; N28-P67 HydrophobicContact CB-CG 4.49Å
29	F	90.5	Very high	91.8	Very high	71 Å²	71	54.1 Å²	54.1	31%	0.311	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-10.9	-179.5	-68.2	-66.3	0	0	0	114.8	V64 P67 P76	F29-V64 HydrophobicContact CB-CG1 4.04Å; F29-V64 PolarHBondContact N-O 3.26Å; F29-P67 HydrophobicContact CD2-CB 3.81Å; F29-P67 HydrophobicContact CD2-CG 4.13Å; F29-P67 HydrophobicContact CE2-CB 3.4Å; F29-P67 HydrophobicContact CE2-CG 4.04Å; F29-P67 HydrophobicContact CZ-CB 4.35Å; F29-P76 HydrophobicContact CE1-CG 4.5Å; F29-P76 HydrophobicContact CZ-CB 4.23Å; F29-P76 HydrophobicContact CZ-CG 4.29Å; F29-P76 WeakPolarHBondContact CZ-O 3.47Å
30	V	91	Very high	91.9	Very high	40 Å²	40	59.2 Å²	59.2	24%	0.242	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-14.5	176.6	-170	0	0	0	0	111.5	N28 V64 Y65	N28-V30 PolarHBondContact O-N 3.06Å; N28-V30 VanDerWaalsContact O-N 3.15Å; N28-V30 WeakPolarHBondContact OD1-CA 3.49Å; N28-V30 WeakPolarHBondContact OD1-CB 3.45Å; N28-V30 PolarHBondContact OD1-N 2.84Å; V30-V64 HydrophobicContact CG2-CG1 3.8Å; V30-Y65 HydrophobicContact CB-CE1 4.18Å; V30-Y65 HydrophobicContact CG1-CE1 4.21Å; V30-Y65 HydrophobicContact CG2-CD1 4.03Å; V30-Y65 HydrophobicContact CG2-CE1 3.76Å; V30-Y65 HydrophobicContact CG2-CE2 4.29Å; V30-Y65 HydrophobicContact CG2-CG 4.4Å
31	G	90	Very high	91.9	Very high	47 Å²	47	57 Å²	57	49%	0.485	30%	0.298	S	S	.	.			trans	96.2	12.3	179.8	0	0	0	0	0	114.6	N28 E33	N28-G31 PolarHBondContact O-N 3.32Å; N28-G31 VanDerWaalsContact O-N 3.13Å; N28-G31 PolarHBondContact OD1-N 3.46Å; G31-E33 PolarHBondContact O-N 3.48Å
32	N	91.1	Very high	92	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.016	30%	0.296	C	S	.	.			trans	-71.9	128.8	173.9	-51.9	124.3	0	0	0	109.8	P27 N28 E37 A38 Q41	P27-N32 VanDerWaalsContact CA-O 3.25Å; P27-N32 WeakPolarHBondContact CA-O 3.47Å; N28-N32 PolarHBondContact N-O 3.32Å; N28-N32 WeakPolarHBondContact ND2-CB 3.31Å; N28-N32 PolarHBondContact ND2-OD1 3.06Å; N28-N32 PolarHBondContact OD1-N 2.79Å; N32-E37 WeakPolarHBondContact CA-OE2 3.47Å; N32-E37 HydrophobicContact CB-CB 4.16Å; N32-E37 HydrophobicContact CB-CG 4.31Å; N32-E37 WeakPolarHBondContact ND2-CG 3.48Å; N32-E37 PolarHBondContact ND2-OE1 2.73Å; N32-E37 PolarHBondContact ND2-OE2 3.18Å; N32-A38 HydrophobicContact CB-CB 4.39Å; N32-Q41 PolarHBondContact ND2-NE2 2.9Å
33	E	90.7	Very high	91.8	Very high	157 Å²	157	54.4 Å²	54.4	73%	0.734	29%	0.289	S	S	*	.	S	Bend	trans	-85.4	-15	-179.8	-61.7	-171.4	165.3	0	0	112.4	V26 G31	V26-E33 VanDerWaalsContact CB-O 3.29Å; V26-E33 WeakPolarHBondContact CB-O 3.44Å; V26-E33 VanDerWaalsContact CG2-O 3.24Å; V26-E33 WeakPolarHBondContact CG2-O 3.34Å; G31-E33 PolarHBondContact O-N 3.48Å
34	E	92.4	Very high	91.6	Very high	126 Å²	126	53.2 Å²	53.2	59%	0.589	30%	0.295	S	S	*	.	S	Bend	trans	-129.4	150.6	177.9	-64.2	-174.2	-174.4	0	0	112.1	S36 E37 A38	E34-S36 VanDerWaalsContact C-N 3.27Å; E34-S36 WeakPolarHBondContact CB-OG 3.41Å; E34-S36 PolarHBondContact O-N 3.02Å; E34-S36 PolarHBondContact OE2-OG 3.14Å; E34-E37 PolarHBondContact O-N 2.97Å; E34-A38 PolarHBondContact O-N 3.23Å
35	Q	93.1	Very high	91.5	Very high	13 Å²	13	54.3 Å²	54.3	6%	0.061	30%	0.3	C	S	.	.	H	α-helix	trans	-67.2	-28.3	173.7	-76.3	-172.9	75.3	0	0	112.9	Q9 H10 V13 T24 V26 E37 A38 E39	Q9-Q35 VanDerWaalsContact CD-NE2 3.35Å; H10-Q35 PolarHBondContact O-NE2 3.44Å; V13-Q35 HydrophobicContact CG2-CB 4.06Å; V13-Q35 HydrophobicContact CG2-CG 4.47Å; T24-Q35 HydrophobicContact CG2-CG 4.26Å; V26-Q35 HydrophobicContact CG1-CG 4.44Å; Q35-E37 VanDerWaalsContact C-N 3.32Å; Q35-E37 PolarHBondContact O-N 3.01Å; Q35-A38 PolarHBondContact O-N 3.21Å; Q35-E39 PolarHBondContact O-N 3.37Å
36	S	92.6	Very high	91.4	Very high	67 Å²	67	56.9 Å²	56.9	47%	0.469	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-42.1	175.9	60.4	0	0	0	0	111.6	E34 E39 L40	E34-S36 VanDerWaalsContact C-N 3.27Å; E34-S36 WeakPolarHBondContact CB-OG 3.41Å; E34-S36 PolarHBondContact O-N 3.02Å; E34-S36 PolarHBondContact OE2-OG 3.14Å; S36-E39 PolarHBondContact O-N 2.91Å; S36-L40 PolarHBondContact O-N 3.42Å; S36-L40 VanDerWaalsContact O-N 3.1Å
37	E	93.2	Very high	91.1	Very high	81 Å²	81	58.8 Å²	58.8	38%	0.379	33%	0.325	S	S	.	.	H	α-helix	trans	-70.7	-40.8	177.8	-167.3	-166.2	167.9	0	0	111.2	N32 E34 Q35 E39 L40 Q41	N32-E37 WeakPolarHBondContact CA-OE2 3.47Å; N32-E37 HydrophobicContact CB-CB 4.16Å; N32-E37 HydrophobicContact CB-CG 4.31Å; N32-E37 WeakPolarHBondContact ND2-CG 3.48Å; N32-E37 PolarHBondContact ND2-OE1 2.73Å; N32-E37 PolarHBondContact ND2-OE2 3.18Å; E34-E37 PolarHBondContact O-N 2.97Å; Q35-E37 VanDerWaalsContact C-N 3.32Å; Q35-E37 PolarHBondContact O-N 3.01Å; E37-E39 VanDerWaalsContact C-N 3.33Å; E37-E39 PolarHBondContact O-N 3.09Å; E37-L40 PolarHBondContact O-N 3.27Å; E37-Q41 PolarHBondContact O-N 3.2Å
38	A	92.8	Very high	90.8	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-41.2	173.5	0	0	0	0	0	111.8	N32 E34 Q35 Q41 L42 Y65	N32-A38 HydrophobicContact CB-CB 4.39Å; E34-A38 PolarHBondContact O-N 3.23Å; Q35-A38 PolarHBondContact O-N 3.21Å; A38-Q41 PolarHBondContact O-N 2.95Å; A38-L42 VanDerWaalsContact O-CB 3.27Å; A38-L42 WeakPolarHBondContact O-CB 3.33Å; A38-L42 WeakPolarHBondContact O-CG 3.49Å; A38-L42 PolarHBondContact O-N 2.99Å; A38-Y65 HydrophobicContact CB-CD1 4.27Å
39	E	93.7	Very high	90.6	Very high	65 Å²	65	58 Å²	58	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-42.4	175.9	-175.9	159.7	-145	0	0	112	V13 S14 Q35 S36 E37 L42 S43	V13-E39 HydrophobicContact CG1-CB 3.97Å; V13-E39 HydrophobicContact CG1-CG 4.07Å; V13-E39 HydrophobicContact CG2-CB 4.2Å; S14-E39 VanDerWaalsContact CB-OE1 3.24Å; S14-E39 WeakPolarHBondContact CB-OE1 3.34Å; S14-E39 PolarHBondContact N-OE1 3.29Å; S14-E39 PolarHBondContact OG-OE1 2.77Å; Q35-E39 PolarHBondContact O-N 3.37Å; S36-E39 PolarHBondContact O-N 2.91Å; E37-E39 VanDerWaalsContact C-N 3.33Å; E37-E39 PolarHBondContact O-N 3.09Å; E39-L42 PolarHBondContact O-N 3.35Å; E39-S43 PolarHBondContact O-N 3.32Å
40	L	92.9	Very high	90.3	Very high	124 Å²	124	60.5 Å²	60.5	65%	0.649	33%	0.33	S	S	*	.	H	α-helix	trans	-61.3	-45.8	175.7	-176	67.8	0	0	0	111.4	S36 E37 S43	S36-L40 PolarHBondContact O-N 3.42Å; S36-L40 VanDerWaalsContact O-N 3.1Å; E37-L40 PolarHBondContact O-N 3.27Å; L40-S43 WeakPolarHBondContact O-CB 3.17Å; L40-S43 PolarHBondContact O-N 3.12Å; L40-S43 PolarHBondContact O-OG 2.74Å
41	Q	91.6	Very high	89.9	Confident	63 Å²	63	61.8 Å²	61.8	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-68.2	-42.3	178.4	-68.7	-168.1	3.6	0	0	112	N32 E37 A38 S43 T44 Y65	N32-Q41 PolarHBondContact ND2-NE2 2.9Å; E37-Q41 PolarHBondContact O-N 3.2Å; A38-Q41 PolarHBondContact O-N 2.95Å; Q41-S43 PolarHBondContact O-N 3.41Å; Q41-T44 WeakPolarHBondContact O-CB 3.36Å; Q41-T44 PolarHBondContact O-N 2.89Å; Q41-T44 VanDerWaalsContact O-N 3.16Å; Q41-T44 PolarHBondContact O-OG1 3.33Å; Q41-Y65 HydrophobicContact CB-CD1 4.41Å; Q41-Y65 HydrophobicContact CB-CE1 3.65Å
42	L	92.7	Very high	89.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-34.7	174.7	-84	168.5	0	0	0	112.6	V13 M15 A38 E39 T44 F45 L61 Y65 V66	V13-L42 HydrophobicContact CG1-CD1 3.87Å; M15-L42 HydrophobicContact CE-CB 3.89Å; M15-L42 HydrophobicContact SD-CB 3.84Å; M15-L42 HydrophobicContact SD-CD1 4.33Å; M15-L42 HydrophobicContact SD-CD2 4.2Å; M15-L42 HydrophobicContact SD-CG 4.37Å; A38-L42 VanDerWaalsContact O-CB 3.27Å; A38-L42 WeakPolarHBondContact O-CB 3.33Å; A38-L42 WeakPolarHBondContact O-CG 3.49Å; A38-L42 PolarHBondContact O-N 2.99Å; E39-L42 PolarHBondContact O-N 3.35Å; L42-T44 PolarHBondContact O-N 3.32Å; L42-T44 VanDerWaalsContact O-N 3.13Å; L42-F45 PolarHBondContact O-N 3.24Å; L42-L61 HydrophobicContact CD2-CB 3.73Å; L42-Y65 HydrophobicContact CD1-CG 4.12Å; L42-Y65 HydrophobicContact CD2-CD2 3.52Å; L42-Y65 HydrophobicContact CD2-CE2 4.09Å; L42-Y65 HydrophobicContact CD2-CG 3.86Å; L42-Y65 HydrophobicContact CG-CD1 4.15Å; L42-Y65 HydrophobicContact CG-CD2 3.87Å; L42-Y65 HydrophobicContact CG-CE2 4.48Å; L42-Y65 HydrophobicContact CG-CG 3.67Å; L42-V66 HydrophobicContact CD1-CG2 4.34Å
43	S	90.4	Very high	89.4	Confident	47 Å²	47	66.6 Å²	66.6	33%	0.329	35%	0.346	S	S	.	.	H	α-helix	trans	-58	-27.4	178.6	80.5	0	0	0	0	113.1	E39 L40 Q41 F45 L46	E39-S43 PolarHBondContact O-N 3.32Å; L40-S43 WeakPolarHBondContact O-CB 3.17Å; L40-S43 PolarHBondContact O-N 3.12Å; L40-S43 PolarHBondContact O-OG 2.74Å; Q41-S43 PolarHBondContact O-N 3.41Å; S43-F45 VanDerWaalsContact C-N 3.25Å; S43-F45 PolarHBondContact O-N 3.25Å; S43-L46 VanDerWaalsContact O-CB 3.31Å; S43-L46 WeakPolarHBondContact O-CB 3.47Å; S43-L46 WeakPolarHBondContact O-CG 3.33Å; S43-L46 PolarHBondContact O-N 2.98Å
44	T	89.8	Confident	89.4	Confident	98 Å²	98	59.4 Å²	59.4	60%	0.601	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.4	177.1	70.1	0	0	0	0	113.3	Q41 L42 P47	Q41-T44 WeakPolarHBondContact O-CB 3.36Å; Q41-T44 PolarHBondContact O-N 2.89Å; Q41-T44 VanDerWaalsContact O-N 3.16Å; Q41-T44 PolarHBondContact O-OG1 3.33Å; L42-T44 PolarHBondContact O-N 3.32Å; L42-T44 VanDerWaalsContact O-N 3.13Å; T44-P47 WeakPolarHBondContact O-CD 3.49Å
45	F	90.1	Very high	89.2	Confident	23 Å²	23	55.4 Å²	55.4	10%	0.101	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.1	176.6	-66.2	-81.2	0	0	0	113.4	L42 S43 P47 L48 I49 L61 Y65 P103 L106	L42-F45 PolarHBondContact O-N 3.24Å; S43-F45 VanDerWaalsContact C-N 3.25Å; S43-F45 PolarHBondContact O-N 3.25Å; F45-P47 VanDerWaalsContact C-CD 3.42Å; F45-P47 VanDerWaalsContact C-N 3.31Å; F45-L48 HydrophobicContact CD1-CD2 4.37Å; F45-L48 WeakPolarHBondContact O-CA 3.42Å; F45-L48 WeakPolarHBondContact O-CB 3.03Å; F45-L48 PolarHBondContact O-N 2.87Å; F45-I49 HydrophobicContact CB-CD1 4.43Å; F45-I49 WeakPolarHBondContact O-CG1 3.44Å; F45-I49 PolarHBondContact O-N 3.36Å; F45-L61 HydrophobicContact CB-CD1 3.55Å; F45-L61 HydrophobicContact CD1-CD1 4.25Å; F45-L61 HydrophobicContact CD1-CD2 4.18Å; F45-L61 HydrophobicContact CD2-CD1 4.41Å; F45-L61 HydrophobicContact CD2-CD2 4.13Å; F45-L61 HydrophobicContact CE1-CD2 4.35Å; F45-L61 HydrophobicContact CE2-CD2 4.3Å; F45-L61 HydrophobicContact CG-CD1 3.83Å; F45-L61 HydrophobicContact CG-CD2 4.07Å; F45-L61 HydrophobicContact CZ-CD2 4.4Å; F45-Y65 HydrophobicContact CE2-CE2 4.19Å; F45-P103 HydrophobicContact CE1-CG 4.31Å; F45-P103 HydrophobicContact CZ-CG 4.2Å; F45-L106 HydrophobicContact CE1-CD1 4.14Å; F45-L106 HydrophobicContact CZ-CD1 3.94Å
46	L	88.4	Confident	89.2	Confident	68 Å²	68	55.5 Å²	55.5	36%	0.356	30%	0.299	S	S	.	.	H	α-helix	trans	-51.2	-42.2	178.9	-76	171.8	0	0	0	113.7	M15 S43 L48 I49 Q50	M15-L46 HydrophobicContact CE-CD1 4.46Å; M15-L46 HydrophobicContact CE-CD2 3.59Å; M15-L46 HydrophobicContact CE-CG 3.91Å; S43-L46 VanDerWaalsContact O-CB 3.31Å; S43-L46 WeakPolarHBondContact O-CB 3.47Å; S43-L46 WeakPolarHBondContact O-CG 3.33Å; S43-L46 PolarHBondContact O-N 2.98Å; L46-L48 VanDerWaalsContact C-N 3.3Å; L46-L48 PolarHBondContact O-N 3.49Å; L46-I49 PolarHBondContact O-N 3.23Å; L46-Q50 WeakPolarHBondContact O-CB 3.33Å; L46-Q50 VanDerWaalsContact O-CG 3.26Å; L46-Q50 WeakPolarHBondContact O-CG 3.47Å; L46-Q50 PolarHBondContact O-N 3.27Å
47	P	83.1	Confident	89.2	Confident	76 Å²	76	52.4 Å²	52.4	49%	0.494	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-38.6	175.2	-23.6	35	0	0	0	112.8	T44 F45 Q50 L51	T44-P47 WeakPolarHBondContact O-CD 3.49Å; F45-P47 VanDerWaalsContact C-CD 3.42Å; F45-P47 VanDerWaalsContact C-N 3.31Å; P47-Q50 PolarHBondContact O-N 3.03Å; P47-L51 WeakPolarHBondContact O-CB 3.39Å; P47-L51 WeakPolarHBondContact O-CD1 3.35Å; P47-L51 VanDerWaalsContact O-CG 3.25Å; P47-L51 WeakPolarHBondContact O-CG 3.29Å; P47-L51 PolarHBondContact O-N 3.22Å
48	L	84.6	Confident	89.2	Confident	13 Å²	13	51.9 Å²	51.9	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-72.6	-37.5	180	-160.7	71.1	0	0	0	111.6	F45 L46 L51 Q52 L57 C91 M94 L95	F45-L48 HydrophobicContact CD1-CD2 4.37Å; F45-L48 WeakPolarHBondContact O-CA 3.42Å; F45-L48 WeakPolarHBondContact O-CB 3.03Å; F45-L48 PolarHBondContact O-N 2.87Å; L46-L48 VanDerWaalsContact C-N 3.3Å; L46-L48 PolarHBondContact O-N 3.49Å; L48-L51 PolarHBondContact O-N 2.91Å; L48-Q52 PolarHBondContact O-N 2.99Å; L48-L57 HydrophobicContact CB-CD2 4Å; L48-L57 HydrophobicContact CD2-CD1 4.37Å; L48-L57 HydrophobicContact CD2-CD2 3.84Å; L48-L57 HydrophobicContact CG-CD2 3.67Å; L48-C91 HydrophobicContact CD2-CB 4.24Å; L48-M94 HydrophobicContact CD1-CB 4.46Å; L48-M94 HydrophobicContact CD1-CG 4.07Å; L48-M94 HydrophobicContact CD1-SD 3.81Å; L48-L95 HydrophobicContact CD1-CD2 4.35Å; L48-L95 HydrophobicContact CD1-CG 4.41Å; L48-L95 HydrophobicContact CD2-CD1 4.32Å; L48-L95 HydrophobicContact CD2-CD2 4.22Å; L48-L95 HydrophobicContact CD2-CG 4.24Å
49	I	87.3	Confident	89.2	Confident	34 Å²	34	53.3 Å²	53.3	17%	0.174	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-43	172.7	-64.7	169.1	0	0	0	110.3	M15 F45 L46 Q52 L57 K58 L61	M15-I49 HydrophobicContact SD-CD1 4.06Å; F45-I49 HydrophobicContact CB-CD1 4.43Å; F45-I49 WeakPolarHBondContact O-CG1 3.44Å; F45-I49 PolarHBondContact O-N 3.36Å; L46-I49 PolarHBondContact O-N 3.23Å; I49-Q52 WeakPolarHBondContact O-CG 3.27Å; I49-Q52 PolarHBondContact O-N 3.19Å; I49-L57 HydrophobicContact CG1-CD2 4.06Å; I49-L57 HydrophobicContact CG1-CG 4.3Å; I49-K58 HydrophobicContact CG2-CB 4.43Å; I49-L61 HydrophobicContact CD1-CD1 3.89Å; I49-L61 HydrophobicContact CG1-CD1 3.96Å
50	Q	84	Confident	89.3	Confident	125 Å²	125	50.2 Å²	50.2	58%	0.584	27%	0.266	S	S	*	.	H	α-helix	trans	-69.4	-32.2	178.5	-73.6	175.1	-8.7	0	0	113.3	L46 P47 Q52	L46-Q50 WeakPolarHBondContact O-CB 3.33Å; L46-Q50 VanDerWaalsContact O-CG 3.26Å; L46-Q50 WeakPolarHBondContact O-CG 3.47Å; L46-Q50 PolarHBondContact O-N 3.27Å; P47-Q50 PolarHBondContact O-N 3.03Å; Q50-Q52 PolarHBondContact O-N 3.45Å
51	L	83.2	Confident	89.4	Confident	66 Å²	66	44.4 Å²	44.4	35%	0.346	24%	0.235	S	C	.	.	H	α-helix	trans	-71.6	-14.1	173.2	-75.1	164.4	0	0	0	112.9	P47 L48 C53 M94 N168	P47-L51 WeakPolarHBondContact O-CB 3.39Å; P47-L51 WeakPolarHBondContact O-CD1 3.35Å; P47-L51 VanDerWaalsContact O-CG 3.25Å; P47-L51 WeakPolarHBondContact O-CG 3.29Å; P47-L51 PolarHBondContact O-N 3.22Å; L48-L51 PolarHBondContact O-N 2.91Å; L51-C53 VanDerWaalsContact C-N 3.31Å; L51-C53 PolarHBondContact O-N 3.41Å; L51-M94 HydrophobicContact CB-CE 4.45Å; L51-M94 HydrophobicContact CB-SD 3.85Å; L51-M94 HydrophobicContact CD1-SD 3.7Å; L51-M94 HydrophobicContact CG-SD 4.31Å; L51-N168 HydrophobicContact CD2-CB 4.49Å
52	Q	83.7	Confident	89.7	Confident	145 Å²	145	41.4 Å²	41.4	68%	0.678	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.9	46.1	178.5	-62.6	-164.5	-61.8	0	0	113.8	L48 I49 Q50 S54	L48-Q52 PolarHBondContact O-N 2.99Å; I49-Q52 WeakPolarHBondContact O-CG 3.27Å; I49-Q52 PolarHBondContact O-N 3.19Å; Q50-Q52 PolarHBondContact O-N 3.45Å; Q52-S54 PolarHBondContact O-N 3.48Å; Q52-S54 VanDerWaalsContact O-N 3.15Å
53	C	87.7	Confident	89.7	Confident	7 Å²	7	41.4 Å²	41.4	5%	0.047	22%	0.221	C	C	.	.	S	Bend	trans	-57.5	-29	176.1	53.6	0	0	0	0	113	L51 C90 C91 M94	L51-C53 VanDerWaalsContact C-N 3.31Å; L51-C53 PolarHBondContact O-N 3.41Å; C53-C90 WeakPolarHBondContact O-CB 3.45Å; C53-C91 HydrophobicContact CB-CB 3.96Å; C53-C91 WeakPolarHBondContact CB-SG 3.32Å; C53-C91 WeakPolarHBondContact SG-CB 3.42Å; C53-C91 CovalentContact SG-SG 2.03Å; C53-C91 PolarHBondContact SG-SG 3.03Å; C53-M94 HydrophobicContact CB-CE 4.26Å; C53-M94 HydrophobicContact CB-SD 4.03Å
54	S	89.6	Confident	90	Very high	5 Å²	5	39.2 Å²	39.2	4%	0.035	21%	0.206	C	C	.	.			trans	-144.8	139.1	166.8	167.3	0	0	0	0	108.4	Q52 Q56 L57 E127	Q52-S54 PolarHBondContact O-N 3.48Å; Q52-S54 VanDerWaalsContact O-N 3.15Å; S54-Q56 PolarHBondContact O-N 3.42Å; S54-Q56 PolarHBondContact OG-N 3.11Å; S54-L57 WeakPolarHBondContact O-CB 3.29Å; S54-L57 PolarHBondContact O-N 3.2Å; S54-L57 VanDerWaalsContact O-N 3.15Å; S54-E127 PolarHBondContact OG-OE1 3.48Å
55	S	89.4	Confident	90.2	Very high	43 Å²	43	35 Å²	35	30%	0.301	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22	174.1	66.9	0	0	0	0	112.3
56	Q	91.4	Very high	90.5	Very high	14 Å²	14	34 Å²	34	7%	0.065	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-10.5	179.2	-63.4	177.6	108.1	0	0	113.9	S54 K58 F59 F60 L83 S86 V87 P125 E127	S54-Q56 PolarHBondContact O-N 3.42Å; S54-Q56 PolarHBondContact OG-N 3.11Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.41Å; Q56-F59 PolarHBondContact O-N 3.11Å; Q56-F60 WeakPolarHBondContact O-CB 3.45Å; Q56-F60 PolarHBondContact O-N 3.18Å; Q56-L83 HydrophobicContact CB-CD1 3.81Å; Q56-L83 HydrophobicContact CG-CD1 4.08Å; Q56-S86 PolarHBondContact NE2-OG 2.97Å; Q56-V87 HydrophobicContact CB-CG2 3.73Å; Q56-P125 HydrophobicContact CG-CG 4.49Å; Q56-P125 PolarHBondContact OE1-O 3.43Å; Q56-E127 VanDerWaalsContact CD-CG 3.41Å; Q56-E127 HydrophobicContact CG-CG 3.83Å; Q56-E127 PolarHBondContact NE2-OE1 3.22Å
57	L	93.2	Very high	90.8	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-56.8	-46	-171.8	174.6	64.3	0	0	0	112.4	L48 I49 S54 F60 L61 V87	L48-L57 HydrophobicContact CB-CD2 4Å; L48-L57 HydrophobicContact CD2-CD1 4.37Å; L48-L57 HydrophobicContact CD2-CD2 3.84Å; L48-L57 HydrophobicContact CG-CD2 3.67Å; I49-L57 HydrophobicContact CG1-CD2 4.06Å; I49-L57 HydrophobicContact CG1-CG 4.3Å; S54-L57 WeakPolarHBondContact O-CB 3.29Å; S54-L57 PolarHBondContact O-N 3.2Å; S54-L57 VanDerWaalsContact O-N 3.15Å; L57-F60 PolarHBondContact O-N 3.13Å; L57-L61 HydrophobicContact CD1-CD1 3.76Å; L57-L61 HydrophobicContact CD1-CD2 4.5Å; L57-L61 HydrophobicContact CD1-CG 3.87Å; L57-L61 HydrophobicContact CG-CD1 3.89Å; L57-L61 HydrophobicContact CG-CG 4.38Å; L57-L61 WeakPolarHBondContact O-CB 3.39Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 2.75Å; L57-V87 HydrophobicContact CB-CG1 4.14Å; L57-V87 HydrophobicContact CD1-CG1 3.44Å; L57-V87 VanDerWaalsContact CD1-CG1 3.44Å; L57-V87 HydrophobicContact CG-CG1 4.39Å
58	K	93.1	Very high	91.3	Very high	70 Å²	70	30 Å²	30	30%	0.304	15%	0.148	S	C	.	.	H	α-helix	trans	-60.1	-49.4	-179.7	-176.4	-174.1	175.8	-170.8	0	111.1	M15 D18 I49 Q56 F60 L61 C62	M15-K58 WeakPolarHBondContact O-CE 3.45Å; M15-K58 PolarHBondContact O-NZ 2.93Å; D18-K58 IonicContact OD1-NZ 3.74Å; D18-K58 PolarHBondContact OD1-NZ 3.29Å; D18-K58 IonicContact OD2-NZ 2.71Å; D18-K58 PolarHBondContact OD2-NZ 3.03Å; I49-K58 HydrophobicContact CG2-CB 4.43Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.41Å; K58-F60 VanDerWaalsContact C-N 3.35Å; K58-F60 PolarHBondContact O-N 2.97Å; K58-L61 PolarHBondContact O-N 2.68Å; K58-C62 WeakPolarHBondContact O-CB 3.34Å; K58-C62 PolarHBondContact O-N 3.14Å; K58-C62 PolarHBondContact O-SG 3.15Å; K58-C62 VanDerWaalsContact O-SG 3.42Å
59	F	93.9	Very high	91.7	Very high	31 Å²	31	30.3 Å²	30.3	14%	0.136	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-44.3	178.7	-179.4	-88.7	0	0	0	111.3	L19 P20 Q56 C62 S63 L83 M122 P125	L19-F59 HydrophobicContact CD2-CD2 4.02Å; L19-F59 HydrophobicContact CD2-CE2 4.24Å; P20-F59 HydrophobicContact CG-CE2 4.07Å; Q56-F59 PolarHBondContact O-N 3.11Å; F59-C62 PolarHBondContact O-N 3.34Å; F59-S63 WeakPolarHBondContact O-CB 3.45Å; F59-S63 PolarHBondContact O-N 2.87Å; F59-S63 PolarHBondContact O-OG 3.03Å; F59-L83 HydrophobicContact CD1-CD2 3.71Å; F59-L83 HydrophobicContact CE1-CD2 3.74Å; F59-M122 HydrophobicContact CE1-CB 4.32Å; F59-M122 HydrophobicContact CZ-CB 4.17Å; F59-M122 HydrophobicContact CZ-SD 4.15Å; F59-P125 HydrophobicContact CB-CG 4.3Å; F59-P125 HydrophobicContact CG-CG 4.35Å
60	F	95.6	Very high	91.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.3	-51.8	176.8	170.1	-109.7	0	0	0	111.9	Q56 L57 K58 C62 S63 V64 P79 L83 C84 V87 W102 L106 F111	Q56-F60 WeakPolarHBondContact O-CB 3.45Å; Q56-F60 PolarHBondContact O-N 3.18Å; L57-F60 PolarHBondContact O-N 3.13Å; K58-F60 VanDerWaalsContact C-N 3.35Å; K58-F60 PolarHBondContact O-N 2.97Å; F60-C62 PolarHBondContact O-N 3.09Å; F60-S63 PolarHBondContact O-N 3.47Å; F60-S63 PolarHBondContact O-OG 3.25Å; F60-V64 HydrophobicContact CD2-CG2 4.35Å; F60-V64 HydrophobicContact CE2-CG2 3.9Å; F60-V64 HydrophobicContact CZ-CG2 4.13Å; F60-V64 WeakPolarHBondContact O-CG2 3.23Å; F60-V64 PolarHBondContact O-N 3.46Å; F60-P79 HydrophobicContact CD2-CB 3.99Å; F60-P79 HydrophobicContact CD2-CG 3.97Å; F60-P79 HydrophobicContact CE2-CB 4.28Å; F60-P79 HydrophobicContact CE2-CG 3.86Å; F60-L83 HydrophobicContact CB-CG 4.36Å; F60-L83 HydrophobicContact CD2-CG 4.35Å; F60-C84 HydrophobicContact CD2-CB 4.28Å; F60-C84 HydrophobicContact CE2-CB 3.53Å; F60-C84 HydrophobicContact CZ-CB 3.97Å; F60-C84 VanDerWaalsContact CZ-SG 3.57Å; F60-V87 HydrophobicContact CB-CG2 3.89Å; F60-V87 HydrophobicContact CD1-CB 4.26Å; F60-V87 HydrophobicContact CD1-CG1 3.91Å; F60-V87 HydrophobicContact CD1-CG2 4.49Å; F60-V87 HydrophobicContact CG-CB 4.42Å; F60-V87 HydrophobicContact CG-CG1 4.46Å; F60-V87 HydrophobicContact CG-CG2 4.24Å; F60-W102 HydrophobicContact CE1-CH2 4.21Å; F60-W102 AromaticContact CE1-CZ2 3.88Å; F60-W102 HydrophobicContact CE1-CZ2 3.88Å; F60-W102 HydrophobicContact CZ-CZ2 4.32Å; F60-L106 HydrophobicContact CE1-CB 4.47Å; F60-L106 HydrophobicContact CE1-CD1 4.28Å; F60-L106 HydrophobicContact CE1-CD2 4.2Å; F60-L106 HydrophobicContact CZ-CB 4.39Å; F60-L106 HydrophobicContact CZ-CD2 4.26Å; F60-F111 AromaticContact CE2-CE2 3.96Å; F60-F111 HydrophobicContact CE2-CE2 3.96Å; F60-F111 HydrophobicContact CE2-CZ 4.41Å; F60-F111 HydrophobicContact CZ-CE2 4.16Å
61	L	95.5	Very high	91.8	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-59.3	-49	179.5	-72.1	172.6	0	0	0	111.4	L42 F45 I49 L57 K58 S63 V64 Y65 L106	L42-L61 HydrophobicContact CD2-CB 3.73Å; F45-L61 HydrophobicContact CB-CD1 3.55Å; F45-L61 HydrophobicContact CD1-CD1 4.25Å; F45-L61 HydrophobicContact CD1-CD2 4.18Å; F45-L61 HydrophobicContact CD2-CD1 4.41Å; F45-L61 HydrophobicContact CD2-CD2 4.13Å; F45-L61 HydrophobicContact CE1-CD2 4.35Å; F45-L61 HydrophobicContact CE2-CD2 4.3Å; F45-L61 HydrophobicContact CG-CD1 3.83Å; F45-L61 HydrophobicContact CG-CD2 4.07Å; F45-L61 HydrophobicContact CZ-CD2 4.4Å; I49-L61 HydrophobicContact CD1-CD1 3.89Å; I49-L61 HydrophobicContact CG1-CD1 3.96Å; L57-L61 HydrophobicContact CD1-CD1 3.76Å; L57-L61 HydrophobicContact CD1-CD2 4.5Å; L57-L61 HydrophobicContact CD1-CG 3.87Å; L57-L61 HydrophobicContact CG-CD1 3.89Å; L57-L61 HydrophobicContact CG-CG 4.38Å; L57-L61 WeakPolarHBondContact O-CB 3.39Å; L57-L61 WeakPolarHBondContact O-CG 3.38Å; L57-L61 PolarHBondContact O-N 2.75Å; K58-L61 PolarHBondContact O-N 2.68Å; L61-S63 VanDerWaalsContact C-N 3.3Å; L61-S63 PolarHBondContact O-N 2.91Å; L61-V64 PolarHBondContact O-N 3.48Å; L61-V64 VanDerWaalsContact O-N 3.1Å; L61-Y65 HydrophobicContact CD2-CE2 4.31Å; L61-Y65 WeakPolarHBondContact O-CD2 3.22Å; L61-Y65 PolarHBondContact O-N 2.9Å; L61-L106 HydrophobicContact CD2-CD1 3.94Å
62	C	96	Very high	91.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-59.3	-39.9	177.4	-73.7	0	0	0	0	112.3	C16 L19 K58 F59 F60 V64 V66	C16-C62 VanDerWaalsContact CA-SG 3.58Å; C16-C62 HydrophobicContact CB-CB 3.84Å; C16-C62 WeakPolarHBondContact CB-SG 3.41Å; C16-C62 VanDerWaalsContact SG-CA 3.59Å; C16-C62 WeakPolarHBondContact SG-CB 3.44Å; C16-C62 CovalentContact SG-SG 2.05Å; C16-C62 PolarHBondContact SG-SG 3.47Å; L19-C62 HydrophobicContact CD1-CB 4.03Å; L19-C62 HydrophobicContact CD2-CB 3.87Å; L19-C62 HydrophobicContact CG-CB 4.31Å; K58-C62 WeakPolarHBondContact O-CB 3.34Å; K58-C62 PolarHBondContact O-N 3.14Å; K58-C62 PolarHBondContact O-SG 3.15Å; K58-C62 VanDerWaalsContact O-SG 3.42Å; F59-C62 PolarHBondContact O-N 3.34Å; F60-C62 PolarHBondContact O-N 3.09Å; C62-V64 PolarHBondContact O-N 2.88Å; C62-V66 CarbonylContact O-C 3.42Å; C62-V66 VanDerWaalsContact O-C 3.24Å; C62-V66 VanDerWaalsContact O-CA 3.3Å; C62-V66 WeakPolarHBondContact O-CA 3.19Å; C62-V66 WeakPolarHBondContact O-CB 3.41Å; C62-V66 PolarHBondContact O-N 3.03Å
63	S	94.5	Very high	91.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.2	-18.8	177.9	70.3	0	0	0	0	115.1	F59 F60 L61 P79	F59-S63 WeakPolarHBondContact O-CB 3.45Å; F59-S63 PolarHBondContact O-N 2.87Å; F59-S63 PolarHBondContact O-OG 3.03Å; F60-S63 PolarHBondContact O-N 3.47Å; F60-S63 PolarHBondContact O-OG 3.25Å; L61-S63 VanDerWaalsContact C-N 3.3Å; L61-S63 PolarHBondContact O-N 2.91Å; S63-P79 WeakPolarHBondContact OG-CB 3.26Å; S63-P79 WeakPolarHBondContact OG-CD 3.39Å; S63-P79 WeakPolarHBondContact OG-CG 3.49Å
64	V	95.2	Very high	91.5	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-92.6	-46.4	177.6	178.3	0	0	0	0	111	F29 V30 F60 L61 C62 P79 L106 F111	F29-V64 HydrophobicContact CB-CG1 4.04Å; F29-V64 PolarHBondContact N-O 3.26Å; V30-V64 HydrophobicContact CG2-CG1 3.8Å; F60-V64 HydrophobicContact CD2-CG2 4.35Å; F60-V64 HydrophobicContact CE2-CG2 3.9Å; F60-V64 HydrophobicContact CZ-CG2 4.13Å; F60-V64 WeakPolarHBondContact O-CG2 3.23Å; F60-V64 PolarHBondContact O-N 3.46Å; L61-V64 PolarHBondContact O-N 3.48Å; L61-V64 VanDerWaalsContact O-N 3.1Å; C62-V64 PolarHBondContact O-N 2.88Å; V64-P79 HydrophobicContact CG2-CG 3.7Å; V64-L106 HydrophobicContact CB-CD2 4.33Å; V64-L106 HydrophobicContact CG1-CD2 3.9Å; V64-L106 HydrophobicContact CG2-CD2 4.32Å; V64-F111 HydrophobicContact CG1-CZ 4.4Å; V64-F111 HydrophobicContact CG2-CE1 4.11Å; V64-F111 HydrophobicContact CG2-CZ 3.67Å
65	Y	95.2	Very high	91.2	Very high	10 Å²	10	45 Å²	45	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-81.9	-26.3	-176.5	-78.9	-87.2	0	0	0	113.5	N28 V30 A38 Q41 L42 F45 L61 L106	N28-Y65 WeakPolarHBondContact CB-O 3.15Å; N28-Y65 PolarHBondContact ND2-O 3.25Å; V30-Y65 HydrophobicContact CB-CE1 4.18Å; V30-Y65 HydrophobicContact CG1-CE1 4.21Å; V30-Y65 HydrophobicContact CG2-CD1 4.03Å; V30-Y65 HydrophobicContact CG2-CE1 3.76Å; V30-Y65 HydrophobicContact CG2-CE2 4.29Å; V30-Y65 HydrophobicContact CG2-CG 4.4Å; A38-Y65 HydrophobicContact CB-CD1 4.27Å; Q41-Y65 HydrophobicContact CB-CD1 4.41Å; Q41-Y65 HydrophobicContact CB-CE1 3.65Å; L42-Y65 HydrophobicContact CD1-CG 4.12Å; L42-Y65 HydrophobicContact CD2-CD2 3.52Å; L42-Y65 HydrophobicContact CD2-CE2 4.09Å; L42-Y65 HydrophobicContact CD2-CG 3.86Å; L42-Y65 HydrophobicContact CG-CD1 4.15Å; L42-Y65 HydrophobicContact CG-CD2 3.87Å; L42-Y65 HydrophobicContact CG-CE2 4.48Å; L42-Y65 HydrophobicContact CG-CG 3.67Å; F45-Y65 HydrophobicContact CE2-CE2 4.19Å; L61-Y65 HydrophobicContact CD2-CE2 4.31Å; L61-Y65 WeakPolarHBondContact O-CD2 3.22Å; L61-Y65 PolarHBondContact O-N 2.9Å; Y65-L106 HydrophobicContact CE2-CD2 4.39Å
66	V	95.1	Very high	91.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	22%	0.222	C	C	.	.	S	Bend	trans	-136.7	64.2	-176.7	-168.8	0	0	0	0	108.4	V11 V13 C16 Y21 T24 L42 C62	V11-V66 HydrophobicContact CB-CG1 4.37Å; V11-V66 HydrophobicContact CG1-CG1 3.93Å; V11-V66 HydrophobicContact CG2-CG1 3.73Å; V13-V66 HydrophobicContact CB-CG2 4.14Å; V13-V66 HydrophobicContact CG2-CG2 3.72Å; C16-V66 HydrophobicContact CB-CG2 4.48Å; Y21-V66 WeakPolarHBondContact CE2-O 3.44Å; Y21-V66 PolarHBondContact OH-O 3.36Å; T24-V66 HydrophobicContact CG2-CG1 3.78Å; T24-V66 WeakPolarHBondContact OG1-CA 3.38Å; T24-V66 WeakPolarHBondContact OG1-CG1 3.43Å; L42-V66 HydrophobicContact CD1-CG2 4.34Å; C62-V66 CarbonylContact O-C 3.42Å; C62-V66 VanDerWaalsContact O-C 3.24Å; C62-V66 VanDerWaalsContact O-CA 3.3Å; C62-V66 WeakPolarHBondContact O-CA 3.19Å; C62-V66 WeakPolarHBondContact O-CB 3.41Å; C62-V66 PolarHBondContact O-N 3.03Å
67	P	94.7	Very high	91.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.			trans	-66.9	157	-171.9	31.8	-38.3	0	0	0	112.3	T24 N28 F29 P76	T24-P67 WeakPolarHBondContact CA-O 3.17Å; T24-P67 VanDerWaalsContact CB-O 3.28Å; T24-P67 WeakPolarHBondContact CB-O 3.32Å; T24-P67 WeakPolarHBondContact OG1-CD 3.42Å; T24-P67 PolarHBondContact OG1-O 2.75Å; N28-P67 HydrophobicContact CB-CG 4.49Å; F29-P67 HydrophobicContact CD2-CB 3.81Å; F29-P67 HydrophobicContact CD2-CG 4.13Å; F29-P67 HydrophobicContact CE2-CB 3.4Å; F29-P67 HydrophobicContact CE2-CG 4.04Å; F29-P67 HydrophobicContact CZ-CB 4.35Å; P67-P76 HydrophobicContact CB-CB 3.87Å; P67-P76 HydrophobicContact CG-CB 3.72Å
68	M	93.4	Very high	91.3	Very high	60 Å²	60	44 Å²	44	30%	0.296	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.9	-179.7	178.7	-179.5	179.2	0	0	110.6	Y21 P76 I77 M122	Y21-M68 HydrophobicContact CD1-CB 3.88Å; Y21-M68 HydrophobicContact CD1-CG 4.07Å; Y21-M68 HydrophobicContact CD1-SD 4.14Å; Y21-M68 HydrophobicContact CD2-CB 3.79Å; Y21-M68 HydrophobicContact CD2-CG 4Å; Y21-M68 HydrophobicContact CE1-CB 3.95Å; Y21-M68 HydrophobicContact CE2-CB 3.84Å; Y21-M68 HydrophobicContact CG-CB 3.8Å; Y21-M68 HydrophobicContact CG-CG 3.73Å; Y21-M68 HydrophobicContact CG-SD 4.17Å; M68-P76 WeakPolarHBondContact O-CA 3.43Å; M68-I77 HydrophobicContact CB-CB 4.29Å; M68-I77 PolarHBondContact N-O 3.13Å; M68-I77 PolarHBondContact O-N 3.32Å; M68-M122 HydrophobicContact CB-CE 4.26Å; M68-M122 HydrophobicContact CB-SD 4.19Å
69	C	92.9	Very high	91.4	Very high	20 Å²	20	40.8 Å²	40.8	14%	0.135	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.1	174.7	-173.9	0	0	0	0	110.5	C8 Y23 T24	C8-C69 WeakPolarHBondContact CA-SG 3.42Å; C8-C69 HydrophobicContact CB-CB 3.76Å; C8-C69 WeakPolarHBondContact CB-SG 3.34Å; C8-C69 WeakPolarHBondContact SG-CB 3.33Å; C8-C69 CovalentContact SG-SG 2.04Å; C8-C69 PolarHBondContact SG-SG 3Å; Y23-C69 PolarHBondContact O-N 3.47Å; T24-C69 VanDerWaalsContact C-CB 3.44Å
70	T	88.9	Confident	91.5	Very high	43 Å²	43	39.4 Å²	39.4	26%	0.264	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	143.1	173.3	-179.4	0	0	0	0	110.4	C8 K72 V73 I77	C8-T70 PolarHBondContact SG-N 3.14Å; C8-T70 VanDerWaalsContact SG-N 3.38Å; T70-K72 HydrophobicContact CG2-CB 4.32Å; T70-K72 PolarHBondContact O-N 3.37Å; T70-V73 HydrophobicContact CG2-CB 3.93Å; T70-V73 HydrophobicContact CG2-CG2 3.79Å; T70-V73 PolarHBondContact O-N 3.03Å; T70-I77 HydrophobicContact CG2-CD1 4.48Å
71	D	85.3	Confident	91.4	Very high	150 Å²	150	43.2 Å²	43.2	80%	0.802	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-7.4	178.6	-49.6	-37.5	0	0	0	114.1
72	K	83	Confident	91.4	Very high	191 Å²	191	46.7 Å²	46.7	83%	0.83	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-12.7	177.5	-61.6	-177.4	-178.1	177.5	0	113.3	T70	T70-K72 HydrophobicContact CG2-CB 4.32Å; T70-K72 PolarHBondContact O-N 3.37Å
73	V	82.8	Confident	91.3	Very high	33 Å²	33	46.9 Å²	46.9	20%	0.2	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	118	-172.3	-175.3	0	0	0	0	108.6	T70 I75 M120	T70-V73 HydrophobicContact CG2-CB 3.93Å; T70-V73 HydrophobicContact CG2-CG2 3.79Å; T70-V73 PolarHBondContact O-N 3.03Å; V73-I75 WeakPolarHBondContact CG1-O 3.41Å; V73-I75 PolarHBondContact O-N 3.08Å; V73-M120 HydrophobicContact CB-CE 4.03Å; V73-M120 HydrophobicContact CG1-CE 3.32Å; V73-M120 HydrophobicContact CG1-SD 4.42Å; V73-M120 HydrophobicContact CG2-CE 3.43Å; V73-M120 VanDerWaalsContact CG2-CE 3.43Å; V73-M120 HydrophobicContact CG2-SD 3.71Å
74	D	82.2	Confident	91.4	Very high	167 Å²	167	46.9 Å²	46.9	89%	0.893	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	-6.1	-175.7	-56.9	-32.3	0	0	0	114.2
75	I	84.8	Confident	91.3	Very high	106 Å²	106	51.1 Å²	51.1	54%	0.544	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	134.8	-173.2	-53.1	173.3	0	0	0	109.4	V73	V73-I75 WeakPolarHBondContact CG1-O 3.41Å; V73-I75 PolarHBondContact O-N 3.08Å
76	P	89.3	Confident	91.2	Very high	17 Å²	17	51.4 Å²	51.4	11%	0.11	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	140	173	17.8	-28.3	0	0	0	112.3	S25 F29 P67 M68	S25-P76 WeakPolarHBondContact OG-CB 3.42Å; F29-P76 HydrophobicContact CE1-CG 4.5Å; F29-P76 HydrophobicContact CZ-CB 4.23Å; F29-P76 HydrophobicContact CZ-CG 4.29Å; F29-P76 WeakPolarHBondContact CZ-O 3.47Å; P67-P76 HydrophobicContact CB-CB 3.87Å; P67-P76 HydrophobicContact CG-CB 3.72Å; M68-P76 WeakPolarHBondContact O-CA 3.43Å
77	I	92.6	Very high	91.1	Very high	17 Å²	17	51.4 Å²	51.4	9%	0.087	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118	179.7	-56.1	173.5	0	0	0	108.5	M68 T70 M120 M122	M68-I77 HydrophobicContact CB-CB 4.29Å; M68-I77 PolarHBondContact N-O 3.13Å; M68-I77 PolarHBondContact O-N 3.32Å; T70-I77 HydrophobicContact CG2-CD1 4.48Å; I77-M120 HydrophobicContact CD1-CB 4.09Å; I77-M120 HydrophobicContact CD1-SD 4.24Å; I77-M120 HydrophobicContact CG1-CB 4.11Å; I77-M120 HydrophobicContact CG2-CB 4.23Å; I77-M122 HydrophobicContact CG2-CG 4.08Å; I77-M122 WeakPolarHBondContact O-CE 3.38Å
78	G	93.3	Very high	91.1	Very high	5 Å²	5	55.4 Å²	55.4	5%	0.052	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-168.3	179.8	0	0	0	0	0	114.2	C121 M122	G78-C121 CarbonylContact O-C 3.26Å; G78-C121 WeakPolarHBondContact O-CA 3.22Å; G78-M122 PolarHBondContact O-N 2.93Å
79	P	95.1	Very high	91	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.013	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	151.1	175.6	29	-32.7	0	0	0	111.8	F60 S63 V64 L83 F111	F60-P79 HydrophobicContact CD2-CB 3.99Å; F60-P79 HydrophobicContact CD2-CG 3.97Å; F60-P79 HydrophobicContact CE2-CB 4.28Å; F60-P79 HydrophobicContact CE2-CG 3.86Å; S63-P79 WeakPolarHBondContact OG-CB 3.26Å; S63-P79 WeakPolarHBondContact OG-CD 3.39Å; S63-P79 WeakPolarHBondContact OG-CG 3.49Å; V64-P79 HydrophobicContact CG2-CG 3.7Å; P79-L83 HydrophobicContact CB-CD2 3.74Å; P79-L83 HydrophobicContact CB-CG 4.47Å; P79-F111 HydrophobicContact CG-CD1 3.85Å; P79-F111 HydrophobicContact CG-CD2 4.34Å; P79-F111 HydrophobicContact CG-CE1 3.78Å; P79-F111 HydrophobicContact CG-CE2 4.29Å; P79-F111 HydrophobicContact CG-CG 4.15Å; P79-F111 HydrophobicContact CG-CZ 4.02Å; P79-F111 WeakPolarHBondContact O-CB 3.22Å
80	C	95.4	Very high	90.8	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.02	29%	0.287	C	S	.	.			trans	-74.2	153.7	165	-59	0	0	0	0	110.7	P82 L83 C84 C121 M122	C80-P82 VanDerWaalsContact C-CD 3.49Å; C80-L83 WeakPolarHBondContact O-CB 3.41Å; C80-L83 PolarHBondContact O-N 3.44Å; C80-C84 PolarHBondContact O-N 3.31Å; C80-C121 WeakPolarHBondContact CA-SG 3.29Å; C80-C121 HydrophobicContact CB-CB 3.96Å; C80-C121 WeakPolarHBondContact CB-SG 3.12Å; C80-C121 WeakPolarHBondContact SG-CB 3.48Å; C80-C121 PolarHBondContact SG-O 3.44Å; C80-C121 VanDerWaalsContact SG-O 3.37Å; C80-C121 CovalentContact SG-SG 2.04Å; C80-C121 PolarHBondContact SG-SG 3.49Å; C80-M122 PolarHBondContact N-O 3.21Å; C80-M122 VanDerWaalsContact SG-C 3.5Å
81	R	94.9	Very high	91	Very high	79 Å²	79	56.3 Å²	56.3	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-55.6	-42.1	179.5	-175.5	-178.9	-59.7	176.1	0.6	114.1	L83 C84 E85 C108 S109 F111 H112	R81-L83 PolarHBondContact O-N 3.32Å; R81-C84 WeakPolarHBondContact O-CB 3.16Å; R81-C84 PolarHBondContact O-N 3.27Å; R81-C84 VanDerWaalsContact O-N 3.1Å; R81-E85 WeakPolarHBondContact CD-OE1 3.49Å; R81-E85 HydrophobicContact CG-CG 4.11Å; R81-E85 WeakPolarHBondContact CG-OE1 3.47Å; R81-E85 WeakPolarHBondContact O-CG 3.24Å; R81-E85 PolarHBondContact O-N 3.47Å; R81-C108 HydrophobicContact CG-CB 4.41Å; R81-S109 PolarHBondContact NH2-O 3.24Å; R81-F111 HydrophobicContact CB-CB 4.34Å; R81-F111 PolarHBondContact NE-O 3.15Å; R81-F111 VanDerWaalsContact NE-O 3.08Å; R81-F111 PolarHBondContact NH2-O 3.32Å; R81-H112 WeakPolarHBondContact CB-O 3.49Å; R81-H112 PolarHBondContact N-O 3.28Å
82	P	94	Very high	91.2	Very high	75 Å²	75	50.4 Å²	50.4	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-59.8	-33.6	179.5	-26.3	36.6	0	0	0	113.6	C80 E85 S86 P113	C80-P82 VanDerWaalsContact C-CD 3.49Å; P82-E85 PolarHBondContact O-N 3.47Å; P82-S86 WeakPolarHBondContact O-CB 3.23Å; P82-S86 PolarHBondContact O-N 3.29Å; P82-P113 VanDerWaalsContact CD-O 3.24Å; P82-P113 WeakPolarHBondContact CD-O 3.1Å
83	L	94.4	Very high	91.4	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-47.4	174.8	176.6	63.3	0	0	0	111	Q56 F59 F60 P79 C80 R81 S86 V87	Q56-L83 HydrophobicContact CB-CD1 3.81Å; Q56-L83 HydrophobicContact CG-CD1 4.08Å; F59-L83 HydrophobicContact CD1-CD2 3.71Å; F59-L83 HydrophobicContact CE1-CD2 3.74Å; F60-L83 HydrophobicContact CB-CG 4.36Å; F60-L83 HydrophobicContact CD2-CG 4.35Å; P79-L83 HydrophobicContact CB-CD2 3.74Å; P79-L83 HydrophobicContact CB-CG 4.47Å; C80-L83 WeakPolarHBondContact O-CB 3.41Å; C80-L83 PolarHBondContact O-N 3.44Å; R81-L83 PolarHBondContact O-N 3.32Å; L83-S86 PolarHBondContact O-N 3.42Å; L83-V87 WeakPolarHBondContact O-CG2 3.14Å; L83-V87 PolarHBondContact O-N 3.13Å; L83-V87 VanDerWaalsContact O-N 3.07Å
84	C	95.8	Very high	91.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-47.1	175.6	-178	0	0	0	0	111.7	F60 C80 R81 S86 V87 R88 L106 C108 F111	F60-C84 HydrophobicContact CD2-CB 4.28Å; F60-C84 HydrophobicContact CE2-CB 3.53Å; F60-C84 HydrophobicContact CZ-CB 3.97Å; F60-C84 VanDerWaalsContact CZ-SG 3.57Å; C80-C84 PolarHBondContact O-N 3.31Å; R81-C84 WeakPolarHBondContact O-CB 3.16Å; R81-C84 PolarHBondContact O-N 3.27Å; R81-C84 VanDerWaalsContact O-N 3.1Å; C84-S86 VanDerWaalsContact C-N 3.29Å; C84-S86 PolarHBondContact O-N 3.36Å; C84-V87 PolarHBondContact O-N 3.3Å; C84-R88 WeakPolarHBondContact O-CB 3.33Å; C84-R88 PolarHBondContact O-N 2.99Å; C84-L106 PolarHBondContact SG-O 3.07Å; C84-C108 HydrophobicContact CB-CB 3.75Å; C84-C108 WeakPolarHBondContact CB-SG 3.06Å; C84-C108 WeakPolarHBondContact SG-CA 3.21Å; C84-C108 WeakPolarHBondContact SG-CB 3.28Å; C84-C108 CovalentContact SG-SG 2.05Å; C84-C108 PolarHBondContact SG-SG 3.27Å; C84-F111 HydrophobicContact CB-CD2 3.83Å; C84-F111 HydrophobicContact CB-CE2 4.15Å
85	E	94.4	Very high	91.7	Very high	90 Å²	90	35.8 Å²	35.8	42%	0.421	17%	0.174	S	C	.	.	H	α-helix	trans	-64.3	-35.7	-179.4	-71.9	175.8	174.5	0	0	111.8	R81 P82 R89 C108	R81-E85 WeakPolarHBondContact CD-OE1 3.49Å; R81-E85 HydrophobicContact CG-CG 4.11Å; R81-E85 WeakPolarHBondContact CG-OE1 3.47Å; R81-E85 WeakPolarHBondContact O-CG 3.24Å; R81-E85 PolarHBondContact O-N 3.47Å; P82-E85 PolarHBondContact O-N 3.47Å; E85-R89 VanDerWaalsContact O-CB 3.3Å; E85-R89 WeakPolarHBondContact O-CB 3.43Å; E85-R89 PolarHBondContact O-N 2.77Å; E85-C108 HydrophobicContact CG-CB 4.01Å
86	S	92.3	Very high	91.8	Very high	17 Å²	17	38.4 Å²	38.4	12%	0.119	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-53.8	174.5	-158.4	0	0	0	0	112.2	Q56 P82 L83 C84 R88 R89 C90 E127	Q56-S86 PolarHBondContact NE2-OG 2.97Å; P82-S86 WeakPolarHBondContact O-CB 3.23Å; P82-S86 PolarHBondContact O-N 3.29Å; L83-S86 PolarHBondContact O-N 3.42Å; C84-S86 VanDerWaalsContact C-N 3.29Å; C84-S86 PolarHBondContact O-N 3.36Å; S86-R88 VanDerWaalsContact C-N 3.32Å; S86-R88 PolarHBondContact O-N 2.66Å; S86-R89 WeakPolarHBondContact O-CB 3.44Å; S86-R89 PolarHBondContact O-N 3.27Å; S86-C90 PolarHBondContact O-N 2.93Å; S86-E127 PolarHBondContact OG-OE1 3.12Å
87	V	93.5	Very high	91.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-43.3	179.2	175	0	0	0	0	110.7	Q56 L57 F60 L83 C84 R89 C90 C91 W102	Q56-V87 HydrophobicContact CB-CG2 3.73Å; L57-V87 HydrophobicContact CB-CG1 4.14Å; L57-V87 HydrophobicContact CD1-CG1 3.44Å; L57-V87 VanDerWaalsContact CD1-CG1 3.44Å; L57-V87 HydrophobicContact CG-CG1 4.39Å; F60-V87 HydrophobicContact CB-CG2 3.89Å; F60-V87 HydrophobicContact CD1-CB 4.26Å; F60-V87 HydrophobicContact CD1-CG1 3.91Å; F60-V87 HydrophobicContact CD1-CG2 4.49Å; F60-V87 HydrophobicContact CG-CB 4.42Å; F60-V87 HydrophobicContact CG-CG1 4.46Å; F60-V87 HydrophobicContact CG-CG2 4.24Å; L83-V87 WeakPolarHBondContact O-CG2 3.14Å; L83-V87 PolarHBondContact O-N 3.13Å; L83-V87 VanDerWaalsContact O-N 3.07Å; C84-V87 PolarHBondContact O-N 3.3Å; V87-R89 VanDerWaalsContact C-N 3.35Å; V87-R89 PolarHBondContact O-N 3.32Å; V87-C90 PolarHBondContact O-N 3.12Å; V87-C91 WeakPolarHBondContact O-CB 3.34Å; V87-C91 PolarHBondContact O-N 2.93Å; V87-C91 PolarHBondContact O-SG 3.25Å; V87-C91 VanDerWaalsContact O-SG 3.38Å; V87-W102 HydrophobicContact CG1-CH2 4.12Å
88	R	93.7	Very high	90.7	Very high	84 Å²	84	48 Å²	48	32%	0.317	22%	0.218	S	C	.	.	H	α-helix	trans	-59.6	-44.2	176.8	-179.1	177.8	172.5	-172.3	-1.2	111.5	C84 S86 C90 C91 E92 W102	C84-R88 WeakPolarHBondContact O-CB 3.33Å; C84-R88 PolarHBondContact O-N 2.99Å; S86-R88 VanDerWaalsContact C-N 3.32Å; S86-R88 PolarHBondContact O-N 2.66Å; R88-C90 VanDerWaalsContact C-N 3.33Å; R88-C90 PolarHBondContact O-N 3.41Å; R88-C91 PolarHBondContact O-N 2.79Å; R88-E92 HydrophobicContact CG-CB 4.11Å; R88-E92 WeakPolarHBondContact CG-OE2 3.46Å; R88-E92 IonicContact CZ-OE2 3.39Å; R88-E92 IonicContact NE-OE2 2.72Å; R88-E92 PolarHBondContact NE-OE2 3.46Å; R88-E92 IonicContact NH2-OE1 2.63Å; R88-E92 IonicContact NH2-OE2 3.99Å; R88-E92 PolarHBondContact NH2-OE2 3.48Å; R88-E92 VanDerWaalsContact NH2-OE2 3.16Å; R88-E92 WeakPolarHBondContact O-CB 3.42Å; R88-E92 PolarHBondContact O-N 3.4Å; R88-W102 HydrophobicContact CB-CD2 4.26Å; R88-W102 HydrophobicContact CB-CE3 4.37Å; R88-W102 HydrophobicContact CB-CH2 4.1Å; R88-W102 HydrophobicContact CB-CZ2 3.94Å; R88-W102 HydrophobicContact CB-CZ3 4.31Å; R88-W102 HydrophobicContact CG-CD2 3.77Å; R88-W102 HydrophobicContact CG-CE3 4.04Å; R88-W102 HydrophobicContact CG-CG 4.13Å; R88-W102 HydrophobicContact CG-CZ2 4.35Å; R88-W102 HydrophobicContact CG-CZ3 4.47Å
89	R	92.1	Very high	90.2	Very high	142 Å²	142	50.8 Å²	50.8	54%	0.536	25%	0.247	S	C	.	.	H	α-helix	trans	-59.1	-42.8	178.9	-168.4	-172.4	-46.8	99.3	7.8	112.1	E85 S86 V87 P93	E85-R89 VanDerWaalsContact O-CB 3.3Å; E85-R89 WeakPolarHBondContact O-CB 3.43Å; E85-R89 PolarHBondContact O-N 2.77Å; S86-R89 WeakPolarHBondContact O-CB 3.44Å; S86-R89 PolarHBondContact O-N 3.27Å; V87-R89 VanDerWaalsContact C-N 3.35Å; V87-R89 PolarHBondContact O-N 3.32Å; R89-P93 VanDerWaalsContact O-CD 3.27Å; R89-P93 WeakPolarHBondContact O-CD 3.4Å; R89-P93 WeakPolarHBondContact O-CG 3.35Å
90	C	89.6	Confident	89.7	Confident	1 Å²	1	57 Å²	57	1%	0.007	27%	0.274	C	S	.	.	H	α-helix	trans	-80.4	-34.9	179.8	-53.1	0	0	0	0	113.6	C53 S86 V87 R88 C133	C53-C90 WeakPolarHBondContact O-CB 3.45Å; S86-C90 PolarHBondContact O-N 2.93Å; V87-C90 PolarHBondContact O-N 3.12Å; R88-C90 VanDerWaalsContact C-N 3.33Å; R88-C90 PolarHBondContact O-N 3.41Å; C90-C133 VanDerWaalsContact CA-SG 3.55Å; C90-C133 HydrophobicContact CB-CB 3.67Å; C90-C133 WeakPolarHBondContact CB-SG 3.16Å; C90-C133 VanDerWaalsContact SG-CA 3.58Å; C90-C133 WeakPolarHBondContact SG-CB 3.17Å; C90-C133 CovalentContact SG-SG 2.04Å; C90-C133 PolarHBondContact SG-SG 3.29Å
91	C	91.3	Very high	89.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-100.3	-24.9	-168.9	-60.7	0	0	0	0	114.6	L48 C53 V87 R88 M94 L95 W102	L48-C91 HydrophobicContact CD2-CB 4.24Å; C53-C91 HydrophobicContact CB-CB 3.96Å; C53-C91 WeakPolarHBondContact CB-SG 3.32Å; C53-C91 WeakPolarHBondContact SG-CB 3.42Å; C53-C91 CovalentContact SG-SG 2.03Å; C53-C91 PolarHBondContact SG-SG 3.03Å; V87-C91 WeakPolarHBondContact O-CB 3.34Å; V87-C91 PolarHBondContact O-N 2.93Å; V87-C91 PolarHBondContact O-SG 3.25Å; V87-C91 VanDerWaalsContact O-SG 3.38Å; R88-C91 PolarHBondContact O-N 2.79Å; C91-M94 WeakPolarHBondContact O-CB 3.45Å; C91-M94 PolarHBondContact O-N 2.63Å; C91-L95 PolarHBondContact O-N 3.19Å; C91-W102 HydrophobicContact CB-CZ3 4.15Å
92	E	90.8	Very high	89.4	Confident	25 Å²	25	58.9 Å²	58.9	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-43.1	175.9	-177.2	178.1	175.2	0	0	112.7	R88 M94 L95 R96 W102	R88-E92 HydrophobicContact CG-CB 4.11Å; R88-E92 WeakPolarHBondContact CG-OE2 3.46Å; R88-E92 IonicContact CZ-OE2 3.39Å; R88-E92 IonicContact NE-OE2 2.72Å; R88-E92 PolarHBondContact NE-OE2 3.46Å; R88-E92 IonicContact NH2-OE1 2.63Å; R88-E92 IonicContact NH2-OE2 3.99Å; R88-E92 PolarHBondContact NH2-OE2 3.48Å; R88-E92 VanDerWaalsContact NH2-OE2 3.16Å; R88-E92 WeakPolarHBondContact O-CB 3.42Å; R88-E92 PolarHBondContact O-N 3.4Å; E92-M94 PolarHBondContact O-N 3.44Å; E92-L95 PolarHBondContact O-N 2.89Å; E92-R96 HydrophobicContact CG-CG 4.3Å; E92-R96 WeakPolarHBondContact O-CG 3.2Å; E92-R96 PolarHBondContact O-N 3.19Å; E92-R96 IonicContact OE1-CZ 3.56Å; E92-R96 IonicContact OE1-NE 3.73Å; E92-R96 PolarHBondContact OE1-NE 3.48Å; E92-R96 IonicContact OE1-NH2 3.46Å; E92-R96 PolarHBondContact OE1-NH2 3.4Å; E92-W102 HydrophobicContact CB-CE3 4.05Å; E92-W102 HydrophobicContact CG-CB 4.14Å
93	P	87.4	Confident	89.3	Confident	52 Å²	52	57 Å²	57	34%	0.338	28%	0.281	S	S	.	.	H	α-helix	trans	-57.6	-38	176	-25.6	35.6	0	0	0	112.5	R89 R96 Q97	R89-P93 VanDerWaalsContact O-CD 3.27Å; R89-P93 WeakPolarHBondContact O-CD 3.4Å; R89-P93 WeakPolarHBondContact O-CG 3.35Å; P93-R96 PolarHBondContact O-N 3.23Å; P93-Q97 WeakPolarHBondContact O-CG 3.33Å; P93-Q97 PolarHBondContact O-N 3.23Å; P93-Q97 VanDerWaalsContact O-N 3.12Å
94	M	83.7	Confident	89.1	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.039	31%	0.311	C	S	.	.	H	α-helix	trans	-67.8	-45.1	176.8	-174.5	170.2	-74.8	0	0	111.5	L48 L51 C53 C91 E92 R96 Q97 F98 F134	L48-M94 HydrophobicContact CD1-CB 4.46Å; L48-M94 HydrophobicContact CD1-CG 4.07Å; L48-M94 HydrophobicContact CD1-SD 3.81Å; L51-M94 HydrophobicContact CB-CE 4.45Å; L51-M94 HydrophobicContact CB-SD 3.85Å; L51-M94 HydrophobicContact CD1-SD 3.7Å; L51-M94 HydrophobicContact CG-SD 4.31Å; C53-M94 HydrophobicContact CB-CE 4.26Å; C53-M94 HydrophobicContact CB-SD 4.03Å; C91-M94 WeakPolarHBondContact O-CB 3.45Å; C91-M94 PolarHBondContact O-N 2.63Å; E92-M94 PolarHBondContact O-N 3.44Å; M94-R96 VanDerWaalsContact C-N 3.32Å; M94-R96 PolarHBondContact O-N 3.45Å; M94-Q97 WeakPolarHBondContact O-CB 3.46Å; M94-Q97 PolarHBondContact O-N 2.93Å; M94-F98 HydrophobicContact CG-CD2 4.49Å; M94-F98 HydrophobicContact CG-CE2 4.12Å; M94-F98 WeakPolarHBondContact O-CD2 3.47Å; M94-F98 PolarHBondContact O-N 3.34Å; M94-F134 HydrophobicContact CE-CB 4.4Å; M94-F134 HydrophobicContact CE-CD1 4.18Å; M94-F134 HydrophobicContact CE-CD2 3.84Å; M94-F134 HydrophobicContact CE-CE1 4.42Å; M94-F134 HydrophobicContact CE-CE2 4.1Å; M94-F134 HydrophobicContact CE-CG 3.89Å; M94-F134 HydrophobicContact CE-CZ 4.38Å
95	L	87.1	Confident	88.9	Confident	24 Å²	24	62.1 Å²	62.1	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-59.8	-42.2	175	-74.7	171.1	0	0	0	112.1	L48 C91 E92 Q97 F98 G99 F100 W102	L48-L95 HydrophobicContact CD1-CD2 4.35Å; L48-L95 HydrophobicContact CD1-CG 4.41Å; L48-L95 HydrophobicContact CD2-CD1 4.32Å; L48-L95 HydrophobicContact CD2-CD2 4.22Å; L48-L95 HydrophobicContact CD2-CG 4.24Å; C91-L95 PolarHBondContact O-N 3.19Å; E92-L95 PolarHBondContact O-N 2.89Å; L95-Q97 VanDerWaalsContact C-N 3.31Å; L95-Q97 PolarHBondContact O-N 3.31Å; L95-F98 CarbonylContact O-C 3.57Å; L95-F98 PolarHBondContact O-N 2.83Å; L95-G99 PolarHBondContact O-N 3.5Å; L95-F100 CarbonylContact C-O 3.53Å; L95-F100 HydrophobicContact CB-CB 4.46Å; L95-F100 WeakPolarHBondContact CB-O 3.48Å; L95-F100 HydrophobicContact CD2-CB 4.44Å; L95-F100 PolarHBondContact O-N 3.34Å; L95-F100 VanDerWaalsContact O-O 3.13Å; L95-W102 HydrophobicContact CD1-CE3 3.75Å; L95-W102 HydrophobicContact CD1-CZ3 4.04Å
96	R	86.7	Confident	88.8	Confident	162 Å²	162	57.8 Å²	57.8	61%	0.611	30%	0.302	S	S	*	.	H	α-helix	trans	-63.3	-34.6	177.8	-74.4	-176.5	179.2	-132.9	3.6	112.8	E92 P93 M94 F98 G99 F100	E92-R96 HydrophobicContact CG-CG 4.3Å; E92-R96 WeakPolarHBondContact O-CG 3.2Å; E92-R96 PolarHBondContact O-N 3.19Å; E92-R96 IonicContact OE1-CZ 3.56Å; E92-R96 IonicContact OE1-NE 3.73Å; E92-R96 PolarHBondContact OE1-NE 3.48Å; E92-R96 IonicContact OE1-NH2 3.46Å; E92-R96 PolarHBondContact OE1-NH2 3.4Å; P93-R96 PolarHBondContact O-N 3.23Å; M94-R96 VanDerWaalsContact C-N 3.32Å; M94-R96 PolarHBondContact O-N 3.45Å; R96-F98 PolarHBondContact O-N 3.16Å; R96-G99 PolarHBondContact O-N 2.91Å; R96-F100 PolarHBondContact N-O 3.06Å
97	Q	77.9	Confident	88.9	Confident	116 Å²	116	60 Å²	60	54%	0.542	31%	0.313	S	S	.	.	H	α-helix	trans	-62.7	-27.7	174.3	-75.4	179.3	18.3	0	0	112.8	P93 M94 L95	P93-Q97 WeakPolarHBondContact O-CG 3.33Å; P93-Q97 PolarHBondContact O-N 3.23Å; P93-Q97 VanDerWaalsContact O-N 3.12Å; M94-Q97 WeakPolarHBondContact O-CB 3.46Å; M94-Q97 PolarHBondContact O-N 2.93Å; L95-Q97 VanDerWaalsContact C-N 3.31Å; L95-Q97 PolarHBondContact O-N 3.31Å
98	F	80.5	Confident	88.9	Confident	118 Å²	118	60.2 Å²	60.2	52%	0.518	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	7	174	-66.4	-72.8	0	0	0	113.4	M94 L95 R96 F100	M94-F98 HydrophobicContact CG-CD2 4.49Å; M94-F98 HydrophobicContact CG-CE2 4.12Å; M94-F98 WeakPolarHBondContact O-CD2 3.47Å; M94-F98 PolarHBondContact O-N 3.34Å; L95-F98 CarbonylContact O-C 3.57Å; L95-F98 PolarHBondContact O-N 2.83Å; R96-F98 PolarHBondContact O-N 3.16Å; F98-F100 HydrophobicContact CB-CD2 3.85Å; F98-F100 HydrophobicContact CB-CE2 4.22Å; F98-F100 WeakPolarHBondContact O-CD2 3.31Å; F98-F100 WeakPolarHBondContact O-CE2 3.28Å
99	G	83.2	Confident	88.9	Confident	64 Å²	64	60.3 Å²	60.3	66%	0.66	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	10.6	179.5	0	0	0	0	0	114.8	L95 R96	L95-G99 PolarHBondContact O-N 3.5Å; R96-G99 PolarHBondContact O-N 2.91Å
100	F	85.7	Confident	88.9	Confident	132 Å²	132	59.7 Å²	59.7	58%	0.579	33%	0.328	S	S	*	.			trans	-104.3	127.9	-179.7	-62.9	-73.4	0	0	0	111.4	L95 R96 F98	L95-F100 CarbonylContact C-O 3.53Å; L95-F100 HydrophobicContact CB-CB 4.46Å; L95-F100 WeakPolarHBondContact CB-O 3.48Å; L95-F100 HydrophobicContact CD2-CB 4.44Å; L95-F100 PolarHBondContact O-N 3.34Å; L95-F100 VanDerWaalsContact O-O 3.13Å; R96-F100 PolarHBondContact N-O 3.06Å; F98-F100 HydrophobicContact CB-CD2 3.85Å; F98-F100 HydrophobicContact CB-CE2 4.22Å; F98-F100 WeakPolarHBondContact O-CD2 3.31Å; F98-F100 WeakPolarHBondContact O-CE2 3.28Å
101	P	91	Very high	89	Confident	96 Å²	96	60.3 Å²	60.3	62%	0.623	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-73.4	164.3	169.9	31.9	-34.2	0	0	0	110.9	P103	P101-P103 WeakPolarHBondContact O-CD 3.38Å
102	W	91.5	Very high	89.1	Confident	26 Å²	26	65 Å²	65	10%	0.098	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-59.8	125.1	171.2	-172.8	-99.8	0	0	0	110.3	F60 V87 R88 C91 E92 L95 L106	F60-W102 HydrophobicContact CE1-CH2 4.21Å; F60-W102 AromaticContact CE1-CZ2 3.88Å; F60-W102 HydrophobicContact CE1-CZ2 3.88Å; F60-W102 HydrophobicContact CZ-CZ2 4.32Å; V87-W102 HydrophobicContact CG1-CH2 4.12Å; R88-W102 HydrophobicContact CB-CD2 4.26Å; R88-W102 HydrophobicContact CB-CE3 4.37Å; R88-W102 HydrophobicContact CB-CH2 4.1Å; R88-W102 HydrophobicContact CB-CZ2 3.94Å; R88-W102 HydrophobicContact CB-CZ3 4.31Å; R88-W102 HydrophobicContact CG-CD2 3.77Å; R88-W102 HydrophobicContact CG-CE3 4.04Å; R88-W102 HydrophobicContact CG-CG 4.13Å; R88-W102 HydrophobicContact CG-CZ2 4.35Å; R88-W102 HydrophobicContact CG-CZ3 4.47Å; C91-W102 HydrophobicContact CB-CZ3 4.15Å; E92-W102 HydrophobicContact CB-CE3 4.05Å; E92-W102 HydrophobicContact CG-CB 4.14Å; L95-W102 HydrophobicContact CD1-CE3 3.75Å; L95-W102 HydrophobicContact CD1-CZ3 4.04Å; W102-L106 HydrophobicContact CZ2-CB 3.92Å; W102-L106 HydrophobicContact CZ2-CD1 4.24Å; W102-L106 PolarHBondContact NE1-O 3.28Å
103	P	92.2	Very high	89.1	Confident	35 Å²	35	67.2 Å²	67.2	23%	0.227	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-58.7	137.9	-173.8	-26.2	34	0	0	0	113.5	F45 P101 S105 L106	F45-P103 HydrophobicContact CE1-CG 4.31Å; F45-P103 HydrophobicContact CZ-CG 4.2Å; P101-P103 WeakPolarHBondContact O-CD 3.38Å; P103-S105 PolarHBondContact O-N 2.98Å; P103-L106 HydrophobicContact CB-CD1 4.38Å; P103-L106 HydrophobicContact CB-CG 4.33Å; P103-L106 HydrophobicContact CG-CD1 4.22Å; P103-L106 PolarHBondContact O-N 3.49Å
104	A	91.6	Very high	89.2	Confident	79 Å²	79	71.1 Å²	71.1	65%	0.653	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-64.8	-26.2	179.8	0	0	0	0	0	113.4	L106 N107 K110	A104-L106 PolarHBondContact O-N 3.39Å; A104-N107 PolarHBondContact O-N 3.33Å; A104-K110 PolarHBondContact O-NZ 2.93Å
105	S	89.6	Confident	89.4	Confident	33 Å²	33	73.9 Å²	73.9	23%	0.231	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-61.4	-33.5	171.3	49.4	0	0	0	0	111.9	P103	P103-S105 PolarHBondContact O-N 2.98Å
106	L	93.1	Very high	89.5	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-97.2	18.9	-177.3	-57	179.3	0	0	0	113.6	F45 F60 L61 V64 Y65 C84 W102 P103 A104 C108	F45-L106 HydrophobicContact CE1-CD1 4.14Å; F45-L106 HydrophobicContact CZ-CD1 3.94Å; F60-L106 HydrophobicContact CE1-CB 4.47Å; F60-L106 HydrophobicContact CE1-CD1 4.28Å; F60-L106 HydrophobicContact CE1-CD2 4.2Å; F60-L106 HydrophobicContact CZ-CB 4.39Å; F60-L106 HydrophobicContact CZ-CD2 4.26Å; L61-L106 HydrophobicContact CD2-CD1 3.94Å; V64-L106 HydrophobicContact CB-CD2 4.33Å; V64-L106 HydrophobicContact CG1-CD2 3.9Å; V64-L106 HydrophobicContact CG2-CD2 4.32Å; Y65-L106 HydrophobicContact CE2-CD2 4.39Å; C84-L106 PolarHBondContact SG-O 3.07Å; W102-L106 HydrophobicContact CZ2-CB 3.92Å; W102-L106 HydrophobicContact CZ2-CD1 4.24Å; W102-L106 PolarHBondContact NE1-O 3.28Å; P103-L106 HydrophobicContact CB-CD1 4.38Å; P103-L106 HydrophobicContact CB-CG 4.33Å; P103-L106 HydrophobicContact CG-CD1 4.22Å; P103-L106 PolarHBondContact O-N 3.49Å; A104-L106 PolarHBondContact O-N 3.39Å; L106-C108 PolarHBondContact O-N 3.33Å; L106-C108 VanDerWaalsContact O-N 3.12Å
107	N	94.3	Very high	89.2	Confident	64 Å²	64	73.1 Å²	73.1	34%	0.342	42%	0.42	S	S	.	.			trans	-61.6	116.4	179.7	-175.3	-13.8	0	0	0	111.4	A104 S109 K110	A104-N107 PolarHBondContact O-N 3.33Å; N107-S109 PolarHBondContact O-N 3.08Å; N107-S109 VanDerWaalsContact O-N 3.07Å; N107-S109 PolarHBondContact OD1-N 3.43Å; N107-S109 VanDerWaalsContact OD1-N 3.13Å; N107-S109 PolarHBondContact OD1-OG 2.89Å; N107-K110 HydrophobicContact CB-CD 4.43Å; N107-K110 WeakPolarHBondContact O-CB 3.46Å; N107-K110 WeakPolarHBondContact O-CG 3.49Å; N107-K110 PolarHBondContact O-N 3.12Å
108	C	94.8	Very high	89.2	Confident	3 Å²	3	75.5 Å²	75.5	2%	0.02	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-60.4	-22.1	-174.6	-56.4	0	0	0	0	114.7	R81 C84 E85 L106 K110 F111	R81-C108 HydrophobicContact CG-CB 4.41Å; C84-C108 HydrophobicContact CB-CB 3.75Å; C84-C108 WeakPolarHBondContact CB-SG 3.06Å; C84-C108 WeakPolarHBondContact SG-CA 3.21Å; C84-C108 WeakPolarHBondContact SG-CB 3.28Å; C84-C108 CovalentContact SG-SG 2.05Å; C84-C108 PolarHBondContact SG-SG 3.27Å; E85-C108 HydrophobicContact CG-CB 4.01Å; L106-C108 PolarHBondContact O-N 3.33Å; L106-C108 VanDerWaalsContact O-N 3.12Å; C108-K110 PolarHBondContact O-N 3.37Å; C108-F111 PolarHBondContact O-N 2.94Å
109	S	93.5	Very high	89.3	Confident	86 Å²	86	70.7 Å²	70.7	60%	0.601	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-63	-19.6	175.2	-56.4	0	0	0	0	113.4	R81 N107 F111	R81-S109 PolarHBondContact NH2-O 3.24Å; N107-S109 PolarHBondContact O-N 3.08Å; N107-S109 VanDerWaalsContact O-N 3.07Å; N107-S109 PolarHBondContact OD1-N 3.43Å; N107-S109 VanDerWaalsContact OD1-N 3.13Å; N107-S109 PolarHBondContact OD1-OG 2.89Å; S109-F111 VanDerWaalsContact C-N 3.3Å; S109-F111 PolarHBondContact O-N 2.93Å
110	K	91.2	Very high	89.6	Confident	130 Å²	130	71.4 Å²	71.4	57%	0.565	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-73.2	-18.7	177.5	-66.3	175.4	172.4	174.2	0	113.6	A104 N107 C108	A104-K110 PolarHBondContact O-NZ 2.93Å; N107-K110 HydrophobicContact CB-CD 4.43Å; N107-K110 WeakPolarHBondContact O-CB 3.46Å; N107-K110 WeakPolarHBondContact O-CG 3.49Å; N107-K110 PolarHBondContact O-N 3.12Å; C108-K110 PolarHBondContact O-N 3.37Å
111	F	92.9	Very high	90	Very high	14 Å²	14	65.4 Å²	65.4	6%	0.061	37%	0.374	C	S	.	.	S	Bend	trans	-99.2	152.1	-174.3	-54.3	-59.5	0	0	0	112.5	F60 V64 P79 R81 C84 C108 S109	F60-F111 AromaticContact CE2-CE2 3.96Å; F60-F111 HydrophobicContact CE2-CE2 3.96Å; F60-F111 HydrophobicContact CE2-CZ 4.41Å; F60-F111 HydrophobicContact CZ-CE2 4.16Å; V64-F111 HydrophobicContact CG1-CZ 4.4Å; V64-F111 HydrophobicContact CG2-CE1 4.11Å; V64-F111 HydrophobicContact CG2-CZ 3.67Å; P79-F111 HydrophobicContact CG-CD1 3.85Å; P79-F111 HydrophobicContact CG-CD2 4.34Å; P79-F111 HydrophobicContact CG-CE1 3.78Å; P79-F111 HydrophobicContact CG-CE2 4.29Å; P79-F111 HydrophobicContact CG-CG 4.15Å; P79-F111 HydrophobicContact CG-CZ 4.02Å; P79-F111 WeakPolarHBondContact O-CB 3.22Å; R81-F111 HydrophobicContact CB-CB 4.34Å; R81-F111 PolarHBondContact NE-O 3.15Å; R81-F111 VanDerWaalsContact NE-O 3.08Å; R81-F111 PolarHBondContact NH2-O 3.32Å; C84-F111 HydrophobicContact CB-CD2 3.83Å; C84-F111 HydrophobicContact CB-CE2 4.15Å; C108-F111 PolarHBondContact O-N 2.94Å; S109-F111 VanDerWaalsContact C-N 3.3Å; S109-F111 PolarHBondContact O-N 2.93Å
112	H	92.7	Very high	90.1	Very high	98 Å²	98	62 Å²	62	45%	0.454	35%	0.35	S	S	.	.			trans	-70.8	141.1	179.6	-66.6	-73.4	0	0	0	111.8	R81 A119 C121	R81-H112 WeakPolarHBondContact CB-O 3.49Å; R81-H112 PolarHBondContact N-O 3.28Å; H112-A119 HydrophobicContact CB-CB 4.22Å; H112-C121 HydrophobicContact CB-CB 4.48Å
113	P	90.9	Very high	90	Very high	71 Å²	71	69 Å²	69	46%	0.461	38%	0.377	S	S	.	.	S	Bend	trans	-67	-40.2	-176.3	25.6	-33.3	0	0	0	113.4	P82	P82-P113 VanDerWaalsContact CD-O 3.24Å; P82-P113 WeakPolarHBondContact CD-O 3.1Å
114	E	88.6	Confident	89.8	Confident	135 Å²	135	68.7 Å²	68.7	63%	0.631	38%	0.38	S	S	*	.	S	Bend	trans	-142.2	151	-176.9	-65.1	-173.6	172.5	0	0	110.9	N116 C121	E114-N116 PolarHBondContact O-N 3.25Å; E114-C121 VanDerWaalsContact C-SG 3.55Å
115	N	89.1	Confident	89.6	Confident	66 Å²	66	68 Å²	68	35%	0.353	37%	0.368	S	S	.	.			trans	-78.7	109.8	173.3	-174.7	25.1	0	0	0	109.5	M120 C121	N115-M120 WeakPolarHBondContact OD1-CA 3.41Å; N115-C121 WeakPolarHBondContact CB-O 3.47Å; N115-C121 VanDerWaalsContact CG-O 3.22Å; N115-C121 PolarHBondContact N-SG 3.4Å; N115-C121 VanDerWaalsContact N-SG 3.44Å; N115-C121 PolarHBondContact ND2-O 3.15Å; N115-C121 PolarHBondContact OD1-N 3.38Å
116	N	87.7	Confident	89.1	Confident	72 Å²	72	71.1 Å²	71.1	39%	0.385	39%	0.39	S	S	.	.			trans	-134.9	178.5	178.5	67.5	28.2	0	0	0	111.3	E114 Q118 A119	E114-N116 PolarHBondContact O-N 3.25Å; N116-Q118 PolarHBondContact O-N 2.96Å; N116-Q118 PolarHBondContact OD1-N 3.39Å; N116-Q118 PolarHBondContact OD1-OE1 3.25Å; N116-A119 PolarHBondContact N-O 3.32Å; N116-A119 CarbonylContact O-C 3.39Å; N116-A119 PolarHBondContact O-N 3.31Å; N116-A119 PolarHBondContact OD1-N 2.93Å
117	A	80.2	Confident	87.9	Confident	98 Å²	98	73.2 Å²	73.2	81%	0.81	40%	0.4	S	S	*	.	S	Bend	trans	-64.3	-21.6	-176.9	0	0	0	0	0	113.7
118	Q	78.6	Confident	86.5	Confident	166 Å²	166	75.1 Å²	75.1	78%	0.776	41%	0.411	S	S	*	.	S	Bend	trans	-94.6	-25.1	-178.9	-61.6	81.8	7.5	0	0	113	N116	N116-Q118 PolarHBondContact O-N 2.96Å; N116-Q118 PolarHBondContact OD1-N 3.39Å; N116-Q118 PolarHBondContact OD1-OE1 3.25Å
119	A	83.2	Confident	84.5	Confident	16 Å²	16	83.9 Å²	83.9	13%	0.132	45%	0.451	C	S	.	.	S	Bend	trans	-143.9	105.7	-175.6	0	0	0	0	0	109.9	H112 N116	H112-A119 HydrophobicContact CB-CB 4.22Å; N116-A119 PolarHBondContact N-O 3.32Å; N116-A119 CarbonylContact O-C 3.39Å; N116-A119 PolarHBondContact O-N 3.31Å; N116-A119 PolarHBondContact OD1-N 2.93Å
120	M	89.4	Confident	82.4	Confident	80 Å²	80	85.8 Å²	85.8	39%	0.394	46%	0.464	S	S	.	.			trans	-84.6	131.3	178.4	-73.8	170.3	-80.9	0	0	110.8	V73 I77 N115	V73-M120 HydrophobicContact CB-CE 4.03Å; V73-M120 HydrophobicContact CG1-CE 3.32Å; V73-M120 HydrophobicContact CG1-SD 4.42Å; V73-M120 HydrophobicContact CG2-CE 3.43Å; V73-M120 VanDerWaalsContact CG2-CE 3.43Å; V73-M120 HydrophobicContact CG2-SD 3.71Å; I77-M120 HydrophobicContact CD1-CB 4.09Å; I77-M120 HydrophobicContact CD1-SD 4.24Å; I77-M120 HydrophobicContact CG1-CB 4.11Å; I77-M120 HydrophobicContact CG2-CB 4.23Å; N115-M120 WeakPolarHBondContact OD1-CA 3.41Å
121	C	93.4	Very high	80.5	Confident	5 Å²	5	81.2 Å²	81.2	3%	0.034	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	155.8	172.9	67	0	0	0	0	111.4	G78 C80 H112 E114 N115	G78-C121 CarbonylContact O-C 3.26Å; G78-C121 WeakPolarHBondContact O-CA 3.22Å; C80-C121 WeakPolarHBondContact CA-SG 3.29Å; C80-C121 HydrophobicContact CB-CB 3.96Å; C80-C121 WeakPolarHBondContact CB-SG 3.12Å; C80-C121 WeakPolarHBondContact SG-CB 3.48Å; C80-C121 PolarHBondContact SG-O 3.44Å; C80-C121 VanDerWaalsContact SG-O 3.37Å; C80-C121 CovalentContact SG-SG 2.04Å; C80-C121 PolarHBondContact SG-SG 3.49Å; H112-C121 HydrophobicContact CB-CB 4.48Å; E114-C121 VanDerWaalsContact C-SG 3.55Å; N115-C121 WeakPolarHBondContact CB-O 3.47Å; N115-C121 VanDerWaalsContact CG-O 3.22Å; N115-C121 PolarHBondContact N-SG 3.4Å; N115-C121 VanDerWaalsContact N-SG 3.44Å; N115-C121 PolarHBondContact ND2-O 3.15Å; N115-C121 PolarHBondContact OD1-N 3.38Å
122	M	92.8	Very high	78.7	Confident	26 Å²	26	86.2 Å²	86.2	13%	0.128	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.1	179	-66	-178.9	-70.9	0	0	111	Y21 F59 M68 I77 G78 C80 G124	Y21-M122 HydrophobicContact CD1-SD 4.05Å; Y21-M122 HydrophobicContact CE1-CE 3.9Å; Y21-M122 HydrophobicContact CE1-SD 3.55Å; Y21-M122 VanDerWaalsContact CE1-SD 3.55Å; F59-M122 HydrophobicContact CE1-CB 4.32Å; F59-M122 HydrophobicContact CZ-CB 4.17Å; F59-M122 HydrophobicContact CZ-SD 4.15Å; M68-M122 HydrophobicContact CB-CE 4.26Å; M68-M122 HydrophobicContact CB-SD 4.19Å; I77-M122 HydrophobicContact CG2-CG 4.08Å; I77-M122 WeakPolarHBondContact O-CE 3.38Å; G78-M122 PolarHBondContact O-N 2.93Å; C80-M122 PolarHBondContact N-O 3.21Å; C80-M122 VanDerWaalsContact SG-C 3.5Å; M122-G124 VanDerWaalsContact C-N 3.33Å
123	R	90.8	Very high	77.3	Confident	172 Å²	172	82 Å²	82	65%	0.649	46%	0.456	S	S	*	.			trans	-70.6	-28.4	177.1	-68.9	-174.9	-179.8	114.2	1.7	113.2
124	G	87.7	Confident	75.8	Confident	29 Å²	29	83.5 Å²	83.5	30%	0.299	46%	0.456	S	S	.	.			trans	82.4	172.9	-174.4	0	0	0	0	0	114	M122	M122-G124 VanDerWaalsContact C-N 3.33Å
125	P	87	Confident	73.9	Confident	63 Å²	63	79.3 Å²	79.3	41%	0.409	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-66.5	153.1	173.7	29.6	-33.3	0	0	0	110.4	Q56 F59	Q56-P125 HydrophobicContact CG-CG 4.49Å; Q56-P125 PolarHBondContact OE1-O 3.43Å; F59-P125 HydrophobicContact CB-CG 4.3Å; F59-P125 HydrophobicContact CG-CG 4.35Å
126	S	78.4	Confident	72	Confident	99 Å²	99	81.5 Å²	81.5	69%	0.692	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-62.4	146.4	170.7	48	0	0	0	0	110.7	D128	S126-D128 PolarHBondContact O-N 3.21Å
127	E	68.6	Low	69.9	Low	44 Å²	44	82.6 Å²	82.6	21%	0.206	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-63.4	134.3	167.2	-67.1	-147.6	149.7	0	0	109.7	S54 Q56 S86 H129	S54-E127 PolarHBondContact OG-OE1 3.48Å; Q56-E127 VanDerWaalsContact CD-CG 3.41Å; Q56-E127 HydrophobicContact CG-CG 3.83Å; Q56-E127 PolarHBondContact NE2-OE1 3.22Å; S86-E127 PolarHBondContact OG-OE1 3.12Å; E127-H129 PolarHBondContact O-N 3.45Å
128	D	64.3	Low	67.7	Low	105 Å²	105	87.2 Å²	87.2	56%	0.561	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-69.3	120.6	169.6	-75	-33.3	0	0	0	106.8	S126 S130 S131	S126-D128 PolarHBondContact O-N 3.21Å; D128-S130 PolarHBondContact O-N 3.44Å; D128-S131 PolarHBondContact O-N 3.08Å; D128-S131 PolarHBondContact O-OG 3.26Å
129	H	53.2	Low	65.6	Low	186 Å²	186	84.2 Å²	84.2	86%	0.861	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-3.8	-178.7	-66.5	-65.5	0	0	0	114	E127	E127-H129 PolarHBondContact O-N 3.45Å
130	S	48.8	Very low	63	Low	126 Å²	126	88.2 Å²	88.2	88%	0.881	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-13.4	170.1	-57.9	0	0	0	0	113.9	D128	D128-S130 PolarHBondContact O-N 3.44Å
131	S	51.7	Low	60.1	Low	35 Å²	35	89.1 Å²	89.1	25%	0.245	52%	0.516	C	S	.	.			trans	-102.7	76.8	172.4	54	0	0	0	0	110.2	D128 C133	D128-S131 PolarHBondContact O-N 3.08Å; D128-S131 PolarHBondContact O-OG 3.26Å; S131-C133 PolarHBondContact O-N 3.23Å
132	L	55.4	Low	57.1	Low	118 Å²	118	94.5 Å²	94.5	62%	0.618	55%	0.549	S	S	*	.			trans	-56.4	135.9	162.7	-79.5	158.8	0	0	0	108.3	F134 D136	L132-F134 PolarHBondContact O-N 3.27Å; L132-D136 HydrophobicContact CD2-CB 4.26Å
133	C	63.4	Low	54	Low	9 Å²	9	98.2 Å²	98.2	6%	0.061	58%	0.583	C	S	.	*			trans	-49.5	140.4	172	-73.6	0	0	0	0	108.6	C90 S131 G135 D136	C90-C133 VanDerWaalsContact CA-SG 3.55Å; C90-C133 HydrophobicContact CB-CB 3.67Å; C90-C133 WeakPolarHBondContact CB-SG 3.16Å; C90-C133 VanDerWaalsContact SG-CA 3.58Å; C90-C133 WeakPolarHBondContact SG-CB 3.17Å; C90-C133 CovalentContact SG-SG 2.04Å; C90-C133 PolarHBondContact SG-SG 3.29Å; S131-C133 PolarHBondContact O-N 3.23Å; C133-G135 PolarHBondContact O-N 2.91Å; C133-D136 PolarHBondContact O-N 3.43Å
134	F	58.6	Low	51.3	Low	103 Å²	103	94.9 Å²	94.9	45%	0.452	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.6	-13.2	-179.1	-161.7	-95.3	0	0	0	114.3	M94 L132	M94-F134 HydrophobicContact CE-CB 4.4Å; M94-F134 HydrophobicContact CE-CD1 4.18Å; M94-F134 HydrophobicContact CE-CD2 3.84Å; M94-F134 HydrophobicContact CE-CE1 4.42Å; M94-F134 HydrophobicContact CE-CE2 4.1Å; M94-F134 HydrophobicContact CE-CG 3.89Å; M94-F134 HydrophobicContact CE-CZ 4.38Å; L132-F134 PolarHBondContact O-N 3.27Å
135	G	48.8	Very low	48.5	Very low	47 Å²	47	103 Å²	103	49%	0.485	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	-16	176.5	0	0	0	0	0	117	C133	C133-G135 PolarHBondContact O-N 2.91Å
136	D	50.1	Low	45.7	Very low	113 Å²	113	105.6 Å²	105.6	60%	0.604	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-2.4	-172.9	-70.4	-31	0	0	0	113.8	L132 C133	L132-D136 HydrophobicContact CD2-CB 4.26Å; C133-D136 PolarHBondContact O-N 3.43Å
137	T	43.4	Very low	43.5	Very low	94 Å²	94	106.3 Å²	106.3	58%	0.577	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	14	-179.2	-31	0	0	0	0	114.1
138	Y	35	Very low	41.9	Very low	196 Å²	196	109.3 Å²	109.3	77%	0.769	65%	0.649	S	S	*	*			trans	-125.8	72.6	173.5	-77.8	-83.4	0	0	0	113.6
139	P	33.3	Very low	40.3	Very low	103 Å²	103	110.7 Å²	110.7	67%	0.669	66%	0.662	S	S	*	*			trans	-75	140.1	143.5	18.6	-3.8	0	0	0	109	A141	P139-A141 PolarHBondContact O-N 2.92Å
140	A	29.4	Very low	39.4	Very low	99 Å²	99	107.5 Å²	107.5	82%	0.818	66%	0.66	S	S	*	*	S	Bend	trans	-44.8	137.2	174	0	0	0	0	0	112.7
141	A	28.9	Very low	38.7	Very low	100 Å²	100	105.9 Å²	105.9	83%	0.826	64%	0.641	S	S	*	*			trans	58.3	81.9	161	0	0	0	0	0	116.7	P139	P139-A141 PolarHBondContact O-N 2.92Å
142	V	30.2	Very low	37.9	Very low	117 Å²	117	111.4 Å²	111.4	71%	0.709	67%	0.666	S	S	*	*			trans	-131	107.2	146.9	-169.7	0	0	0	0	108.1	V144	V142-V144 HydrophobicContact CB-CG2 4.26Å; V142-V144 HydrophobicContact CG1-CG2 3.53Å; V142-V144 PolarHBondContact O-N 3.3Å
143	A	27.9	Very low	37.1	Very low	104 Å²	104	107.6 Å²	107.6	86%	0.86	65%	0.648	S	S	*	*			trans	-60.6	100.7	160	0	0	0	0	0	107.4
144	V	32.4	Very low	35.7	Very low	103 Å²	103	109.5 Å²	109.5	62%	0.624	67%	0.669	S	S	*	*			trans	-108.3	101.7	164.6	-175.5	0	0	0	0	106.1	V142 D146	V142-V144 HydrophobicContact CB-CG2 4.26Å; V142-V144 HydrophobicContact CG1-CG2 3.53Å; V142-V144 PolarHBondContact O-N 3.3Å; V144-D146 HydrophobicContact CG1-CB 3.87Å; V144-D146 PolarHBondContact O-N 2.95Å
145	E	29.5	Very low	34.5	Very low	200 Å²	200	112 Å²	112	94%	0.935	69%	0.693	S	S	*	*			trans	-55.3	92	149.6	-72.3	179.1	140.9	0	0	107.2
146	D	28.8	Very low	34.3	Very low	116 Å²	116	116.4 Å²	116.4	62%	0.62	70%	0.701	S	S	*	*			trans	-143.6	123.5	156.9	-148.7	-8	0	0	0	111.5	V144 T148	V144-D146 HydrophobicContact CG1-CB 3.87Å; V144-D146 PolarHBondContact O-N 2.95Å; D146-T148 PolarHBondContact O-N 3.16Å; D146-T148 VanDerWaalsContact O-N 3.13Å
147	S	32.5	Very low	34.2	Very low	115 Å²	115	113.8 Å²	113.8	80%	0.804	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	76	-170.7	-64.2	0	0	0	0	108.5
148	T	34.1	Very low	34.1	Very low	106 Å²	106	114.5 Å²	114.5	65%	0.65	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.9	-2.3	174.5	19.2	0	0	0	0	118	D146	D146-T148 PolarHBondContact O-N 3.16Å; D146-T148 VanDerWaalsContact O-N 3.13Å
149	T	30.5	Very low	34.9	Very low	135 Å²	135	109.7 Å²	109.7	83%	0.828	68%	0.676	S	S	*	*	S	Bend	trans	-132	58.7	-171.6	32.9	0	0	0	0	113.9
150	S	34.8	Very low	35.7	Very low	119 Å²	119	106.4 Å²	106.4	83%	0.832	66%	0.661	S	S	*	*	S	Bend	trans	-155.9	11.4	151.1	54.2	0	0	0	0	113.2
151	I	34.8	Very low	37.2	Very low	91 Å²	91	102.1 Å²	102.1	47%	0.467	63%	0.626	S	S	.	*			trans	-126.8	85.8	-171.5	-54.8	177.5	0	0	0	108.8	G160	I151-G160 WeakPolarHBondContact CG2-O 3.39Å
152	I	34.3	Very low	38.9	Very low	151 Å²	151	106.5 Å²	106.5	77%	0.774	62%	0.622	S	S	*	*			trans	-129.5	70.4	156.8	-50	-178.2	0	0	0	107.5
153	V	37.7	Very low	41.1	Very low	39 Å²	39	102.9 Å²	102.9	24%	0.236	60%	0.598	C	S	.	*	S	Bend	trans	-123.1	95	157.5	-178.2	0	0	0	0	106.5	C174	V153-C174 HydrophobicContact CG1-CB 4.37Å; V153-C174 WeakPolarHBondContact CG2-SG 3.25Å
154	G	34.5	Very low	43.4	Very low	49 Å²	49	99.4 Å²	99.4	51%	0.505	56%	0.564	S	S	.	*			trans	60.8	105.8	159.8	0	0	0	0	0	116.9	E156	G154-E156 PolarHBondContact O-N 2.96Å
155	T	33.6	Very low	45.4	Very low	155 Å²	155	95.2 Å²	95.2	95%	0.951	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	27.1	165.6	45.1	0	0	0	0	114.6
156	E	45.3	Very low	47.4	Very low	140 Å²	140	92.1 Å²	92.1	65%	0.654	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.4	-4.6	-174.6	-65.3	-171.7	163.1	0	0	114.5	G154	G154-E156 PolarHBondContact O-N 2.96Å
157	R	47.7	Very low	49.4	Very low	57 Å²	57	86.6 Å²	86.6	22%	0.215	49%	0.489	C	S	.	.	S	Bend	trans	-105.7	137	174	-86.8	-167.7	175.5	133.2	-6.5	112.7	D159 G160 W459 L460	R157-D159 PolarHBondContact O-N 3.38Å; R157-D159 VanDerWaalsContact O-N 3.15Å; R157-G160 PolarHBondContact O-N 3.15Å; R157-W459 PolarHBondContact NH2-O 3.4Å; R157-L460 PolarHBondContact NH1-O 3.2Å; R157-L460 VanDerWaalsContact NH2-C 3.29Å; R157-L460 VanDerWaalsContact NH2-CA 3.32Å; R157-L460 PolarHBondContact NH2-O 3.19Å
158	P	42	Very low	51.1	Low	110 Å²	110	85.8 Å²	85.8	71%	0.714	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.8	-178.5	12.8	-18	0	0	0	113.9	G160 S463	P158-G160 VanDerWaalsContact C-N 3.27Å; P158-G160 PolarHBondContact O-N 3.37Å; P158-S463 WeakPolarHBondContact CD-OG 3.43Å
159	D	50.4	Low	52.5	Low	94 Å²	94	88.3 Å²	88.3	50%	0.503	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	4.3	176.1	-71.2	-18.2	0	0	0	114.2	R157 G161 R162 N163	R157-D159 PolarHBondContact O-N 3.38Å; R157-D159 VanDerWaalsContact O-N 3.15Å; D159-G161 PolarHBondContact O-N 2.91Å; D159-G161 VanDerWaalsContact O-N 3.08Å; D159-R162 WeakPolarHBondContact O-CB 3.27Å; D159-R162 VanDerWaalsContact O-CG 3.28Å; D159-R162 WeakPolarHBondContact O-CG 3.49Å; D159-R162 PolarHBondContact O-N 3.22Å; D159-R162 VanDerWaalsContact O-N 3.14Å; D159-N163 PolarHBondContact OD2-ND2 3.3Å
160	G	51.1	Low	54.1	Low	34 Å²	34	83.4 Å²	83.4	35%	0.351	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	26.6	-179.2	0	0	0	0	0	113.5	I151 R157 P158 R162	I151-G160 WeakPolarHBondContact CG2-O 3.39Å; R157-G160 PolarHBondContact O-N 3.15Å; P158-G160 VanDerWaalsContact C-N 3.27Å; P158-G160 PolarHBondContact O-N 3.37Å; G160-R162 VanDerWaalsContact C-N 3.31Å; G160-R162 PolarHBondContact O-N 3.24Å
161	G	59.9	Low	55.3	Low	9 Å²	9	80.3 Å²	80.3	9%	0.093	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	7	179.9	0	0	0	0	0	116	D159 N163 F164	D159-G161 PolarHBondContact O-N 2.91Å; D159-G161 VanDerWaalsContact O-N 3.08Å; G161-N163 PolarHBondContact O-N 3.04Å; G161-F164 PolarHBondContact O-N 3.47Å; G161-F164 VanDerWaalsContact O-N 3.09Å
162	R	64.3	Low	56.7	Low	193 Å²	193	76.6 Å²	76.6	73%	0.728	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.9	-176.3	-72.4	175.7	-179.1	-178.3	1	115.3	D159 G160	D159-R162 WeakPolarHBondContact O-CB 3.27Å; D159-R162 VanDerWaalsContact O-CG 3.28Å; D159-R162 WeakPolarHBondContact O-CG 3.49Å; D159-R162 PolarHBondContact O-N 3.22Å; D159-R162 VanDerWaalsContact O-N 3.14Å; G160-R162 VanDerWaalsContact C-N 3.31Å; G160-R162 PolarHBondContact O-N 3.24Å
163	N	76.5	Confident	58.4	Low	41 Å²	41	73.5 Å²	73.5	22%	0.219	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	7.3	-177	-65.3	-29.9	0	0	0	114.3	D159 G161 L177 A180 V182	D159-N163 PolarHBondContact OD2-ND2 3.3Å; G161-N163 PolarHBondContact O-N 3.04Å; N163-L177 PolarHBondContact O-N 2.95Å; N163-A180 HydrophobicContact CB-CB 3.76Å; N163-V182 HydrophobicContact CB-CG2 3.98Å
164	F	76.2	Confident	60.2	Low	30 Å²	30	73.7 Å²	73.7	13%	0.132	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.5	-178.6	-67.5	-97	0	0	0	111.3	G161 C174 A175 Q176 V182	G161-F164 PolarHBondContact O-N 3.47Å; G161-F164 VanDerWaalsContact O-N 3.09Å; F164-C174 HydrophobicContact CD1-CB 4.46Å; F164-A175 CarbonylContact C-O 3.24Å; F164-A175 VanDerWaalsContact CA-O 3.29Å; F164-A175 WeakPolarHBondContact CA-O 3.39Å; F164-Q176 HydrophobicContact CD1-CG 3.88Å; F164-Q176 HydrophobicContact CE1-CB 4.5Å; F164-Q176 HydrophobicContact CE1-CG 3.36Å; F164-Q176 HydrophobicContact CZ-CG 3.94Å; F164-V182 HydrophobicContact CE1-CG1 4.32Å; F164-V182 HydrophobicContact CE2-CG1 3.72Å; F164-V182 HydrophobicContact CZ-CG1 3.34Å
165	V	74.3	Confident	62.4	Low	16 Å²	16	71.4 Å²	71.4	10%	0.097	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.9	175.9	-177.9	0	0	0	0	108.7	L167 C174 A175 L177 Y258 V267	V165-L167 PolarHBondContact O-N 3.31Å; V165-C174 WeakPolarHBondContact O-CA 3.39Å; V165-A175 PolarHBondContact N-O 3.29Å; V165-A175 PolarHBondContact O-N 3.02Å; V165-L177 HydrophobicContact CG2-CD2 3.49Å; V165-L177 VanDerWaalsContact CG2-CD2 3.49Å; V165-L177 HydrophobicContact CG2-CG 4.04Å; V165-Y258 HydrophobicContact CG1-CD1 4.09Å; V165-Y258 HydrophobicContact CG1-CE1 4.08Å; V165-V267 HydrophobicContact CB-CG1 4.19Å; V165-V267 HydrophobicContact CG2-CG1 4.25Å
166	R	72.7	Confident	64.8	Low	134 Å²	134	64.6 Å²	64.6	51%	0.506	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	120.1	174.3	-167.1	178.7	177.6	107.9	1.6	109.5	N168 G172	R166-N168 PolarHBondContact O-N 3.43Å; R166-G172 WeakPolarHBondContact CG-O 3.45Å; R166-G172 PolarHBondContact NE-O 3.42Å
167	L	71.3	Confident	66.7	Low	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	109.4	178.2	-62	179.7	0	0	0	109.5	V165 K169 T170 G172 Q173 A175 Y258 F271 L273	V165-L167 PolarHBondContact O-N 3.31Å; L167-K169 VanDerWaalsContact C-N 3.29Å; L167-K169 PolarHBondContact O-N 3.29Å; L167-T170 VanDerWaalsContact CB-OG1 3.23Å; L167-T170 WeakPolarHBondContact CB-OG1 3.44Å; L167-T170 HydrophobicContact CD1-CG2 4.45Å; L167-T170 PolarHBondContact O-OG1 3.42Å; L167-G172 WeakPolarHBondContact O-CA 3.29Å; L167-G172 PolarHBondContact O-N 3.01Å; L167-Q173 WeakPolarHBondContact CB-O 3.27Å; L167-Q173 PolarHBondContact N-O 3.41Å; L167-A175 HydrophobicContact CD1-CB 3.62Å; L167-A175 HydrophobicContact CD2-CB 4.24Å; L167-A175 HydrophobicContact CG-CB 3.84Å; L167-Y258 HydrophobicContact CD2-CD1 3.8Å; L167-Y258 HydrophobicContact CD2-CD2 3.62Å; L167-Y258 HydrophobicContact CD2-CE1 3.76Å; L167-Y258 HydrophobicContact CD2-CE2 3.58Å; L167-Y258 HydrophobicContact CD2-CG 3.74Å; L167-F271 HydrophobicContact CD1-CB 4.41Å; L167-F271 HydrophobicContact CD1-CD2 4.37Å; L167-L273 HydrophobicContact CD1-CD1 3.75Å; L167-L273 HydrophobicContact CD1-CG 4.4Å; L167-L273 HydrophobicContact CD2-CD1 4.18Å
168	N	67.6	Low	68.6	Low	98 Å²	98	57.6 Å²	57.6	52%	0.524	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-68.7	-31.6	177.1	-69	-8.1	0	0	0	111.3	L51 R166 T170 Y258	L51-N168 HydrophobicContact CD2-CB 4.49Å; R166-N168 PolarHBondContact O-N 3.43Å; N168-T170 PolarHBondContact O-N 2.87Å; N168-Y258 PolarHBondContact N-OH 3.38Å
169	K	63.4	Low	70.7	Confident	160 Å²	160	57.9 Å²	57.9	70%	0.696	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-65.8	-20.9	-179.2	-72.1	-173.4	177.4	179.4	0	114.4	L167 Y258	L167-K169 VanDerWaalsContact C-N 3.29Å; L167-K169 PolarHBondContact O-N 3.29Å; K169-Y258 HydrophobicContact CD-CE2 4.48Å
170	T	63.3	Low	72.3	Confident	32 Å²	32	53.9 Å²	53.9	20%	0.196	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-116.2	26.5	-172	58.9	0	0	0	0	112.4	L167 N168 Q173 F271	L167-T170 VanDerWaalsContact CB-OG1 3.23Å; L167-T170 WeakPolarHBondContact CB-OG1 3.44Å; L167-T170 HydrophobicContact CD1-CG2 4.45Å; L167-T170 PolarHBondContact O-OG1 3.42Å; N168-T170 PolarHBondContact O-N 2.87Å; T170-Q173 WeakPolarHBondContact O-CG 3.33Å; T170-F271 HydrophobicContact CG2-CB 4.36Å; T170-F271 WeakPolarHBondContact CG2-O 3.47Å
171	G	59.8	Low	73.9	Confident	54 Å²	54	55.6 Å²	55.6	56%	0.557	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	23.3	180	0	0	0	0	0	114.1
172	G	65.5	Low	75	Confident	12 Å²	12	56.5 Å²	56.5	12%	0.124	29%	0.285	C	S	.	.	S	Bend	trans	85.4	21.5	177.4	0	0	0	0	0	114.7	R166 L167	R166-G172 WeakPolarHBondContact CG-O 3.45Å; R166-G172 PolarHBondContact NE-O 3.42Å; L167-G172 WeakPolarHBondContact O-CA 3.29Å; L167-G172 PolarHBondContact O-N 3.01Å
173	Q	70.4	Confident	75.9	Confident	87 Å²	87	48.3 Å²	48.3	41%	0.407	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	147.5	172.7	-67	175.5	-24.8	0	0	110.7	L167 T170 F271	L167-Q173 WeakPolarHBondContact CB-O 3.27Å; L167-Q173 PolarHBondContact N-O 3.41Å; T170-Q173 WeakPolarHBondContact O-CG 3.33Å; Q173-F271 HydrophobicContact CB-CD1 4.44Å
174	C	75.6	Confident	76.6	Confident	43 Å²	43	46.8 Å²	46.8	29%	0.291	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.2	179.1	-61.7	0	0	0	0	109.9	V153 F164 V165	V153-C174 HydrophobicContact CG1-CB 4.37Å; V153-C174 WeakPolarHBondContact CG2-SG 3.25Å; F164-C174 HydrophobicContact CD1-CB 4.46Å; V165-C174 WeakPolarHBondContact O-CA 3.39Å
175	A	79.7	Confident	77.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	149.5	174.8	0	0	0	0	0	111.1	F164 V165 L167 V267 F271	F164-A175 CarbonylContact C-O 3.24Å; F164-A175 VanDerWaalsContact CA-O 3.29Å; F164-A175 WeakPolarHBondContact CA-O 3.39Å; V165-A175 PolarHBondContact N-O 3.29Å; V165-A175 PolarHBondContact O-N 3.02Å; L167-A175 HydrophobicContact CD1-CB 3.62Å; L167-A175 HydrophobicContact CD2-CB 4.24Å; L167-A175 HydrophobicContact CG-CB 3.84Å; A175-V267 HydrophobicContact CB-CB 4.26Å; A175-V267 HydrophobicContact CB-CG1 4.47Å; A175-F271 HydrophobicContact CB-CD2 4.31Å; A175-F271 HydrophobicContact CB-CE2 4.28Å
176	Q	84.2	Confident	78.2	Confident	11 Å²	11	51.6 Å²	51.6	5%	0.051	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	142.2	177.7	-65.3	173.6	16.1	0	0	110.8	F164 V182 V267 I268	F164-Q176 HydrophobicContact CD1-CG 3.88Å; F164-Q176 HydrophobicContact CE1-CB 4.5Å; F164-Q176 HydrophobicContact CE1-CG 3.36Å; F164-Q176 HydrophobicContact CZ-CG 3.94Å; Q176-V182 HydrophobicContact CB-CG2 4.24Å; Q176-V182 HydrophobicContact CG-CG1 4.26Å; Q176-V182 HydrophobicContact CG-CG2 4.18Å; Q176-V267 WeakPolarHBondContact O-CA 3.44Å; Q176-I268 HydrophobicContact CB-CD1 4.16Å; Q176-I268 HydrophobicContact CB-CG1 4.5Å; Q176-I268 PolarHBondContact O-N 3.46Å
177	L	85.3	Confident	79.2	Confident	38 Å²	38	50.3 Å²	50.3	20%	0.199	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-65.9	136.9	169.5	-72.1	174.2	0	0	0	110.3	N163 V165 H179 A180 Q265	N163-L177 PolarHBondContact O-N 2.95Å; V165-L177 HydrophobicContact CG2-CD2 3.49Å; V165-L177 VanDerWaalsContact CG2-CD2 3.49Å; V165-L177 HydrophobicContact CG2-CG 4.04Å; L177-H179 VanDerWaalsContact C-N 3.29Å; L177-H179 PolarHBondContact O-N 3.11Å; L177-A180 HydrophobicContact CB-CB 3.76Å; L177-A180 PolarHBondContact O-N 2.92Å; L177-Q265 HydrophobicContact CD2-CB 4.17Å
178	C	87.8	Confident	80.3	Confident	12 Å²	12	53 Å²	53	8%	0.081	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-32.7	-171.6	-156	0	0	0	0	113.7	C255 Y266 I268	C178-C255 HydrophobicContact CB-CB 3.78Å; C178-C255 WeakPolarHBondContact CB-SG 3.38Å; C178-C255 WeakPolarHBondContact SG-CA 3.48Å; C178-C255 WeakPolarHBondContact SG-CB 3.45Å; C178-C255 CovalentContact SG-SG 2.03Å; C178-C255 PolarHBondContact SG-SG 3.26Å; C178-Y266 PolarHBondContact N-O 3.01Å; C178-I268 HydrophobicContact CB-CG1 4.34Å
179	H	86.2	Confident	81.6	Confident	116 Å²	116	49 Å²	49	54%	0.537	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	5.8	-177.6	-53.5	-73	0	0	0	113.2	L177 E251	L177-H179 VanDerWaalsContact C-N 3.29Å; L177-H179 PolarHBondContact O-N 3.11Å; H179-E251 IonicContact CE1-OE1 2.78Å; H179-E251 PolarHBondContact CE1-OE1 3.09Å; H179-E251 VanDerWaalsContact CE1-OE1 3.3Å; H179-E251 IonicContact ND1-OE1 2.99Å
180	A	83.2	Confident	83.1	Confident	10 Å²	10	49.4 Å²	49.4	8%	0.083	27%	0.268	C	S	.	.	S	Bend	trans	-83.8	150	177.5	0	0	0	0	0	111.4	N163 L177 V182 K189	N163-A180 HydrophobicContact CB-CB 3.76Å; L177-A180 HydrophobicContact CB-CB 3.76Å; L177-A180 PolarHBondContact O-N 2.92Å; A180-V182 HydrophobicContact CB-CG2 4.01Å; A180-K189 PolarHBondContact O-NZ 3.46Å
181	D	85	Confident	84.7	Confident	70 Å²	70	51 Å²	51	37%	0.374	28%	0.276	S	S	.	.			trans	-92.1	98.6	168.4	-71.3	-10.6	0	0	0	108.3	V186 K189	D181-V186 WeakPolarHBondContact OD2-CG2 3.26Å; D181-V186 PolarHBondContact OD2-N 3.42Å; D181-K189 IonicContact OD1-NZ 3.17Å; D181-K189 PolarHBondContact OD1-NZ 2.95Å
182	V	82.1	Confident	86.4	Confident	28 Å²	28	48.5 Å²	48.5	17%	0.17	25%	0.249	C	C	.	.	S	Bend	trans	-101.2	-59.6	-174.9	-177.6	0	0	0	0	110.2	N163 F164 Q176 A180 E339	N163-V182 HydrophobicContact CB-CG2 3.98Å; F164-V182 HydrophobicContact CE1-CG1 4.32Å; F164-V182 HydrophobicContact CE2-CG1 3.72Å; F164-V182 HydrophobicContact CZ-CG1 3.34Å; Q176-V182 HydrophobicContact CB-CG2 4.24Å; Q176-V182 HydrophobicContact CG-CG1 4.26Å; Q176-V182 HydrophobicContact CG-CG2 4.18Å; A180-V182 HydrophobicContact CB-CG2 4.01Å; V182-E339 PolarHBondContact N-OE1 2.9Å
183	L	84.6	Confident	87.8	Confident	22 Å²	22	50.9 Å²	50.9	12%	0.115	26%	0.257	C	S	.	.	S	Bend	trans	-107.9	-22.1	-179.4	-61.6	173.6	0	0	0	112.5	E339 W459 P467	L183-E339 VanDerWaalsContact CB-OE2 3.28Å; L183-E339 WeakPolarHBondContact CB-OE2 3.38Å; L183-E339 PolarHBondContact N-OE1 3.42Å; L183-E339 PolarHBondContact N-OE2 3.16Å; L183-W459 HydrophobicContact CD2-CB 4.24Å; L183-P467 HydrophobicContact CB-CG 3.93Å; L183-P467 HydrophobicContact CD1-CG 4.49Å; L183-P467 HydrophobicContact CD2-CG 4.4Å
184	F	90.7	Very high	89	Confident	8 Å²	8	50.5 Å²	50.5	4%	0.035	26%	0.26	C	S	.	.	S	Bend	trans	-136.6	144.5	-173.1	-57.6	-79.8	0	0	0	111.7	Q188 K189 L340 P467 Y469 F472	F184-Q188 HydrophobicContact CB-CB 4.35Å; F184-K189 HydrophobicContact CB-CG 4.34Å; F184-K189 WeakPolarHBondContact O-CE 3.35Å; F184-K189 PolarHBondContact O-NZ 3.35Å; F184-L340 HydrophobicContact CB-CD1 3.95Å; F184-L340 HydrophobicContact CD1-CD1 3.9Å; F184-L340 HydrophobicContact CD1-CD2 4.32Å; F184-L340 HydrophobicContact CD1-CG 4.48Å; F184-L340 HydrophobicContact CD2-CB 3.63Å; F184-L340 HydrophobicContact CD2-CD1 4.27Å; F184-L340 HydrophobicContact CD2-CG 4.4Å; F184-L340 HydrophobicContact CE1-CD1 4.46Å; F184-L340 HydrophobicContact CE1-CD2 4.06Å; F184-L340 HydrophobicContact CE2-CB 3.73Å; F184-L340 HydrophobicContact CE2-CD2 4.46Å; F184-L340 HydrophobicContact CG-CB 4.04Å; F184-L340 HydrophobicContact CG-CD1 3.77Å; F184-L340 HydrophobicContact CG-CG 4.35Å; F184-L340 HydrophobicContact CZ-CB 4.23Å; F184-L340 HydrophobicContact CZ-CD2 4.12Å; F184-P467 HydrophobicContact CE1-CB 4.29Å; F184-P467 HydrophobicContact CE1-CG 3.8Å; F184-P467 HydrophobicContact CE2-CG 4.06Å; F184-P467 HydrophobicContact CZ-CB 3.95Å; F184-P467 HydrophobicContact CZ-CG 3.47Å; F184-P467 VanDerWaalsContact CZ-CG 3.47Å; F184-Y469 HydrophobicContact CD1-CD2 4.41Å; F184-F472 HydrophobicContact CE1-CD2 4.2Å; F184-F472 HydrophobicContact CE1-CE2 4.42Å; F184-F472 AromaticContact CZ-CD2 3.91Å; F184-F472 HydrophobicContact CZ-CD2 3.91Å; F184-F472 HydrophobicContact CZ-CE1 4.41Å; F184-F472 AromaticContact CZ-CE2 3.8Å; F184-F472 HydrophobicContact CZ-CE2 3.8Å; F184-F472 HydrophobicContact CZ-CG 4.32Å; F184-F472 HydrophobicContact CZ-CZ 4.05Å
185	S	91.4	Very high	90	Very high	50 Å²	50	50.2 Å²	50.2	35%	0.35	26%	0.256	S	S	.	.			trans	-76.4	159.6	176.9	69.5	0	0	0	0	112.4	E187 Q188 K189	S185-E187 PolarHBondContact O-N 3.16Å; S185-Q188 PolarHBondContact O-N 3.3Å; S185-Q188 VanDerWaalsContact O-N 3.11Å; S185-Q188 WeakPolarHBondContact OG-CG 3.28Å; S185-Q188 PolarHBondContact OG-N 3.03Å; S185-K189 WeakPolarHBondContact O-CG 3.33Å; S185-K189 PolarHBondContact O-N 3.47Å
186	V	92.3	Very high	90.8	Very high	98 Å²	98	50.5 Å²	50.5	59%	0.594	26%	0.257	S	S	*	.	H	α-helix	trans	-49.7	-41.4	172.4	-175.3	0	0	0	0	112.5	D181 K189 R190	D181-V186 WeakPolarHBondContact OD2-CG2 3.26Å; D181-V186 PolarHBondContact OD2-N 3.42Å; V186-K189 PolarHBondContact O-N 3.36Å; V186-R190 WeakPolarHBondContact O-CB 3.36Å; V186-R190 PolarHBondContact O-N 2.95Å
187	E	94.1	Very high	91.4	Very high	106 Å²	106	52.5 Å²	52.5	50%	0.495	27%	0.268	S	S	.	.	H	α-helix	trans	-67.1	-42.4	-179.1	-177.5	56.5	-159.7	0	0	111.9	S185 K189 R190 N191	S185-E187 PolarHBondContact O-N 3.16Å; E187-K189 VanDerWaalsContact C-N 3.34Å; E187-K189 PolarHBondContact O-N 2.87Å; E187-R190 PolarHBondContact O-N 3.24Å; E187-N191 WeakPolarHBondContact O-CB 3.46Å; E187-N191 VanDerWaalsContact O-CG 3.24Å; E187-N191 PolarHBondContact O-N 3.35Å; E187-N191 PolarHBondContact O-ND2 2.91Å; E187-N191 PolarHBondContact OE1-ND2 2.93Å; E187-N191 PolarHBondContact OE1-OD1 3Å
188	Q	95.1	Very high	92	Very high	58 Å²	58	55 Å²	55	27%	0.271	28%	0.284	S	S	.	.	H	α-helix	trans	-62.9	-41.4	174.4	-73.1	171.2	-28.3	0	0	111.6	F184 S185 N191 A192 L340 Y469	F184-Q188 HydrophobicContact CB-CB 4.35Å; S185-Q188 PolarHBondContact O-N 3.3Å; S185-Q188 VanDerWaalsContact O-N 3.11Å; S185-Q188 WeakPolarHBondContact OG-CG 3.28Å; S185-Q188 PolarHBondContact OG-N 3.03Å; Q188-N191 PolarHBondContact O-N 2.93Å; Q188-A192 WeakPolarHBondContact O-CB 3.37Å; Q188-A192 PolarHBondContact O-N 3.47Å; Q188-L340 HydrophobicContact CB-CD1 4.24Å; Q188-Y469 HydrophobicContact CB-CD2 3.76Å; Q188-Y469 HydrophobicContact CB-CE2 3.71Å; Q188-Y469 HydrophobicContact CG-CD2 3.77Å; Q188-Y469 HydrophobicContact CG-CE2 4Å; Q188-Y469 HydrophobicContact CG-CG 4.06Å
189	K	94.3	Very high	92.5	Very high	14 Å²	14	56.8 Å²	56.8	6%	0.061	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-43.9	175.8	-69.5	169	-179.6	175.5	0	111.6	A180 D181 F184 S185 V186 E187 E193 E339 L340	A180-K189 PolarHBondContact O-NZ 3.46Å; D181-K189 IonicContact OD1-NZ 3.17Å; D181-K189 PolarHBondContact OD1-NZ 2.95Å; F184-K189 HydrophobicContact CB-CG 4.34Å; F184-K189 WeakPolarHBondContact O-CE 3.35Å; F184-K189 PolarHBondContact O-NZ 3.35Å; S185-K189 WeakPolarHBondContact O-CG 3.33Å; S185-K189 PolarHBondContact O-N 3.47Å; V186-K189 PolarHBondContact O-N 3.36Å; E187-K189 VanDerWaalsContact C-N 3.34Å; E187-K189 PolarHBondContact O-N 2.87Å; K189-E193 WeakPolarHBondContact O-CB 3.29Å; K189-E193 PolarHBondContact O-N 3.45Å; K189-E339 WeakPolarHBondContact CE-OE1 3.33Å; K189-E339 IonicContact NZ-OE1 3.33Å; K189-E339 PolarHBondContact NZ-OE1 3.44Å; K189-L340 HydrophobicContact CG-CD1 4.39Å
190	R	94.7	Very high	93.1	Very high	168 Å²	168	51.3 Å²	51.3	63%	0.634	27%	0.266	S	S	*	.	H	α-helix	trans	-64.8	-44.5	176.9	-174.1	179.2	-174.4	169.2	2.3	111.8	V186 E187 E193 V194	V186-R190 WeakPolarHBondContact O-CB 3.36Å; V186-R190 PolarHBondContact O-N 2.95Å; E187-R190 PolarHBondContact O-N 3.24Å; R190-E193 WeakPolarHBondContact O-CB 3.28Å; R190-E193 PolarHBondContact O-N 3.43Å; R190-V194 WeakPolarHBondContact O-CG2 3.39Å; R190-V194 PolarHBondContact O-N 3.17Å
191	N	96.2	Very high	93.8	Very high	66 Å²	66	52.3 Å²	52.3	35%	0.353	27%	0.274	S	S	.	.	H	α-helix	trans	-66.8	-41.4	-180	-71.2	-27.5	0	0	0	112.1	E187 Q188 E193 V194 L195 Y469	E187-N191 WeakPolarHBondContact O-CB 3.46Å; E187-N191 VanDerWaalsContact O-CG 3.24Å; E187-N191 PolarHBondContact O-N 3.35Å; E187-N191 PolarHBondContact O-ND2 2.91Å; E187-N191 PolarHBondContact OE1-ND2 2.93Å; E187-N191 PolarHBondContact OE1-OD1 3Å; Q188-N191 PolarHBondContact O-N 2.93Å; N191-E193 VanDerWaalsContact C-N 3.32Å; N191-E193 PolarHBondContact O-N 3.22Å; N191-V194 PolarHBondContact O-N 2.76Å; N191-L195 VanDerWaalsContact O-CB 3.3Å; N191-L195 WeakPolarHBondContact O-CB 3.3Å; N191-L195 PolarHBondContact O-N 3.28Å; N191-Y469 WeakPolarHBondContact CB-OH 3.49Å
192	A	95.9	Very high	94.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-39.9	173.3	0	0	0	0	0	112.1	Q188 L195 M196 L340 I476	Q188-A192 WeakPolarHBondContact O-CB 3.37Å; Q188-A192 PolarHBondContact O-N 3.47Å; A192-L195 PolarHBondContact O-N 3.15Å; A192-M196 HydrophobicContact CB-CE 4.39Å; A192-M196 WeakPolarHBondContact O-CB 3.42Å; A192-M196 WeakPolarHBondContact O-CE 3.49Å; A192-M196 WeakPolarHBondContact O-CG 3.47Å; A192-M196 PolarHBondContact O-N 2.92Å; A192-L340 HydrophobicContact CB-CD1 3.84Å; A192-L340 HydrophobicContact CB-CD2 4.35Å; A192-L340 HydrophobicContact CB-CG 3.86Å; A192-I476 HydrophobicContact CB-CD1 4.03Å
193	E	94.8	Very high	95.2	Very high	63 Å²	63	49.5 Å²	49.5	29%	0.294	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-53.4	175.1	180	169	152.7	0	0	112.4	K189 R190 N191 L195 M196 L197 R246	K189-E193 WeakPolarHBondContact O-CB 3.29Å; K189-E193 PolarHBondContact O-N 3.45Å; R190-E193 WeakPolarHBondContact O-CB 3.28Å; R190-E193 PolarHBondContact O-N 3.43Å; N191-E193 VanDerWaalsContact C-N 3.32Å; N191-E193 PolarHBondContact O-N 3.22Å; E193-L195 VanDerWaalsContact C-N 3.28Å; E193-L195 PolarHBondContact O-N 3.3Å; E193-M196 PolarHBondContact O-N 3.14Å; E193-L197 HydrophobicContact CG-CD1 4.19Å; E193-L197 WeakPolarHBondContact O-CG 3.38Å; E193-L197 PolarHBondContact O-N 3.39Å; E193-R246 VanDerWaalsContact CD-NH2 3.33Å; E193-R246 IonicContact OE2-CZ 3.39Å; E193-R246 IonicContact OE2-NH2 2.73Å; E193-R246 PolarHBondContact OE2-NH2 3.13Å
194	V	96.3	Very high	95.8	Very high	78 Å²	78	49 Å²	49	47%	0.473	26%	0.262	S	S	.	.	H	α-helix	trans	-58.2	-44.6	178.5	173.9	0	0	0	0	110.5	R190 N191 L197 V198	R190-V194 WeakPolarHBondContact O-CG2 3.39Å; R190-V194 PolarHBondContact O-N 3.17Å; N191-V194 PolarHBondContact O-N 2.76Å; V194-L197 PolarHBondContact O-N 3.25Å; V194-V198 HydrophobicContact CG1-CG2 4.42Å; V194-V198 WeakPolarHBondContact O-CG2 3.47Å; V194-V198 PolarHBondContact O-N 3.22Å
195	L	97	Very high	96.1	Very high	38 Å²	38	53.3 Å²	53.3	20%	0.199	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-48.5	179.5	-174.5	68.4	0	0	0	112	N191 A192 E193 L197 V198 F199 V473 I476 V477	N191-L195 VanDerWaalsContact O-CB 3.3Å; N191-L195 WeakPolarHBondContact O-CB 3.3Å; N191-L195 PolarHBondContact O-N 3.28Å; A192-L195 PolarHBondContact O-N 3.15Å; E193-L195 VanDerWaalsContact C-N 3.28Å; E193-L195 PolarHBondContact O-N 3.3Å; L195-L197 VanDerWaalsContact C-N 3.31Å; L195-L197 PolarHBondContact O-N 2.94Å; L195-V198 PolarHBondContact O-N 3.03Å; L195-F199 HydrophobicContact CD1-CD2 3.74Å; L195-F199 HydrophobicContact CD1-CE2 3.52Å; L195-F199 HydrophobicContact CG-CD2 4.19Å; L195-F199 HydrophobicContact CG-CE2 4.38Å; L195-F199 WeakPolarHBondContact O-CD2 3.17Å; L195-F199 PolarHBondContact O-N 3.22Å; L195-F199 VanDerWaalsContact O-N 3.12Å; L195-V473 HydrophobicContact CD2-CB 4.41Å; L195-V473 HydrophobicContact CD2-CG1 3.81Å; L195-V473 HydrophobicContact CD2-CG2 4.47Å; L195-I476 HydrophobicContact CD2-CB 4.12Å; L195-I476 HydrophobicContact CD2-CD1 4.29Å; L195-I476 HydrophobicContact CD2-CG2 3.82Å; L195-I476 HydrophobicContact CG-CG2 3.86Å; L195-V477 HydrophobicContact CD1-CG2 4.49Å; L195-V477 HydrophobicContact CD2-CG2 4.32Å
196	M	96.4	Very high	96.4	Very high	7 Å²	7	53.3 Å²	53.3	3%	0.034	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-41.9	177.4	-77.5	-177.1	-74.7	0	0	111.9	A192 E193 A200 Y243 T341 M343 I476	A192-M196 HydrophobicContact CB-CE 4.39Å; A192-M196 WeakPolarHBondContact O-CB 3.42Å; A192-M196 WeakPolarHBondContact O-CE 3.49Å; A192-M196 WeakPolarHBondContact O-CG 3.47Å; A192-M196 PolarHBondContact O-N 2.92Å; E193-M196 PolarHBondContact O-N 3.14Å; M196-A200 WeakPolarHBondContact O-CB 3.18Å; M196-A200 PolarHBondContact O-N 3.4Å; M196-Y243 HydrophobicContact SD-CD1 4.34Å; M196-Y243 HydrophobicContact SD-CE1 4.24Å; M196-T341 HydrophobicContact CE-CG2 3.67Å; M196-T341 HydrophobicContact SD-CG2 3.65Å; M196-M343 HydrophobicContact SD-CG 4.32Å; M196-I476 HydrophobicContact CB-CG2 4.43Å; M196-I476 HydrophobicContact CG-CB 4.4Å; M196-I476 HydrophobicContact CG-CD1 3.98Å; M196-I476 HydrophobicContact CG-CG1 3.92Å; M196-I476 HydrophobicContact CG-CG2 3.57Å; M196-I476 HydrophobicContact SD-CD1 4.47Å; M196-I476 HydrophobicContact SD-CG1 4.44Å
197	L	96.9	Very high	96.7	Very high	52 Å²	52	48.7 Å²	48.7	27%	0.272	26%	0.256	S	S	.	.	H	α-helix	trans	-62.3	-46.1	178.5	-72.5	174.6	0	0	0	112.1	E193 V194 L195 F199 A200 A201 A247	E193-L197 HydrophobicContact CG-CD1 4.19Å; E193-L197 WeakPolarHBondContact O-CG 3.38Å; E193-L197 PolarHBondContact O-N 3.39Å; V194-L197 PolarHBondContact O-N 3.25Å; L195-L197 VanDerWaalsContact C-N 3.31Å; L195-L197 PolarHBondContact O-N 2.94Å; L197-F199 PolarHBondContact O-N 2.94Å; L197-A200 PolarHBondContact O-N 3.11Å; L197-A201 WeakPolarHBondContact O-CB 3.39Å; L197-A201 PolarHBondContact O-N 3.35Å; L197-A247 HydrophobicContact CD2-CB 3.54Å
198	V	97.9	Very high	96.8	Very high	90 Å²	90	47.4 Å²	47.4	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-60	-49.2	179.4	170	0	0	0	0	110.9	V194 L195 A201 A202	V194-V198 HydrophobicContact CG1-CG2 4.42Å; V194-V198 WeakPolarHBondContact O-CG2 3.47Å; V194-V198 PolarHBondContact O-N 3.22Å; L195-V198 PolarHBondContact O-N 3.03Å; V198-A201 PolarHBondContact O-N 3.5Å; V198-A202 WeakPolarHBondContact O-CB 3.28Å; V198-A202 PolarHBondContact O-N 3.03Å
199	F	98.1	Very high	96.8	Very high	51 Å²	51	46.5 Å²	46.5	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-72.5	-37.3	-178.5	-83.5	-90	0	0	0	112.9	L195 L197 A201 A202 C203 V477 F480 V481 I484	L195-F199 HydrophobicContact CD1-CD2 3.74Å; L195-F199 HydrophobicContact CD1-CE2 3.52Å; L195-F199 HydrophobicContact CG-CD2 4.19Å; L195-F199 HydrophobicContact CG-CE2 4.38Å; L195-F199 WeakPolarHBondContact O-CD2 3.17Å; L195-F199 PolarHBondContact O-N 3.22Å; L195-F199 VanDerWaalsContact O-N 3.12Å; L197-F199 PolarHBondContact O-N 2.94Å; F199-A201 VanDerWaalsContact C-N 3.34Å; F199-A202 PolarHBondContact O-N 2.84Å; F199-C203 VanDerWaalsContact O-CB 3.26Å; F199-C203 WeakPolarHBondContact O-CB 3.41Å; F199-C203 PolarHBondContact O-N 3.48Å; F199-V477 HydrophobicContact CE1-CG1 3.92Å; F199-V477 HydrophobicContact CE1-CG2 4.48Å; F199-V477 HydrophobicContact CE2-CG2 3.94Å; F199-V477 HydrophobicContact CZ-CB 4.43Å; F199-V477 HydrophobicContact CZ-CG1 3.95Å; F199-V477 HydrophobicContact CZ-CG2 3.9Å; F199-F480 HydrophobicContact CB-CB 3.93Å; F199-F480 HydrophobicContact CB-CD2 3.44Å; F199-F480 VanDerWaalsContact CB-CD2 3.44Å; F199-F480 HydrophobicContact CB-CE2 4.1Å; F199-F480 HydrophobicContact CB-CG 3.79Å; F199-F480 HydrophobicContact CD1-CB 4.16Å; F199-F480 HydrophobicContact CG-CD2 4.4Å; F199-V481 HydrophobicContact CE1-CG2 4.46Å; F199-I484 HydrophobicContact CD1-CD1 3.9Å; F199-I484 HydrophobicContact CE1-CD1 4.49Å
200	A	97.7	Very high	96.7	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-40.1	173.8	0	0	0	0	0	111.5	M196 L197 S204 Y243 F480	M196-A200 WeakPolarHBondContact O-CB 3.18Å; M196-A200 PolarHBondContact O-N 3.4Å; L197-A200 PolarHBondContact O-N 3.11Å; A200-S204 VanDerWaalsContact O-CB 3.24Å; A200-S204 WeakPolarHBondContact O-CB 3.39Å; A200-S204 PolarHBondContact O-N 3.02Å; A200-S204 PolarHBondContact O-OG 3.27Å; A200-Y243 HydrophobicContact CB-CG 4.38Å; A200-F480 HydrophobicContact CB-CE1 3.81Å; A200-F480 HydrophobicContact CB-CZ 3.82Å
201	A	98.2	Very high	96.7	Very high	30 Å²	30	38.9 Å²	38.9	25%	0.248	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-49.1	175.6	0	0	0	0	0	111.8	L197 V198 F199 C203 S204 V205 W244	L197-A201 WeakPolarHBondContact O-CB 3.39Å; L197-A201 PolarHBondContact O-N 3.35Å; V198-A201 PolarHBondContact O-N 3.5Å; F199-A201 VanDerWaalsContact C-N 3.34Å; A201-C203 VanDerWaalsContact C-N 3.34Å; A201-C203 PolarHBondContact O-N 3.45Å; A201-S204 PolarHBondContact O-N 3.29Å; A201-V205 WeakPolarHBondContact O-CB 3.4Å; A201-V205 VanDerWaalsContact O-CG2 3.29Å; A201-V205 WeakPolarHBondContact O-CG2 3.35Å; A201-V205 PolarHBondContact O-N 3.43Å; A201-W244 HydrophobicContact CB-CH2 4Å; A201-W244 HydrophobicContact CB-CZ2 3.95Å
202	A	98.1	Very high	96.5	Very high	39 Å²	39	38 Å²	38	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-57.6	-46.3	176.7	0	0	0	0	0	111.9	V198 F199 L206 I484	V198-A202 WeakPolarHBondContact O-CB 3.28Å; V198-A202 PolarHBondContact O-N 3.03Å; F199-A202 PolarHBondContact O-N 2.84Å; A202-L206 WeakPolarHBondContact O-CB 3.27Å; A202-L206 WeakPolarHBondContact O-CG 3.39Å; A202-L206 PolarHBondContact O-N 3.3Å; A202-L206 VanDerWaalsContact O-N 3.1Å; A202-I484 HydrophobicContact CB-CD1 3.94Å; A202-I484 HydrophobicContact CB-CG1 4.35Å
203	C	98.3	Very high	96.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-47.4	177.5	-171.4	0	0	0	0	111.9	F199 A201 C207 T240 F480 I484	F199-C203 VanDerWaalsContact O-CB 3.26Å; F199-C203 WeakPolarHBondContact O-CB 3.41Å; F199-C203 PolarHBondContact O-N 3.48Å; A201-C203 VanDerWaalsContact C-N 3.34Å; A201-C203 PolarHBondContact O-N 3.45Å; C203-C207 VanDerWaalsContact O-CB 3.29Å; C203-C207 WeakPolarHBondContact O-CB 3.37Å; C203-C207 PolarHBondContact O-N 2.99Å; C203-C207 PolarHBondContact O-SG 3.32Å; C203-T240 HydrophobicContact CB-CG2 4.02Å; C203-F480 HydrophobicContact CB-CB 4.37Å; C203-F480 HydrophobicContact CB-CD1 3.87Å; C203-I484 HydrophobicContact CB-CD1 4.47Å; C203-I484 HydrophobicContact CB-CG1 3.85Å
204	S	97.6	Very high	95.7	Very high	13 Å²	13	39 Å²	39	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-50.2	179.2	-59	0	0	0	0	111.3	A200 A201 L206 V208 T240 W244	A200-S204 VanDerWaalsContact O-CB 3.24Å; A200-S204 WeakPolarHBondContact O-CB 3.39Å; A200-S204 PolarHBondContact O-N 3.02Å; A200-S204 PolarHBondContact O-OG 3.27Å; A201-S204 PolarHBondContact O-N 3.29Å; S204-L206 PolarHBondContact O-N 3.11Å; S204-V208 WeakPolarHBondContact O-CB 3.47Å; S204-V208 WeakPolarHBondContact O-CG2 3.14Å; S204-V208 PolarHBondContact O-N 2.86Å; S204-T240 WeakPolarHBondContact OG-CB 3.37Å; S204-T240 WeakPolarHBondContact OG-CG2 3.43Å; S204-T240 PolarHBondContact OG-OG1 3.44Å; S204-W244 PolarHBondContact OG-NE1 3.37Å
205	V	97.7	Very high	95.2	Very high	98 Å²	98	41.7 Å²	41.7	59%	0.594	24%	0.242	S	C	*	.	H	α-helix	trans	-61.3	-48.6	-177.9	169.9	0	0	0	0	110.9	A201 A209	A201-V205 WeakPolarHBondContact O-CB 3.4Å; A201-V205 VanDerWaalsContact O-CG2 3.29Å; A201-V205 WeakPolarHBondContact O-CG2 3.35Å; A201-V205 PolarHBondContact O-N 3.43Å; V205-A209 WeakPolarHBondContact O-CB 3.24Å; V205-A209 PolarHBondContact O-N 2.63Å
206	L	97.6	Very high	94.6	Very high	50 Å²	50	44.9 Å²	44.9	26%	0.262	27%	0.266	S	S	.	.	H	α-helix	trans	-67.8	-44.1	-177.8	-69.3	171.4	0	0	0	112.3	A202 S204 A210 I484 L491	A202-L206 WeakPolarHBondContact O-CB 3.27Å; A202-L206 WeakPolarHBondContact O-CG 3.39Å; A202-L206 PolarHBondContact O-N 3.3Å; A202-L206 VanDerWaalsContact O-N 3.1Å; S204-L206 PolarHBondContact O-N 3.11Å; L206-A210 WeakPolarHBondContact O-CB 3.29Å; L206-A210 PolarHBondContact O-N 3.28Å; L206-I484 HydrophobicContact CD1-CB 4.24Å; L206-I484 HydrophobicContact CD1-CG1 4.47Å; L206-I484 HydrophobicContact CD1-CG2 3.63Å; L206-L491 HydrophobicContact CD2-CD1 3.94Å
207	C	97.6	Very high	93.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.7	-47.4	178.5	-67.7	0	0	0	0	111.3	C203 A209 A210 L211 C233 A237 G483	C203-C207 VanDerWaalsContact O-CB 3.29Å; C203-C207 WeakPolarHBondContact O-CB 3.37Å; C203-C207 PolarHBondContact O-N 2.99Å; C203-C207 PolarHBondContact O-SG 3.32Å; C207-A209 PolarHBondContact O-N 3.25Å; C207-A210 WeakPolarHBondContact O-CB 3.21Å; C207-A210 PolarHBondContact O-N 2.9Å; C207-L211 VanDerWaalsContact O-CG 3.23Å; C207-L211 WeakPolarHBondContact O-CG 3.35Å; C207-L211 PolarHBondContact O-N 2.92Å; C207-C233 HydrophobicContact CB-CB 4.25Å; C207-A237 HydrophobicContact CB-CB 3.98Å; C207-G483 PolarHBondContact SG-O 3.5Å; C207-G483 VanDerWaalsContact SG-O 3.4Å
208	V	96.6	Very high	92.6	Very high	80 Å²	80	51.5 Å²	51.5	49%	0.485	30%	0.302	S	S	.	.	H	α-helix	trans	-64.2	-41.6	179.1	173	0	0	0	0	111	S204 A210 L211 A212 A237	S204-V208 WeakPolarHBondContact O-CB 3.47Å; S204-V208 WeakPolarHBondContact O-CG2 3.14Å; S204-V208 PolarHBondContact O-N 2.86Å; V208-A210 VanDerWaalsContact C-N 3.34Å; V208-A210 PolarHBondContact O-N 3.45Å; V208-L211 PolarHBondContact O-N 3.3Å; V208-A212 WeakPolarHBondContact O-CB 3.23Å; V208-A212 PolarHBondContact O-N 3.48Å; V208-A237 HydrophobicContact CG2-CB 4.22Å
209	A	94.5	Very high	91.1	Very high	39 Å²	39	55.3 Å²	55.3	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-41.7	175.2	0	0	0	0	0	111.9	V205 C207 F213 L491	V205-A209 WeakPolarHBondContact O-CB 3.24Å; V205-A209 PolarHBondContact O-N 2.63Å; C207-A209 PolarHBondContact O-N 3.25Å; A209-F213 WeakPolarHBondContact O-CB 3.24Å; A209-F213 PolarHBondContact O-N 3.3Å; A209-L491 HydrophobicContact CB-CD1 4.12Å; A209-L491 HydrophobicContact CB-CD2 4.23Å
210	A	93.1	Very high	89.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.4	-41.8	175.4	0	0	0	0	0	112.3	L206 C207 V208 Q214 L490 L491 R494	L206-A210 WeakPolarHBondContact O-CB 3.29Å; L206-A210 PolarHBondContact O-N 3.28Å; C207-A210 WeakPolarHBondContact O-CB 3.21Å; C207-A210 PolarHBondContact O-N 2.9Å; V208-A210 VanDerWaalsContact C-N 3.34Å; V208-A210 PolarHBondContact O-N 3.45Å; A210-Q214 PolarHBondContact O-N 2.92Å; A210-L490 HydrophobicContact CB-CB 3.89Å; A210-L490 HydrophobicContact CB-CD1 4.16Å; A210-L491 HydrophobicContact CB-CD2 4.45Å; A210-L491 HydrophobicContact CB-CG 4.16Å; A210-R494 PolarHBondContact O-NH1 3.08Å
211	L	93.9	Very high	88.5	Confident	22 Å²	22	60.6 Å²	60.6	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-68.6	-49.1	176.8	-65.7	170.8	0	0	0	111.4	C207 V208 F213 Q214 F215 L230 C233 I234 A237	C207-L211 VanDerWaalsContact O-CG 3.23Å; C207-L211 WeakPolarHBondContact O-CG 3.35Å; C207-L211 PolarHBondContact O-N 2.92Å; V208-L211 PolarHBondContact O-N 3.3Å; L211-F213 VanDerWaalsContact C-N 3.3Å; L211-F213 PolarHBondContact O-N 2.84Å; L211-Q214 WeakPolarHBondContact O-CA 3.26Å; L211-Q214 WeakPolarHBondContact O-CB 3.43Å; L211-Q214 PolarHBondContact O-N 2.94Å; L211-F215 HydrophobicContact CB-CD2 4.32Å; L211-F215 HydrophobicContact CB-CE2 4.31Å; L211-F215 HydrophobicContact CD2-CE2 4.12Å; L211-F215 WeakPolarHBondContact O-CD2 3.49Å; L211-F215 PolarHBondContact O-N 3.24Å; L211-L230 HydrophobicContact CD2-CD1 3.65Å; L211-L230 HydrophobicContact CD2-CG 4.13Å; L211-C233 HydrophobicContact CD2-CB 4.25Å; L211-C233 HydrophobicContact CG-CB 4.37Å; L211-I234 HydrophobicContact CD1-CG1 3.99Å; L211-I234 HydrophobicContact CD2-CD1 4.25Å; L211-I234 HydrophobicContact CD2-CG1 3.48Å; L211-I234 VanDerWaalsContact CD2-CG1 3.48Å; L211-I234 HydrophobicContact CG-CG1 4.41Å; L211-A237 HydrophobicContact CD1-CB 4.14Å
212	A	92.7	Very high	87.5	Confident	46 Å²	46	61 Å²	61	38%	0.38	35%	0.347	S	S	.	.	H	α-helix	trans	-57.7	-43.3	178	0	0	0	0	0	111.4	V208 Q214 F215 C216	V208-A212 WeakPolarHBondContact O-CB 3.23Å; V208-A212 PolarHBondContact O-N 3.48Å; A212-Q214 VanDerWaalsContact C-N 3.26Å; A212-Q214 PolarHBondContact O-N 3.49Å; A212-F215 PolarHBondContact O-N 2.63Å; A212-C216 WeakPolarHBondContact O-CB 3.32Å; A212-C216 PolarHBondContact O-N 3.21Å; A212-C216 PolarHBondContact O-SG 3.1Å; A212-C216 VanDerWaalsContact O-SG 3.33Å
213	F	88.1	Confident	86.6	Confident	61 Å²	61	65.3 Å²	65.3	27%	0.268	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-36.2	175.2	-166.1	-69.4	0	0	0	111.6	A209 L211 K217 R494	A209-F213 WeakPolarHBondContact O-CB 3.24Å; A209-F213 PolarHBondContact O-N 3.3Å; L211-F213 VanDerWaalsContact C-N 3.3Å; L211-F213 PolarHBondContact O-N 2.84Å; F213-K217 PolarHBondContact O-N 3.03Å; F213-R494 HydrophobicContact CD1-CB 4.24Å; F213-R494 HydrophobicContact CD1-CG 4.33Å; F213-R494 HydrophobicContact CE1-CB 3.8Å; F213-R494 HydrophobicContact CE1-CG 4.17Å; F213-R494 HydrophobicContact CZ-CB 4.19Å
214	Q	85.7	Confident	85.7	Confident	23 Å²	23	66.5 Å²	66.5	11%	0.107	37%	0.365	C	S	.	.	H	α-helix	trans	-68.1	-49.5	179.2	-171.9	44.3	33.5	0	0	111.9	A210 L211 A212 P218 L222 L230 R494	A210-Q214 PolarHBondContact O-N 2.92Å; L211-Q214 WeakPolarHBondContact O-CA 3.26Å; L211-Q214 WeakPolarHBondContact O-CB 3.43Å; L211-Q214 PolarHBondContact O-N 2.94Å; A212-Q214 VanDerWaalsContact C-N 3.26Å; A212-Q214 PolarHBondContact O-N 3.49Å; Q214-P218 WeakPolarHBondContact O-CA 3.48Å; Q214-L222 HydrophobicContact CG-CD1 4.22Å; Q214-L222 VanDerWaalsContact NE2-CD1 3.33Å; Q214-L230 HydrophobicContact CB-CD1 4.07Å; Q214-L230 HydrophobicContact CG-CD1 3.98Å; Q214-L230 HydrophobicContact CG-CD2 4.23Å; Q214-R494 VanDerWaalsContact OE1-NE 3.15Å
215	F	85.1	Confident	85.1	Confident	136 Å²	136	66.6 Å²	66.6	60%	0.596	37%	0.366	S	S	*	.	H	α-helix	trans	-80.8	-33.8	-172.2	-68	-66.6	0	0	0	112.5	L211 A212	L211-F215 HydrophobicContact CB-CD2 4.32Å; L211-F215 HydrophobicContact CB-CE2 4.31Å; L211-F215 HydrophobicContact CD2-CE2 4.12Å; L211-F215 WeakPolarHBondContact O-CD2 3.49Å; L211-F215 PolarHBondContact O-N 3.24Å; A212-F215 PolarHBondContact O-N 2.63Å
216	C	85.5	Confident	84.6	Confident	104 Å²	104	62.6 Å²	62.6	70%	0.703	34%	0.341	S	S	*	.	H	α-helix	trans	-82.8	-24.8	179.4	-61	0	0	0	0	113.2	A212	A212-C216 WeakPolarHBondContact O-CB 3.32Å; A212-C216 PolarHBondContact O-N 3.21Å; A212-C216 PolarHBondContact O-SG 3.1Å; A212-C216 VanDerWaalsContact O-SG 3.33Å
217	K	77.5	Confident	84.2	Confident	104 Å²	104	61.2 Å²	61.2	45%	0.452	34%	0.335	S	S	.	.			trans	-136.2	66	178.5	-66.4	-174.9	-178.8	170.7	0	111.2	F213 R219	F213-K217 PolarHBondContact O-N 3.03Å; K217-R219 PolarHBondContact O-N 3.28Å
218	P	73.9	Confident	84	Confident	94 Å²	94	61.2 Å²	61.2	61%	0.61	34%	0.335	S	S	*	.			trans	-72.6	73.8	178.4	32.3	-35.6	0	0	0	110.1	Q214	Q214-P218 WeakPolarHBondContact O-CA 3.48Å
219	R	65.2	Low	83.9	Confident	170 Å²	170	57.4 Å²	57.4	64%	0.642	31%	0.312	S	S	*	.			trans	-87.5	-22.1	-179.3	-68.8	-176.4	179.8	164	-3.3	112.8	K217	K217-R219 PolarHBondContact O-N 3.28Å
220	V	67.9	Low	83.9	Confident	94 Å²	94	56.3 Å²	56.3	57%	0.57	30%	0.3	S	S	*	.	S	Bend	trans	-135.4	126.7	179.6	-176.8	0	0	0	0	108	L222	V220-L222 PolarHBondContact O-N 3.03Å
221	A	73.4	Confident	84.1	Confident	70 Å²	70	59.1 Å²	59.1	58%	0.579	31%	0.311	S	S	*	.			trans	-66.6	123.3	172.7	0	0	0	0	0	109	H223	A221-H223 PolarHBondContact O-N 3.4Å; A221-H223 PolarHBondContact O-ND1 3.1Å
222	L	78.1	Confident	84.2	Confident	38 Å²	38	58.1 Å²	58.1	20%	0.199	31%	0.306	C	S	.	.			trans	-68.6	130.9	169.3	-87.3	82.2	0	0	0	108.2	Q214 V220 D226 V227 L230 L490	Q214-L222 HydrophobicContact CG-CD1 4.22Å; Q214-L222 VanDerWaalsContact NE2-CD1 3.33Å; V220-L222 PolarHBondContact O-N 3.03Å; L222-D226 HydrophobicContact CB-CB 4.48Å; L222-D226 HydrophobicContact CD2-CB 3.79Å; L222-D226 HydrophobicContact CG-CB 4.19Å; L222-V227 HydrophobicContact CB-CG2 3.85Å; L222-V227 WeakPolarHBondContact O-CG2 3.26Å; L222-L230 HydrophobicContact CD2-CB 4.33Å; L222-L490 HydrophobicContact CD2-CD2 4.35Å
223	H	78.7	Confident	84.5	Confident	129 Å²	129	55.9 Å²	55.9	60%	0.597	29%	0.288	S	S	*	.			trans	-104.4	154.2	170.9	-66.5	75.4	0	0	0	108.8	A221 D226	A221-H223 PolarHBondContact O-N 3.4Å; A221-H223 PolarHBondContact O-ND1 3.1Å; H223-D226 WeakPolarHBondContact O-CB 3.23Å; H223-D226 PolarHBondContact O-N 3.36Å
224	Y	79.9	Confident	84.9	Confident	25 Å²	25	55 Å²	55	10%	0.098	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	136.1	168.6	-74.6	-85.8	0	0	0	109.3	V227 Q308 S311 F314	Y224-V227 HydrophobicContact CD1-CB 4.05Å; Y224-V227 HydrophobicContact CD2-CB 4.42Å; Y224-V227 HydrophobicContact CD2-CG2 4.42Å; Y224-V227 HydrophobicContact CE1-CB 3.97Å; Y224-V227 HydrophobicContact CE1-CG1 3.98Å; Y224-V227 HydrophobicContact CE2-CB 4.34Å; Y224-V227 HydrophobicContact CE2-CG1 4.25Å; Y224-V227 HydrophobicContact CG-CB 4.28Å; Y224-Q308 PolarHBondContact O-NE2 3.49Å; Y224-S311 PolarHBondContact OH-OG 3.5Å; Y224-S311 VanDerWaalsContact OH-OG 3.13Å; Y224-F314 AromaticContact CE1-CD2 3.89Å; Y224-F314 HydrophobicContact CE1-CD2 3.89Å; Y224-F314 HydrophobicContact CE1-CE2 4.38Å
225	P	85.4	Confident	85.5	Confident	16 Å²	16	54 Å²	54	10%	0.104	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	cis	-85.8	-12.2	14.7	31.5	-36	0	0	0	116.9	V227 A228 L299 C302 L428 T431	P225-V227 PolarHBondContact O-N 3.32Å; P225-V227 VanDerWaalsContact O-N 3.12Å; P225-A228 WeakPolarHBondContact O-CB 3.38Å; P225-A228 PolarHBondContact O-N 3.33Å; P225-L299 HydrophobicContact CB-CD1 3.8Å; P225-C302 HydrophobicContact CB-CB 3.79Å; P225-L428 HydrophobicContact CG-CD1 4.44Å; P225-T431 HydrophobicContact CB-CG2 4.07Å; P225-T431 HydrophobicContact CG-CG2 3.61Å
226	D	86.7	Confident	86.1	Confident	13 Å²	13	48.7 Å²	48.7	7%	0.07	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-27.2	-169.9	-58.1	-26.4	0	0	0	113.6	L222 H223 A228 I229 L230 T431 R493	L222-D226 HydrophobicContact CB-CB 4.48Å; L222-D226 HydrophobicContact CD2-CB 3.79Å; L222-D226 HydrophobicContact CG-CB 4.19Å; H223-D226 WeakPolarHBondContact O-CB 3.23Å; H223-D226 PolarHBondContact O-N 3.36Å; D226-A228 PolarHBondContact O-N 2.75Å; D226-I229 WeakPolarHBondContact O-CB 3.22Å; D226-I229 PolarHBondContact O-N 3Å; D226-I229 VanDerWaalsContact O-N 3.08Å; D226-L230 PolarHBondContact O-N 2.89Å; D226-L230 VanDerWaalsContact O-N 3.12Å; D226-T431 PolarHBondContact OD1-OG1 3.19Å; D226-R493 VanDerWaalsContact CG-CZ 3.44Å; D226-R493 IonicContact OD1-CZ 2.72Å; D226-R493 IonicContact OD1-NH1 2.64Å; D226-R493 PolarHBondContact OD1-NH1 3.21Å; D226-R493 IonicContact OD1-NH2 2.83Å; D226-R493 IonicContact OD2-CZ 2.7Å; D226-R493 IonicContact OD2-NE 2.73Å; D226-R493 PolarHBondContact OD2-NE 3.09Å; D226-R493 IonicContact OD2-NH1 3.18Å; D226-R493 PolarHBondContact OD2-NH1 3.32Å; D226-R493 IonicContact OD2-NH2 3.63Å; D226-R493 PolarHBondContact OD2-NH2 2.86Å
227	V	89.6	Confident	86.7	Confident	22 Å²	22	44.4 Å²	44.4	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-56.3	-38.3	173.8	175.3	0	0	0	0	111.2	L222 Y224 P225 I229 L230 Y231	L222-V227 HydrophobicContact CB-CG2 3.85Å; L222-V227 WeakPolarHBondContact O-CG2 3.26Å; Y224-V227 HydrophobicContact CD1-CB 4.05Å; Y224-V227 HydrophobicContact CD2-CB 4.42Å; Y224-V227 HydrophobicContact CD2-CG2 4.42Å; Y224-V227 HydrophobicContact CE1-CB 3.97Å; Y224-V227 HydrophobicContact CE1-CG1 3.98Å; Y224-V227 HydrophobicContact CE2-CB 4.34Å; Y224-V227 HydrophobicContact CE2-CG1 4.25Å; Y224-V227 HydrophobicContact CG-CB 4.28Å; P225-V227 PolarHBondContact O-N 3.32Å; P225-V227 VanDerWaalsContact O-N 3.12Å; V227-I229 VanDerWaalsContact C-N 3.33Å; V227-I229 PolarHBondContact O-N 3.48Å; V227-L230 WeakPolarHBondContact O-CB 3.23Å; V227-L230 PolarHBondContact O-N 2.86Å; V227-Y231 HydrophobicContact CG1-CD2 3.89Å; V227-Y231 HydrophobicContact CG1-CE2 3.52Å; V227-Y231 WeakPolarHBondContact O-CD2 3.41Å; V227-Y231 PolarHBondContact O-N 3.08Å
228	A	93.4	Very high	87.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-39.3	176.8	0	0	0	0	0	111.6	P225 D226 L230 Y231 I232 W295 I298 L299	P225-A228 WeakPolarHBondContact O-CB 3.38Å; P225-A228 PolarHBondContact O-N 3.33Å; D226-A228 PolarHBondContact O-N 2.75Å; A228-L230 VanDerWaalsContact C-N 3.31Å; A228-L230 PolarHBondContact O-N 2.77Å; A228-Y231 PolarHBondContact O-N 3.46Å; A228-I232 VanDerWaalsContact O-CG1 3.32Å; A228-I232 WeakPolarHBondContact O-CG1 3.47Å; A228-I232 PolarHBondContact O-N 3.24Å; A228-W295 HydrophobicContact CB-CE3 4.11Å; A228-I298 HydrophobicContact CB-CG2 4.49Å; A228-L299 HydrophobicContact CB-CB 3.93Å
229	I	94.5	Very high	88.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-39.3	176.2	-54.2	171.1	0	0	0	110.7	D226 V227 Y231 I232 C233 L299 T431 L434 C486 F489 L490	D226-I229 WeakPolarHBondContact O-CB 3.22Å; D226-I229 PolarHBondContact O-N 3Å; D226-I229 VanDerWaalsContact O-N 3.08Å; V227-I229 VanDerWaalsContact C-N 3.33Å; V227-I229 PolarHBondContact O-N 3.48Å; I229-Y231 VanDerWaalsContact C-N 3.34Å; I229-Y231 PolarHBondContact O-N 3.19Å; I229-I232 WeakPolarHBondContact O-CB 3.48Å; I229-I232 PolarHBondContact O-N 3.25Å; I229-C233 PolarHBondContact O-N 2.81Å; I229-L299 HydrophobicContact CD1-CD1 4.45Å; I229-L299 HydrophobicContact CG1-CD1 4.06Å; I229-L299 HydrophobicContact CG1-CD2 4.11Å; I229-T431 HydrophobicContact CD1-CG2 3.86Å; I229-L434 HydrophobicContact CD1-CD2 3.83Å; I229-L434 HydrophobicContact CG1-CD2 4.33Å; I229-L434 HydrophobicContact CG2-CD2 4.22Å; I229-C486 HydrophobicContact CG2-CB 3.96Å; I229-F489 HydrophobicContact CD1-CD1 3.9Å; I229-F489 HydrophobicContact CD1-CE1 3.61Å; I229-L490 HydrophobicContact CB-CD2 4.31Å; I229-L490 HydrophobicContact CG2-CD1 4.04Å; I229-L490 HydrophobicContact CG2-CD2 4Å; I229-L490 HydrophobicContact CG2-CG 3.81Å
230	L	94.3	Very high	90.3	Very high	16 Å²	16	28.9 Å²	28.9	8%	0.084	16%	0.162	C	C	.	.	H	α-helix	trans	-58.2	-46.6	175	-172.2	75	0	0	0	111.4	L211 Q214 L222 D226 V227 A228 C233 I234 L490	L211-L230 HydrophobicContact CD2-CD1 3.65Å; L211-L230 HydrophobicContact CD2-CG 4.13Å; Q214-L230 HydrophobicContact CB-CD1 4.07Å; Q214-L230 HydrophobicContact CG-CD1 3.98Å; Q214-L230 HydrophobicContact CG-CD2 4.23Å; L222-L230 HydrophobicContact CD2-CB 4.33Å; D226-L230 PolarHBondContact O-N 2.89Å; D226-L230 VanDerWaalsContact O-N 3.12Å; V227-L230 WeakPolarHBondContact O-CB 3.23Å; V227-L230 PolarHBondContact O-N 2.86Å; A228-L230 VanDerWaalsContact C-N 3.31Å; A228-L230 PolarHBondContact O-N 2.77Å; L230-C233 WeakPolarHBondContact O-CB 3.47Å; L230-C233 PolarHBondContact O-N 3.49Å; L230-I234 WeakPolarHBondContact O-CG1 3.47Å; L230-I234 PolarHBondContact O-N 2.91Å; L230-L490 HydrophobicContact CD1-CD1 4.28Å
231	Y	96.1	Very high	91.7	Very high	59 Å²	59	27.9 Å²	27.9	23%	0.231	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-32.7	177.5	-73.3	-71.4	0	0	0	113.1	V227 A228 I229 C233 I234 C235 W295 H315 W319	V227-Y231 HydrophobicContact CG1-CD2 3.89Å; V227-Y231 HydrophobicContact CG1-CE2 3.52Å; V227-Y231 WeakPolarHBondContact O-CD2 3.41Å; V227-Y231 PolarHBondContact O-N 3.08Å; A228-Y231 PolarHBondContact O-N 3.46Å; I229-Y231 VanDerWaalsContact C-N 3.34Å; I229-Y231 PolarHBondContact O-N 3.19Å; Y231-C233 VanDerWaalsContact C-N 3.33Å; Y231-I234 HydrophobicContact CD1-CD1 3.81Å; Y231-I234 HydrophobicContact CE1-CD1 4.08Å; Y231-I234 WeakPolarHBondContact O-CB 3.43Å; Y231-I234 PolarHBondContact O-N 3.36Å; Y231-C235 PolarHBondContact O-N 3.14Å; Y231-C235 PolarHBondContact O-SG 2.95Å; Y231-W295 VanDerWaalsContact CB-CE2 3.42Å; Y231-W295 HydrophobicContact CD1-CZ2 4.02Å; Y231-W295 HydrophobicContact CD2-CD2 4.5Å; Y231-W295 HydrophobicContact CD2-CE3 4.32Å; Y231-W295 AromaticContact CD2-CH2 3.62Å; Y231-W295 HydrophobicContact CD2-CH2 3.62Å; Y231-W295 AromaticContact CD2-CZ2 3.79Å; Y231-W295 HydrophobicContact CD2-CZ2 3.79Å; Y231-W295 AromaticContact CD2-CZ3 3.89Å; Y231-W295 HydrophobicContact CD2-CZ3 3.89Å; Y231-W295 HydrophobicContact CE2-CH2 4.12Å; Y231-W295 HydrophobicContact CE2-CZ2 4.41Å; Y231-W295 HydrophobicContact CG-CD2 4.19Å; Y231-W295 AromaticContact CG-CE2 3.73Å; Y231-W295 HydrophobicContact CG-CE3 4.46Å; Y231-W295 AromaticContact CG-CH2 3.95Å; Y231-W295 HydrophobicContact CG-CH2 3.95Å; Y231-W295 AromaticContact CG-CZ2 3.61Å; Y231-W295 HydrophobicContact CG-CZ2 3.61Å; Y231-W295 HydrophobicContact CG-CZ3 4.36Å; Y231-H315 AromaticContact CE1-CE1 3.93Å; Y231-H315 AromaticContact CE2-CE1 3.38Å; Y231-H315 WeakPolarHBondContact CE2-CE1 3.44Å; Y231-H315 AromaticContact CZ-CE1 3.29Å; Y231-H315 PolarHBondContact OH-CE1 3.23Å; Y231-H315 VanDerWaalsContact OH-CE1 3.28Å; Y231-W319 AromaticContact CD1-CZ2 3.99Å; Y231-W319 HydrophobicContact CD1-CZ2 3.99Å
232	I	97.3	Very high	92.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59	-46.7	169.5	-68.8	166.9	0	0	0	109.7	A228 I229 I234 C235 Y236 W295 W296 L299 Y482 C486	A228-I232 VanDerWaalsContact O-CG1 3.32Å; A228-I232 WeakPolarHBondContact O-CG1 3.47Å; A228-I232 PolarHBondContact O-N 3.24Å; I229-I232 WeakPolarHBondContact O-CB 3.48Å; I229-I232 PolarHBondContact O-N 3.25Å; I232-I234 VanDerWaalsContact C-N 3.32Å; I232-I234 PolarHBondContact O-N 3Å; I232-C235 WeakPolarHBondContact O-CB 3.19Å; I232-C235 PolarHBondContact O-N 3.4Å; I232-C235 VanDerWaalsContact O-N 3.14Å; I232-Y236 HydrophobicContact CG2-CD2 3.6Å; I232-Y236 HydrophobicContact CG2-CE2 3.66Å; I232-Y236 WeakPolarHBondContact O-CD2 3.35Å; I232-Y236 PolarHBondContact O-N 3.49Å; I232-W295 HydrophobicContact CD1-CB 4.3Å; I232-W295 HydrophobicContact CG1-CB 3.6Å; I232-W296 HydrophobicContact CD1-CB 4.43Å; I232-L299 HydrophobicContact CD1-CD2 4.13Å; I232-Y482 HydrophobicContact CD1-CE1 4.25Å; I232-Y482 HydrophobicContact CG2-CD1 4.26Å; I232-Y482 HydrophobicContact CG2-CE1 3.93Å; I232-C486 HydrophobicContact CG2-CB 4.34Å
233	C	97.5	Very high	93.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-37	175.1	-71	0	0	0	0	113.1	C207 L211 I229 L230 Y231 Y236 A237 L490	C207-C233 HydrophobicContact CB-CB 4.25Å; L211-C233 HydrophobicContact CD2-CB 4.25Å; L211-C233 HydrophobicContact CG-CB 4.37Å; I229-C233 PolarHBondContact O-N 2.81Å; L230-C233 WeakPolarHBondContact O-CB 3.47Å; L230-C233 PolarHBondContact O-N 3.49Å; Y231-C233 VanDerWaalsContact C-N 3.33Å; C233-Y236 PolarHBondContact O-N 3.09Å; C233-A237 VanDerWaalsContact O-CB 3.27Å; C233-A237 WeakPolarHBondContact O-CB 3.41Å; C233-A237 PolarHBondContact O-N 3.45Å; C233-L490 HydrophobicContact CB-CD1 4.47Å
234	I	97.3	Very high	94.6	Very high	43 Å²	43	23.4 Å²	23.4	22%	0.221	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-45.7	173.3	-65.7	171.4	0	0	0	110.4	L211 L230 Y231 I232 A237 S238	L211-I234 HydrophobicContact CD1-CG1 3.99Å; L211-I234 HydrophobicContact CD2-CD1 4.25Å; L211-I234 HydrophobicContact CD2-CG1 3.48Å; L211-I234 VanDerWaalsContact CD2-CG1 3.48Å; L211-I234 HydrophobicContact CG-CG1 4.41Å; L230-I234 WeakPolarHBondContact O-CG1 3.47Å; L230-I234 PolarHBondContact O-N 2.91Å; Y231-I234 HydrophobicContact CD1-CD1 3.81Å; Y231-I234 HydrophobicContact CE1-CD1 4.08Å; Y231-I234 WeakPolarHBondContact O-CB 3.43Å; Y231-I234 PolarHBondContact O-N 3.36Å; I232-I234 VanDerWaalsContact C-N 3.32Å; I232-I234 PolarHBondContact O-N 3Å; I234-A237 PolarHBondContact O-N 3.28Å; I234-S238 WeakPolarHBondContact O-CB 3.42Å; I234-S238 PolarHBondContact O-N 3.02Å; I234-S238 PolarHBondContact O-OG 3.48Å
235	C	98.3	Very high	95.3	Very high	1 Å²	1	26 Å²	26	1%	0.007	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-47.7	178.3	-63.8	0	0	0	0	111	Y231 I232 S238 A239 F288	Y231-C235 PolarHBondContact O-N 3.14Å; Y231-C235 PolarHBondContact O-SG 2.95Å; I232-C235 WeakPolarHBondContact O-CB 3.19Å; I232-C235 PolarHBondContact O-N 3.4Å; I232-C235 VanDerWaalsContact O-N 3.14Å; C235-S238 PolarHBondContact O-N 3.3Å; C235-A239 VanDerWaalsContact O-CB 3.27Å; C235-A239 WeakPolarHBondContact O-CB 3.42Å; C235-A239 PolarHBondContact O-N 3.4Å; C235-F288 WeakPolarHBondContact CB-O 3.06Å
236	Y	98.2	Very high	95.8	Very high	24 Å²	24	25.5 Å²	25.5	9%	0.094	13%	0.128	C	C	.	.	H	α-helix	trans	-66.6	-40.6	179.6	-86.1	-75.8	0	0	0	113.5	I232 C233 S238 A239 T240 V479 Y482	I232-Y236 HydrophobicContact CG2-CD2 3.6Å; I232-Y236 HydrophobicContact CG2-CE2 3.66Å; I232-Y236 WeakPolarHBondContact O-CD2 3.35Å; I232-Y236 PolarHBondContact O-N 3.49Å; C233-Y236 PolarHBondContact O-N 3.09Å; Y236-S238 VanDerWaalsContact C-N 3.25Å; Y236-S238 PolarHBondContact O-N 3.24Å; Y236-A239 PolarHBondContact O-N 3.02Å; Y236-T240 WeakPolarHBondContact O-CG2 3.27Å; Y236-T240 PolarHBondContact O-N 2.98Å; Y236-V479 VanDerWaalsContact CE1-O 3.28Å; Y236-V479 WeakPolarHBondContact CE1-O 3.49Å; Y236-Y482 AromaticContact CE2-CD1 3.85Å; Y236-Y482 HydrophobicContact CE2-CD1 3.85Å
237	A	97.7	Very high	96.2	Very high	15 Å²	15	26.9 Å²	26.9	12%	0.124	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-32.6	174.5	0	0	0	0	0	112.3	C207 V208 L211 C233 I234 T240	C207-A237 HydrophobicContact CB-CB 3.98Å; V208-A237 HydrophobicContact CG2-CB 4.22Å; L211-A237 HydrophobicContact CD1-CB 4.14Å; C233-A237 VanDerWaalsContact O-CB 3.27Å; C233-A237 WeakPolarHBondContact O-CB 3.41Å; C233-A237 PolarHBondContact O-N 3.45Å; I234-A237 PolarHBondContact O-N 3.28Å; A237-T240 PolarHBondContact O-OG1 3.32Å
238	S	97.6	Very high	96.4	Very high	29 Å²	29	30.4 Å²	30.4	20%	0.203	17%	0.172	C	C	.	.	H	α-helix	trans	-78	-38.7	176.2	-51.9	0	0	0	0	111.5	I234 C235 Y236 T240 V241 P242 F288	I234-S238 WeakPolarHBondContact O-CB 3.42Å; I234-S238 PolarHBondContact O-N 3.02Å; I234-S238 PolarHBondContact O-OG 3.48Å; C235-S238 PolarHBondContact O-N 3.3Å; Y236-S238 VanDerWaalsContact C-N 3.25Å; Y236-S238 PolarHBondContact O-N 3.24Å; S238-T240 PolarHBondContact O-N 2.9Å; S238-V241 WeakPolarHBondContact O-CB 3.2Å; S238-V241 PolarHBondContact O-N 3.47Å; S238-P242 WeakPolarHBondContact O-CD 3.48Å; S238-F288 VanDerWaalsContact CB-CD2 3.49Å
239	A	97	Very high	96.3	Very high	8 Å²	8	31.6 Å²	31.6	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-23.1	176.6	0	0	0	0	0	113	C235 Y236 P242 Y243 L285 F288	C235-A239 VanDerWaalsContact O-CB 3.27Å; C235-A239 WeakPolarHBondContact O-CB 3.42Å; C235-A239 PolarHBondContact O-N 3.4Å; Y236-A239 PolarHBondContact O-N 3.02Å; A239-P242 WeakPolarHBondContact O-CD 3.45Å; A239-Y243 VanDerWaalsContact O-CD2 3.27Å; A239-Y243 WeakPolarHBondContact O-CD2 3.21Å; A239-Y243 WeakPolarHBondContact O-CE2 3.27Å; A239-L285 HydrophobicContact CB-CD1 4.03Å; A239-L285 WeakPolarHBondContact O-CD1 3.37Å; A239-F288 HydrophobicContact CB-CB 4.08Å
240	T	97.5	Very high	96.2	Very high	4 Å²	4	34.5 Å²	34.5	3%	0.025	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.5	175.2	61.1	0	0	0	0	113.5	C203 S204 Y236 A237 S238 Y243 W244 F480	C203-T240 HydrophobicContact CB-CG2 4.02Å; S204-T240 WeakPolarHBondContact OG-CB 3.37Å; S204-T240 WeakPolarHBondContact OG-CG2 3.43Å; S204-T240 PolarHBondContact OG-OG1 3.44Å; Y236-T240 WeakPolarHBondContact O-CG2 3.27Å; Y236-T240 PolarHBondContact O-N 2.98Å; A237-T240 PolarHBondContact O-OG1 3.32Å; S238-T240 PolarHBondContact O-N 2.9Å; T240-Y243 WeakPolarHBondContact O-CB 3.5Å; T240-Y243 PolarHBondContact O-N 2.93Å; T240-W244 VanDerWaalsContact O-CD1 3.25Å; T240-W244 PolarHBondContact O-N 3.05Å; T240-F480 HydrophobicContact CG2-CD1 4.39Å; T240-F480 HydrophobicContact CG2-CE1 4.07Å
241	V	97.3	Very high	96	Very high	73 Å²	73	39.5 Å²	39.5	44%	0.442	22%	0.218	S	C	.	.	H	α-helix	trans	-56.8	-48.5	179.2	175	0	0	0	0	112.7	S238 Y243 W244 I245	S238-V241 WeakPolarHBondContact O-CB 3.2Å; S238-V241 PolarHBondContact O-N 3.47Å; V241-Y243 PolarHBondContact O-N 3.45Å; V241-W244 WeakPolarHBondContact O-CB 3.29Å; V241-W244 PolarHBondContact O-N 3.05Å; V241-I245 HydrophobicContact CG1-CD1 3.91Å; V241-I245 HydrophobicContact CG1-CG1 4.32Å; V241-I245 WeakPolarHBondContact O-CG1 3.47Å; V241-I245 PolarHBondContact O-N 3.27Å
242	P	96.4	Very high	95.6	Very high	1 Å²	1	39 Å²	39	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-42	-43.9	167.7	-39.6	40.2	0	0	0	116	S238 A239 I245 R246 V281 L285 M343	S238-P242 WeakPolarHBondContact O-CD 3.48Å; A239-P242 WeakPolarHBondContact O-CD 3.45Å; P242-I245 PolarHBondContact O-N 3Å; P242-R246 PolarHBondContact O-N 3.05Å; P242-V281 HydrophobicContact CB-CG1 3.54Å; P242-V281 HydrophobicContact CG-CG1 4.13Å; P242-L285 HydrophobicContact CB-CB 4.21Å; P242-L285 HydrophobicContact CB-CD1 4.48Å; P242-L285 HydrophobicContact CG-CB 3.88Å; P242-L285 HydrophobicContact CG-CD1 4.41Å; P242-M343 HydrophobicContact CB-CE 3.89Å
243	Y	97.2	Very high	95.3	Very high	28 Å²	28	39.2 Å²	39.2	11%	0.11	23%	0.228	C	C	.	.	H	α-helix	trans	-70.7	-36	-177.8	-63.8	-92.3	0	0	0	111.6	M196 A200 A239 T240 V241 A247 L285 M343 F480	M196-Y243 HydrophobicContact SD-CD1 4.34Å; M196-Y243 HydrophobicContact SD-CE1 4.24Å; A200-Y243 HydrophobicContact CB-CG 4.38Å; A239-Y243 VanDerWaalsContact O-CD2 3.27Å; A239-Y243 WeakPolarHBondContact O-CD2 3.21Å; A239-Y243 WeakPolarHBondContact O-CE2 3.27Å; T240-Y243 WeakPolarHBondContact O-CB 3.5Å; T240-Y243 PolarHBondContact O-N 2.93Å; V241-Y243 PolarHBondContact O-N 3.45Å; Y243-A247 WeakPolarHBondContact O-CB 3.24Å; Y243-A247 PolarHBondContact O-N 3.08Å; Y243-L285 HydrophobicContact CE2-CD1 3.7Å; Y243-L285 HydrophobicContact CE2-CD2 4.3Å; Y243-M343 HydrophobicContact CD1-CE 3.8Å; Y243-M343 HydrophobicContact CD1-SD 4.09Å; Y243-M343 HydrophobicContact CD2-CE 4.28Å; Y243-M343 HydrophobicContact CE1-CE 3.95Å; Y243-M343 HydrophobicContact CE1-CG 4.48Å; Y243-M343 HydrophobicContact CE2-CE 4.43Å; Y243-M343 HydrophobicContact CG-CE 3.98Å; Y243-F480 AromaticContact CD1-CZ 3.84Å; Y243-F480 HydrophobicContact CD1-CZ 3.84Å; Y243-F480 HydrophobicContact CD2-CE1 4.17Å; Y243-F480 AromaticContact CD2-CZ 3.97Å; Y243-F480 HydrophobicContact CD2-CZ 3.97Å; Y243-F480 HydrophobicContact CE1-CE2 4.22Å; Y243-F480 AromaticContact CE1-CZ 3.63Å; Y243-F480 HydrophobicContact CE1-CZ 3.63Å; Y243-F480 AromaticContact CE2-CE1 3.99Å; Y243-F480 HydrophobicContact CE2-CE1 3.99Å; Y243-F480 AromaticContact CE2-CZ 3.74Å; Y243-F480 HydrophobicContact CE2-CZ 3.74Å; Y243-F480 AromaticContact CG-CZ 4Å; Y243-F480 HydrophobicContact CG-CZ 4Å; Y243-F480 AromaticContact CZ-CZ 3.57Å
244	W	97.1	Very high	95	Very high	115 Å²	115	39.4 Å²	39.4	44%	0.436	23%	0.229	S	C	.	.	H	α-helix	trans	-69	-37.9	172.5	-67.4	113	0	0	0	112.6	A201 S204 T240 V241 A247 A248	A201-W244 HydrophobicContact CB-CH2 4Å; A201-W244 HydrophobicContact CB-CZ2 3.95Å; S204-W244 PolarHBondContact OG-NE1 3.37Å; T240-W244 VanDerWaalsContact O-CD1 3.25Å; T240-W244 PolarHBondContact O-N 3.05Å; V241-W244 WeakPolarHBondContact O-CB 3.29Å; V241-W244 PolarHBondContact O-N 3.05Å; W244-A247 WeakPolarHBondContact O-CB 3.25Å; W244-A247 PolarHBondContact O-N 3.38Å; W244-A247 VanDerWaalsContact O-N 3.12Å; W244-A248 PolarHBondContact O-N 3.48Å
245	I	95.7	Very high	94.6	Very high	80 Å²	80	38.1 Å²	38.1	41%	0.41	22%	0.223	S	C	.	.	H	α-helix	trans	-62	-45.9	174.5	-67	169.4	0	0	0	110.1	V241 P242 A247 A248 G249 V281	V241-I245 HydrophobicContact CG1-CD1 3.91Å; V241-I245 HydrophobicContact CG1-CG1 4.32Å; V241-I245 WeakPolarHBondContact O-CG1 3.47Å; V241-I245 PolarHBondContact O-N 3.27Å; P242-I245 PolarHBondContact O-N 3Å; I245-A247 VanDerWaalsContact C-N 3.26Å; I245-A247 PolarHBondContact O-N 3.05Å; I245-A248 PolarHBondContact O-N 3.05Å; I245-G249 PolarHBondContact O-N 3.13Å; I245-V281 HydrophobicContact CB-CG2 4.45Å; I245-V281 HydrophobicContact CD1-CG2 4.11Å; I245-V281 HydrophobicContact CG2-CG2 3.95Å
246	R	95.3	Very high	94	Very high	5 Å²	5	38.4 Å²	38.4	2%	0.019	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-43.2	171.9	172.1	-85.9	165.1	104.4	3.2	111.2	E193 P242 A248 G249 R250 L253 T341 G342 M343	E193-R246 VanDerWaalsContact CD-NH2 3.33Å; E193-R246 IonicContact OE2-CZ 3.39Å; E193-R246 IonicContact OE2-NH2 2.73Å; E193-R246 PolarHBondContact OE2-NH2 3.13Å; P242-R246 PolarHBondContact O-N 3.05Å; R246-A248 VanDerWaalsContact C-N 3.25Å; R246-A248 PolarHBondContact O-N 3.4Å; R246-G249 CarbonylContact O-C 3.55Å; R246-G249 VanDerWaalsContact O-C 3.26Å; R246-G249 PolarHBondContact O-N 3.24Å; R246-G249 VanDerWaalsContact O-N 3.12Å; R246-R250 PolarHBondContact O-N 3.49Å; R246-R250 VanDerWaalsContact O-N 3.08Å; R246-L253 HydrophobicContact CB-CD2 3.78Å; R246-L253 HydrophobicContact CG-CD2 4.46Å; R246-T341 PolarHBondContact NH1-O 3.32Å; R246-T341 PolarHBondContact NH2-O 3.2Å; R246-G342 WeakPolarHBondContact CG-O 2.96Å; R246-M343 HydrophobicContact CB-SD 3.34Å; R246-M343 WeakPolarHBondContact CB-SD 3.41Å; R246-M343 HydrophobicContact CG-CG 4.49Å; R246-M343 HydrophobicContact CG-SD 3.62Å
247	A	95.1	Very high	93.1	Very high	41 Å²	41	39.3 Å²	39.3	34%	0.339	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-35.6	-176.1	0	0	0	0	0	111.7	L197 Y243 W244 I245 G249	L197-A247 HydrophobicContact CD2-CB 3.54Å; Y243-A247 WeakPolarHBondContact O-CB 3.24Å; Y243-A247 PolarHBondContact O-N 3.08Å; W244-A247 WeakPolarHBondContact O-CB 3.25Å; W244-A247 PolarHBondContact O-N 3.38Å; W244-A247 VanDerWaalsContact O-N 3.12Å; I245-A247 VanDerWaalsContact C-N 3.26Å; I245-A247 PolarHBondContact O-N 3.05Å; A247-G249 VanDerWaalsContact C-N 3.31Å
248	A	94.5	Very high	92	Very high	96 Å²	96	40.3 Å²	40.3	79%	0.793	24%	0.243	S	C	*	.	H	α-helix	trans	-71.7	-22.8	176.5	0	0	0	0	0	113.4	W244 I245 R246	W244-A248 PolarHBondContact O-N 3.48Å; I245-A248 PolarHBondContact O-N 3.05Å; R246-A248 VanDerWaalsContact C-N 3.25Å; R246-A248 PolarHBondContact O-N 3.4Å
249	G	91.2	Very high	90.5	Very high	25 Å²	25	41.1 Å²	41.1	26%	0.258	26%	0.256	S	S	.	.			trans	-173.9	88.9	179.9	0	0	0	0	0	113.5	I245 R246 A247 L253	I245-G249 PolarHBondContact O-N 3.13Å; R246-G249 CarbonylContact O-C 3.55Å; R246-G249 VanDerWaalsContact O-C 3.26Å; R246-G249 PolarHBondContact O-N 3.24Å; R246-G249 VanDerWaalsContact O-N 3.12Å; A247-G249 VanDerWaalsContact C-N 3.31Å; G249-L253 PolarHBondContact O-N 3Å
250	R	91.5	Very high	88.6	Confident	62 Å²	62	48.5 Å²	48.5	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-56.7	-55.4	176.3	177.8	-178.4	174.9	140.9	5.5	111.4	R246 A252 L253 T254 E339	R246-R250 PolarHBondContact O-N 3.49Å; R246-R250 VanDerWaalsContact O-N 3.08Å; R250-A252 VanDerWaalsContact C-N 3.34Å; R250-A252 PolarHBondContact O-N 3.26Å; R250-L253 PolarHBondContact O-N 3.32Å; R250-L253 VanDerWaalsContact O-N 3.09Å; R250-T254 PolarHBondContact O-N 3.33Å; R250-T254 PolarHBondContact O-OG1 3.43Å; R250-E339 PolarHBondContact NH2-O 3.33Å
251	E	89.5	Confident	86.5	Confident	120 Å²	120	56.3 Å²	56.3	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-63.1	-41.8	-174.9	-61	-179.6	171	0	0	112.1	H179 L253 T254 C255	H179-E251 IonicContact CE1-OE1 2.78Å; H179-E251 PolarHBondContact CE1-OE1 3.09Å; H179-E251 VanDerWaalsContact CE1-OE1 3.3Å; H179-E251 IonicContact ND1-OE1 2.99Å; E251-L253 PolarHBondContact O-N 2.97Å; E251-T254 PolarHBondContact O-N 2.69Å; E251-C255 WeakPolarHBondContact O-CB 3.41Å; E251-C255 PolarHBondContact O-N 3Å
252	A	88.5	Confident	84.5	Confident	50 Å²	50	61.4 Å²	61.4	41%	0.413	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-23.3	177.8	0	0	0	0	0	113.4	R250 R277	R250-A252 VanDerWaalsContact C-N 3.34Å; R250-A252 PolarHBondContact O-N 3.26Å; A252-R277 WeakPolarHBondContact O-CD 3.24Å; A252-R277 PolarHBondContact O-NH1 3.49Å
253	L	91.2	Very high	82.9	Confident	4 Å²	4	69 Å²	69	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-93.2	-44	178.8	-175.7	63.2	0	0	0	112.1	R246 G249 R250 E251 R277 C278 V281	R246-L253 HydrophobicContact CB-CD2 3.78Å; R246-L253 HydrophobicContact CG-CD2 4.46Å; G249-L253 PolarHBondContact O-N 3Å; R250-L253 PolarHBondContact O-N 3.32Å; R250-L253 VanDerWaalsContact O-N 3.09Å; E251-L253 PolarHBondContact O-N 2.97Å; L253-R277 HydrophobicContact CD1-CB 4.18Å; L253-C278 WeakPolarHBondContact O-CB 3.31Å; L253-V281 HydrophobicContact CD1-CB 3.95Å; L253-V281 HydrophobicContact CD1-CG1 4.43Å; L253-V281 HydrophobicContact CD1-CG2 3.63Å; L253-V281 HydrophobicContact CD2-CG1 4.21Å
254	T	91.4	Very high	81.4	Confident	4 Å²	4	72.5 Å²	72.5	3%	0.025	39%	0.391	C	S	.	.	H	α-helix	trans	-102	-29.3	-168.9	59.3	0	0	0	0	115.5	R250 E251 A269 A337 G342	R250-T254 PolarHBondContact O-N 3.33Å; R250-T254 PolarHBondContact O-OG1 3.43Å; E251-T254 PolarHBondContact O-N 2.69Å; T254-A269 WeakPolarHBondContact O-CB 3.43Å; T254-A269 PolarHBondContact O-N 3.38Å; T254-A337 HydrophobicContact CG2-CB 4.07Å; T254-G342 WeakPolarHBondContact CG2-O 3.23Å
255	C	89.3	Confident	80.4	Confident	15 Å²	15	71.3 Å²	71.3	10%	0.101	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.2	-171.9	-55.6	0	0	0	0	110.8	C178 E251 Y266	C178-C255 HydrophobicContact CB-CB 3.78Å; C178-C255 WeakPolarHBondContact CB-SG 3.38Å; C178-C255 WeakPolarHBondContact SG-CA 3.48Å; C178-C255 WeakPolarHBondContact SG-CB 3.45Å; C178-C255 CovalentContact SG-SG 2.03Å; C178-C255 PolarHBondContact SG-SG 3.26Å; E251-C255 WeakPolarHBondContact O-CB 3.41Å; E251-C255 PolarHBondContact O-N 3Å; C255-Y266 HydrophobicContact CB-CD1 4.31Å
256	S	85.1	Confident	79.8	Confident	7 Å²	7	72.8 Å²	72.8	5%	0.049	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.1	175.3	-175.6	0	0	0	0	110.2	Y258 Y266 V267 H275	S256-Y258 PolarHBondContact O-N 2.87Å; S256-Y266 CarbonylContact O-C 3.51Å; S256-Y266 VanDerWaalsContact O-CA 3.28Å; S256-Y266 WeakPolarHBondContact O-CA 3.08Å; S256-V267 PolarHBondContact N-O 3.49Å; S256-V267 PolarHBondContact O-N 2.98Å; S256-H275 WeakPolarHBondContact CA-NE2 3.41Å; S256-H275 VanDerWaalsContact CB-CD2 3.41Å; S256-H275 WeakPolarHBondContact CB-CD2 3.41Å; S256-H275 WeakPolarHBondContact CB-NE2 3.28Å; S256-H275 PolarHBondContact OG-CD2 2.81Å; S256-H275 VanDerWaalsContact OG-CD2 3.27Å; S256-H275 PolarHBondContact OG-NE2 3.23Å
257	G	80.1	Confident	79.4	Confident	43 Å²	43	72.6 Å²	72.6	44%	0.443	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	115.6	168.8	0	0	0	0	0	110
258	Y	74	Confident	79	Confident	36 Å²	36	70.9 Å²	70.9	14%	0.141	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.9	175.2	-179.5	-94.5	0	0	0	109.4	V165 L167 N168 K169 S256 Q265	V165-Y258 HydrophobicContact CG1-CD1 4.09Å; V165-Y258 HydrophobicContact CG1-CE1 4.08Å; L167-Y258 HydrophobicContact CD2-CD1 3.8Å; L167-Y258 HydrophobicContact CD2-CD2 3.62Å; L167-Y258 HydrophobicContact CD2-CE1 3.76Å; L167-Y258 HydrophobicContact CD2-CE2 3.58Å; L167-Y258 HydrophobicContact CD2-CG 3.74Å; N168-Y258 PolarHBondContact N-OH 3.38Å; K169-Y258 HydrophobicContact CD-CE2 4.48Å; S256-Y258 PolarHBondContact O-N 2.87Å; Y258-Q265 PolarHBondContact N-O 3.34Å; Y258-Q265 PolarHBondContact O-N 3.49Å
259	G	66.3	Low	78.6	Confident	47 Å²	47	66.3 Å²	66.3	49%	0.485	34%	0.338	S	S	.	.	S	Bend	trans	137.5	172.1	179.6	0	0	0	0	0	112.9
260	Y	56.6	Low	78.1	Confident	163 Å²	163	65.2 Å²	65.2	64%	0.639	33%	0.327	S	S	*	.			trans	-78.3	161.5	175.5	-165.9	-104.3	0	0	0	110.6	Q262 Q263 Q264	Y260-Q262 PolarHBondContact O-N 3.18Å; Y260-Q263 CarbonylContact O-C 3.53Å; Y260-Q263 PolarHBondContact O-N 3.49Å; Y260-Q264 PolarHBondContact O-N 2.99Å
261	H	54.3	Low	77.1	Confident	167 Å²	167	64.9 Å²	64.9	77%	0.773	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-19.4	-172	-113	-73.9	0	0	0	116.2
262	Q	55.2	Low	75.9	Confident	181 Å²	181	60.7 Å²	60.7	85%	0.846	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-6.9	179.1	-69.9	-177.9	-19	0	0	114.6	Y260	Y260-Q262 PolarHBondContact O-N 3.18Å
263	Q	61.2	Low	74.8	Confident	159 Å²	159	59.8 Å²	59.8	74%	0.743	30%	0.304	S	S	*	.	S	Bend	trans	-141.3	56.8	178.9	-74.9	-179	-25.2	0	0	110.4	Y260 Q265	Y260-Q263 CarbonylContact O-C 3.53Å; Y260-Q263 PolarHBondContact O-N 3.49Å; Q263-Q265 PolarHBondContact O-N 3.37Å
264	Q	67.2	Low	73.5	Confident	102 Å²	102	66.1 Å²	66.1	48%	0.477	33%	0.334	S	S	.	.			trans	-72.6	113.4	173.4	-76	-172.6	-32.7	0	0	109.9	Y260	Y260-Q264 PolarHBondContact O-N 2.99Å
265	Q	74.9	Confident	73.1	Confident	90 Å²	90	68.2 Å²	68.2	42%	0.421	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.5	169.8	-67.5	178.2	-31	0	0	108.8	L177 Y258 Q263	L177-Q265 HydrophobicContact CD2-CB 4.17Å; Y258-Q265 PolarHBondContact N-O 3.34Å; Y258-Q265 PolarHBondContact O-N 3.49Å; Q263-Q265 PolarHBondContact O-N 3.37Å
266	Y	84.2	Confident	73	Confident	112 Å²	112	72.6 Å²	72.6	44%	0.439	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.9	176.1	-67.9	-83.8	0	0	0	109.4	C178 C255 S256	C178-Y266 PolarHBondContact N-O 3.01Å; C255-Y266 HydrophobicContact CB-CD1 4.31Å; S256-Y266 CarbonylContact O-C 3.51Å; S256-Y266 VanDerWaalsContact O-CA 3.28Å; S256-Y266 WeakPolarHBondContact O-CA 3.08Å
267	V	85.3	Confident	73.3	Confident	0 Å²	0	80 Å²	80	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	153.7	177.4	-61.1	0	0	0	0	110.5	V165 A175 Q176 S256 A269 L273	V165-V267 HydrophobicContact CB-CG1 4.19Å; V165-V267 HydrophobicContact CG2-CG1 4.25Å; A175-V267 HydrophobicContact CB-CB 4.26Å; A175-V267 HydrophobicContact CB-CG1 4.47Å; Q176-V267 WeakPolarHBondContact O-CA 3.44Å; S256-V267 PolarHBondContact N-O 3.49Å; S256-V267 PolarHBondContact O-N 2.98Å; V267-A269 PolarHBondContact O-N 2.86Å; V267-L273 HydrophobicContact CG2-CD1 4.01Å
268	I	87.1	Confident	73.9	Confident	5 Å²	5	78.1 Å²	78.1	3%	0.026	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	131	173.4	-62.2	-175.9	0	0	0	109	Q176 C178 G270 A337 E339 Q349	Q176-I268 HydrophobicContact CB-CD1 4.16Å; Q176-I268 HydrophobicContact CB-CG1 4.5Å; Q176-I268 PolarHBondContact O-N 3.46Å; C178-I268 HydrophobicContact CB-CG1 4.34Å; I268-G270 PolarHBondContact O-N 2.98Å; I268-A337 HydrophobicContact CG2-CB 3.37Å; I268-A337 WeakPolarHBondContact CG2-O 3.27Å; I268-E339 HydrophobicContact CD1-CB 3.92Å; I268-E339 HydrophobicContact CD1-CG 4.09Å; I268-Q349 VanDerWaalsContact CG2-NE2 3.31Å
269	A	85.8	Confident	74.7	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.008	38%	0.378	C	S	.	.	S	Bend	trans	-57.8	133.4	178	0	0	0	0	0	111.3	T254 V267 H275 C278 A337	T254-A269 WeakPolarHBondContact O-CB 3.43Å; T254-A269 PolarHBondContact O-N 3.38Å; V267-A269 PolarHBondContact O-N 2.86Å; A269-H275 HydrophobicContact CB-CB 4.05Å; A269-C278 HydrophobicContact CB-CB 4.26Å; A269-A337 HydrophobicContact CB-CB 4.27Å; A269-A337 WeakPolarHBondContact O-CB 3.46Å; A269-A337 PolarHBondContact O-N 2.87Å
270	G	82.3	Confident	75.9	Confident	2 Å²	2	79.9 Å²	79.9	2%	0.021	38%	0.381	C	S	.	.			trans	165.5	-176.4	-178.4	0	0	0	0	0	111.2	I268 G272 L273 D336	I268-G270 PolarHBondContact O-N 2.98Å; G270-G272 VanDerWaalsContact C-N 3.25Å; G270-G272 PolarHBondContact O-N 3.4Å; G270-L273 WeakPolarHBondContact O-CB 3.4Å; G270-L273 PolarHBondContact O-N 3.37Å; G270-D336 VanDerWaalsContact CA-OD1 3.22Å; G270-D336 WeakPolarHBondContact CA-OD1 3.36Å
271	F	70	Confident	77.7	Confident	54 Å²	54	72.4 Å²	72.4	24%	0.237	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	33.9	173.8	-55.7	-72.7	0	0	0	114.6	L167 T170 Q173 A175 L273 D336 Q349	L167-F271 HydrophobicContact CD1-CB 4.41Å; L167-F271 HydrophobicContact CD1-CD2 4.37Å; T170-F271 HydrophobicContact CG2-CB 4.36Å; T170-F271 WeakPolarHBondContact CG2-O 3.47Å; Q173-F271 HydrophobicContact CB-CD1 4.44Å; A175-F271 HydrophobicContact CB-CD2 4.31Å; A175-F271 HydrophobicContact CB-CE2 4.28Å; F271-L273 VanDerWaalsContact C-N 3.25Å; F271-L273 PolarHBondContact O-N 3.32Å; F271-D336 PolarHBondContact N-OD1 3.37Å; F271-D336 VanDerWaalsContact N-OD1 3.14Å; F271-Q349 HydrophobicContact CZ-CB 4.33Å
272	G	63.3	Low	79.6	Confident	33 Å²	33	64.5 Å²	64.5	34%	0.34	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	1.8	-178.7	0	0	0	0	0	115.1	G270 Q274	G270-G272 VanDerWaalsContact C-N 3.25Å; G270-G272 PolarHBondContact O-N 3.4Å; G272-Q274 PolarHBondContact O-N 3.05Å
273	L	66.1	Low	81.4	Confident	30 Å²	30	58 Å²	58	16%	0.157	29%	0.286	C	S	.	.			trans	-67	98.5	165	-66.8	173.4	0	0	0	108.4	L167 V267 G270 F271 H275	L167-L273 HydrophobicContact CD1-CD1 3.75Å; L167-L273 HydrophobicContact CD1-CG 4.4Å; L167-L273 HydrophobicContact CD2-CD1 4.18Å; V267-L273 HydrophobicContact CG2-CD1 4.01Å; G270-L273 WeakPolarHBondContact O-CB 3.4Å; G270-L273 PolarHBondContact O-N 3.37Å; F271-L273 VanDerWaalsContact C-N 3.25Å; F271-L273 PolarHBondContact O-N 3.32Å; L273-H275 PolarHBondContact O-N 3.34Å
274	Q	64.1	Low	82.9	Confident	138 Å²	138	52.2 Å²	52.2	65%	0.645	26%	0.263	S	S	*	.			trans	-70	88.7	-174.1	-68.7	-168.9	-6.4	0	0	112	G272 V276	G272-Q274 PolarHBondContact O-N 3.05Å; Q274-V276 PolarHBondContact O-N 2.66Å
275	H	82.5	Confident	84.3	Confident	48 Å²	48	47.7 Å²	47.7	22%	0.222	24%	0.243	C	C	.	.			trans	-83.5	103.8	160.6	-89.8	-91.4	0	0	0	109.4	S256 A269 L273 R277 C278 T279	S256-H275 WeakPolarHBondContact CA-NE2 3.41Å; S256-H275 VanDerWaalsContact CB-CD2 3.41Å; S256-H275 WeakPolarHBondContact CB-CD2 3.41Å; S256-H275 WeakPolarHBondContact CB-NE2 3.28Å; S256-H275 PolarHBondContact OG-CD2 2.81Å; S256-H275 VanDerWaalsContact OG-CD2 3.27Å; S256-H275 PolarHBondContact OG-NE2 3.23Å; A269-H275 HydrophobicContact CB-CB 4.05Å; L273-H275 PolarHBondContact O-N 3.34Å; H275-R277 VanDerWaalsContact C-N 3.25Å; H275-R277 PolarHBondContact O-N 3.21Å; H275-C278 HydrophobicContact CB-CB 3.6Å; H275-C278 WeakPolarHBondContact O-CB 3.47Å; H275-C278 PolarHBondContact O-N 2.93Å; H275-C278 VanDerWaalsContact O-N 3.16Å; H275-T279 WeakPolarHBondContact O-CB 3.44Å; H275-T279 PolarHBondContact O-N 3.1Å; H275-T279 PolarHBondContact O-OG1 2.87Å
276	V	87.8	Confident	85.3	Confident	106 Å²	106	43.5 Å²	43.5	64%	0.642	22%	0.223	S	C	*	.	H	α-helix	trans	-52.9	-45	-179	179.8	0	0	0	0	111	Q274 T279 V280	Q274-V276 PolarHBondContact O-N 2.66Å; V276-T279 PolarHBondContact O-N 2.88Å; V276-V280 HydrophobicContact CG1-CG2 4.31Å; V276-V280 WeakPolarHBondContact O-CB 3.25Å; V276-V280 VanDerWaalsContact O-CG2 3.27Å; V276-V280 WeakPolarHBondContact O-CG2 3.39Å; V276-V280 PolarHBondContact O-N 3.4Å
277	R	90.8	Very high	85.9	Confident	163 Å²	163	40.4 Å²	40.4	62%	0.615	21%	0.211	S	C	*	.	H	α-helix	trans	-62.9	-48	179.9	-57.3	-179.5	-162.4	165.4	0.8	112.2	A252 L253 H275 T279 V280 V281	A252-R277 WeakPolarHBondContact O-CD 3.24Å; A252-R277 PolarHBondContact O-NH1 3.49Å; L253-R277 HydrophobicContact CD1-CB 4.18Å; H275-R277 VanDerWaalsContact C-N 3.25Å; H275-R277 PolarHBondContact O-N 3.21Å; R277-T279 VanDerWaalsContact C-N 3.3Å; R277-T279 PolarHBondContact O-N 3.29Å; R277-V280 PolarHBondContact O-N 2.86Å; R277-V281 WeakPolarHBondContact O-CG2 3.47Å; R277-V281 PolarHBondContact O-N 3.36Å; R277-V281 VanDerWaalsContact O-N 3.09Å
278	C	92.8	Very high	86.5	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-58.1	-44.6	177.1	-175.1	0	0	0	0	111.4	L253 A269 H275 S282 C344	L253-C278 WeakPolarHBondContact O-CB 3.31Å; A269-C278 HydrophobicContact CB-CB 4.26Å; H275-C278 HydrophobicContact CB-CB 3.6Å; H275-C278 WeakPolarHBondContact O-CB 3.47Å; H275-C278 PolarHBondContact O-N 2.93Å; H275-C278 VanDerWaalsContact O-N 3.16Å; C278-S282 VanDerWaalsContact O-CB 3.27Å; C278-S282 WeakPolarHBondContact O-CB 3.32Å; C278-S282 PolarHBondContact O-N 3.44Å; C278-C344 WeakPolarHBondContact CA-SG 2.97Å; C278-C344 HydrophobicContact CB-CB 3.97Å; C278-C344 WeakPolarHBondContact CB-SG 3.43Å; C278-C344 WeakPolarHBondContact O-CB 3.46Å; C278-C344 WeakPolarHBondContact SG-CB 3.4Å; C278-C344 CovalentContact SG-SG 2.02Å; C278-C344 PolarHBondContact SG-SG 2.98Å
279	T	91.1	Very high	86.9	Confident	29 Å²	29	43.7 Å²	43.7	18%	0.178	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-48.4	-179.8	-55.2	0	0	0	0	111.8	H275 V276 R277 V281 S282 I283 F330	H275-T279 WeakPolarHBondContact O-CB 3.44Å; H275-T279 PolarHBondContact O-N 3.1Å; H275-T279 PolarHBondContact O-OG1 2.87Å; V276-T279 PolarHBondContact O-N 2.88Å; R277-T279 VanDerWaalsContact C-N 3.3Å; R277-T279 PolarHBondContact O-N 3.29Å; T279-V281 PolarHBondContact O-N 3.42Å; T279-S282 PolarHBondContact O-N 3.01Å; T279-I283 HydrophobicContact CG2-CD1 3.67Å; T279-I283 HydrophobicContact CG2-CG1 4.34Å; T279-I283 WeakPolarHBondContact O-CB 3.45Å; T279-I283 VanDerWaalsContact O-CG1 3.28Å; T279-I283 WeakPolarHBondContact O-CG1 3.46Å; T279-I283 PolarHBondContact O-N 3.27Å; T279-F330 HydrophobicContact CG2-CD2 4.29Å; T279-F330 HydrophobicContact CG2-CE2 4.2Å
280	V	91.8	Very high	87.4	Confident	91 Å²	91	43.6 Å²	43.6	55%	0.552	23%	0.227	S	C	*	.	H	α-helix	trans	-60.6	-44.6	179.6	168.9	0	0	0	0	111.5	V276 R277 S284	V276-V280 HydrophobicContact CG1-CG2 4.31Å; V276-V280 WeakPolarHBondContact O-CB 3.25Å; V276-V280 VanDerWaalsContact O-CG2 3.27Å; V276-V280 WeakPolarHBondContact O-CG2 3.39Å; V276-V280 PolarHBondContact O-N 3.4Å; R277-V280 PolarHBondContact O-N 2.86Å; V280-S284 WeakPolarHBondContact O-CB 3.49Å; V280-S284 PolarHBondContact O-N 2.93Å
281	V	94	Very high	88.1	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-44.1	178.8	173.3	0	0	0	0	111.3	P242 I245 L253 R277 T279 S284 L285	P242-V281 HydrophobicContact CB-CG1 3.54Å; P242-V281 HydrophobicContact CG-CG1 4.13Å; I245-V281 HydrophobicContact CB-CG2 4.45Å; I245-V281 HydrophobicContact CD1-CG2 4.11Å; I245-V281 HydrophobicContact CG2-CG2 3.95Å; L253-V281 HydrophobicContact CD1-CB 3.95Å; L253-V281 HydrophobicContact CD1-CG1 4.43Å; L253-V281 HydrophobicContact CD1-CG2 3.63Å; L253-V281 HydrophobicContact CD2-CG1 4.21Å; R277-V281 WeakPolarHBondContact O-CG2 3.47Å; R277-V281 PolarHBondContact O-N 3.36Å; R277-V281 VanDerWaalsContact O-N 3.09Å; T279-V281 PolarHBondContact O-N 3.42Å; V281-S284 PolarHBondContact O-N 3.2Å; V281-L285 WeakPolarHBondContact O-CB 3.41Å; V281-L285 PolarHBondContact O-N 2.93Å
282	S	94	Very high	89.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-47.3	176.4	178.7	0	0	0	0	112.1	C278 T279 S284 L285 Y286 V335 C344 F345	C278-S282 VanDerWaalsContact O-CB 3.27Å; C278-S282 WeakPolarHBondContact O-CB 3.32Å; C278-S282 PolarHBondContact O-N 3.44Å; T279-S282 PolarHBondContact O-N 3.01Å; S282-S284 PolarHBondContact O-N 3.34Å; S282-L285 PolarHBondContact O-N 3.47Å; S282-Y286 VanDerWaalsContact O-CB 3.24Å; S282-Y286 WeakPolarHBondContact O-CB 3.48Å; S282-Y286 PolarHBondContact O-N 3.08Å; S282-V335 VanDerWaalsContact CB-CG1 3.5Å; S282-V335 WeakPolarHBondContact OG-CG1 3.34Å; S282-C344 WeakPolarHBondContact CA-O 3.4Å; S282-C344 WeakPolarHBondContact CB-O 3.36Å; S282-F345 WeakPolarHBondContact OG-CA 3.23Å
283	I	92.6	Very high	91.1	Very high	44 Å²	44	40 Å²	40	23%	0.226	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-47.3	178.9	-73.7	170.8	0	0	0	110.9	T279 Y286 Y287 V326 F330	T279-I283 HydrophobicContact CG2-CD1 3.67Å; T279-I283 HydrophobicContact CG2-CG1 4.34Å; T279-I283 WeakPolarHBondContact O-CB 3.45Å; T279-I283 VanDerWaalsContact O-CG1 3.28Å; T279-I283 WeakPolarHBondContact O-CG1 3.46Å; T279-I283 PolarHBondContact O-N 3.27Å; I283-Y286 PolarHBondContact O-N 3.21Å; I283-Y287 VanDerWaalsContact O-CB 3.29Å; I283-Y287 WeakPolarHBondContact O-CB 3.44Å; I283-Y287 PolarHBondContact O-N 3.32Å; I283-V326 HydrophobicContact CB-CG1 4.5Å; I283-V326 HydrophobicContact CG1-CG1 4.35Å; I283-V326 HydrophobicContact CG2-CG1 3.53Å; I283-V326 HydrophobicContact CG2-CG2 4.34Å; I283-F330 HydrophobicContact CD1-CD2 4Å
284	S	94.2	Very high	92.5	Very high	38 Å²	38	38.8 Å²	38.8	27%	0.266	20%	0.196	S	C	.	.	H	α-helix	trans	-59.1	-50.8	178	-179.5	0	0	0	0	110.9	V280 V281 S282 Y286 Y287 F288	V280-S284 WeakPolarHBondContact O-CB 3.49Å; V280-S284 PolarHBondContact O-N 2.93Å; V281-S284 PolarHBondContact O-N 3.2Å; S282-S284 PolarHBondContact O-N 3.34Å; S284-Y286 PolarHBondContact O-N 2.85Å; S284-Y287 PolarHBondContact O-N 2.69Å; S284-F288 WeakPolarHBondContact O-CD2 3.35Å; S284-F288 PolarHBondContact O-N 3.49Å; S284-F288 VanDerWaalsContact O-N 3.14Å
285	L	95.8	Very high	94.1	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-58.8	-46.4	178.5	-175.9	55.6	0	0	0	111.7	A239 P242 Y243 V281 S282 T289 M343 F345	A239-L285 HydrophobicContact CB-CD1 4.03Å; A239-L285 WeakPolarHBondContact O-CD1 3.37Å; P242-L285 HydrophobicContact CB-CB 4.21Å; P242-L285 HydrophobicContact CB-CD1 4.48Å; P242-L285 HydrophobicContact CG-CB 3.88Å; P242-L285 HydrophobicContact CG-CD1 4.41Å; Y243-L285 HydrophobicContact CE2-CD1 3.7Å; Y243-L285 HydrophobicContact CE2-CD2 4.3Å; V281-L285 WeakPolarHBondContact O-CB 3.41Å; V281-L285 PolarHBondContact O-N 2.93Å; S282-L285 PolarHBondContact O-N 3.47Å; L285-T289 VanDerWaalsContact O-CB 3.26Å; L285-T289 WeakPolarHBondContact O-CB 3.37Å; L285-T289 PolarHBondContact O-N 3.13Å; L285-T289 PolarHBondContact O-OG1 3.22Å; L285-M343 HydrophobicContact CD2-CE 4.09Å; L285-F345 HydrophobicContact CB-CD2 4.25Å; L285-F345 HydrophobicContact CB-CE2 4.07Å; L285-F345 HydrophobicContact CD2-CD2 3.65Å; L285-F345 HydrophobicContact CD2-CE2 3.85Å; L285-F345 HydrophobicContact CG-CD2 3.92Å; L285-F345 HydrophobicContact CG-CE2 3.62Å
286	Y	95.5	Very high	94.8	Very high	3 Å²	3	30 Å²	30	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-44.7	-179.1	-175.5	-92.5	0	0	0	111.7	S282 I283 S284 T289 M290 K325 V326 V329 F345 V346 F356 L357	S282-Y286 VanDerWaalsContact O-CB 3.24Å; S282-Y286 WeakPolarHBondContact O-CB 3.48Å; S282-Y286 PolarHBondContact O-N 3.08Å; I283-Y286 PolarHBondContact O-N 3.21Å; S284-Y286 PolarHBondContact O-N 2.85Å; Y286-T289 PolarHBondContact O-N 3.45Å; Y286-M290 HydrophobicContact CD1-CG 4.04Å; Y286-M290 HydrophobicContact CD2-CE 4.18Å; Y286-M290 HydrophobicContact CE1-CG 3.7Å; Y286-M290 HydrophobicContact CE2-CE 3.6Å; Y286-M290 HydrophobicContact CE2-CG 4.32Å; Y286-M290 HydrophobicContact CG-CG 4.47Å; Y286-M290 WeakPolarHBondContact O-CB 3.42Å; Y286-M290 VanDerWaalsContact O-CG 3.25Å; Y286-M290 WeakPolarHBondContact O-CG 3.2Å; Y286-M290 PolarHBondContact O-N 3.22Å; Y286-K325 HydrophobicContact CE1-CB 3.74Å; Y286-V326 HydrophobicContact CD1-CG2 3.92Å; Y286-V329 HydrophobicContact CE1-CG2 3.97Å; Y286-V329 HydrophobicContact CE2-CG2 4.33Å; Y286-F345 HydrophobicContact CD2-CE2 4.28Å; Y286-F345 HydrophobicContact CD2-CZ 4.06Å; Y286-V346 HydrophobicContact CD2-CB 4.3Å; Y286-V346 HydrophobicContact CD2-CG2 3.84Å; Y286-V346 HydrophobicContact CE2-CB 4.48Å; Y286-V346 HydrophobicContact CE2-CG2 4.29Å; Y286-V346 HydrophobicContact CG-CG2 4.24Å; Y286-F356 PolarHBondContact OH-O 3.35Å; Y286-F356 VanDerWaalsContact OH-O 3.13Å; Y286-L357 HydrophobicContact CE2-CD1 4.18Å
287	Y	97.2	Very high	95.2	Very high	47 Å²	47	26.6 Å²	26.6	18%	0.184	13%	0.133	C	C	.	.	H	α-helix	trans	-58.4	-54	179	-178.8	-102.3	0	0	0	112.1	I283 S284 T289 M290 A291 W319 P322 L323 V326	I283-Y287 VanDerWaalsContact O-CB 3.29Å; I283-Y287 WeakPolarHBondContact O-CB 3.44Å; I283-Y287 PolarHBondContact O-N 3.32Å; S284-Y287 PolarHBondContact O-N 2.69Å; Y287-T289 VanDerWaalsContact C-N 3.33Å; Y287-T289 PolarHBondContact O-N 3.31Å; Y287-M290 PolarHBondContact O-N 3.43Å; Y287-A291 WeakPolarHBondContact O-CB 3.34Å; Y287-A291 PolarHBondContact O-N 3.05Å; Y287-W319 HydrophobicContact CE1-CE3 4.09Å; Y287-W319 HydrophobicContact CE1-CZ3 4.21Å; Y287-W319 PolarHBondContact OH-O 3.21Å; Y287-P322 HydrophobicContact CD2-CB 3.72Å; Y287-P322 HydrophobicContact CE2-CB 3.72Å; Y287-L323 HydrophobicContact CE2-CB 4.05Å; Y287-V326 HydrophobicContact CD2-CG2 3.95Å; Y287-V326 HydrophobicContact CG-CG2 4.41Å
288	F	97.5	Very high	95.3	Very high	45 Å²	45	19.4 Å²	19.4	20%	0.197	11%	0.106	C	C	.	.	H	α-helix	trans	-69.1	-33.1	-177.4	-70	-62.8	0	0	0	112.5	C235 S238 A239 S284 A291 S292	C235-F288 WeakPolarHBondContact CB-O 3.06Å; S238-F288 VanDerWaalsContact CB-CD2 3.49Å; A239-F288 HydrophobicContact CB-CB 4.08Å; S284-F288 WeakPolarHBondContact O-CD2 3.35Å; S284-F288 PolarHBondContact O-N 3.49Å; S284-F288 VanDerWaalsContact O-N 3.14Å; F288-A291 PolarHBondContact O-N 3.23Å; F288-S292 WeakPolarHBondContact O-CB 3.27Å; F288-S292 PolarHBondContact O-N 3.24Å
289	T	96.1	Very high	95.3	Very high	28 Å²	28	19.2 Å²	19.2	17%	0.172	11%	0.105	C	C	.	.	H	α-helix	trans	-60.6	-54.3	170.7	-58.9	0	0	0	0	109.8	L285 Y286 Y287 A291 S292 H293	L285-T289 VanDerWaalsContact O-CB 3.26Å; L285-T289 WeakPolarHBondContact O-CB 3.37Å; L285-T289 PolarHBondContact O-N 3.13Å; L285-T289 PolarHBondContact O-OG1 3.22Å; Y286-T289 PolarHBondContact O-N 3.45Å; Y287-T289 VanDerWaalsContact C-N 3.33Å; Y287-T289 PolarHBondContact O-N 3.31Å; T289-A291 VanDerWaalsContact C-N 3.33Å; T289-A291 PolarHBondContact O-N 3.38Å; T289-S292 WeakPolarHBondContact O-CB 3.44Å; T289-S292 PolarHBondContact O-N 3.42Å; T289-S292 VanDerWaalsContact O-N 3.11Å; T289-S292 PolarHBondContact O-OG 3.36Å; T289-H293 WeakPolarHBondContact CG2-NE2 3.31Å; T289-H293 PolarHBondContact O-CD2 3.3Å; T289-H293 PolarHBondContact O-N 2.87Å
290	M	96.3	Very high	95.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.8	-41.1	178	-69.8	-60.8	143.7	0	0	113.1	Y286 Y287 H293 V294 P322 K325 Q361 Y364	Y286-M290 HydrophobicContact CD1-CG 4.04Å; Y286-M290 HydrophobicContact CD2-CE 4.18Å; Y286-M290 HydrophobicContact CE1-CG 3.7Å; Y286-M290 HydrophobicContact CE2-CE 3.6Å; Y286-M290 HydrophobicContact CE2-CG 4.32Å; Y286-M290 HydrophobicContact CG-CG 4.47Å; Y286-M290 WeakPolarHBondContact O-CB 3.42Å; Y286-M290 VanDerWaalsContact O-CG 3.25Å; Y286-M290 WeakPolarHBondContact O-CG 3.2Å; Y286-M290 PolarHBondContact O-N 3.22Å; Y287-M290 PolarHBondContact O-N 3.43Å; M290-H293 PolarHBondContact O-N 3.36Å; M290-V294 PolarHBondContact O-N 2.94Å; M290-P322 HydrophobicContact CB-CB 3.79Å; M290-P322 HydrophobicContact CB-CG 4.16Å; M290-K325 HydrophobicContact CG-CD 4.08Å; M290-K325 HydrophobicContact SD-CD 3.9Å; M290-K325 PolarHBondContact SD-NZ 3.49Å; M290-Q361 HydrophobicContact CE-CG 3.89Å; M290-Y364 HydrophobicContact SD-CE2 3.98Å
291	A	97.7	Very high	95.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.5	-41.1	176.3	0	0	0	0	0	112.2	Y287 F288 T289 H293 V294 W295 W319 P322	Y287-A291 WeakPolarHBondContact O-CB 3.34Å; Y287-A291 PolarHBondContact O-N 3.05Å; F288-A291 PolarHBondContact O-N 3.23Å; T289-A291 VanDerWaalsContact C-N 3.33Å; T289-A291 PolarHBondContact O-N 3.38Å; A291-H293 VanDerWaalsContact C-N 3.31Å; A291-H293 PolarHBondContact O-N 2.93Å; A291-V294 PolarHBondContact O-N 3.27Å; A291-V294 VanDerWaalsContact O-N 3.15Å; A291-W295 VanDerWaalsContact O-CD1 3.24Å; A291-W295 PolarHBondContact O-N 3.22Å; A291-W319 HydrophobicContact CB-CE3 4.01Å; A291-W319 HydrophobicContact CB-CZ3 3.64Å; A291-P322 VanDerWaalsContact CA-CG 3.48Å; A291-P322 HydrophobicContact CB-CB 4.38Å; A291-P322 HydrophobicContact CB-CG 3.86Å
292	S	97.4	Very high	95.1	Very high	5 Å²	5	14.6 Å²	14.6	4%	0.035	8%	0.079	C	C	.	.	H	α-helix	trans	-59.9	-39.3	178.4	77	0	0	0	0	112.8	F288 T289 W295 W296	F288-S292 WeakPolarHBondContact O-CB 3.27Å; F288-S292 PolarHBondContact O-N 3.24Å; T289-S292 WeakPolarHBondContact O-CB 3.44Å; T289-S292 PolarHBondContact O-N 3.42Å; T289-S292 VanDerWaalsContact O-N 3.11Å; T289-S292 PolarHBondContact O-OG 3.36Å; S292-W295 PolarHBondContact O-N 3.33Å; S292-W296 PolarHBondContact O-N 3.01Å
293	H	97.3	Very high	94.7	Very high	7 Å²	7	15.5 Å²	15.5	3%	0.032	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-41.4	176.1	-62.8	-79.6	0	0	0	111.5	T289 M290 A291 W296 I297 Y364 Y438 H442	T289-H293 WeakPolarHBondContact CG2-NE2 3.31Å; T289-H293 PolarHBondContact O-CD2 3.3Å; T289-H293 PolarHBondContact O-N 2.87Å; M290-H293 PolarHBondContact O-N 3.36Å; A291-H293 VanDerWaalsContact C-N 3.31Å; A291-H293 PolarHBondContact O-N 2.93Å; H293-W296 WeakPolarHBondContact O-CB 3.46Å; H293-W296 PolarHBondContact O-N 2.9Å; H293-I297 WeakPolarHBondContact O-CG1 3.35Å; H293-I297 PolarHBondContact O-N 2.89Å; H293-Y364 HydrophobicContact CB-CD2 3.32Å; H293-Y364 HydrophobicContact CB-CE2 3.9Å; H293-Y364 HydrophobicContact CB-CG 4.06Å; H293-Y364 AromaticContact CG-CD2 3.87Å; H293-Y438 PolarHBondContact CE1-OH 3.44Å; H293-Y438 AromaticContact ND1-CZ 3.88Å; H293-Y438 PolarHBondContact ND1-OH 3.43Å; H293-H442 AromaticContact CE1-CD2 3.32Å; H293-H442 PolarHBondContact CE1-CD2 3.39Å; H293-H442 AromaticContact CE1-NE2 3.05Å; H293-H442 PolarHBondContact CE1-NE2 2.91Å; H293-H442 AromaticContact ND1-CD2 3.59Å; H293-H442 AromaticContact ND1-NE2 3.24Å; H293-H442 PolarHBondContact ND1-NE2 3.48Å
294	V	96.8	Very high	94.3	Very high	5 Å²	5	14 Å²	14	3%	0.03	8%	0.08	C	C	.	.	H	α-helix	trans	-67.8	-40.6	178.7	-176	0	0	0	0	110.8	M290 A291 W296 I297 I298 V317 A318 P322 Y364	M290-V294 PolarHBondContact O-N 2.94Å; A291-V294 PolarHBondContact O-N 3.27Å; A291-V294 VanDerWaalsContact O-N 3.15Å; V294-W296 VanDerWaalsContact C-N 3.28Å; V294-W296 PolarHBondContact O-N 3.24Å; V294-I297 PolarHBondContact O-N 2.94Å; V294-I298 HydrophobicContact CG1-CD1 4.23Å; V294-I298 WeakPolarHBondContact O-CG1 3Å; V294-I298 PolarHBondContact O-N 3.48Å; V294-V317 HydrophobicContact CG1-CG1 4.01Å; V294-A318 HydrophobicContact CG1-CB 4.12Å; V294-P322 HydrophobicContact CG2-CG 4.46Å; V294-Y364 HydrophobicContact CG2-CE1 4.2Å; V294-Y364 HydrophobicContact CG2-CE2 3.96Å
295	W	97.3	Very high	93.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-34.3	172.2	-78.8	114.7	0	0	0	113	A228 Y231 I232 A291 S292 I298 L299 H315 A318 W319	A228-W295 HydrophobicContact CB-CE3 4.11Å; Y231-W295 VanDerWaalsContact CB-CE2 3.42Å; Y231-W295 HydrophobicContact CD1-CZ2 4.02Å; Y231-W295 HydrophobicContact CD2-CD2 4.5Å; Y231-W295 HydrophobicContact CD2-CE3 4.32Å; Y231-W295 AromaticContact CD2-CH2 3.62Å; Y231-W295 HydrophobicContact CD2-CH2 3.62Å; Y231-W295 AromaticContact CD2-CZ2 3.79Å; Y231-W295 HydrophobicContact CD2-CZ2 3.79Å; Y231-W295 AromaticContact CD2-CZ3 3.89Å; Y231-W295 HydrophobicContact CD2-CZ3 3.89Å; Y231-W295 HydrophobicContact CE2-CH2 4.12Å; Y231-W295 HydrophobicContact CE2-CZ2 4.41Å; Y231-W295 HydrophobicContact CG-CD2 4.19Å; Y231-W295 AromaticContact CG-CE2 3.73Å; Y231-W295 HydrophobicContact CG-CE3 4.46Å; Y231-W295 AromaticContact CG-CH2 3.95Å; Y231-W295 HydrophobicContact CG-CH2 3.95Å; Y231-W295 AromaticContact CG-CZ2 3.61Å; Y231-W295 HydrophobicContact CG-CZ2 3.61Å; Y231-W295 HydrophobicContact CG-CZ3 4.36Å; I232-W295 HydrophobicContact CD1-CB 4.3Å; I232-W295 HydrophobicContact CG1-CB 3.6Å; A291-W295 VanDerWaalsContact O-CD1 3.24Å; A291-W295 PolarHBondContact O-N 3.22Å; S292-W295 PolarHBondContact O-N 3.33Å; W295-I298 HydrophobicContact CD2-CD1 4.37Å; W295-I298 HydrophobicContact CE3-CB 4.38Å; W295-I298 HydrophobicContact CE3-CD1 3.85Å; W295-I298 HydrophobicContact CE3-CG2 4.35Å; W295-I298 HydrophobicContact CZ3-CD1 4.02Å; W295-I298 HydrophobicContact CZ3-CG2 4.33Å; W295-I298 PolarHBondContact O-N 3.45Å; W295-L299 WeakPolarHBondContact O-CB 2.94Å; W295-L299 PolarHBondContact O-N 2.97Å; W295-H315 AromaticContact CH2-CE1 3.39Å; W295-H315 WeakPolarHBondContact CH2-CE1 3.49Å; W295-H315 AromaticContact CH2-ND1 3.44Å; W295-H315 WeakPolarHBondContact CH2-ND1 3.19Å; W295-H315 AromaticContact CZ2-CE1 3.76Å; W295-H315 AromaticContact CZ2-ND1 3.52Å; W295-A318 HydrophobicContact CD2-CB 3.98Å; W295-A318 VanDerWaalsContact CE2-CB 3.46Å; W295-A318 HydrophobicContact CG-CB 4.36Å; W295-A318 HydrophobicContact CH2-CB 4.3Å; W295-A318 HydrophobicContact CZ2-CB 3.66Å; W295-W319 HydrophobicContact CZ2-CZ2 4.17Å; W295-W319 AromaticContact NE1-CE2 3.94Å; W295-W319 AromaticContact NE1-CH2 3.67Å; W295-W319 AromaticContact NE1-CZ2 3.51Å
296	W	97.2	Very high	92	Very high	1 Å²	1	22 Å²	22	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-65.3	-41.3	172.5	177.1	79.9	0	0	0	112.5	I232 S292 H293 V294 I298 L299 C300 L365 A435 Y438 V439 Y482	I232-W296 HydrophobicContact CD1-CB 4.43Å; S292-W296 PolarHBondContact O-N 3.01Å; H293-W296 WeakPolarHBondContact O-CB 3.46Å; H293-W296 PolarHBondContact O-N 2.9Å; V294-W296 VanDerWaalsContact C-N 3.28Å; V294-W296 PolarHBondContact O-N 3.24Å; W296-I298 VanDerWaalsContact C-N 3.32Å; W296-I298 PolarHBondContact O-N 2.95Å; W296-L299 WeakPolarHBondContact O-CB 3.41Å; W296-L299 PolarHBondContact O-N 3.43Å; W296-C300 VanDerWaalsContact CZ2-SG 3.51Å; W296-C300 PolarHBondContact O-N 3.43Å; W296-C300 PolarHBondContact O-SG 3.17Å; W296-C300 VanDerWaalsContact O-SG 3.4Å; W296-L365 HydrophobicContact CH2-CD1 4.07Å; W296-L365 HydrophobicContact CZ3-CD1 4.38Å; W296-A435 PolarHBondContact NE1-O 3.24Å; W296-Y438 HydrophobicContact CB-CE1 4.46Å; W296-Y438 AromaticContact CD1-CD1 3.66Å; W296-Y438 AromaticContact CD1-CG 3.52Å; W296-Y438 AromaticContact CD2-CD1 3.33Å; W296-Y438 HydrophobicContact CD2-CD1 3.33Å; W296-Y438 AromaticContact CD2-CE1 3.6Å; W296-Y438 HydrophobicContact CD2-CE1 3.6Å; W296-Y438 HydrophobicContact CD2-CG 4.03Å; W296-Y438 AromaticContact CE2-CD1 3.16Å; W296-Y438 AromaticContact CE2-CE1 3.95Å; W296-Y438 AromaticContact CE2-CG 3.7Å; W296-Y438 AromaticContact CE3-CD1 3.87Å; W296-Y438 HydrophobicContact CE3-CD1 3.87Å; W296-Y438 AromaticContact CE3-CE1 3.8Å; W296-Y438 HydrophobicContact CE3-CE1 3.8Å; W296-Y438 AromaticContact CG-CD1 3.67Å; W296-Y438 HydrophobicContact CG-CD1 3.67Å; W296-Y438 HydrophobicContact CG-CD2 4.46Å; W296-Y438 AromaticContact CG-CE1 3.87Å; W296-Y438 HydrophobicContact CG-CE1 3.87Å; W296-Y438 AromaticContact CG-CG 3.94Å; W296-Y438 HydrophobicContact CG-CG 3.94Å; W296-Y438 HydrophobicContact CH2-CD1 4.1Å; W296-Y438 AromaticContact CZ2-CD1 3.6Å; W296-Y438 HydrophobicContact CZ2-CD1 3.6Å; W296-Y438 HydrophobicContact CZ2-CE1 4.44Å; W296-Y438 HydrophobicContact CZ2-CG 4.34Å; W296-Y438 HydrophobicContact CZ3-CD1 4.2Å; W296-Y438 HydrophobicContact CZ3-CE1 4.28Å; W296-Y438 AromaticContact NE1-CD1 3.38Å; W296-Y438 AromaticContact NE1-CG 3.36Å; W296-V439 HydrophobicContact CZ2-CG2 4.15Å; W296-Y482 AromaticContact CD1-CZ 3.94Å
297	I	95.4	Very high	90.8	Very high	36 Å²	36	23.9 Å²	23.9	19%	0.185	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-43.9	174.3	-62.8	165.1	0	0	0	110.6	H293 V294 L299 C300 A301 Y364 A367	H293-I297 WeakPolarHBondContact O-CG1 3.35Å; H293-I297 PolarHBondContact O-N 2.89Å; V294-I297 PolarHBondContact O-N 2.94Å; I297-L299 VanDerWaalsContact C-N 3.32Å; I297-L299 PolarHBondContact O-N 3.09Å; I297-C300 PolarHBondContact O-N 2.91Å; I297-A301 WeakPolarHBondContact O-CB 2.95Å; I297-A301 PolarHBondContact O-N 3.05Å; I297-Y364 HydrophobicContact CD1-CD1 3.88Å; I297-Y364 HydrophobicContact CD1-CG 4.12Å; I297-A367 HydrophobicContact CD1-CB 4.04Å
298	I	93.8	Very high	89.4	Confident	11 Å²	11	27.5 Å²	27.5	6%	0.056	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-42.2	175.9	-67.1	160.4	0	0	0	110.6	A228 V294 W295 W296 A301 C302 F314 A318	A228-I298 HydrophobicContact CB-CG2 4.49Å; V294-I298 HydrophobicContact CG1-CD1 4.23Å; V294-I298 WeakPolarHBondContact O-CG1 3Å; V294-I298 PolarHBondContact O-N 3.48Å; W295-I298 HydrophobicContact CD2-CD1 4.37Å; W295-I298 HydrophobicContact CE3-CB 4.38Å; W295-I298 HydrophobicContact CE3-CD1 3.85Å; W295-I298 HydrophobicContact CE3-CG2 4.35Å; W295-I298 HydrophobicContact CZ3-CD1 4.02Å; W295-I298 HydrophobicContact CZ3-CG2 4.33Å; W295-I298 PolarHBondContact O-N 3.45Å; W296-I298 VanDerWaalsContact C-N 3.32Å; W296-I298 PolarHBondContact O-N 2.95Å; I298-A301 PolarHBondContact O-N 3.32Å; I298-C302 WeakPolarHBondContact O-CB 3.42Å; I298-C302 PolarHBondContact O-N 3.32Å; I298-C302 PolarHBondContact O-SG 3.3Å; I298-F314 HydrophobicContact CD1-CB 3.99Å; I298-F314 HydrophobicContact CG1-CD1 4.4Å; I298-F314 HydrophobicContact CG2-CB 4.27Å; I298-F314 HydrophobicContact CG2-CD1 4.31Å; I298-F314 HydrophobicContact CG2-CD2 3.92Å; I298-F314 HydrophobicContact CG2-CE2 4.26Å; I298-F314 HydrophobicContact CG2-CG 3.92Å; I298-A318 HydrophobicContact CD1-CB 3.95Å
299	L	93.3	Very high	87.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-56.8	-49.7	173.7	171.1	61.4	0	0	0	111.2	P225 A228 I229 I232 W295 W296 I297 A301 C302 C303 T431 A435	P225-L299 HydrophobicContact CB-CD1 3.8Å; A228-L299 HydrophobicContact CB-CB 3.93Å; I229-L299 HydrophobicContact CD1-CD1 4.45Å; I229-L299 HydrophobicContact CG1-CD1 4.06Å; I229-L299 HydrophobicContact CG1-CD2 4.11Å; I232-L299 HydrophobicContact CD1-CD2 4.13Å; W295-L299 WeakPolarHBondContact O-CB 2.94Å; W295-L299 PolarHBondContact O-N 2.97Å; W296-L299 WeakPolarHBondContact O-CB 3.41Å; W296-L299 PolarHBondContact O-N 3.43Å; I297-L299 VanDerWaalsContact C-N 3.32Å; I297-L299 PolarHBondContact O-N 3.09Å; L299-A301 PolarHBondContact O-N 2.96Å; L299-C302 PolarHBondContact O-N 3.4Å; L299-C303 PolarHBondContact O-N 3.1Å; L299-C303 PolarHBondContact O-SG 3.31Å; L299-T431 HydrophobicContact CD1-CG2 3.72Å; L299-A435 HydrophobicContact CD2-CB 3.92Å; L299-A435 HydrophobicContact CG-CB 4.02Å
300	C	93.3	Very high	87	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-43.7	177.5	-67.5	0	0	0	0	112.4	W296 I297 C303 A304 P371 L372	W296-C300 VanDerWaalsContact CZ2-SG 3.51Å; W296-C300 PolarHBondContact O-N 3.43Å; W296-C300 PolarHBondContact O-SG 3.17Å; W296-C300 VanDerWaalsContact O-SG 3.4Å; I297-C300 PolarHBondContact O-N 2.91Å; C300-C303 PolarHBondContact O-N 3.06Å; C300-A304 PolarHBondContact O-N 3.33Å; C300-A304 VanDerWaalsContact O-N 3.15Å; C300-P371 HydrophobicContact CB-CB 4.36Å; C300-P371 HydrophobicContact CB-CG 3.84Å; C300-L372 HydrophobicContact CB-CB 4.4Å
301	A	90.6	Very high	86.3	Confident	24 Å²	24	39.9 Å²	39.9	20%	0.198	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-44.3	178.2	0	0	0	0	0	112.5	I297 I298 L299 C303 A304 Q305 P371	I297-A301 WeakPolarHBondContact O-CB 2.95Å; I297-A301 PolarHBondContact O-N 3.05Å; I298-A301 PolarHBondContact O-N 3.32Å; L299-A301 PolarHBondContact O-N 2.96Å; A301-C303 VanDerWaalsContact C-N 3.29Å; A301-C303 PolarHBondContact O-N 3.21Å; A301-A304 PolarHBondContact O-N 3.43Å; A301-Q305 PolarHBondContact O-N 3.01Å; A301-P371 HydrophobicContact CB-CB 4.46Å
302	C	88.4	Confident	85.9	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-61.1	-37.9	175.3	-72.3	0	0	0	0	112	P225 I298 L299 A304 S306 I307	P225-C302 HydrophobicContact CB-CB 3.79Å; I298-C302 WeakPolarHBondContact O-CB 3.42Å; I298-C302 PolarHBondContact O-N 3.32Å; I298-C302 PolarHBondContact O-SG 3.3Å; L299-C302 PolarHBondContact O-N 3.4Å; C302-A304 VanDerWaalsContact C-N 3.35Å; C302-S306 PolarHBondContact O-N 3.46Å; C302-I307 PolarHBondContact SG-O 3.44Å
303	C	84.5	Confident	85.6	Confident	19 Å²	19	50.7 Å²	50.7	13%	0.128	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-30.4	176.7	-74.5	0	0	0	0	113.5	L299 C300 A301	L299-C303 PolarHBondContact O-N 3.1Å; L299-C303 PolarHBondContact O-SG 3.31Å; C300-C303 PolarHBondContact O-N 3.06Å; A301-C303 VanDerWaalsContact C-N 3.29Å; A301-C303 PolarHBondContact O-N 3.21Å
304	A	84.3	Confident	85.4	Confident	12 Å²	12	51.3 Å²	51.3	10%	0.099	26%	0.259	C	S	.	.	H	α-helix	trans	-85	-43.1	-173.9	0	0	0	0	0	114.1	C300 A301 C302 P371	C300-A304 PolarHBondContact O-N 3.33Å; C300-A304 VanDerWaalsContact O-N 3.15Å; A301-A304 PolarHBondContact O-N 3.43Å; C302-A304 VanDerWaalsContact C-N 3.35Å; A304-P371 HydrophobicContact CB-CB 4.01Å; A304-P371 WeakPolarHBondContact CB-O 3.34Å
305	Q	75.6	Confident	85.2	Confident	119 Å²	119	53 Å²	53	56%	0.556	27%	0.266	S	S	*	.	H	α-helix	trans	-120.2	9.1	-166.7	-73.7	-178.3	0.6	0	0	113.6	A301 I307 L374	A301-Q305 PolarHBondContact O-N 3.01Å; Q305-I307 HydrophobicContact CB-CD1 3.97Å; Q305-I307 HydrophobicContact CB-CG1 3.6Å; Q305-I307 PolarHBondContact O-N 3.47Å; Q305-I307 VanDerWaalsContact O-N 3.14Å; Q305-L374 HydrophobicContact CG-CD2 4.41Å
306	S	67.2	Low	85.2	Confident	96 Å²	96	55 Å²	55	67%	0.671	28%	0.28	S	S	*	.			trans	51.1	33.7	-174.1	63.4	0	0	0	0	113.3	C302 Q308	C302-S306 PolarHBondContact O-N 3.46Å; S306-Q308 PolarHBondContact O-N 2.83Å
307	I	69.2	Low	85	Confident	42 Å²	42	57.9 Å²	57.9	22%	0.215	30%	0.298	C	S	.	.			trans	-70.1	100.5	-179.8	-49.9	173.6	0	0	0	108.4	C302 Q305 Q310 F314	C302-I307 PolarHBondContact SG-O 3.44Å; Q305-I307 HydrophobicContact CB-CD1 3.97Å; Q305-I307 HydrophobicContact CB-CG1 3.6Å; Q305-I307 PolarHBondContact O-N 3.47Å; Q305-I307 VanDerWaalsContact O-N 3.14Å; I307-Q310 HydrophobicContact CG2-CG 4.36Å; I307-F314 HydrophobicContact CB-CZ 4.31Å; I307-F314 HydrophobicContact CG2-CE2 4.46Å; I307-F314 HydrophobicContact CG2-CZ 3.67Å
308	Q	68	Low	85.1	Confident	123 Å²	123	56.2 Å²	56.2	58%	0.575	29%	0.289	S	S	*	.			trans	-109.1	-12.3	-179.9	-68.4	-176.1	-30.9	0	0	113.6	Y224 S306	Y224-Q308 PolarHBondContact O-NE2 3.49Å; S306-Q308 PolarHBondContact O-N 2.83Å
309	R	66.8	Low	85.2	Confident	200 Å²	200	58.9 Å²	58.9	76%	0.755	30%	0.298	S	S	*	.	S	Bend	trans	-98.4	7.2	-163.2	-147.9	173.1	176	-170.9	-1.2	115.6
310	Q	76.9	Confident	85.4	Confident	97 Å²	97	63.2 Å²	63.2	45%	0.453	32%	0.321	S	S	.	.			trans	-119.7	36	-171.4	-64.6	-172.7	-4	0	0	114.4	I307 F312 T313 F314	I307-Q310 HydrophobicContact CG2-CG 4.36Å; Q310-F312 VanDerWaalsContact C-N 3.35Å; Q310-F312 PolarHBondContact O-N 3.12Å; Q310-T313 PolarHBondContact O-N 2.89Å; Q310-F314 HydrophobicContact CB-CD1 4.3Å; Q310-F314 HydrophobicContact CB-CE1 3.89Å; Q310-F314 HydrophobicContact CB-CE2 4.17Å; Q310-F314 HydrophobicContact CB-CZ 3.84Å; Q310-F314 WeakPolarHBondContact O-CD2 3.1Å; Q310-F314 WeakPolarHBondContact O-CG 3.35Å; Q310-F314 PolarHBondContact O-N 3Å
311	S	80.8	Confident	85.5	Confident	35 Å²	35	66.9 Å²	66.9	25%	0.245	34%	0.34	C	S	.	.	H	α-helix	trans	-52.8	-47.2	-176.1	-180	0	0	0	0	113.2	Y224 T313 F314 H315	Y224-S311 PolarHBondContact OH-OG 3.5Å; Y224-S311 VanDerWaalsContact OH-OG 3.13Å; S311-T313 PolarHBondContact O-N 3.15Å; S311-F314 PolarHBondContact O-N 3.46Å; S311-H315 PolarHBondContact O-CD2 3.47Å; S311-H315 PolarHBondContact O-N 2.88Å; S311-H315 VanDerWaalsContact O-N 3.08Å
312	F	89.6	Confident	85.8	Confident	161 Å²	161	65.7 Å²	65.7	71%	0.706	33%	0.33	S	S	*	.	H	α-helix	trans	-59.5	-49.9	179.3	177.9	-100.8	0	0	0	112.7	Q310 F314 H315 C316	Q310-F312 VanDerWaalsContact C-N 3.35Å; Q310-F312 PolarHBondContact O-N 3.12Å; F312-F314 VanDerWaalsContact C-N 3.3Å; F312-F314 PolarHBondContact O-N 2.81Å; F312-H315 WeakPolarHBondContact O-CB 3.09Å; F312-H315 PolarHBondContact O-N 3.25Å; F312-H315 VanDerWaalsContact O-N 3.14Å; F312-C316 VanDerWaalsContact CE1-SG 3.58Å; F312-C316 WeakPolarHBondContact CZ-SG 3.45Å; F312-C316 PolarHBondContact O-N 2.82Å; F312-C316 PolarHBondContact O-SG 3.35Å
313	T	90.7	Very high	86.2	Confident	72 Å²	72	69.7 Å²	69.7	44%	0.442	35%	0.35	S	S	.	.	H	α-helix	trans	-59.7	-42.3	179.2	-51.1	0	0	0	0	111.5	Q310 S311 H315 C316 V317	Q310-T313 PolarHBondContact O-N 2.89Å; S311-T313 PolarHBondContact O-N 3.15Å; T313-H315 VanDerWaalsContact C-N 3.32Å; T313-H315 PolarHBondContact O-N 3.25Å; T313-C316 PolarHBondContact O-N 2.91Å; T313-V317 HydrophobicContact CG2-CG2 4.4Å; T313-V317 WeakPolarHBondContact O-CG2 3.5Å; T313-V317 PolarHBondContact O-N 3.01Å
314	F	92.8	Very high	86.7	Confident	20 Å²	20	73.1 Å²	73.1	9%	0.088	37%	0.367	C	S	.	.	H	α-helix	trans	-58.9	-43.8	176.3	-63.7	-21.3	0	0	0	111.9	Y224 I298 I307 Q310 S311 F312 A318	Y224-F314 AromaticContact CE1-CD2 3.89Å; Y224-F314 HydrophobicContact CE1-CD2 3.89Å; Y224-F314 HydrophobicContact CE1-CE2 4.38Å; I298-F314 HydrophobicContact CD1-CB 3.99Å; I298-F314 HydrophobicContact CG1-CD1 4.4Å; I298-F314 HydrophobicContact CG2-CB 4.27Å; I298-F314 HydrophobicContact CG2-CD1 4.31Å; I298-F314 HydrophobicContact CG2-CD2 3.92Å; I298-F314 HydrophobicContact CG2-CE2 4.26Å; I298-F314 HydrophobicContact CG2-CG 3.92Å; I307-F314 HydrophobicContact CB-CZ 4.31Å; I307-F314 HydrophobicContact CG2-CE2 4.46Å; I307-F314 HydrophobicContact CG2-CZ 3.67Å; Q310-F314 HydrophobicContact CB-CD1 4.3Å; Q310-F314 HydrophobicContact CB-CE1 3.89Å; Q310-F314 HydrophobicContact CB-CE2 4.17Å; Q310-F314 HydrophobicContact CB-CZ 3.84Å; Q310-F314 WeakPolarHBondContact O-CD2 3.1Å; Q310-F314 WeakPolarHBondContact O-CG 3.35Å; Q310-F314 PolarHBondContact O-N 3Å; S311-F314 PolarHBondContact O-N 3.46Å; F312-F314 VanDerWaalsContact C-N 3.3Å; F312-F314 PolarHBondContact O-N 2.81Å; F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 2.97Å
315	H	94.1	Very high	87.1	Confident	40 Å²	40	74.2 Å²	74.2	19%	0.185	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-46.5	175.7	-76.8	-61.7	0	0	0	112.9	Y231 W295 S311 F312 T313 V317 A318 W319	Y231-H315 AromaticContact CE1-CE1 3.93Å; Y231-H315 AromaticContact CE2-CE1 3.38Å; Y231-H315 WeakPolarHBondContact CE2-CE1 3.44Å; Y231-H315 AromaticContact CZ-CE1 3.29Å; Y231-H315 PolarHBondContact OH-CE1 3.23Å; Y231-H315 VanDerWaalsContact OH-CE1 3.28Å; W295-H315 AromaticContact CH2-CE1 3.39Å; W295-H315 WeakPolarHBondContact CH2-CE1 3.49Å; W295-H315 AromaticContact CH2-ND1 3.44Å; W295-H315 WeakPolarHBondContact CH2-ND1 3.19Å; W295-H315 AromaticContact CZ2-CE1 3.76Å; W295-H315 AromaticContact CZ2-ND1 3.52Å; S311-H315 PolarHBondContact O-CD2 3.47Å; S311-H315 PolarHBondContact O-N 2.88Å; S311-H315 VanDerWaalsContact O-N 3.08Å; F312-H315 WeakPolarHBondContact O-CB 3.09Å; F312-H315 PolarHBondContact O-N 3.25Å; F312-H315 VanDerWaalsContact O-N 3.14Å; T313-H315 VanDerWaalsContact C-N 3.32Å; T313-H315 PolarHBondContact O-N 3.25Å; H315-V317 PolarHBondContact O-N 3Å; H315-A318 PolarHBondContact O-N 2.89Å; H315-W319 AromaticContact ND1-NE1 3.74Å; H315-W319 PolarHBondContact O-N 2.78Å; H315-W319 VanDerWaalsContact O-N 3.15Å
316	C	95.7	Very high	88	Confident	41 Å²	41	69.3 Å²	69.3	28%	0.277	35%	0.348	S	S	.	.	H	α-helix	trans	-58.1	-49.9	178	-68.2	0	0	0	0	111.2	F312 T313 A318 W319 I320	F312-C316 VanDerWaalsContact CE1-SG 3.58Å; F312-C316 WeakPolarHBondContact CZ-SG 3.45Å; F312-C316 PolarHBondContact O-N 2.82Å; F312-C316 PolarHBondContact O-SG 3.35Å; T313-C316 PolarHBondContact O-N 2.91Å; C316-A318 PolarHBondContact O-N 3.24Å; C316-W319 PolarHBondContact O-N 3.02Å; C316-I320 HydrophobicContact CB-CD1 4.14Å; C316-I320 WeakPolarHBondContact O-CB 3.37Å; C316-I320 WeakPolarHBondContact O-CG1 3.45Å; C316-I320 PolarHBondContact O-N 3.44Å
317	V	94.9	Very high	89.2	Confident	63 Å²	63	68.9 Å²	68.9	38%	0.382	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-44.9	-179.3	175	0	0	0	0	111.2	V294 T313 H315 W319 L321	V294-V317 HydrophobicContact CG1-CG1 4.01Å; T313-V317 HydrophobicContact CG2-CG2 4.4Å; T313-V317 WeakPolarHBondContact O-CG2 3.5Å; T313-V317 PolarHBondContact O-N 3.01Å; H315-V317 PolarHBondContact O-N 3Å; V317-W319 VanDerWaalsContact C-N 3.29Å; V317-W319 PolarHBondContact O-N 2.58Å; V317-L321 HydrophobicContact CG1-CD1 3.6Å; V317-L321 HydrophobicContact CG1-CG 4.29Å; V317-L321 WeakPolarHBondContact O-CB 3.3Å; V317-L321 WeakPolarHBondContact O-CG 3.12Å; V317-L321 PolarHBondContact O-N 3.42Å
318	A	95.9	Very high	90.2	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-27.7	-177.3	0	0	0	0	0	114.3	V294 W295 I298 F314 H315 C316 P322	V294-A318 HydrophobicContact CG1-CB 4.12Å; W295-A318 HydrophobicContact CD2-CB 3.98Å; W295-A318 VanDerWaalsContact CE2-CB 3.46Å; W295-A318 HydrophobicContact CG-CB 4.36Å; W295-A318 HydrophobicContact CH2-CB 4.3Å; W295-A318 HydrophobicContact CZ2-CB 3.66Å; I298-A318 HydrophobicContact CD1-CB 3.95Å; F314-A318 WeakPolarHBondContact O-CB 3.28Å; F314-A318 PolarHBondContact O-N 2.97Å; H315-A318 PolarHBondContact O-N 2.89Å; C316-A318 PolarHBondContact O-N 3.24Å; A318-P322 WeakPolarHBondContact O-CD 3.48Å; A318-P322 WeakPolarHBondContact O-CG 3.22Å
319	W	97.2	Very high	91.2	Very high	68 Å²	68	64.1 Å²	64.1	26%	0.258	32%	0.318	S	S	.	.	H	α-helix	trans	-105.1	-32.3	-176.8	-60.2	127.8	0	0	0	114.2	Y231 Y287 A291 W295 H315 C316 V317 L323	Y231-W319 AromaticContact CD1-CZ2 3.99Å; Y231-W319 HydrophobicContact CD1-CZ2 3.99Å; Y287-W319 HydrophobicContact CE1-CE3 4.09Å; Y287-W319 HydrophobicContact CE1-CZ3 4.21Å; Y287-W319 PolarHBondContact OH-O 3.21Å; A291-W319 HydrophobicContact CB-CE3 4.01Å; A291-W319 HydrophobicContact CB-CZ3 3.64Å; W295-W319 HydrophobicContact CZ2-CZ2 4.17Å; W295-W319 AromaticContact NE1-CE2 3.94Å; W295-W319 AromaticContact NE1-CH2 3.67Å; W295-W319 AromaticContact NE1-CZ2 3.51Å; H315-W319 AromaticContact ND1-NE1 3.74Å; H315-W319 PolarHBondContact O-N 2.78Å; H315-W319 VanDerWaalsContact O-N 3.15Å; C316-W319 PolarHBondContact O-N 3.02Å; V317-W319 VanDerWaalsContact C-N 3.29Å; V317-W319 PolarHBondContact O-N 2.58Å; W319-L323 WeakPolarHBondContact O-CB 3.43Å; W319-L323 PolarHBondContact O-N 3.49Å
320	I	96.9	Very high	92.2	Very high	91 Å²	91	60 Å²	60	47%	0.467	31%	0.306	S	S	.	.	H	α-helix	trans	-75.9	-42.8	179.9	-64.4	171.4	0	0	0	111	C316 L323 I324	C316-I320 HydrophobicContact CB-CD1 4.14Å; C316-I320 WeakPolarHBondContact O-CB 3.37Å; C316-I320 WeakPolarHBondContact O-CG1 3.45Å; C316-I320 PolarHBondContact O-N 3.44Å; I320-L323 WeakPolarHBondContact O-CB 3.33Å; I320-L323 PolarHBondContact O-N 3.39Å; I320-L323 VanDerWaalsContact O-N 3.15Å; I320-I324 HydrophobicContact CG2-CD1 3.79Å; I320-I324 HydrophobicContact CG2-CG1 4.28Å; I320-I324 WeakPolarHBondContact O-CG1 3.28Å; I320-I324 PolarHBondContact O-N 3.07Å
321	L	95.9	Very high	92.7	Very high	76 Å²	76	61.1 Å²	61.1	40%	0.398	31%	0.314	S	S	.	.	H	α-helix	trans	-60.7	-46.6	-178.8	-70.6	179.3	0	0	0	112.9	V317 L323 I324 K325	V317-L321 HydrophobicContact CG1-CD1 3.6Å; V317-L321 HydrophobicContact CG1-CG 4.29Å; V317-L321 WeakPolarHBondContact O-CB 3.3Å; V317-L321 WeakPolarHBondContact O-CG 3.12Å; V317-L321 PolarHBondContact O-N 3.42Å; L321-L323 VanDerWaalsContact C-N 3.31Å; L321-L323 PolarHBondContact O-N 2.73Å; L321-I324 PolarHBondContact O-N 3.38Å; L321-K325 PolarHBondContact O-N 3.2Å
322	P	96.1	Very high	93	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-35.9	173.4	-25.9	37.8	0	0	0	113.5	Y287 M290 A291 V294 A318 K325 V326	Y287-P322 HydrophobicContact CD2-CB 3.72Å; Y287-P322 HydrophobicContact CE2-CB 3.72Å; M290-P322 HydrophobicContact CB-CB 3.79Å; M290-P322 HydrophobicContact CB-CG 4.16Å; A291-P322 VanDerWaalsContact CA-CG 3.48Å; A291-P322 HydrophobicContact CB-CB 4.38Å; A291-P322 HydrophobicContact CB-CG 3.86Å; V294-P322 HydrophobicContact CG2-CG 4.46Å; A318-P322 WeakPolarHBondContact O-CD 3.48Å; A318-P322 WeakPolarHBondContact O-CG 3.22Å; P322-K325 PolarHBondContact O-N 2.91Å; P322-V326 WeakPolarHBondContact O-CG2 3.3Å; P322-V326 PolarHBondContact O-N 3.45Å
323	L	96.4	Very high	92.8	Very high	88 Å²	88	60.8 Å²	60.8	46%	0.461	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-45.6	179.1	-179.4	62.2	0	0	0	111.3	Y287 W319 I320 L321 K325 V326 I327	Y287-L323 HydrophobicContact CE2-CB 4.05Å; W319-L323 WeakPolarHBondContact O-CB 3.43Å; W319-L323 PolarHBondContact O-N 3.49Å; I320-L323 WeakPolarHBondContact O-CB 3.33Å; I320-L323 PolarHBondContact O-N 3.39Å; I320-L323 VanDerWaalsContact O-N 3.15Å; L321-L323 VanDerWaalsContact C-N 3.31Å; L321-L323 PolarHBondContact O-N 2.73Å; L323-K325 VanDerWaalsContact C-N 3.27Å; L323-K325 PolarHBondContact O-N 2.91Å; L323-V326 WeakPolarHBondContact O-CB 3.5Å; L323-V326 PolarHBondContact O-N 3.2Å; L323-I327 HydrophobicContact CG-CD1 4.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.44Å; L323-I327 PolarHBondContact O-N 3.34Å; L323-I327 VanDerWaalsContact O-N 3.08Å
324	I	96	Very high	92.6	Very high	91 Å²	91	57.7 Å²	57.7	47%	0.467	29%	0.292	S	S	.	.	H	α-helix	trans	-57.6	-43.5	176	-67.5	167.5	0	0	0	110.4	I320 L321 V326 I327 V328	I320-I324 HydrophobicContact CG2-CD1 3.79Å; I320-I324 HydrophobicContact CG2-CG1 4.28Å; I320-I324 WeakPolarHBondContact O-CG1 3.28Å; I320-I324 PolarHBondContact O-N 3.07Å; L321-I324 PolarHBondContact O-N 3.38Å; I324-V326 PolarHBondContact O-N 3.04Å; I324-I327 PolarHBondContact O-N 2.71Å; I324-V328 WeakPolarHBondContact O-CG2 3.15Å; I324-V328 PolarHBondContact O-N 3.04Å; I324-V328 VanDerWaalsContact O-N 3.09Å
325	K	93.1	Very high	92.5	Very high	35 Å²	35	57.6 Å²	57.6	15%	0.152	29%	0.293	C	S	.	.	H	α-helix	trans	-64	-39.8	178.4	-68	-178.2	171.1	-178.7	0	113	Y286 M290 L321 P322 L323 I327 V328 V329 P360 Y364	Y286-K325 HydrophobicContact CE1-CB 3.74Å; M290-K325 HydrophobicContact CG-CD 4.08Å; M290-K325 HydrophobicContact SD-CD 3.9Å; M290-K325 PolarHBondContact SD-NZ 3.49Å; L321-K325 PolarHBondContact O-N 3.2Å; P322-K325 PolarHBondContact O-N 2.91Å; L323-K325 VanDerWaalsContact C-N 3.27Å; L323-K325 PolarHBondContact O-N 2.91Å; K325-I327 VanDerWaalsContact C-N 3.31Å; K325-I327 PolarHBondContact O-N 2.97Å; K325-V328 PolarHBondContact O-N 2.99Å; K325-V329 WeakPolarHBondContact O-CG2 3.19Å; K325-V329 PolarHBondContact O-N 3.46Å; K325-P360 HydrophobicContact CD-CB 4.48Å; K325-Y364 VanDerWaalsContact CE-OH 3.28Å; K325-Y364 WeakPolarHBondContact CE-OH 3.39Å; K325-Y364 PolarHBondContact NZ-OH 3.3Å
326	V	92.9	Very high	92.3	Very high	17 Å²	17	55.9 Å²	55.9	10%	0.103	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-44.9	174.3	165.6	0	0	0	0	111	I283 Y286 Y287 P322 L323 I324 V328 V329 F330	I283-V326 HydrophobicContact CB-CG1 4.5Å; I283-V326 HydrophobicContact CG1-CG1 4.35Å; I283-V326 HydrophobicContact CG2-CG1 3.53Å; I283-V326 HydrophobicContact CG2-CG2 4.34Å; Y286-V326 HydrophobicContact CD1-CG2 3.92Å; Y287-V326 HydrophobicContact CD2-CG2 3.95Å; Y287-V326 HydrophobicContact CG-CG2 4.41Å; P322-V326 WeakPolarHBondContact O-CG2 3.3Å; P322-V326 PolarHBondContact O-N 3.45Å; L323-V326 WeakPolarHBondContact O-CB 3.5Å; L323-V326 PolarHBondContact O-N 3.2Å; I324-V326 PolarHBondContact O-N 3.04Å; V326-V328 VanDerWaalsContact C-N 3.34Å; V326-V328 PolarHBondContact O-N 3.28Å; V326-V329 PolarHBondContact O-N 3.06Å; V326-F330 WeakPolarHBondContact O-CB 3.1Å; V326-F330 PolarHBondContact O-N 3.17Å
327	I	93.1	Very high	92.2	Very high	87 Å²	87	54 Å²	54	45%	0.446	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-45.7	179	-66	165.8	0	0	0	110.4	L323 I324 K325 F330 I331	L323-I327 HydrophobicContact CG-CD1 4.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.44Å; L323-I327 PolarHBondContact O-N 3.34Å; L323-I327 VanDerWaalsContact O-N 3.08Å; I324-I327 PolarHBondContact O-N 2.71Å; K325-I327 VanDerWaalsContact C-N 3.31Å; K325-I327 PolarHBondContact O-N 2.97Å; I327-F330 PolarHBondContact O-N 3.42Å; I327-I331 HydrophobicContact CG2-CD1 3.83Å; I327-I331 WeakPolarHBondContact O-CG1 3.34Å; I327-I331 PolarHBondContact O-N 3.19Å
328	V	91.4	Very high	92	Very high	61 Å²	61	51.5 Å²	51.5	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-48.9	177.8	174.3	0	0	0	0	111.4	I324 K325 V326 F330 I331 M332 F356	I324-V328 WeakPolarHBondContact O-CG2 3.15Å; I324-V328 PolarHBondContact O-N 3.04Å; I324-V328 VanDerWaalsContact O-N 3.09Å; K325-V328 PolarHBondContact O-N 2.99Å; V326-V328 VanDerWaalsContact C-N 3.34Å; V326-V328 PolarHBondContact O-N 3.28Å; V328-F330 VanDerWaalsContact C-N 3.26Å; V328-F330 PolarHBondContact O-N 2.98Å; V328-I331 PolarHBondContact O-N 2.9Å; V328-M332 HydrophobicContact CG1-CG 4.32Å; V328-M332 VanDerWaalsContact O-CG 3.23Å; V328-M332 WeakPolarHBondContact O-CG 3.2Å; V328-M332 PolarHBondContact O-N 3.19Å; V328-F356 HydrophobicContact CG1-CD1 4.34Å; V328-F356 HydrophobicContact CG1-CE1 3.72Å; V328-F356 HydrophobicContact CG1-CZ 4.33Å
329	V	88.4	Confident	91.7	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-57.5	-41	177.5	162.7	0	0	0	0	111.8	Y286 K325 V326 M332 Q333 V335 V346 F356	Y286-V329 HydrophobicContact CE1-CG2 3.97Å; Y286-V329 HydrophobicContact CE2-CG2 4.33Å; K325-V329 WeakPolarHBondContact O-CG2 3.19Å; K325-V329 PolarHBondContact O-N 3.46Å; V326-V329 PolarHBondContact O-N 3.06Å; V329-M332 PolarHBondContact O-N 2.84Å; V329-Q333 PolarHBondContact O-N 2.63Å; V329-V335 HydrophobicContact CG1-CG2 4.06Å; V329-V346 HydrophobicContact CB-CG2 4.37Å; V329-V346 HydrophobicContact CG1-CB 4.28Å; V329-V346 HydrophobicContact CG1-CG1 3.99Å; V329-V346 HydrophobicContact CG1-CG2 3.28Å; V329-V346 HydrophobicContact CG2-CG1 4.07Å; V329-V346 HydrophobicContact CG2-CG2 4.19Å; V329-F356 HydrophobicContact CG2-CB 4.46Å
330	F	86.6	Confident	91.6	Very high	114 Å²	114	48.6 Å²	48.6	50%	0.5	25%	0.246	S	C	.	.	H	α-helix	trans	-66.1	-45	179.8	-176	-102.7	0	0	0	111.9	T279 I283 V326 I327 V328 M332 Q333	T279-F330 HydrophobicContact CG2-CD2 4.29Å; T279-F330 HydrophobicContact CG2-CE2 4.2Å; I283-F330 HydrophobicContact CD1-CD2 4Å; V326-F330 WeakPolarHBondContact O-CB 3.1Å; V326-F330 PolarHBondContact O-N 3.17Å; I327-F330 PolarHBondContact O-N 3.42Å; V328-F330 VanDerWaalsContact C-N 3.26Å; V328-F330 PolarHBondContact O-N 2.98Å; F330-M332 VanDerWaalsContact C-N 3.3Å; F330-M332 PolarHBondContact O-N 3.36Å; F330-Q333 PolarHBondContact O-N 3.46Å
331	I	88.3	Confident	91.4	Very high	121 Å²	121	45 Å²	45	62%	0.621	23%	0.229	S	C	*	.	H	α-helix	trans	-61.1	-40.6	176.5	-68.4	166.8	0	0	0	111	I327 V328 Q333	I327-I331 HydrophobicContact CG2-CD1 3.83Å; I327-I331 WeakPolarHBondContact O-CG1 3.34Å; I327-I331 PolarHBondContact O-N 3.19Å; V328-I331 PolarHBondContact O-N 2.9Å; I331-Q333 PolarHBondContact O-N 3.18Å
332	M	86.4	Confident	91.2	Very high	77 Å²	77	41.4 Å²	41.4	38%	0.379	21%	0.21	S	C	.	.	H	α-helix	trans	-76.1	-9.5	-178.7	-63.4	-61.3	-62.3	0	0	113.7	V328 V329 F330 T334 F356	V328-M332 HydrophobicContact CG1-CG 4.32Å; V328-M332 VanDerWaalsContact O-CG 3.23Å; V328-M332 WeakPolarHBondContact O-CG 3.2Å; V328-M332 PolarHBondContact O-N 3.19Å; V329-M332 PolarHBondContact O-N 2.84Å; F330-M332 VanDerWaalsContact C-N 3.3Å; F330-M332 PolarHBondContact O-N 3.36Å; M332-T334 HydrophobicContact CB-CG2 3.93Å; M332-T334 WeakPolarHBondContact O-CG2 3.35Å; M332-T334 PolarHBondContact O-N 2.92Å; M332-T334 VanDerWaalsContact O-N 3.15Å; M332-F356 HydrophobicContact CB-CE2 4.32Å; M332-F356 HydrophobicContact CB-CZ 4.47Å; M332-F356 HydrophobicContact CE-CE2 4.46Å; M332-F356 HydrophobicContact CE-CZ 4.3Å; M332-F356 HydrophobicContact CG-CE2 4.14Å; M332-F356 HydrophobicContact CG-CZ 3.8Å
333	Q	86.4	Confident	91.1	Very high	111 Å²	111	41.8 Å²	41.8	52%	0.519	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	31.1	179.1	-58.5	-173.6	-16.7	0	0	114.7	V329 F330 I331 V335	V329-Q333 PolarHBondContact O-N 2.63Å; F330-Q333 PolarHBondContact O-N 3.46Å; I331-Q333 PolarHBondContact O-N 3.18Å; Q333-V335 VanDerWaalsContact C-N 3.28Å; Q333-V335 PolarHBondContact O-N 3.13Å
334	T	87.1	Confident	91	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.043	19%	0.19	C	C	.	.			trans	-89.6	28.6	-175.3	56.7	0	0	0	0	113.9	M332 V346 G347 F356	M332-T334 HydrophobicContact CB-CG2 3.93Å; M332-T334 WeakPolarHBondContact O-CG2 3.35Å; M332-T334 PolarHBondContact O-N 2.92Å; M332-T334 VanDerWaalsContact O-N 3.15Å; T334-V346 WeakPolarHBondContact O-CA 3.45Å; T334-V346 WeakPolarHBondContact OG1-CG1 3.33Å; T334-G347 PolarHBondContact O-N 3.35Å; T334-F356 HydrophobicContact CG2-CE2 4.4Å
335	V	89.9	Confident	90.9	Very high	19 Å²	19	34.1 Å²	34.1	12%	0.115	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.5	179.6	174.3	0	0	0	0	109.4	S282 V329 Q333 V346	S282-V335 VanDerWaalsContact CB-CG1 3.5Å; S282-V335 WeakPolarHBondContact OG-CG1 3.34Å; V329-V335 HydrophobicContact CG1-CG2 4.06Å; Q333-V335 VanDerWaalsContact C-N 3.28Å; Q333-V335 PolarHBondContact O-N 3.13Å; V335-V346 HydrophobicContact CG2-CG2 4.23Å
336	D	90.2	Very high	90.8	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.6	-176.2	-52.3	-58.2	0	0	0	110.7	G270 F271 F345 N348 Q349 S350	G270-D336 VanDerWaalsContact CA-OD1 3.22Å; G270-D336 WeakPolarHBondContact CA-OD1 3.36Å; F271-D336 PolarHBondContact N-OD1 3.37Å; F271-D336 VanDerWaalsContact N-OD1 3.14Å; D336-F345 PolarHBondContact N-O 3.31Å; D336-F345 PolarHBondContact O-N 3.32Å; D336-N348 HydrophobicContact CB-CB 4.16Å; D336-N348 PolarHBondContact O-ND2 3.44Å; D336-Q349 HydrophobicContact CB-CB 3.94Å; D336-Q349 HydrophobicContact CB-CG 3.91Å; D336-S350 PolarHBondContact OD2-N 3.15Å; D336-S350 PolarHBondContact OD2-OG 3.24Å; D336-S350 VanDerWaalsContact OD2-OG 3.09Å
337	A	92.2	Very high	90.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	147.6	171.7	0	0	0	0	0	111.3	T254 I268 A269 M343 Q349	T254-A337 HydrophobicContact CG2-CB 4.07Å; I268-A337 HydrophobicContact CG2-CB 3.37Å; I268-A337 WeakPolarHBondContact CG2-O 3.27Å; A269-A337 HydrophobicContact CB-CB 4.27Å; A269-A337 WeakPolarHBondContact O-CB 3.46Å; A269-A337 PolarHBondContact O-N 2.87Å; A337-M343 WeakPolarHBondContact CA-O 3.46Å; A337-Q349 PolarHBondContact O-NE2 2.96Å
338	D	91.8	Very high	90.4	Very high	11 Å²	11	28.1 Å²	28.1	6%	0.059	14%	0.142	C	C	.	.			trans	-98.5	136.4	178.5	176.8	48.6	0	0	0	111.7	T341 G342 M343 N348	D338-T341 WeakPolarHBondContact CB-OG1 3.5Å; D338-T341 VanDerWaalsContact OD2-CB 3.28Å; D338-T341 WeakPolarHBondContact OD2-CB 3.27Å; D338-T341 WeakPolarHBondContact OD2-CG2 3.43Å; D338-T341 PolarHBondContact OD2-N 3.24Å; D338-T341 PolarHBondContact OD2-OG1 2.84Å; D338-G342 VanDerWaalsContact O-CA 3.25Å; D338-G342 WeakPolarHBondContact O-CA 3.41Å; D338-G342 PolarHBondContact O-N 3.39Å; D338-M343 PolarHBondContact N-O 2.89Å; D338-N348 HydrophobicContact CB-CB 4.2Å
339	E	90.4	Very high	90	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.033	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-44.1	-178.4	-169.9	-156	158.8	0	0	112	V182 L183 K189 R250 I268	V182-E339 PolarHBondContact N-OE1 2.9Å; L183-E339 VanDerWaalsContact CB-OE2 3.28Å; L183-E339 WeakPolarHBondContact CB-OE2 3.38Å; L183-E339 PolarHBondContact N-OE1 3.42Å; L183-E339 PolarHBondContact N-OE2 3.16Å; K189-E339 WeakPolarHBondContact CE-OE1 3.33Å; K189-E339 IonicContact NZ-OE1 3.33Å; K189-E339 PolarHBondContact NZ-OE1 3.44Å; R250-E339 PolarHBondContact NH2-O 3.33Å; I268-E339 HydrophobicContact CD1-CB 3.92Å; I268-E339 HydrophobicContact CD1-CG 4.09Å
340	L	93.4	Very high	89.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-55.8	-176.2	178.3	63.1	0	0	0	110.5	F184 Q188 K189 A192 Y469 F472	F184-L340 HydrophobicContact CB-CD1 3.95Å; F184-L340 HydrophobicContact CD1-CD1 3.9Å; F184-L340 HydrophobicContact CD1-CD2 4.32Å; F184-L340 HydrophobicContact CD1-CG 4.48Å; F184-L340 HydrophobicContact CD2-CB 3.63Å; F184-L340 HydrophobicContact CD2-CD1 4.27Å; F184-L340 HydrophobicContact CD2-CG 4.4Å; F184-L340 HydrophobicContact CE1-CD1 4.46Å; F184-L340 HydrophobicContact CE1-CD2 4.06Å; F184-L340 HydrophobicContact CE2-CB 3.73Å; F184-L340 HydrophobicContact CE2-CD2 4.46Å; F184-L340 HydrophobicContact CG-CB 4.04Å; F184-L340 HydrophobicContact CG-CD1 3.77Å; F184-L340 HydrophobicContact CG-CG 4.35Å; F184-L340 HydrophobicContact CZ-CB 4.23Å; F184-L340 HydrophobicContact CZ-CD2 4.12Å; Q188-L340 HydrophobicContact CB-CD1 4.24Å; K189-L340 HydrophobicContact CG-CD1 4.39Å; A192-L340 HydrophobicContact CB-CD1 3.84Å; A192-L340 HydrophobicContact CB-CD2 4.35Å; A192-L340 HydrophobicContact CB-CG 3.86Å; L340-Y469 HydrophobicContact CD1-CD2 4.22Å; L340-Y469 HydrophobicContact CD1-CE2 4.09Å; L340-Y469 HydrophobicContact CD2-CD2 4.33Å; L340-Y469 HydrophobicContact CD2-CE2 4.46Å; L340-F472 HydrophobicContact CD2-CB 3.45Å; L340-F472 VanDerWaalsContact CD2-CB 3.45Å; L340-F472 HydrophobicContact CD2-CD1 4.02Å; L340-F472 HydrophobicContact CD2-CG 3.78Å
341	T	93.7	Very high	89.7	Confident	17 Å²	17	25.7 Å²	25.7	10%	0.104	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-19.6	-171.5	62.1	0	0	0	0	113.3	M196 R246 D338 M343 I476	M196-T341 HydrophobicContact CE-CG2 3.67Å; M196-T341 HydrophobicContact SD-CG2 3.65Å; R246-T341 PolarHBondContact NH1-O 3.32Å; R246-T341 PolarHBondContact NH2-O 3.2Å; D338-T341 WeakPolarHBondContact CB-OG1 3.5Å; D338-T341 VanDerWaalsContact OD2-CB 3.28Å; D338-T341 WeakPolarHBondContact OD2-CB 3.27Å; D338-T341 WeakPolarHBondContact OD2-CG2 3.43Å; D338-T341 PolarHBondContact OD2-N 3.24Å; D338-T341 PolarHBondContact OD2-OG1 2.84Å; T341-M343 PolarHBondContact O-N 3.12Å; T341-M343 PolarHBondContact OG1-N 2.96Å; T341-I476 HydrophobicContact CG2-CD1 4.25Å
342	G	92.4	Very high	89.5	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.			trans	61	28	-172.1	0	0	0	0	0	112.7	R246 T254 D338	R246-G342 WeakPolarHBondContact CG-O 2.96Å; T254-G342 WeakPolarHBondContact CG2-O 3.23Å; D338-G342 VanDerWaalsContact O-CA 3.25Å; D338-G342 WeakPolarHBondContact O-CA 3.41Å; D338-G342 PolarHBondContact O-N 3.39Å
343	M	93.5	Very high	89.5	Confident	8 Å²	8	21.4 Å²	21.4	4%	0.039	10%	0.104	C	C	.	.			trans	-107.9	144.5	176.8	-69	-68.3	-66.2	0	0	110.1	M196 P242 Y243 R246 L285 A337 D338 T341 N348	M196-M343 HydrophobicContact SD-CG 4.32Å; P242-M343 HydrophobicContact CB-CE 3.89Å; Y243-M343 HydrophobicContact CD1-CE 3.8Å; Y243-M343 HydrophobicContact CD1-SD 4.09Å; Y243-M343 HydrophobicContact CD2-CE 4.28Å; Y243-M343 HydrophobicContact CE1-CE 3.95Å; Y243-M343 HydrophobicContact CE1-CG 4.48Å; Y243-M343 HydrophobicContact CE2-CE 4.43Å; Y243-M343 HydrophobicContact CG-CE 3.98Å; R246-M343 HydrophobicContact CB-SD 3.34Å; R246-M343 WeakPolarHBondContact CB-SD 3.41Å; R246-M343 HydrophobicContact CG-CG 4.49Å; R246-M343 HydrophobicContact CG-SD 3.62Å; L285-M343 HydrophobicContact CD2-CE 4.09Å; A337-M343 WeakPolarHBondContact CA-O 3.46Å; D338-M343 PolarHBondContact N-O 2.89Å; T341-M343 PolarHBondContact O-N 3.12Å; T341-M343 PolarHBondContact OG1-N 2.96Å; M343-N348 PolarHBondContact O-ND2 3.38Å
344	C	93.7	Very high	89.7	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.2	170.8	-65.5	0	0	0	0	110.3	C278 S282	C278-C344 WeakPolarHBondContact CA-SG 2.97Å; C278-C344 HydrophobicContact CB-CB 3.97Å; C278-C344 WeakPolarHBondContact CB-SG 3.43Å; C278-C344 WeakPolarHBondContact O-CB 3.46Å; C278-C344 WeakPolarHBondContact SG-CB 3.4Å; C278-C344 CovalentContact SG-SG 2.02Å; C278-C344 PolarHBondContact SG-SG 2.98Å; S282-C344 WeakPolarHBondContact CA-O 3.4Å; S282-C344 WeakPolarHBondContact CB-O 3.36Å
345	F	93.4	Very high	89.9	Confident	18 Å²	18	19.8 Å²	19.8	8%	0.079	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	167.2	176.8	-153.7	-124.9	0	0	0	111.2	S282 L285 Y286 D336 G347 N348 L357	S282-F345 WeakPolarHBondContact OG-CA 3.23Å; L285-F345 HydrophobicContact CB-CD2 4.25Å; L285-F345 HydrophobicContact CB-CE2 4.07Å; L285-F345 HydrophobicContact CD2-CD2 3.65Å; L285-F345 HydrophobicContact CD2-CE2 3.85Å; L285-F345 HydrophobicContact CG-CD2 3.92Å; L285-F345 HydrophobicContact CG-CE2 3.62Å; Y286-F345 HydrophobicContact CD2-CE2 4.28Å; Y286-F345 HydrophobicContact CD2-CZ 4.06Å; D336-F345 PolarHBondContact N-O 3.31Å; D336-F345 PolarHBondContact O-N 3.32Å; F345-G347 PolarHBondContact O-N 3Å; F345-N348 WeakPolarHBondContact CB-ND2 3.42Å; F345-N348 PolarHBondContact N-ND2 3.16Å; F345-L357 HydrophobicContact CD1-CD2 3.81Å; F345-L357 HydrophobicContact CE1-CD1 4.47Å; F345-L357 HydrophobicContact CE1-CD2 3.43Å; F345-L357 VanDerWaalsContact CE1-CD2 3.43Å; F345-L357 HydrophobicContact CE1-CG 4.05Å
346	V	91.7	Very high	89.8	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.006	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	128.3	-178.2	-179.4	0	0	0	0	109.5	Y286 V329 T334 V335 F356 L357	Y286-V346 HydrophobicContact CD2-CB 4.3Å; Y286-V346 HydrophobicContact CD2-CG2 3.84Å; Y286-V346 HydrophobicContact CE2-CB 4.48Å; Y286-V346 HydrophobicContact CE2-CG2 4.29Å; Y286-V346 HydrophobicContact CG-CG2 4.24Å; V329-V346 HydrophobicContact CB-CG2 4.37Å; V329-V346 HydrophobicContact CG1-CB 4.28Å; V329-V346 HydrophobicContact CG1-CG1 3.99Å; V329-V346 HydrophobicContact CG1-CG2 3.28Å; V329-V346 HydrophobicContact CG2-CG1 4.07Å; V329-V346 HydrophobicContact CG2-CG2 4.19Å; T334-V346 WeakPolarHBondContact O-CA 3.45Å; T334-V346 WeakPolarHBondContact OG1-CG1 3.33Å; V335-V346 HydrophobicContact CG2-CG2 4.23Å; V346-F356 HydrophobicContact CG1-CB 4.42Å; V346-L357 HydrophobicContact CB-CD1 3.66Å; V346-L357 HydrophobicContact CG1-CD1 3.78Å; V346-L357 VanDerWaalsContact O-CD1 3.23Å; V346-L357 WeakPolarHBondContact O-CD1 3.41Å
347	G	88.4	Confident	89.9	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.01	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	22.4	172.7	0	0	0	0	0	116.7	T334 F345 Q349 G353	T334-G347 PolarHBondContact O-N 3.35Å; F345-G347 PolarHBondContact O-N 3Å; G347-Q349 VanDerWaalsContact C-N 3.3Å; G347-Q349 PolarHBondContact O-N 2.85Å; G347-G353 VanDerWaalsContact CA-C 3.46Å
348	N	88.6	Confident	89.9	Confident	11 Å²	11	22.8 Å²	22.8	6%	0.059	11%	0.109	C	C	.	.	S	Bend	trans	-67.6	-30.8	175.8	-76.5	-26.5	0	0	0	112.6	D336 D338 M343 F345 R456	D336-N348 HydrophobicContact CB-CB 4.16Å; D336-N348 PolarHBondContact O-ND2 3.44Å; D338-N348 HydrophobicContact CB-CB 4.2Å; M343-N348 PolarHBondContact O-ND2 3.38Å; F345-N348 WeakPolarHBondContact CB-ND2 3.42Å; F345-N348 PolarHBondContact N-ND2 3.16Å; N348-R456 PolarHBondContact O-NH1 2.86Å; N348-R456 PolarHBondContact O-NH2 2.86Å
349	Q	82.8	Confident	90.1	Very high	25 Å²	25	26.5 Å²	26.5	12%	0.117	13%	0.132	C	C	.	.	S	Bend	trans	-115.7	-20.4	179	-61.5	-173.6	40.8	0	0	113	I268 F271 D336 A337 G347	I268-Q349 VanDerWaalsContact CG2-NE2 3.31Å; F271-Q349 HydrophobicContact CZ-CB 4.33Å; D336-Q349 HydrophobicContact CB-CB 3.94Å; D336-Q349 HydrophobicContact CB-CG 3.91Å; A337-Q349 PolarHBondContact O-NE2 2.96Å; G347-Q349 VanDerWaalsContact C-N 3.3Å; G347-Q349 PolarHBondContact O-N 2.85Å
350	S	82.3	Confident	90.2	Very high	29 Å²	29	27.3 Å²	27.3	20%	0.203	14%	0.138	C	C	.	.			trans	-105.8	127.9	-177.2	56.9	0	0	0	0	113.1	D336 Q352 G353 L354	D336-S350 PolarHBondContact OD2-N 3.15Å; D336-S350 PolarHBondContact OD2-OG 3.24Å; D336-S350 VanDerWaalsContact OD2-OG 3.09Å; S350-Q352 VanDerWaalsContact C-N 3.29Å; S350-Q352 PolarHBondContact O-N 3.13Å; S350-G353 PolarHBondContact O-N 3.36Å; S350-G353 PolarHBondContact OG-N 2.95Å; S350-L354 PolarHBondContact O-N 2.65Å
351	R	86.2	Confident	90.3	Very high	72 Å²	72	27.3 Å²	27.3	27%	0.272	14%	0.138	S	C	.	.	H	α-helix	trans	-59.5	-40.2	171.7	-81.8	-173.1	163.7	176.3	-0.8	112.1	L354 Q355 Y453 F454 R456 D457	R351-L354 PolarHBondContact O-N 3.35Å; R351-Q355 PolarHBondContact O-N 2.96Å; R351-Y453 HydrophobicContact CB-CE2 4.44Å; R351-Y453 PolarHBondContact NE-O 2.72Å; R351-Y453 PolarHBondContact NH2-O 2.84Å; R351-Y453 VanDerWaalsContact NH2-O 3.17Å; R351-F454 PolarHBondContact NH2-O 3.3Å; R351-R456 HydrophobicContact CG-CB 4.06Å; R351-R456 HydrophobicContact CG-CG 4.3Å; R351-D457 VanDerWaalsContact CD-OD1 3.23Å; R351-D457 WeakPolarHBondContact CD-OD1 3.46Å; R351-D457 IonicContact CZ-OD1 3.41Å; R351-D457 IonicContact CZ-OD2 3.3Å; R351-D457 VanDerWaalsContact NE-CG 3.35Å; R351-D457 IonicContact NE-OD1 3.35Å; R351-D457 PolarHBondContact NE-OD1 2.62Å; R351-D457 IonicContact NE-OD2 3.81Å; R351-D457 IonicContact NH1-OD1 2.79Å; R351-D457 IonicContact NH1-OD2 3.16Å; R351-D457 PolarHBondContact NH1-OD2 3.31Å; R351-D457 IonicContact NH2-OD2 3.91Å
352	Q	85.1	Confident	90.5	Very high	109 Å²	109	29.2 Å²	29.2	51%	0.509	15%	0.15	S	C	.	.	H	α-helix	trans	-62.4	-42.6	176.5	-170.7	179	22.4	0	0	111.5	S350 L354 Q355 F356	S350-Q352 VanDerWaalsContact C-N 3.29Å; S350-Q352 PolarHBondContact O-N 3.13Å; Q352-L354 VanDerWaalsContact C-N 3.32Å; Q352-L354 PolarHBondContact O-N 3.21Å; Q352-Q355 WeakPolarHBondContact O-CB 3.33Å; Q352-Q355 PolarHBondContact O-N 3.01Å; Q352-F356 HydrophobicContact CG-CE2 4.44Å; Q352-F356 VanDerWaalsContact O-CD2 3.32Å; Q352-F356 WeakPolarHBondContact O-CD2 3.05Å
353	G	86.4	Confident	90.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.5	-42.2	173.4	0	0	0	0	0	112.4	G347 S350 Q355 F356	G347-G353 VanDerWaalsContact CA-C 3.46Å; S350-G353 PolarHBondContact O-N 3.36Å; S350-G353 PolarHBondContact OG-N 2.95Å; G353-Q355 VanDerWaalsContact C-N 3.27Å; G353-Q355 PolarHBondContact O-N 3.32Å; G353-F356 WeakPolarHBondContact O-CB 3.5Å; G353-F356 PolarHBondContact O-N 3.41Å; G353-F356 VanDerWaalsContact O-N 3.08Å
354	L	90.3	Very high	90.8	Very high	3 Å²	3	34 Å²	34	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-28.5	-178.7	-169.8	59.9	0	0	0	112.9	S350 R351 Q352 F356 L357 L358 Y449 E452 Y453	S350-L354 PolarHBondContact O-N 2.65Å; R351-L354 PolarHBondContact O-N 3.35Å; Q352-L354 VanDerWaalsContact C-N 3.32Å; Q352-L354 PolarHBondContact O-N 3.21Å; L354-F356 VanDerWaalsContact C-N 3.27Å; L354-F356 PolarHBondContact O-N 3.01Å; L354-L357 HydrophobicContact CD1-CD2 4.25Å; L354-L357 WeakPolarHBondContact O-CB 3.5Å; L354-L357 PolarHBondContact O-N 2.04Å; L354-L357 VanDerWaalsContact O-N 3.09Å; L354-L358 PolarHBondContact O-N 2.71Å; L354-Y449 HydrophobicContact CD1-CD1 4Å; L354-Y449 HydrophobicContact CD1-CG 4.44Å; L354-E452 HydrophobicContact CD2-CB 3.85Å; L354-Y453 HydrophobicContact CD2-CD2 4.35Å
355	Q	91.2	Very high	90.9	Very high	81 Å²	81	34.9 Å²	34.9	38%	0.379	18%	0.181	S	C	.	.	H	α-helix	trans	-61.5	-34.8	173	-67.5	174.1	-20.5	0	0	112.2	R351 Q352 G353 L357 L358 V359 Y453	R351-Q355 PolarHBondContact O-N 2.96Å; Q352-Q355 WeakPolarHBondContact O-CB 3.33Å; Q352-Q355 PolarHBondContact O-N 3.01Å; G353-Q355 VanDerWaalsContact C-N 3.27Å; G353-Q355 PolarHBondContact O-N 3.32Å; Q355-L357 PolarHBondContact O-N 2.02Å; Q355-L358 PolarHBondContact O-N 2.63Å; Q355-V359 PolarHBondContact O-N 3.02Å; Q355-Y453 HydrophobicContact CG-CD2 4.34Å; Q355-Y453 HydrophobicContact CG-CE2 3.57Å; Q355-Y453 PolarHBondContact NE2-OH 3.3Å
356	F	88.8	Confident	91.1	Very high	51 Å²	51	38 Å²	38	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-68.7	-12	176	-68.9	-73.6	0	0	0	113.9	Y286 V328 V329 M332 T334 V346 Q352 G353 L354 P360	Y286-F356 PolarHBondContact OH-O 3.35Å; Y286-F356 VanDerWaalsContact OH-O 3.13Å; V328-F356 HydrophobicContact CG1-CD1 4.34Å; V328-F356 HydrophobicContact CG1-CE1 3.72Å; V328-F356 HydrophobicContact CG1-CZ 4.33Å; V329-F356 HydrophobicContact CG2-CB 4.46Å; M332-F356 HydrophobicContact CB-CE2 4.32Å; M332-F356 HydrophobicContact CB-CZ 4.47Å; M332-F356 HydrophobicContact CE-CE2 4.46Å; M332-F356 HydrophobicContact CE-CZ 4.3Å; M332-F356 HydrophobicContact CG-CE2 4.14Å; M332-F356 HydrophobicContact CG-CZ 3.8Å; T334-F356 HydrophobicContact CG2-CE2 4.4Å; V346-F356 HydrophobicContact CG1-CB 4.42Å; Q352-F356 HydrophobicContact CG-CE2 4.44Å; Q352-F356 VanDerWaalsContact O-CD2 3.32Å; Q352-F356 WeakPolarHBondContact O-CD2 3.05Å; G353-F356 WeakPolarHBondContact O-CB 3.5Å; G353-F356 PolarHBondContact O-N 3.41Å; G353-F356 VanDerWaalsContact O-N 3.08Å; L354-F356 VanDerWaalsContact C-N 3.27Å; L354-F356 PolarHBondContact O-N 3.01Å; F356-P360 WeakPolarHBondContact O-CD 3.4Å; F356-P360 WeakPolarHBondContact O-CG 3.43Å
357	L	91.1	Very high	91.3	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-93.1	-55.6	167.4	-80.1	66.4	0	0	0	110.6	Y286 F345 V346 L354 Q355 V359 P360 Q361 Y449	Y286-L357 HydrophobicContact CE2-CD1 4.18Å; F345-L357 HydrophobicContact CD1-CD2 3.81Å; F345-L357 HydrophobicContact CE1-CD1 4.47Å; F345-L357 HydrophobicContact CE1-CD2 3.43Å; F345-L357 VanDerWaalsContact CE1-CD2 3.43Å; F345-L357 HydrophobicContact CE1-CG 4.05Å; V346-L357 HydrophobicContact CB-CD1 3.66Å; V346-L357 HydrophobicContact CG1-CD1 3.78Å; V346-L357 VanDerWaalsContact O-CD1 3.23Å; V346-L357 WeakPolarHBondContact O-CD1 3.41Å; L354-L357 HydrophobicContact CD1-CD2 4.25Å; L354-L357 WeakPolarHBondContact O-CB 3.5Å; L354-L357 PolarHBondContact O-N 2.04Å; L354-L357 VanDerWaalsContact O-N 3.09Å; Q355-L357 PolarHBondContact O-N 2.02Å; L357-V359 PolarHBondContact O-N 3.18Å; L357-P360 WeakPolarHBondContact O-CD 3.23Å; L357-Q361 VanDerWaalsContact O-CB 3.3Å; L357-Q361 WeakPolarHBondContact O-CB 3.45Å; L357-Q361 VanDerWaalsContact O-CG 3.28Å; L357-Q361 WeakPolarHBondContact O-CG 3.46Å; L357-Q361 PolarHBondContact O-N 3.14Å; L357-Q361 VanDerWaalsContact O-N 3.1Å; L357-Y449 HydrophobicContact CD2-CD1 4.32Å; L357-Y449 HydrophobicContact CD2-CE1 3.81Å; L357-Y449 HydrophobicContact CD2-CE2 4.37Å
358	L	93.9	Very high	91.6	Very high	33 Å²	33	39.9 Å²	39.9	17%	0.173	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-49	-168.2	-176.3	65.8	0	0	0	111.9	L354 Q355 T362 L446	L354-L358 PolarHBondContact O-N 2.71Å; Q355-L358 PolarHBondContact O-N 2.63Å; L358-T362 VanDerWaalsContact O-CB 3.29Å; L358-T362 WeakPolarHBondContact O-CB 3.26Å; L358-T362 PolarHBondContact O-N 3.49Å; L358-T362 PolarHBondContact O-OG1 2.81Å; L358-L446 HydrophobicContact CD1-CD2 4.19Å
359	V	94.1	Very high	91.9	Very high	89 Å²	89	42 Å²	42	54%	0.539	23%	0.228	S	C	.	.	H	α-helix	trans	-64.4	-54	-176.7	176.4	0	0	0	0	110.7	Q355 L357 Q361 T362 V363	Q355-V359 PolarHBondContact O-N 3.02Å; L357-V359 PolarHBondContact O-N 3.18Å; V359-Q361 PolarHBondContact O-N 3.09Å; V359-T362 PolarHBondContact O-N 2.78Å; V359-V363 WeakPolarHBondContact O-CG2 3.46Å; V359-V363 PolarHBondContact O-N 2.93Å
360	P	94	Very high	92.5	Very high	24 Å²	24	45.2 Å²	45.2	16%	0.156	25%	0.249	C	C	.	.	H	α-helix	trans	-71.8	-30.4	-173.7	-19	35.1	0	0	0	113.6	K325 F356 L357 Y364	K325-P360 HydrophobicContact CD-CB 4.48Å; F356-P360 WeakPolarHBondContact O-CD 3.4Å; F356-P360 WeakPolarHBondContact O-CG 3.43Å; L357-P360 WeakPolarHBondContact O-CD 3.23Å; P360-Y364 PolarHBondContact O-N 3.29Å
361	Q	95.4	Very high	93	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-71.1	-36.7	174.1	-70.6	-176.6	0.8	0	0	112	M290 L357 V359 V363 Y364 L365 H442 L446	M290-Q361 HydrophobicContact CE-CG 3.89Å; L357-Q361 VanDerWaalsContact O-CB 3.3Å; L357-Q361 WeakPolarHBondContact O-CB 3.45Å; L357-Q361 VanDerWaalsContact O-CG 3.28Å; L357-Q361 WeakPolarHBondContact O-CG 3.46Å; L357-Q361 PolarHBondContact O-N 3.14Å; L357-Q361 VanDerWaalsContact O-N 3.1Å; V359-Q361 PolarHBondContact O-N 3.09Å; Q361-V363 VanDerWaalsContact C-N 3.35Å; Q361-Y364 PolarHBondContact O-N 2.6Å; Q361-L365 PolarHBondContact O-N 2.96Å; Q361-H442 PolarHBondContact O-CE1 3.32Å; Q361-L446 HydrophobicContact CB-CD2 3.7Å
362	T	96.6	Very high	93.2	Very high	57 Å²	57	42.7 Å²	42.7	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-62	-45.2	173.2	-58.2	0	0	0	0	110.7	L358 V359 Y364 L365 V366	L358-T362 VanDerWaalsContact O-CB 3.29Å; L358-T362 WeakPolarHBondContact O-CB 3.26Å; L358-T362 PolarHBondContact O-N 3.49Å; L358-T362 PolarHBondContact O-OG1 2.81Å; V359-T362 PolarHBondContact O-N 2.78Å; T362-Y364 VanDerWaalsContact C-N 3.33Å; T362-Y364 PolarHBondContact O-N 2.87Å; T362-L365 PolarHBondContact O-N 3.37Å; T362-V366 WeakPolarHBondContact O-CG2 3.25Å; T362-V366 PolarHBondContact O-N 3.47Å
363	V	96.6	Very high	93.6	Very high	87 Å²	87	41.3 Å²	41.3	53%	0.527	24%	0.239	S	C	.	.	H	α-helix	trans	-58.7	-44.9	175.2	171.9	0	0	0	0	111.2	V359 Q361 V366 A367	V359-V363 WeakPolarHBondContact O-CG2 3.46Å; V359-V363 PolarHBondContact O-N 2.93Å; Q361-V363 VanDerWaalsContact C-N 3.35Å; V363-V366 PolarHBondContact O-N 2.92Å; V363-A367 VanDerWaalsContact O-CB 3.22Å; V363-A367 WeakPolarHBondContact O-CB 3.42Å; V363-A367 PolarHBondContact O-N 3.4Å
364	Y	96.3	Very high	93.8	Very high	20 Å²	20	44.8 Å²	44.8	8%	0.078	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-41.4	178.2	-72.1	-15.2	0	0	0	113.3	M290 H293 V294 I297 K325 P360 Q361 T362 A367 G368	M290-Y364 HydrophobicContact SD-CE2 3.98Å; H293-Y364 HydrophobicContact CB-CD2 3.32Å; H293-Y364 HydrophobicContact CB-CE2 3.9Å; H293-Y364 HydrophobicContact CB-CG 4.06Å; H293-Y364 AromaticContact CG-CD2 3.87Å; V294-Y364 HydrophobicContact CG2-CE1 4.2Å; V294-Y364 HydrophobicContact CG2-CE2 3.96Å; I297-Y364 HydrophobicContact CD1-CD1 3.88Å; I297-Y364 HydrophobicContact CD1-CG 4.12Å; K325-Y364 VanDerWaalsContact CE-OH 3.28Å; K325-Y364 WeakPolarHBondContact CE-OH 3.39Å; K325-Y364 PolarHBondContact NZ-OH 3.3Å; P360-Y364 PolarHBondContact O-N 3.29Å; Q361-Y364 PolarHBondContact O-N 2.6Å; T362-Y364 VanDerWaalsContact C-N 3.33Å; T362-Y364 PolarHBondContact O-N 2.87Å; Y364-A367 PolarHBondContact O-N 3.45Å; Y364-G368 PolarHBondContact O-N 2.94Å; Y364-G368 VanDerWaalsContact O-N 3.08Å
365	L	96.5	Very high	93.6	Very high	20 Å²	20	45.4 Å²	45.4	11%	0.105	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-51.4	175.4	-177.6	61.8	0	0	0	110.7	W296 Q361 T362 A367 G368 L369 L446	W296-L365 HydrophobicContact CH2-CD1 4.07Å; W296-L365 HydrophobicContact CZ3-CD1 4.38Å; Q361-L365 PolarHBondContact O-N 2.96Å; T362-L365 PolarHBondContact O-N 3.37Å; L365-A367 VanDerWaalsContact C-N 3.33Å; L365-A367 PolarHBondContact O-N 2.96Å; L365-G368 PolarHBondContact O-N 3.38Å; L365-L369 HydrophobicContact CD1-CD1 4.35Å; L365-L369 HydrophobicContact CD1-CG 4.29Å; L365-L369 HydrophobicContact CG-CD1 3.98Å; L365-L369 HydrophobicContact CG-CG 4.35Å; L365-L369 WeakPolarHBondContact O-CB 3.44Å; L365-L369 VanDerWaalsContact O-CG 3.26Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 3.48Å; L365-L446 HydrophobicContact CB-CD1 4.33Å; L365-L446 HydrophobicContact CD2-CD1 3.56Å
366	V	96.5	Very high	93.5	Very high	84 Å²	84	47.8 Å²	47.8	51%	0.509	27%	0.274	S	S	.	.	H	α-helix	trans	-59.9	-44.4	179.1	174.7	0	0	0	0	110.8	T362 V363 G368 L369 V370	T362-V366 WeakPolarHBondContact O-CG2 3.25Å; T362-V366 PolarHBondContact O-N 3.47Å; V363-V366 PolarHBondContact O-N 2.92Å; V366-G368 VanDerWaalsContact C-N 3.31Å; V366-G368 PolarHBondContact O-N 3.02Å; V366-L369 PolarHBondContact O-N 3.43Å; V366-V370 PolarHBondContact O-N 3.36Å
367	A	96.1	Very high	93.4	Very high	41 Å²	41	49.5 Å²	49.5	34%	0.339	29%	0.289	S	S	.	.	H	α-helix	trans	-61.1	-35	179.9	0	0	0	0	0	113.4	I297 V363 Y364 L365 P371	I297-A367 HydrophobicContact CD1-CB 4.04Å; V363-A367 VanDerWaalsContact O-CB 3.22Å; V363-A367 WeakPolarHBondContact O-CB 3.42Å; V363-A367 PolarHBondContact O-N 3.4Å; Y364-A367 PolarHBondContact O-N 3.45Å; L365-A367 VanDerWaalsContact C-N 3.33Å; L365-A367 PolarHBondContact O-N 2.96Å; A367-P371 WeakPolarHBondContact O-CD 3.44Å
368	G	95.2	Very high	93.2	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-86.3	-25	175.7	0	0	0	0	0	114.3	Y364 L365 V366 V370 P371 L372	Y364-G368 PolarHBondContact O-N 2.94Å; Y364-G368 VanDerWaalsContact O-N 3.08Å; L365-G368 PolarHBondContact O-N 3.38Å; V366-G368 VanDerWaalsContact C-N 3.31Å; V366-G368 PolarHBondContact O-N 3.02Å; G368-V370 VanDerWaalsContact C-N 3.3Å; G368-V370 PolarHBondContact O-N 3.37Å; G368-P371 VanDerWaalsContact O-CD 3.27Å; G368-P371 WeakPolarHBondContact O-CD 3.28Å; G368-P371 WeakPolarHBondContact O-CG 2.79Å; G368-L372 VanDerWaalsContact O-CB 3.29Å; G368-L372 WeakPolarHBondContact O-CB 3.39Å; G368-L372 PolarHBondContact O-N 3.25Å; G368-L372 VanDerWaalsContact O-N 3.12Å
369	L	95.4	Very high	92.6	Very high	55 Å²	55	54.3 Å²	54.3	29%	0.288	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-34.9	172.9	-76.1	175	0	0	0	112.4	L365 V366 L372 T373 V439	L365-L369 HydrophobicContact CD1-CD1 4.35Å; L365-L369 HydrophobicContact CD1-CG 4.29Å; L365-L369 HydrophobicContact CG-CD1 3.98Å; L365-L369 HydrophobicContact CG-CG 4.35Å; L365-L369 WeakPolarHBondContact O-CB 3.44Å; L365-L369 VanDerWaalsContact O-CG 3.26Å; L365-L369 WeakPolarHBondContact O-CG 3.45Å; L365-L369 PolarHBondContact O-N 3.48Å; V366-L369 PolarHBondContact O-N 3.43Å; L369-L372 HydrophobicContact CD2-CD2 4.27Å; L369-L372 PolarHBondContact O-N 3.26Å; L369-T373 WeakPolarHBondContact O-CB 3.39Å; L369-T373 VanDerWaalsContact O-CG2 3.29Å; L369-T373 WeakPolarHBondContact O-CG2 3.44Å; L369-T373 PolarHBondContact O-N 3.34Å; L369-T373 PolarHBondContact O-OG1 3.1Å; L369-V439 HydrophobicContact CD2-CG1 4.15Å; L369-V439 HydrophobicContact CD2-CG2 3.64Å
370	V	93.9	Very high	92.2	Very high	93 Å²	93	53.7 Å²	53.7	56%	0.564	30%	0.303	S	S	*	.	H	α-helix	trans	-57.3	-58.2	177.1	174.1	0	0	0	0	112.5	V366 G368 L372 T373 L374	V366-V370 PolarHBondContact O-N 3.36Å; G368-V370 VanDerWaalsContact C-N 3.3Å; G368-V370 PolarHBondContact O-N 3.37Å; V370-L372 VanDerWaalsContact C-N 3.35Å; V370-L372 PolarHBondContact O-N 3.02Å; V370-T373 PolarHBondContact O-OG1 3.22Å; V370-L374 WeakPolarHBondContact O-CB 3.43Å; V370-L374 PolarHBondContact O-N 2.9Å; V370-L374 VanDerWaalsContact O-N 3.09Å
371	P	92.8	Very high	91.8	Very high	20 Å²	20	60.5 Å²	60.5	13%	0.13	33%	0.326	C	S	.	.	H	α-helix	trans	-66.9	-33.7	175.9	23.5	-31.4	0	0	0	112.7	C300 A301 A304 A367 G368 T373 L374 G375	C300-P371 HydrophobicContact CB-CB 4.36Å; C300-P371 HydrophobicContact CB-CG 3.84Å; A301-P371 HydrophobicContact CB-CB 4.46Å; A304-P371 HydrophobicContact CB-CB 4.01Å; A304-P371 WeakPolarHBondContact CB-O 3.34Å; A367-P371 WeakPolarHBondContact O-CD 3.44Å; G368-P371 VanDerWaalsContact O-CD 3.27Å; G368-P371 WeakPolarHBondContact O-CD 3.28Å; G368-P371 WeakPolarHBondContact O-CG 2.79Å; P371-T373 PolarHBondContact O-N 3.45Å; P371-L374 PolarHBondContact O-N 3.3Å; P371-G375 PolarHBondContact O-N 2.96Å
372	L	92.4	Very high	91.2	Very high	28 Å²	28	65.2 Å²	65.2	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-46.4	178.1	-174.1	69.8	0	0	0	112	C300 G368 L369 V370 G375 F376 A435 A436 V439	C300-L372 HydrophobicContact CB-CB 4.4Å; G368-L372 VanDerWaalsContact O-CB 3.29Å; G368-L372 WeakPolarHBondContact O-CB 3.39Å; G368-L372 PolarHBondContact O-N 3.25Å; G368-L372 VanDerWaalsContact O-N 3.12Å; L369-L372 HydrophobicContact CD2-CD2 4.27Å; L369-L372 PolarHBondContact O-N 3.26Å; V370-L372 VanDerWaalsContact C-N 3.35Å; V370-L372 PolarHBondContact O-N 3.02Å; L372-G375 PolarHBondContact O-N 3.17Å; L372-F376 PolarHBondContact O-N 3.18Å; L372-A435 HydrophobicContact CD1-CB 4.1Å; L372-A436 HydrophobicContact CD1-CB 4.34Å; L372-A436 HydrophobicContact CD2-CB 4.14Å; L372-V439 HydrophobicContact CD2-CG2 4.04Å
373	T	91.7	Very high	90.4	Very high	80 Å²	80	66.9 Å²	66.9	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-66.8	-40.9	176.5	53.2	0	0	0	0	111.9	L369 V370 P371 G375 F376 V377	L369-T373 WeakPolarHBondContact O-CB 3.39Å; L369-T373 VanDerWaalsContact O-CG2 3.29Å; L369-T373 WeakPolarHBondContact O-CG2 3.44Å; L369-T373 PolarHBondContact O-N 3.34Å; L369-T373 PolarHBondContact O-OG1 3.1Å; V370-T373 PolarHBondContact O-OG1 3.22Å; P371-T373 PolarHBondContact O-N 3.45Å; T373-G375 PolarHBondContact O-N 2.95Å; T373-F376 PolarHBondContact O-N 2.7Å; T373-V377 WeakPolarHBondContact O-CG2 3.46Å; T373-V377 PolarHBondContact O-N 3.26Å
374	L	91	Very high	89.8	Confident	72 Å²	72	69.3 Å²	69.3	38%	0.377	37%	0.373	S	S	.	.	H	α-helix	trans	-58.2	-48.2	174	179.1	62.5	0	0	0	111.7	Q305 V370 P371 F376 V377 I378	Q305-L374 HydrophobicContact CG-CD2 4.41Å; V370-L374 WeakPolarHBondContact O-CB 3.43Å; V370-L374 PolarHBondContact O-N 2.9Å; V370-L374 VanDerWaalsContact O-N 3.09Å; P371-L374 PolarHBondContact O-N 3.3Å; L374-F376 VanDerWaalsContact C-N 3.31Å; L374-F376 PolarHBondContact O-N 3.31Å; L374-V377 PolarHBondContact O-N 3.15Å; L374-I378 HydrophobicContact CD1-CD1 4.12Å; L374-I378 HydrophobicContact CD1-CG1 4.38Å; L374-I378 HydrophobicContact CG-CD1 3.94Å; L374-I378 VanDerWaalsContact O-CG1 3.29Å; L374-I378 WeakPolarHBondContact O-CG1 3.48Å; L374-I378 PolarHBondContact O-N 3.27Å
375	G	87.2	Confident	88.6	Confident	17 Å²	17	70.5 Å²	70.5	18%	0.175	39%	0.392	C	S	.	.	H	α-helix	trans	-61.8	-38.4	177.4	0	0	0	0	0	112.7	P371 L372 T373 K379	P371-G375 PolarHBondContact O-N 2.96Å; L372-G375 PolarHBondContact O-N 3.17Å; T373-G375 PolarHBondContact O-N 2.95Å; G375-K379 WeakPolarHBondContact O-CB 3.41Å; G375-K379 PolarHBondContact O-N 3.09Å; G375-K379 VanDerWaalsContact O-N 3.12Å
376	F	87.4	Confident	86.8	Confident	130 Å²	130	72.8 Å²	72.8	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-64.2	-45.7	174.3	-178.8	-109.1	0	0	0	112.2	L372 T373 L374 K379 L380	L372-F376 PolarHBondContact O-N 3.18Å; T373-F376 PolarHBondContact O-N 2.7Å; L374-F376 VanDerWaalsContact C-N 3.31Å; L374-F376 PolarHBondContact O-N 3.31Å; F376-K379 PolarHBondContact O-N 3.2Å; F376-L380 HydrophobicContact CD1-CD1 3.74Å; F376-L380 HydrophobicContact CD1-CG 4.27Å; F376-L380 HydrophobicContact CE1-CD1 3.22Å; F376-L380 HydrophobicContact CE1-CG 3.95Å; F376-L380 HydrophobicContact CE2-CD1 4.33Å; F376-L380 HydrophobicContact CE2-CD2 4.35Å; F376-L380 HydrophobicContact CE2-CG 4.2Å; F376-L380 HydrophobicContact CG-CD1 4.49Å; F376-L380 HydrophobicContact CZ-CD1 3.57Å; F376-L380 HydrophobicContact CZ-CD2 4.08Å; F376-L380 HydrophobicContact CZ-CG 3.9Å; F376-L380 WeakPolarHBondContact O-CB 3.34Å; F376-L380 WeakPolarHBondContact O-CG 3.33Å; F376-L380 PolarHBondContact O-N 3.41Å
377	V	88.4	Confident	84.5	Confident	88 Å²	88	76.4 Å²	76.4	53%	0.533	44%	0.436	S	S	.	.	H	α-helix	trans	-63.2	-44.3	177.9	170.9	0	0	0	0	111.7	T373 L374 K379 L380 R381	T373-V377 WeakPolarHBondContact O-CG2 3.46Å; T373-V377 PolarHBondContact O-N 3.26Å; L374-V377 PolarHBondContact O-N 3.15Å; V377-K379 VanDerWaalsContact C-N 3.3Å; V377-K379 PolarHBondContact O-N 3.08Å; V377-L380 PolarHBondContact O-N 2.93Å; V377-R381 WeakPolarHBondContact O-CB 3.39Å; V377-R381 PolarHBondContact O-N 2.64Å
378	I	85.2	Confident	82.1	Confident	53 Å²	53	78.4 Å²	78.4	27%	0.272	45%	0.453	S	S	.	.	H	α-helix	trans	-56.7	-48.3	176.2	-69.1	165.1	0	0	0	109.8	L374 R381 D382	L374-I378 HydrophobicContact CD1-CD1 4.12Å; L374-I378 HydrophobicContact CD1-CG1 4.38Å; L374-I378 HydrophobicContact CG-CD1 3.94Å; L374-I378 VanDerWaalsContact O-CG1 3.29Å; L374-I378 WeakPolarHBondContact O-CG1 3.48Å; L374-I378 PolarHBondContact O-N 3.27Å; I378-R381 WeakPolarHBondContact O-CB 3.48Å; I378-R381 PolarHBondContact O-N 3.27Å; I378-D382 VanDerWaalsContact O-CG 3.25Å; I378-D382 PolarHBondContact O-N 3.29Å
379	K	82.2	Confident	79.6	Confident	82 Å²	82	81.7 Å²	81.7	36%	0.357	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-40	-179.3	-170.3	176	-178.8	-173.2	0	113.2	G375 F376 V377 R381 D382 C383 T429	G375-K379 WeakPolarHBondContact O-CB 3.41Å; G375-K379 PolarHBondContact O-N 3.09Å; G375-K379 VanDerWaalsContact O-N 3.12Å; F376-K379 PolarHBondContact O-N 3.2Å; V377-K379 VanDerWaalsContact C-N 3.3Å; V377-K379 PolarHBondContact O-N 3.08Å; K379-R381 VanDerWaalsContact C-N 3.33Å; K379-D382 PolarHBondContact O-N 3.12Å; K379-C383 PolarHBondContact O-N 3.38Å; K379-C383 PolarHBondContact O-SG 3.03Å; K379-C383 VanDerWaalsContact O-SG 3.35Å; K379-T429 WeakPolarHBondContact CE-OG1 3.09Å; K379-T429 PolarHBondContact NZ-OG1 3.4Å
380	L	85	Confident	77	Confident	75 Å²	75	86.4 Å²	86.4	39%	0.393	51%	0.512	S	S	.	.	H	α-helix	trans	-60.9	-43.4	173.1	-78.4	-178.1	0	0	0	111.3	F376 V377 D382 C383 L384	F376-L380 HydrophobicContact CD1-CD1 3.74Å; F376-L380 HydrophobicContact CD1-CG 4.27Å; F376-L380 HydrophobicContact CE1-CD1 3.22Å; F376-L380 HydrophobicContact CE1-CG 3.95Å; F376-L380 HydrophobicContact CE2-CD1 4.33Å; F376-L380 HydrophobicContact CE2-CD2 4.35Å; F376-L380 HydrophobicContact CE2-CG 4.2Å; F376-L380 HydrophobicContact CG-CD1 4.49Å; F376-L380 HydrophobicContact CZ-CD1 3.57Å; F376-L380 HydrophobicContact CZ-CD2 4.08Å; F376-L380 HydrophobicContact CZ-CG 3.9Å; F376-L380 WeakPolarHBondContact O-CB 3.34Å; F376-L380 WeakPolarHBondContact O-CG 3.33Å; F376-L380 PolarHBondContact O-N 3.41Å; V377-L380 PolarHBondContact O-N 2.93Å; L380-D382 VanDerWaalsContact C-N 3.32Å; L380-D382 PolarHBondContact O-N 2.94Å; L380-C383 PolarHBondContact O-N 3.04Å; L380-L384 WeakPolarHBondContact O-CB 3.49Å; L380-L384 VanDerWaalsContact O-CG 3.3Å; L380-L384 WeakPolarHBondContact O-CG 3.35Å; L380-L384 PolarHBondContact O-N 2.73Å
381	R	87	Confident	74.3	Confident	168 Å²	168	87 Å²	87	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-59.7	-43.9	176.1	-175.6	-174.5	68.3	168.3	0.5	111.2	V377 I378 K379 C383 L384 G385	V377-R381 WeakPolarHBondContact O-CB 3.39Å; V377-R381 PolarHBondContact O-N 2.64Å; I378-R381 WeakPolarHBondContact O-CB 3.48Å; I378-R381 PolarHBondContact O-N 3.27Å; K379-R381 VanDerWaalsContact C-N 3.33Å; R381-C383 VanDerWaalsContact C-N 3.33Å; R381-C383 PolarHBondContact O-N 2.97Å; R381-L384 PolarHBondContact O-N 3.45Å; R381-G385 PolarHBondContact O-N 2.84Å
382	D	81.2	Confident	71.7	Confident	99 Å²	99	93.8 Å²	93.8	53%	0.529	56%	0.555	S	S	.	*	H	α-helix	trans	-65.5	-37.2	178.4	-62.9	-13.9	0	0	0	111.5	I378 K379 L380 G386	I378-D382 VanDerWaalsContact O-CG 3.25Å; I378-D382 PolarHBondContact O-N 3.29Å; K379-D382 PolarHBondContact O-N 3.12Å; L380-D382 VanDerWaalsContact C-N 3.32Å; L380-D382 PolarHBondContact O-N 2.94Å; D382-G386 PolarHBondContact O-N 3.02Å
383	C	80.3	Confident	69.4	Low	92 Å²	92	97.7 Å²	97.7	62%	0.622	58%	0.582	S	S	*	*	H	α-helix	trans	-67.7	-38.2	174.2	-72.2	0	0	0	0	113.4	K379 L380 R381	K379-C383 PolarHBondContact O-N 3.38Å; K379-C383 PolarHBondContact O-SG 3.03Å; K379-C383 VanDerWaalsContact O-SG 3.35Å; L380-C383 PolarHBondContact O-N 3.04Å; R381-C383 VanDerWaalsContact C-N 3.33Å; R381-C383 PolarHBondContact O-N 2.97Å
384	L	83.7	Confident	66.8	Low	138 Å²	138	99.7 Å²	99.7	72%	0.723	60%	0.599	S	S	*	*	H	α-helix	trans	-79.9	-37.7	-179.8	-67.2	172.3	0	0	0	112.2	L380 R381	L380-L384 WeakPolarHBondContact O-CB 3.49Å; L380-L384 VanDerWaalsContact O-CG 3.3Å; L380-L384 WeakPolarHBondContact O-CG 3.35Å; L380-L384 PolarHBondContact O-N 2.73Å; R381-L384 PolarHBondContact O-N 3.45Å
385	G	72.1	Confident	64.5	Low	46 Å²	46	104.9 Å²	104.9	47%	0.474	62%	0.622	S	S	.	*	H	α-helix	trans	-75.8	-19	-178.6	0	0	0	0	0	114.5	R381 N387 A388	R381-G385 PolarHBondContact O-N 2.84Å; G385-N387 PolarHBondContact O-N 3.36Å; G385-A388 PolarHBondContact O-N 3.06Å
386	G	57.4	Low	62.3	Low	67 Å²	67	109.7 Å²	109.7	69%	0.691	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-4.3	176.3	0	0	0	0	0	115.6	D382	D382-G386 PolarHBondContact O-N 3.02Å
387	N	48.3	Very low	59.9	Low	160 Å²	160	110.2 Å²	110.2	86%	0.856	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	0.9	177.6	-109.5	1.7	0	0	0	114.9	G385	G385-N387 PolarHBondContact O-N 3.36Å
388	A	46.1	Very low	57.7	Low	83 Å²	83	112.7 Å²	112.7	69%	0.686	68%	0.679	S	S	*	*	S	Bend	trans	-101	11.4	-173.4	0	0	0	0	0	115.3	G385	G385-A388 PolarHBondContact O-N 3.06Å
389	G	43.7	Very low	55.7	Low	69 Å²	69	115.6 Å²	115.6	71%	0.711	70%	0.704	S	S	*	*			trans	-103.6	9.4	-169.5	0	0	0	0	0	118.3
390	N	40.2	Very low	53.9	Low	154 Å²	154	117.7 Å²	117.7	82%	0.824	73%	0.729	S	S	*	*			trans	-104.1	26.8	-177.3	-90.6	7.8	0	0	0	115.1	L392	N390-L392 PolarHBondContact O-N 3.04Å
391	S	36.7	Very low	52.1	Low	107 Å²	107	120 Å²	120	75%	0.748	75%	0.751	S	S	*	*			trans	-90.2	80	169.3	41.4	0	0	0	0	110.9
392	L	39.7	Very low	50.3	Low	162 Å²	162	115.4 Å²	115.4	85%	0.848	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-73.3	130.1	165.1	-156.9	79	0	0	0	108.7	N390 S394	N390-L392 PolarHBondContact O-N 3.04Å; L392-S394 PolarHBondContact O-N 2.83Å
393	P	42.8	Very low	48.4	Very low	109 Å²	109	116.3 Å²	116.3	71%	0.708	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-70.2	125.7	173.5	15.2	-10.2	0	0	0	109.9	Q395	P393-Q395 PolarHBondContact O-N 2.9Å
394	S	37.2	Very low	46.9	Very low	122 Å²	122	118.2 Å²	118.2	85%	0.853	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-58.7	119.6	169	34.8	0	0	0	0	110.6	L392	L392-S394 PolarHBondContact O-N 2.83Å
395	Q	42.9	Very low	45.3	Very low	182 Å²	182	118.2 Å²	118.2	85%	0.85	78%	0.782	S	S	*	*			trans	-112.3	144.1	160.2	-78.4	-136.8	-19.1	0	0	110.8	P393	P393-Q395 PolarHBondContact O-N 2.9Å
396	P	40	Very low	43.6	Very low	118 Å²	118	123 Å²	123	77%	0.766	80%	0.797	S	S	*	*			trans	-82.8	146.9	-171.7	9.4	8.6	0	0	0	112.2
397	V	38.4	Very low	43	Very low	140 Å²	140	129.9 Å²	129.9	85%	0.848	80%	0.802	S	S	*	*			trans	-67.8	130	178.3	176.4	0	0	0	0	111.1
398	T	42.3	Very low	42.7	Very low	141 Å²	141	133.5 Å²	133.5	87%	0.865	80%	0.803	S	S	*	*			trans	-129.4	128.7	154.7	41.2	0	0	0	0	110.7
399	S	41.8	Very low	42.4	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	80%	0.803	S	S	*	*			trans	-63.3	139.5	-174.5	49.1	0	0	0	0	115.7
400	S	45.6	Very low	42.5	Very low	126 Å²	126	138 Å²	138	88%	0.881	80%	0.8	S	S	*	*			trans	-160	150.9	131.9	67.4	0	0	0	0	111.4
401	S	47.4	Very low	42.4	Very low	124 Å²	124	137 Å²	137	87%	0.867	80%	0.8	S	S	*	*			trans	-79.9	141.3	-160.9	46.9	0	0	0	0	116
402	G	48.1	Very low	42.6	Very low	72 Å²	72	137 Å²	137	74%	0.742	80%	0.796	S	S	*	*			trans	-170.8	125.8	160.5	0	0	0	0	0	110.5
403	P	42.4	Very low	42.5	Very low	117 Å²	117	135.9 Å²	135.9	76%	0.76	79%	0.789	S	S	*	*			trans	-90.6	158.7	-173.2	36.8	-33	0	0	0	112.1
404	T	47.4	Very low	42.5	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	78%	0.782	S	S	*	*			trans	79.8	101.4	164	70.1	0	0	0	0	117.8
405	V	50.1	Low	42.3	Very low	138 Å²	138	137.5 Å²	137.5	84%	0.836	78%	0.777	S	S	*	*				-174.1	117.2	107.9	158.9	0	0	0	0	107	R407	V405-R407 PolarHBondContact O-N 3.21Å
406	D	36.3	Very low	42.2	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	77%	0.769	S	S	*	*			trans	-76.7	109.7	-179.6	-155.6	-7.3	0	0	0	109.5
407	R	45.5	Very low	42.1	Very low	212 Å²	212	133.1 Å²	133.1	80%	0.8	76%	0.759	S	S	*	*			trans	-144.2	79.2	160.1	-155.3	173.7	-167.3	166.2	3.5	109.1	V405 Q409	V405-R407 PolarHBondContact O-N 3.21Å; R407-Q409 VanDerWaalsContact C-N 3.28Å; R407-Q409 PolarHBondContact O-N 3.1Å
408	R	41.5	Very low	42.2	Very low	235 Å²	235	134 Å²	134	89%	0.887	76%	0.758	S	S	*	*			trans	-56.2	94.2	158.5	-77.6	-176.5	-169.9	-170.7	2	108.9
409	Q	40.3	Very low	42	Very low	146 Å²	146	138.6 Å²	138.6	68%	0.682	76%	0.76	S	S	*	*			trans	-101.1	110.5	159.8	-156.4	158.6	-4	0	0	105.6	R407 T411	R407-Q409 VanDerWaalsContact C-N 3.28Å; R407-Q409 PolarHBondContact O-N 3.1Å; Q409-T411 PolarHBondContact O-N 3.27Å
410	P	45	Very low	41.8	Very low	100 Å²	100	139.3 Å²	139.3	65%	0.649	75%	0.751	S	S	*	*			trans	-64.7	116.3	175.2	26.5	-28.8	0	0	0	106.4	T412	P410-T412 PolarHBondContact O-N 3.34Å
411	T	39.9	Very low	41.8	Very low	133 Å²	133	138 Å²	138	82%	0.816	73%	0.73	S	S	*	*			trans	-65.4	81.2	160.5	48	0	0	0	0	106.6	Q409 I413	Q409-T411 PolarHBondContact O-N 3.27Å; T411-I413 VanDerWaalsContact C-N 3.26Å; T411-I413 PolarHBondContact O-N 2.9Å
412	T	39.4	Very low	41.7	Very low	108 Å²	108	136.4 Å²	136.4	66%	0.663	72%	0.715	S	S	*	*			trans	-63.7	99	161.4	36.1	0	0	0	0	105.8	P410 V414	P410-T412 PolarHBondContact O-N 3.34Å; T412-V414 PolarHBondContact O-N 3.2Å
413	I	38.3	Very low	42	Very low	139 Å²	139	138.5 Å²	138.5	71%	0.713	72%	0.716	S	S	*	*			trans	-60.7	87.9	157.2	-62.9	174.7	0	0	0	104.6	T411 K415	T411-I413 VanDerWaalsContact C-N 3.26Å; T411-I413 PolarHBondContact O-N 2.9Å; I413-K415 VanDerWaalsContact C-N 3.29Å; I413-K415 PolarHBondContact O-N 3.45Å
414	V	41.6	Very low	42.6	Very low	93 Å²	93	136.5 Å²	136.5	56%	0.564	71%	0.71	S	S	*	*			trans	-64.2	100.4	168.1	176.6	0	0	0	0	104.2	T412 P416	T412-V414 PolarHBondContact O-N 3.2Å; V414-P416 VanDerWaalsContact O-N 3.14Å
415	K	34.6	Very low	43.3	Very low	172 Å²	172	132.2 Å²	132.2	75%	0.748	69%	0.685	S	S	*	*			trans	-45.5	124	159.1	-75.6	-179.4	177	178	0	105.1	I413 N417	I413-K415 VanDerWaalsContact C-N 3.29Å; I413-K415 PolarHBondContact O-N 3.45Å; K415-N417 PolarHBondContact O-N 2.99Å
416	P	39.7	Very low	43.7	Very low	103 Å²	103	127.7 Å²	127.7	67%	0.669	66%	0.662	S	S	*	*			trans	-55.9	115.2	173	23.4	-29.5	0	0	0	105	V414 L418	V414-P416 VanDerWaalsContact O-N 3.14Å; P416-L418 PolarHBondContact O-N 3.49Å
417	N	39	Very low	44.9	Very low	105 Å²	105	122.4 Å²	122.4	56%	0.561	64%	0.636	S	S	*	*			trans	-52.5	139.5	171	-66.5	-38	0	0	0	105.1	K415 W419 Q420	K415-N417 PolarHBondContact O-N 2.99Å; N417-W419 PolarHBondContact O-N 2.92Å; N417-Q420 WeakPolarHBondContact O-CB 3.42Å; N417-Q420 PolarHBondContact O-N 2.92Å
418	L	39.7	Very low	46.2	Very low	159 Å²	159	116.1 Å²	116.1	83%	0.832	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51	-15.6	-178.3	-156.8	76.3	0	0	0	113.3	P416	P416-L418 PolarHBondContact O-N 3.49Å
419	W	38.2	Very low	48	Very low	237 Å²	237	106.4 Å²	106.4	90%	0.898	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-5.2	176.7	-54.3	104.5	0	0	0	115.8	N417 Q421	N417-W419 PolarHBondContact O-N 2.92Å; W419-Q421 VanDerWaalsContact C-N 3.25Å; W419-Q421 PolarHBondContact O-N 2.9Å
420	Q	37.4	Very low	50.2	Low	128 Å²	128	100.9 Å²	100.9	60%	0.598	56%	0.563	S	S	*	*			trans	-94.3	43	-179.8	-120.7	162.6	-20.8	0	0	111.2	N417	N417-Q420 WeakPolarHBondContact O-CB 3.42Å; N417-Q420 PolarHBondContact O-N 2.92Å
421	Q	45.2	Very low	52.3	Low	98 Å²	98	96.1 Å²	96.1	46%	0.458	53%	0.532	S	S	.	.			trans	-66.2	132.1	166.3	-85.1	-176.7	1.7	0	0	109.1	W419 S425 A426	W419-Q421 VanDerWaalsContact C-N 3.25Å; W419-Q421 PolarHBondContact O-N 2.9Å; Q421-S425 WeakPolarHBondContact CB-OG 3.45Å; Q421-A426 HydrophobicContact CB-CB 4.4Å
422	T	46.8	Very low	54.6	Low	90 Å²	90	90.7 Å²	90.7	55%	0.552	50%	0.502	S	S	*	.			trans	-54.4	143.4	168.3	60.4	0	0	0	0	109.1	A424 S425 A426	T422-A424 PolarHBondContact O-N 3.44Å; T422-S425 PolarHBondContact N-OG 3.38Å; T422-S425 PolarHBondContact O-N 2.91Å; T422-S425 PolarHBondContact O-OG 3.33Å; T422-S425 PolarHBondContact OG1-N 2.82Å; T422-S425 PolarHBondContact OG1-OG 3.26Å; T422-S425 VanDerWaalsContact OG1-OG 3.09Å; T422-A426 PolarHBondContact O-N 3.5Å
423	P	54.2	Low	57.1	Low	117 Å²	117	91.1 Å²	91.1	76%	0.76	50%	0.5	S	S	*	.	H	α-helix	trans	-51.6	-33.7	-178.4	-26	32.1	0	0	0	113.3	S427	P423-S427 WeakPolarHBondContact O-CB 3.42Å; P423-S427 PolarHBondContact O-N 3.28Å; P423-S427 VanDerWaalsContact O-N 3.11Å
424	A	55.1	Low	59.8	Low	75 Å²	75	85.3 Å²	85.3	62%	0.62	47%	0.47	S	S	*	.	H	α-helix	trans	-64.3	-45.5	175.6	0	0	0	0	0	113	T422 S427 L428	T422-A424 PolarHBondContact O-N 3.44Å; A424-S427 PolarHBondContact O-N 3.06Å; A424-L428 PolarHBondContact O-N 2.86Å; A424-L428 VanDerWaalsContact O-N 3.11Å
425	S	60.8	Low	62.4	Low	42 Å²	42	80.9 Å²	80.9	29%	0.294	44%	0.443	S	S	.	.	H	α-helix	trans	-66.9	-36.2	178.4	61.4	0	0	0	0	113.4	Q421 T422 T429	Q421-S425 WeakPolarHBondContact CB-OG 3.45Å; T422-S425 PolarHBondContact N-OG 3.38Å; T422-S425 PolarHBondContact O-N 2.91Å; T422-S425 PolarHBondContact O-OG 3.33Å; T422-S425 PolarHBondContact OG1-N 2.82Å; T422-S425 PolarHBondContact OG1-OG 3.26Å; T422-S425 VanDerWaalsContact OG1-OG 3.09Å; S425-T429 PolarHBondContact O-N 3.48Å; S425-T429 VanDerWaalsContact O-N 3.13Å; S425-T429 PolarHBondContact O-OG1 2.92Å
426	A	59.7	Low	65.2	Low	42 Å²	42	74.6 Å²	74.6	35%	0.347	42%	0.423	S	S	.	.	H	α-helix	trans	-67.6	-42.5	175.7	0	0	0	0	0	111.7	Q421 T422 L428 T429 S430	Q421-A426 HydrophobicContact CB-CB 4.4Å; T422-A426 PolarHBondContact O-N 3.5Å; A426-L428 PolarHBondContact O-N 2.97Å; A426-T429 VanDerWaalsContact O-CB 3.31Å; A426-T429 WeakPolarHBondContact O-CB 3.28Å; A426-T429 PolarHBondContact O-N 2.92Å; A426-S430 PolarHBondContact O-N 3.03Å; A426-S430 VanDerWaalsContact O-N 3.14Å
427	S	61.5	Low	67.9	Low	36 Å²	36	73.8 Å²	73.8	25%	0.252	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-43.2	175.9	165.3	0	0	0	0	113	P423 A424 T429 S430 T431 R493	P423-S427 WeakPolarHBondContact O-CB 3.42Å; P423-S427 PolarHBondContact O-N 3.28Å; P423-S427 VanDerWaalsContact O-N 3.11Å; A424-S427 PolarHBondContact O-N 3.06Å; S427-T429 VanDerWaalsContact C-N 3.26Å; S427-T429 PolarHBondContact O-N 2.93Å; S427-S430 PolarHBondContact O-OG 3.33Å; S427-T431 WeakPolarHBondContact O-CB 3.43Å; S427-T431 PolarHBondContact O-N 2.05Å; S427-T431 PolarHBondContact O-OG1 2.64Å; S427-R493 PolarHBondContact OG-NH1 3.17Å; S427-R493 PolarHBondContact OG-NH2 3.35Å
428	L	72.2	Confident	70.7	Confident	80 Å²	80	69 Å²	69	42%	0.419	38%	0.384	S	S	.	.	H	α-helix	trans	-67.6	-32.3	177.8	-169.2	63.3	0	0	0	111.3	P225 A424 A426 G432	P225-L428 HydrophobicContact CG-CD1 4.44Å; A424-L428 PolarHBondContact O-N 2.86Å; A424-L428 VanDerWaalsContact O-N 3.11Å; A426-L428 PolarHBondContact O-N 2.97Å; L428-G432 PolarHBondContact O-N 3.34Å
429	T	78.9	Confident	73.4	Confident	31 Å²	31	63.5 Å²	63.5	19%	0.19	36%	0.356	C	S	.	.	H	α-helix	trans	-63.3	-51.7	176.3	-58.1	0	0	0	0	112.6	K379 S425 A426 S427 T431 G432 L433	K379-T429 WeakPolarHBondContact CE-OG1 3.09Å; K379-T429 PolarHBondContact NZ-OG1 3.4Å; S425-T429 PolarHBondContact O-N 3.48Å; S425-T429 VanDerWaalsContact O-N 3.13Å; S425-T429 PolarHBondContact O-OG1 2.92Å; A426-T429 VanDerWaalsContact O-CB 3.31Å; A426-T429 WeakPolarHBondContact O-CB 3.28Å; A426-T429 PolarHBondContact O-N 2.92Å; S427-T429 VanDerWaalsContact C-N 3.26Å; S427-T429 PolarHBondContact O-N 2.93Å; T429-T431 VanDerWaalsContact C-N 3.35Å; T429-T431 PolarHBondContact O-N 3.39Å; T429-G432 PolarHBondContact O-N 2.72Å; T429-L433 HydrophobicContact CG2-CD1 4.35Å; T429-L433 WeakPolarHBondContact O-CG 3.1Å; T429-L433 PolarHBondContact O-N 2.85Å
430	S	86.2	Confident	76.2	Confident	31 Å²	31	56.7 Å²	56.7	22%	0.217	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-38.4	-177.9	61.7	0	0	0	0	112.1	A426 S427 L433 L434	A426-S430 PolarHBondContact O-N 3.03Å; A426-S430 VanDerWaalsContact O-N 3.14Å; S427-S430 PolarHBondContact O-OG 3.33Å; S430-L433 PolarHBondContact O-N 3.42Å; S430-L434 PolarHBondContact O-N 3.17Å
431	T	89	Confident	79.1	Confident	0 Å²	0	51 Å²	51	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-41.3	176.9	-52	0	0	0	0	111.8	P225 D226 I229 L299 S427 T429 L433 L434 A435 R493	P225-T431 HydrophobicContact CB-CG2 4.07Å; P225-T431 HydrophobicContact CG-CG2 3.61Å; D226-T431 PolarHBondContact OD1-OG1 3.19Å; I229-T431 HydrophobicContact CD1-CG2 3.86Å; L299-T431 HydrophobicContact CD1-CG2 3.72Å; S427-T431 WeakPolarHBondContact O-CB 3.43Å; S427-T431 PolarHBondContact O-N 2.05Å; S427-T431 PolarHBondContact O-OG1 2.64Å; T429-T431 VanDerWaalsContact C-N 3.35Å; T429-T431 PolarHBondContact O-N 3.39Å; T431-L433 PolarHBondContact O-N 2.98Å; T431-L434 PolarHBondContact O-N 2.86Å; T431-A435 PolarHBondContact O-N 3.11Å; T431-R493 PolarHBondContact OG1-NH1 3.05Å
432	G	89.8	Confident	81.6	Confident	19 Å²	19	46.4 Å²	46.4	20%	0.196	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-38	174.1	0	0	0	0	0	113.2	L428 T429 A435 A436	L428-G432 PolarHBondContact O-N 3.34Å; T429-G432 PolarHBondContact O-N 2.72Å; G432-A435 PolarHBondContact O-N 3.45Å; G432-A436 PolarHBondContact O-N 3.44Å
433	L	91.8	Very high	84	Confident	117 Å²	117	43.5 Å²	43.5	61%	0.613	28%	0.281	S	S	*	.	H	α-helix	trans	-65.1	-41.4	174.7	-71.8	171.8	0	0	0	112	T429 S430 T431 A435 A436 F437	T429-L433 HydrophobicContact CG2-CD1 4.35Å; T429-L433 WeakPolarHBondContact O-CG 3.1Å; T429-L433 PolarHBondContact O-N 2.85Å; S430-L433 PolarHBondContact O-N 3.42Å; T431-L433 PolarHBondContact O-N 2.98Å; L433-A435 VanDerWaalsContact C-N 3.34Å; L433-A436 PolarHBondContact O-N 2.93Å; L433-F437 PolarHBondContact O-N 3.42Å
434	L	95	Very high	86	Confident	16 Å²	16	40.2 Å²	40.2	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-42	173.2	-178.9	70.5	0	0	0	111.3	I229 S430 T431 A436 F437 Y482 A485 F489	I229-L434 HydrophobicContact CD1-CD2 3.83Å; I229-L434 HydrophobicContact CG1-CD2 4.33Å; I229-L434 HydrophobicContact CG2-CD2 4.22Å; S430-L434 PolarHBondContact O-N 3.17Å; T431-L434 PolarHBondContact O-N 2.86Å; L434-A436 VanDerWaalsContact C-N 3.33Å; L434-A436 PolarHBondContact O-N 2.87Å; L434-F437 WeakPolarHBondContact O-CB 3.34Å; L434-F437 PolarHBondContact O-N 3.35Å; L434-Y482 HydrophobicContact CD1-CE2 4.38Å; L434-Y482 HydrophobicContact CG-CE2 4.41Å; L434-Y482 WeakPolarHBondContact O-CE2 3.35Å; L434-A485 HydrophobicContact CD1-CB 3.99Å; L434-F489 HydrophobicContact CB-CD2 4.45Å; L434-F489 HydrophobicContact CD1-CB 4.38Å; L434-F489 HydrophobicContact CD2-CB 3.88Å; L434-F489 HydrophobicContact CD2-CD1 3.69Å; L434-F489 HydrophobicContact CD2-CD2 4.13Å; L434-F489 HydrophobicContact CD2-CE1 4.2Å; L434-F489 HydrophobicContact CD2-CG 3.65Å
435	A	95.1	Very high	88	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-41.1	176.3	0	0	0	0	0	111.7	W296 L299 L372 T431 G432 L433 Y438	W296-A435 PolarHBondContact NE1-O 3.24Å; L299-A435 HydrophobicContact CD2-CB 3.92Å; L299-A435 HydrophobicContact CG-CB 4.02Å; L372-A435 HydrophobicContact CD1-CB 4.1Å; T431-A435 PolarHBondContact O-N 3.11Å; G432-A435 PolarHBondContact O-N 3.45Å; L433-A435 VanDerWaalsContact C-N 3.34Å; A435-Y438 VanDerWaalsContact O-CB 3.24Å; A435-Y438 WeakPolarHBondContact O-CB 3.41Å; A435-Y438 PolarHBondContact O-N 3.37Å
436	A	95	Very high	89.7	Confident	40 Å²	40	36.3 Å²	36.3	33%	0.331	23%	0.226	S	C	.	.	H	α-helix	trans	-67.9	-35.6	176.3	0	0	0	0	0	113.1	L372 G432 L433 L434 Y438 V439	L372-A436 HydrophobicContact CD1-CB 4.34Å; L372-A436 HydrophobicContact CD2-CB 4.14Å; G432-A436 PolarHBondContact O-N 3.44Å; L433-A436 PolarHBondContact O-N 2.93Å; L434-A436 VanDerWaalsContact C-N 3.33Å; L434-A436 PolarHBondContact O-N 2.87Å; A436-Y438 PolarHBondContact O-N 3.27Å; A436-Y438 VanDerWaalsContact O-N 3.16Å; A436-V439 WeakPolarHBondContact O-CB 3.36Å; A436-V439 WeakPolarHBondContact O-CG2 3.45Å; A436-V439 PolarHBondContact O-N 3.44Å; A436-V439 VanDerWaalsContact O-N 3.11Å
437	F	96.3	Very high	91.5	Very high	86 Å²	86	37.2 Å²	37.2	38%	0.377	23%	0.233	S	C	.	.	H	α-helix	trans	-56.1	-32	176.9	174.1	-108.7	0	0	0	112.5	L433 L434 V439 V440 P441 V481 Y482 A485	L433-F437 PolarHBondContact O-N 3.42Å; L434-F437 WeakPolarHBondContact O-CB 3.34Å; L434-F437 PolarHBondContact O-N 3.35Å; F437-V439 PolarHBondContact O-N 2.79Å; F437-V440 PolarHBondContact O-N 2.98Å; F437-P441 WeakPolarHBondContact O-CD 3.45Å; F437-V481 HydrophobicContact CE1-CG1 3.72Å; F437-V481 HydrophobicContact CZ-CG1 3.45Å; F437-V481 VanDerWaalsContact CZ-CG1 3.45Å; F437-Y482 AromaticContact CD1-CD2 3.99Å; F437-Y482 HydrophobicContact CD1-CD2 3.99Å; F437-Y482 HydrophobicContact CD1-CE2 4.46Å; F437-Y482 HydrophobicContact CE1-CD2 4.45Å; F437-A485 HydrophobicContact CD1-CB 3.92Å; F437-A485 HydrophobicContact CE1-CB 3.61Å
438	Y	97.1	Very high	93.1	Very high	5 Å²	5	35.8 Å²	35.8	2%	0.02	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.4	176.8	-175.4	-110	0	0	0	114.8	H293 W296 A435 A436 V440 P441 H442 Y482	H293-Y438 PolarHBondContact CE1-OH 3.44Å; H293-Y438 AromaticContact ND1-CZ 3.88Å; H293-Y438 PolarHBondContact ND1-OH 3.43Å; W296-Y438 HydrophobicContact CB-CE1 4.46Å; W296-Y438 AromaticContact CD1-CD1 3.66Å; W296-Y438 AromaticContact CD1-CG 3.52Å; W296-Y438 AromaticContact CD2-CD1 3.33Å; W296-Y438 HydrophobicContact CD2-CD1 3.33Å; W296-Y438 AromaticContact CD2-CE1 3.6Å; W296-Y438 HydrophobicContact CD2-CE1 3.6Å; W296-Y438 HydrophobicContact CD2-CG 4.03Å; W296-Y438 AromaticContact CE2-CD1 3.16Å; W296-Y438 AromaticContact CE2-CE1 3.95Å; W296-Y438 AromaticContact CE2-CG 3.7Å; W296-Y438 AromaticContact CE3-CD1 3.87Å; W296-Y438 HydrophobicContact CE3-CD1 3.87Å; W296-Y438 AromaticContact CE3-CE1 3.8Å; W296-Y438 HydrophobicContact CE3-CE1 3.8Å; W296-Y438 AromaticContact CG-CD1 3.67Å; W296-Y438 HydrophobicContact CG-CD1 3.67Å; W296-Y438 HydrophobicContact CG-CD2 4.46Å; W296-Y438 AromaticContact CG-CE1 3.87Å; W296-Y438 HydrophobicContact CG-CE1 3.87Å; W296-Y438 AromaticContact CG-CG 3.94Å; W296-Y438 HydrophobicContact CG-CG 3.94Å; W296-Y438 HydrophobicContact CH2-CD1 4.1Å; W296-Y438 AromaticContact CZ2-CD1 3.6Å; W296-Y438 HydrophobicContact CZ2-CD1 3.6Å; W296-Y438 HydrophobicContact CZ2-CE1 4.44Å; W296-Y438 HydrophobicContact CZ2-CG 4.34Å; W296-Y438 HydrophobicContact CZ3-CD1 4.2Å; W296-Y438 HydrophobicContact CZ3-CE1 4.28Å; W296-Y438 AromaticContact NE1-CD1 3.38Å; W296-Y438 AromaticContact NE1-CG 3.36Å; A435-Y438 VanDerWaalsContact O-CB 3.24Å; A435-Y438 WeakPolarHBondContact O-CB 3.41Å; A435-Y438 PolarHBondContact O-N 3.37Å; A436-Y438 PolarHBondContact O-N 3.27Å; A436-Y438 VanDerWaalsContact O-N 3.16Å; Y438-V440 PolarHBondContact O-N 2.98Å; Y438-P441 VanDerWaalsContact O-CD 3.28Å; Y438-P441 WeakPolarHBondContact O-CD 3.21Å; Y438-P441 WeakPolarHBondContact O-CG 3.47Å; Y438-H442 HydrophobicContact CD1-CB 4.04Å; Y438-H442 HydrophobicContact CE1-CB 3.73Å; Y438-H442 AromaticContact CE1-CD2 3.81Å; Y438-H442 AromaticContact CE1-CG 3.68Å; Y438-H442 HydrophobicContact CE2-CB 4.43Å; Y438-H442 AromaticContact CZ-CD2 3.63Å; Y438-H442 AromaticContact CZ-CG 3.91Å; Y438-H442 WeakPolarHBondContact O-CB 3.45Å; Y438-H442 PolarHBondContact O-N 2.92Å; Y438-H442 VanDerWaalsContact O-N 3.09Å; Y438-H442 PolarHBondContact OH-CD2 3.4Å; Y438-Y482 AromaticContact CD2-CD1 3.25Å; Y438-Y482 HydrophobicContact CD2-CD1 3.25Å; Y438-Y482 AromaticContact CD2-CD2 3.65Å; Y438-Y482 HydrophobicContact CD2-CD2 3.65Å; Y438-Y482 AromaticContact CD2-CE1 3.42Å; Y438-Y482 HydrophobicContact CD2-CE1 3.42Å; Y438-Y482 VanDerWaalsContact CD2-CE1 3.42Å; Y438-Y482 AromaticContact CD2-CE2 3.84Å; Y438-Y482 HydrophobicContact CD2-CE2 3.84Å; Y438-Y482 AromaticContact CD2-CG 3.36Å; Y438-Y482 HydrophobicContact CD2-CG 3.36Å; Y438-Y482 AromaticContact CD2-CZ 3.73Å; Y438-Y482 AromaticContact CE2-CD1 3.55Å; Y438-Y482 HydrophobicContact CE2-CD1 3.55Å; Y438-Y482 AromaticContact CE2-CE1 3.9Å; Y438-Y482 HydrophobicContact CE2-CE1 3.9Å; Y438-Y482 AromaticContact CE2-CG 3.96Å; Y438-Y482 HydrophobicContact CE2-CG 3.96Å; Y438-Y482 HydrophobicContact CG-CD1 4.37Å; Y438-Y482 HydrophobicContact CG-CD2 4.33Å; Y438-Y482 HydrophobicContact CG-CE1 4.21Å; Y438-Y482 HydrophobicContact CG-CE2 4.21Å; Y438-Y482 HydrophobicContact CG-CG 4.42Å
439	V	97.1	Very high	94.2	Very high	43 Å²	43	32.4 Å²	32.4	26%	0.261	21%	0.205	S	C	.	.	H	α-helix	trans	-60.5	-33.9	-173.3	178.9	0	0	0	0	111	W296 L369 L372 A436 F437 G443	W296-V439 HydrophobicContact CZ2-CG2 4.15Å; L369-V439 HydrophobicContact CD2-CG1 4.15Å; L369-V439 HydrophobicContact CD2-CG2 3.64Å; L372-V439 HydrophobicContact CD2-CG2 4.04Å; A436-V439 WeakPolarHBondContact O-CB 3.36Å; A436-V439 WeakPolarHBondContact O-CG2 3.45Å; A436-V439 PolarHBondContact O-N 3.44Å; A436-V439 VanDerWaalsContact O-N 3.11Å; F437-V439 PolarHBondContact O-N 2.79Å; V439-G443 WeakPolarHBondContact O-CA 3.37Å; V439-G443 PolarHBondContact O-N 3.33Å
440	V	97	Very high	95	Very high	95 Å²	95	32.2 Å²	32.2	58%	0.576	21%	0.206	S	C	*	.	H	α-helix	trans	-68.8	-63.3	-178.1	-179.9	0	0	0	0	112.4	F437 Y438 H442 G443 C444	F437-V440 PolarHBondContact O-N 2.98Å; Y438-V440 PolarHBondContact O-N 2.98Å; V440-H442 VanDerWaalsContact C-N 3.27Å; V440-H442 PolarHBondContact O-N 2.03Å; V440-G443 PolarHBondContact O-N 2.9Å; V440-C444 PolarHBondContact O-N 3.48Å; V440-C444 PolarHBondContact O-SG 3.34Å; V440-C444 VanDerWaalsContact O-SG 3.37Å
441	P	97.3	Very high	95.4	Very high	8 Å²	8	33.8 Å²	33.8	5%	0.052	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-35.9	179.1	25.6	-33.5	0	0	0	111.8	F437 Y438 C444 L445 A478 V481	F437-P441 WeakPolarHBondContact O-CD 3.45Å; Y438-P441 VanDerWaalsContact O-CD 3.28Å; Y438-P441 WeakPolarHBondContact O-CD 3.21Å; Y438-P441 WeakPolarHBondContact O-CG 3.47Å; P441-C444 WeakPolarHBondContact O-CB 3.25Å; P441-C444 PolarHBondContact O-N 2.79Å; P441-L445 WeakPolarHBondContact O-CG 3.44Å; P441-L445 PolarHBondContact O-N 2.84Å; P441-A478 HydrophobicContact CB-CB 4.25Å; P441-V481 HydrophobicContact CB-CB 4.39Å; P441-V481 HydrophobicContact CB-CG1 4.36Å; P441-V481 HydrophobicContact CG-CG1 4.39Å
442	H	97.3	Very high	95.6	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-40	176.5	-167.9	-94.7	0	0	0	112.5	H293 Q361 Y438 V440 C444 L445 L446	H293-H442 AromaticContact CE1-CD2 3.32Å; H293-H442 PolarHBondContact CE1-CD2 3.39Å; H293-H442 AromaticContact CE1-NE2 3.05Å; H293-H442 PolarHBondContact CE1-NE2 2.91Å; H293-H442 AromaticContact ND1-CD2 3.59Å; H293-H442 AromaticContact ND1-NE2 3.24Å; H293-H442 PolarHBondContact ND1-NE2 3.48Å; Q361-H442 PolarHBondContact O-CE1 3.32Å; Y438-H442 HydrophobicContact CD1-CB 4.04Å; Y438-H442 HydrophobicContact CE1-CB 3.73Å; Y438-H442 AromaticContact CE1-CD2 3.81Å; Y438-H442 AromaticContact CE1-CG 3.68Å; Y438-H442 HydrophobicContact CE2-CB 4.43Å; Y438-H442 AromaticContact CZ-CD2 3.63Å; Y438-H442 AromaticContact CZ-CG 3.91Å; Y438-H442 WeakPolarHBondContact O-CB 3.45Å; Y438-H442 PolarHBondContact O-N 2.92Å; Y438-H442 VanDerWaalsContact O-N 3.09Å; Y438-H442 PolarHBondContact OH-CD2 3.4Å; V440-H442 VanDerWaalsContact C-N 3.27Å; V440-H442 PolarHBondContact O-N 2.03Å; H442-C444 VanDerWaalsContact C-N 3.35Å; H442-L445 PolarHBondContact O-N 2.81Å; H442-L446 WeakPolarHBondContact O-CG 3.36Å; H442-L446 PolarHBondContact O-N 2.66Å
443	G	97	Very high	95.8	Very high	28 Å²	28	35.8 Å²	35.8	29%	0.289	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-42.5	172.9	0	0	0	0	0	112.2	V439 V440 L445 L446 A447	V439-G443 WeakPolarHBondContact O-CA 3.37Å; V439-G443 PolarHBondContact O-N 3.33Å; V440-G443 PolarHBondContact O-N 2.9Å; G443-L445 PolarHBondContact O-N 3.42Å; G443-L446 PolarHBondContact O-N 2.91Å; G443-A447 WeakPolarHBondContact O-CB 3.48Å; G443-A447 PolarHBondContact O-N 2.98Å
444	C	97.3	Very high	95.8	Very high	49 Å²	49	36.8 Å²	36.8	33%	0.331	21%	0.21	S	C	.	.	H	α-helix	trans	-59.5	-44.9	172.9	-65.6	0	0	0	0	111.9	V440 P441 H442 L446 A447 C448 V474 A478	V440-C444 PolarHBondContact O-N 3.48Å; V440-C444 PolarHBondContact O-SG 3.34Å; V440-C444 VanDerWaalsContact O-SG 3.37Å; P441-C444 WeakPolarHBondContact O-CB 3.25Å; P441-C444 PolarHBondContact O-N 2.79Å; H442-C444 VanDerWaalsContact C-N 3.35Å; C444-L446 PolarHBondContact O-N 3.42Å; C444-A447 PolarHBondContact O-N 3.44Å; C444-C448 PolarHBondContact O-N 2.98Å; C444-C448 PolarHBondContact O-SG 2.99Å; C444-V474 HydrophobicContact CB-CG1 4.05Å; C444-A478 HydrophobicContact CB-CB 4.16Å
445	L	96.4	Very high	95.7	Very high	15 Å²	15	38.4 Å²	38.4	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-59.4	-47.4	176.7	-72.9	171.9	0	0	0	112.3	P441 H442 G443 A447 C448 Y449 K475 A478 V479	P441-L445 WeakPolarHBondContact O-CG 3.44Å; P441-L445 PolarHBondContact O-N 2.84Å; H442-L445 PolarHBondContact O-N 2.81Å; G443-L445 PolarHBondContact O-N 3.42Å; L445-A447 VanDerWaalsContact C-N 3.31Å; L445-A447 PolarHBondContact O-N 3.29Å; L445-C448 WeakPolarHBondContact O-CB 3.38Å; L445-C448 PolarHBondContact O-N 3.47Å; L445-Y449 HydrophobicContact CB-CE2 4.24Å; L445-Y449 VanDerWaalsContact O-CD2 3.23Å; L445-Y449 WeakPolarHBondContact O-CD2 3.22Å; L445-Y449 PolarHBondContact O-N 3.28Å; L445-K475 HydrophobicContact CD2-CG 4.15Å; L445-K475 WeakPolarHBondContact CD2-O 3.12Å; L445-A478 HydrophobicContact CD1-CB 4.46Å; L445-A478 HydrophobicContact CD2-CB 3.77Å; L445-A478 HydrophobicContact CG-CB 3.68Å; L445-V479 HydrophobicContact CD1-CG2 4.43Å; L445-V479 HydrophobicContact CD2-CG2 3.7Å
446	L	96.8	Very high	95.3	Very high	20 Å²	20	38.9 Å²	38.9	11%	0.105	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-39.9	177.4	-69.6	179.1	0	0	0	111.9	L358 Q361 L365 H442 G443 C444 Y449 A450	L358-L446 HydrophobicContact CD1-CD2 4.19Å; Q361-L446 HydrophobicContact CB-CD2 3.7Å; L365-L446 HydrophobicContact CB-CD1 4.33Å; L365-L446 HydrophobicContact CD2-CD1 3.56Å; H442-L446 WeakPolarHBondContact O-CG 3.36Å; H442-L446 PolarHBondContact O-N 2.66Å; G443-L446 PolarHBondContact O-N 2.91Å; C444-L446 PolarHBondContact O-N 3.42Å; L446-Y449 PolarHBondContact O-N 3.3Å; L446-A450 WeakPolarHBondContact O-CB 3.48Å; L446-A450 PolarHBondContact O-N 3.43Å
447	A	96.8	Very high	94.5	Very high	61 Å²	61	39.5 Å²	39.5	50%	0.504	22%	0.218	S	C	.	.	H	α-helix	trans	-63.7	-42	175.8	0	0	0	0	0	111.9	G443 C444 L445 A450 Y451	G443-A447 WeakPolarHBondContact O-CB 3.48Å; G443-A447 PolarHBondContact O-N 2.98Å; C444-A447 PolarHBondContact O-N 3.44Å; L445-A447 VanDerWaalsContact C-N 3.31Å; L445-A447 PolarHBondContact O-N 3.29Å; A447-A450 PolarHBondContact O-N 3.18Å; A447-Y451 WeakPolarHBondContact O-CB 3.43Å; A447-Y451 PolarHBondContact O-N 2.84Å
448	C	96	Very high	93.9	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.034	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-45.5	173.4	-66.1	0	0	0	0	111.7	C444 L445 A450 Y451 E452 T471 K475	C444-C448 PolarHBondContact O-N 2.98Å; C444-C448 PolarHBondContact O-SG 2.99Å; L445-C448 WeakPolarHBondContact O-CB 3.38Å; L445-C448 PolarHBondContact O-N 3.47Å; C448-A450 PolarHBondContact O-N 3.49Å; C448-Y451 WeakPolarHBondContact O-CB 3.29Å; C448-Y451 PolarHBondContact O-N 3.5Å; C448-E452 WeakPolarHBondContact O-CG 3.16Å; C448-E452 PolarHBondContact O-N 2.99Å; C448-T471 HydrophobicContact CB-CG2 4.02Å; C448-T471 PolarHBondContact SG-O 2.8Å; C448-T471 VanDerWaalsContact SG-O 3.33Å; C448-K475 HydrophobicContact CB-CB 4.03Å
449	Y	95.2	Very high	93.3	Very high	10 Å²	10	37.6 Å²	37.6	4%	0.039	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-38.4	177.1	-65.9	-40.3	0	0	0	112.7	L354 L357 L445 L446 E452 Y453 K475	L354-Y449 HydrophobicContact CD1-CD1 4Å; L354-Y449 HydrophobicContact CD1-CG 4.44Å; L357-Y449 HydrophobicContact CD2-CD1 4.32Å; L357-Y449 HydrophobicContact CD2-CE1 3.81Å; L357-Y449 HydrophobicContact CD2-CE2 4.37Å; L445-Y449 HydrophobicContact CB-CE2 4.24Å; L445-Y449 VanDerWaalsContact O-CD2 3.23Å; L445-Y449 WeakPolarHBondContact O-CD2 3.22Å; L445-Y449 PolarHBondContact O-N 3.28Å; L446-Y449 PolarHBondContact O-N 3.3Å; Y449-E452 PolarHBondContact O-N 3.25Å; Y449-Y453 WeakPolarHBondContact O-CB 3.44Å; Y449-Y453 PolarHBondContact O-N 3.4Å; Y449-K475 HydrophobicContact CE1-CD 4.26Å
450	A	95.3	Very high	92	Very high	26 Å²	26	38.3 Å²	38.3	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-44.3	173.8	0	0	0	0	0	111.3	L446 A447 C448 E452 Y453 F454	L446-A450 WeakPolarHBondContact O-CB 3.48Å; L446-A450 PolarHBondContact O-N 3.43Å; A447-A450 PolarHBondContact O-N 3.18Å; C448-A450 PolarHBondContact O-N 3.49Å; A450-E452 PolarHBondContact O-N 2.82Å; A450-Y453 PolarHBondContact O-N 2.85Å; A450-F454 HydrophobicContact CB-CD2 4.48Å; A450-F454 HydrophobicContact CB-CE2 4.32Å; A450-F454 WeakPolarHBondContact O-CD2 3.12Å; A450-F454 PolarHBondContact O-N 3.39Å
451	Y	95.2	Very high	90.7	Very high	64 Å²	64	39.7 Å²	39.7	25%	0.251	21%	0.212	S	C	.	.	H	α-helix	trans	-56.5	-47.8	174.4	171.1	-97.8	0	0	0	111.9	A447 C448 N455 W459 S468 T471	A447-Y451 WeakPolarHBondContact O-CB 3.43Å; A447-Y451 PolarHBondContact O-N 2.84Å; C448-Y451 WeakPolarHBondContact O-CB 3.29Å; C448-Y451 PolarHBondContact O-N 3.5Å; Y451-N455 WeakPolarHBondContact CD2-ND2 3.19Å; Y451-N455 WeakPolarHBondContact O-CB 3.04Å; Y451-N455 PolarHBondContact O-N 3.11Å; Y451-N455 PolarHBondContact O-ND2 2.77Å; Y451-W459 AromaticContact CD1-CH2 3.86Å; Y451-W459 HydrophobicContact CD1-CH2 3.86Å; Y451-W459 HydrophobicContact CD1-CZ2 4.05Å; Y451-W459 AromaticContact CE1-CH2 3.49Å; Y451-W459 HydrophobicContact CE1-CH2 3.49Å; Y451-W459 VanDerWaalsContact CE1-CH2 3.49Å; Y451-W459 AromaticContact CE1-CZ2 3.33Å; Y451-W459 HydrophobicContact CE1-CZ2 3.33Å; Y451-W459 HydrophobicContact CE2-CZ2 4.45Å; Y451-W459 AromaticContact CZ-CZ2 3.57Å; Y451-S468 VanDerWaalsContact OH-CB 3.27Å; Y451-S468 WeakPolarHBondContact OH-CB 3.41Å; Y451-S468 PolarHBondContact OH-N 3.47Å; Y451-T471 HydrophobicContact CD1-CG2 3.54Å; Y451-T471 HydrophobicContact CE1-CG2 4.05Å; Y451-T471 HydrophobicContact CG-CG2 4.05Å
452	E	93.4	Very high	89.3	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-44.5	175.5	-71.9	-178.1	-116.8	0	0	111.5	L354 C448 Y449 A450 F454 N455 R456 W459 F472 K475	L354-E452 HydrophobicContact CD2-CB 3.85Å; C448-E452 WeakPolarHBondContact O-CG 3.16Å; C448-E452 PolarHBondContact O-N 2.99Å; Y449-E452 PolarHBondContact O-N 3.25Å; A450-E452 PolarHBondContact O-N 2.82Å; E452-F454 PolarHBondContact O-N 3.02Å; E452-N455 PolarHBondContact O-N 2.83Å; E452-R456 VanDerWaalsContact O-CB 3.25Å; E452-R456 WeakPolarHBondContact O-CB 3.48Å; E452-R456 PolarHBondContact O-N 3.38Å; E452-R456 IonicContact OE2-CZ 2.72Å; E452-R456 IonicContact OE2-NH2 2.66Å; E452-R456 PolarHBondContact OE2-NH2 3.43Å; E452-W459 HydrophobicContact CB-CH2 4.41Å; E452-W459 HydrophobicContact CB-CZ3 4.42Å; E452-W459 HydrophobicContact CG-CH2 4.16Å; E452-W459 HydrophobicContact CG-CZ3 4.27Å; E452-F472 HydrophobicContact CG-CE1 4.34Å; E452-F472 HydrophobicContact CG-CZ 3.94Å; E452-K475 VanDerWaalsContact OE1-CD 3.31Å; E452-K475 WeakPolarHBondContact OE1-CD 3.17Å; E452-K475 IonicContact OE1-NZ 2.88Å; E452-K475 PolarHBondContact OE1-NZ 3.35Å; E452-K475 IonicContact OE2-NZ 3.25Å; E452-K475 PolarHBondContact OE2-NZ 3.02Å
453	Y	93.5	Very high	87.6	Confident	60 Å²	60	47.8 Å²	47.8	24%	0.235	25%	0.25	C	S	.	.	H	α-helix	trans	-59.4	-51	-178.9	-178.6	-98.4	0	0	0	112.2	R351 L354 Q355 Y449 A450 N455	R351-Y453 HydrophobicContact CB-CE2 4.44Å; R351-Y453 PolarHBondContact NE-O 2.72Å; R351-Y453 PolarHBondContact NH2-O 2.84Å; R351-Y453 VanDerWaalsContact NH2-O 3.17Å; L354-Y453 HydrophobicContact CD2-CD2 4.35Å; Q355-Y453 HydrophobicContact CG-CD2 4.34Å; Q355-Y453 HydrophobicContact CG-CE2 3.57Å; Q355-Y453 PolarHBondContact NE2-OH 3.3Å; Y449-Y453 WeakPolarHBondContact O-CB 3.44Å; Y449-Y453 PolarHBondContact O-N 3.4Å; A450-Y453 PolarHBondContact O-N 2.85Å; Y453-N455 PolarHBondContact O-N 3.42Å
454	F	92.7	Very high	86.2	Confident	138 Å²	138	50 Å²	50	61%	0.605	27%	0.273	S	S	*	.	H	α-helix	trans	-70.3	-31.3	-176.5	-70.1	-63.2	0	0	0	113.2	R351 A450 E452	R351-F454 PolarHBondContact NH2-O 3.3Å; A450-F454 HydrophobicContact CB-CD2 4.48Å; A450-F454 HydrophobicContact CB-CE2 4.32Å; A450-F454 WeakPolarHBondContact O-CD2 3.12Å; A450-F454 PolarHBondContact O-N 3.39Å; E452-F454 PolarHBondContact O-N 3.02Å
455	N	91.5	Very high	85.2	Confident	49 Å²	49	52.7 Å²	52.7	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-102.7	-9.4	-173.8	-62.6	-78.6	0	0	0	114.7	Y451 E452 Y453 D457 D458 W459	Y451-N455 WeakPolarHBondContact CD2-ND2 3.19Å; Y451-N455 WeakPolarHBondContact O-CB 3.04Å; Y451-N455 PolarHBondContact O-N 3.11Å; Y451-N455 PolarHBondContact O-ND2 2.77Å; E452-N455 PolarHBondContact O-N 2.83Å; Y453-N455 PolarHBondContact O-N 3.42Å; N455-D457 PolarHBondContact O-N 3.41Å; N455-D458 WeakPolarHBondContact O-CB 3.3Å; N455-D458 PolarHBondContact O-N 3Å; N455-D458 VanDerWaalsContact O-N 3.1Å; N455-W459 HydrophobicContact CB-CD2 4.27Å; N455-W459 VanDerWaalsContact CB-CE2 3.47Å; N455-W459 HydrophobicContact CB-CH2 4.08Å; N455-W459 HydrophobicContact CB-CZ2 3.35Å; N455-W459 PolarHBondContact O-N 3.08Å
456	R	86.6	Confident	84.6	Confident	11 Å²	11	58.7 Å²	58.7	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-51	-52.9	-174.9	-174.1	71.9	68.4	-178.6	0.4	114.2	N348 R351 E452 D458 W459 L460	N348-R456 PolarHBondContact O-NH1 2.86Å; N348-R456 PolarHBondContact O-NH2 2.86Å; R351-R456 HydrophobicContact CG-CB 4.06Å; R351-R456 HydrophobicContact CG-CG 4.3Å; E452-R456 VanDerWaalsContact O-CB 3.25Å; E452-R456 WeakPolarHBondContact O-CB 3.48Å; E452-R456 PolarHBondContact O-N 3.38Å; E452-R456 IonicContact OE2-CZ 2.72Å; E452-R456 IonicContact OE2-NH2 2.66Å; E452-R456 PolarHBondContact OE2-NH2 3.43Å; R456-D458 PolarHBondContact O-N 3.31Å; R456-W459 PolarHBondContact O-N 3.19Å; R456-L460 HydrophobicContact CG-CD1 4.1Å; R456-L460 WeakPolarHBondContact O-CG 3.14Å; R456-L460 PolarHBondContact O-N 3.33Å; R456-L460 VanDerWaalsContact O-N 3.15Å
457	D	79.6	Confident	84.3	Confident	52 Å²	52	58.3 Å²	58.3	28%	0.278	31%	0.306	S	S	.	.	H	α-helix	trans	-66.3	-30.8	-175.7	-70.4	1	0	0	0	111.4	R351 N455 L460 K461	R351-D457 VanDerWaalsContact CD-OD1 3.23Å; R351-D457 WeakPolarHBondContact CD-OD1 3.46Å; R351-D457 IonicContact CZ-OD1 3.41Å; R351-D457 IonicContact CZ-OD2 3.3Å; R351-D457 VanDerWaalsContact NE-CG 3.35Å; R351-D457 IonicContact NE-OD1 3.35Å; R351-D457 PolarHBondContact NE-OD1 2.62Å; R351-D457 IonicContact NE-OD2 3.81Å; R351-D457 IonicContact NH1-OD1 2.79Å; R351-D457 IonicContact NH1-OD2 3.16Å; R351-D457 PolarHBondContact NH1-OD2 3.31Å; R351-D457 IonicContact NH2-OD2 3.91Å; N455-D457 PolarHBondContact O-N 3.41Å; D457-L460 PolarHBondContact O-N 3.13Å; D457-K461 WeakPolarHBondContact O-CB 3.45Å; D457-K461 VanDerWaalsContact O-CG 3.27Å; D457-K461 WeakPolarHBondContact O-CG 3.47Å; D457-K461 PolarHBondContact O-N 3.28Å
458	D	83.1	Confident	84.2	Confident	43 Å²	43	57.5 Å²	57.5	23%	0.23	30%	0.296	C	S	.	.	H	α-helix	trans	-66.6	-42.7	177.6	-78.8	6.7	0	0	0	111.1	N455 R456 L460 K461 Y462 K465	N455-D458 WeakPolarHBondContact O-CB 3.3Å; N455-D458 PolarHBondContact O-N 3Å; N455-D458 VanDerWaalsContact O-N 3.1Å; R456-D458 PolarHBondContact O-N 3.31Å; D458-L460 VanDerWaalsContact C-N 3.26Å; D458-L460 PolarHBondContact O-N 3.49Å; D458-K461 PolarHBondContact O-N 3.18Å; D458-Y462 HydrophobicContact CB-CD2 4.47Å; D458-Y462 WeakPolarHBondContact O-CB 3.38Å; D458-Y462 PolarHBondContact O-N 3Å; D458-K465 HydrophobicContact CB-CD 3.77Å; D458-K465 IonicContact OD2-NZ 3.59Å; D458-K465 PolarHBondContact OD2-NZ 2.05Å
459	W	83.4	Confident	84.1	Confident	8 Å²	8	59.2 Å²	59.2	3%	0.03	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-32.7	175.1	-54.1	-30.2	0	0	0	112.4	R157 L183 Y451 E452 N455 R456 K465 P467 F472	R157-W459 PolarHBondContact NH2-O 3.4Å; L183-W459 HydrophobicContact CD2-CB 4.24Å; Y451-W459 AromaticContact CD1-CH2 3.86Å; Y451-W459 HydrophobicContact CD1-CH2 3.86Å; Y451-W459 HydrophobicContact CD1-CZ2 4.05Å; Y451-W459 AromaticContact CE1-CH2 3.49Å; Y451-W459 HydrophobicContact CE1-CH2 3.49Å; Y451-W459 VanDerWaalsContact CE1-CH2 3.49Å; Y451-W459 AromaticContact CE1-CZ2 3.33Å; Y451-W459 HydrophobicContact CE1-CZ2 3.33Å; Y451-W459 HydrophobicContact CE2-CZ2 4.45Å; Y451-W459 AromaticContact CZ-CZ2 3.57Å; E452-W459 HydrophobicContact CB-CH2 4.41Å; E452-W459 HydrophobicContact CB-CZ3 4.42Å; E452-W459 HydrophobicContact CG-CH2 4.16Å; E452-W459 HydrophobicContact CG-CZ3 4.27Å; N455-W459 HydrophobicContact CB-CD2 4.27Å; N455-W459 VanDerWaalsContact CB-CE2 3.47Å; N455-W459 HydrophobicContact CB-CH2 4.08Å; N455-W459 HydrophobicContact CB-CZ2 3.35Å; N455-W459 PolarHBondContact O-N 3.08Å; R456-W459 PolarHBondContact O-N 3.19Å; W459-K465 WeakPolarHBondContact CA-O 3.19Å; W459-P467 HydrophobicContact CD2-CB 3.91Å; W459-P467 HydrophobicContact CD2-CG 4.45Å; W459-P467 HydrophobicContact CE3-CB 4.05Å; W459-P467 HydrophobicContact CH2-CB 3.98Å; W459-P467 HydrophobicContact CZ2-CB 3.84Å; W459-P467 HydrophobicContact CZ3-CB 4.09Å; W459-F472 HydrophobicContact CZ3-CZ 4.37Å
460	L	71.2	Confident	84.1	Confident	59 Å²	59	64.5 Å²	64.5	31%	0.309	33%	0.327	S	S	.	.	H	α-helix	trans	-81.4	-27	-179.1	-67.7	178.8	0	0	0	113.3	R157 R456 D457 D458	R157-L460 PolarHBondContact NH1-O 3.2Å; R157-L460 VanDerWaalsContact NH2-C 3.29Å; R157-L460 VanDerWaalsContact NH2-CA 3.32Å; R157-L460 PolarHBondContact NH2-O 3.19Å; R456-L460 HydrophobicContact CG-CD1 4.1Å; R456-L460 WeakPolarHBondContact O-CG 3.14Å; R456-L460 PolarHBondContact O-N 3.33Å; R456-L460 VanDerWaalsContact O-N 3.15Å; D457-L460 PolarHBondContact O-N 3.13Å; D458-L460 VanDerWaalsContact C-N 3.26Å; D458-L460 PolarHBondContact O-N 3.49Å
461	K	69.4	Low	84.1	Confident	123 Å²	123	64.6 Å²	64.6	54%	0.535	33%	0.326	S	S	.	.	H	α-helix	trans	-94.1	-45.5	179.8	-70	174.4	-178.9	178.4	0	112.9	D457 D458	D457-K461 WeakPolarHBondContact O-CB 3.45Å; D457-K461 VanDerWaalsContact O-CG 3.27Å; D457-K461 WeakPolarHBondContact O-CG 3.47Å; D457-K461 PolarHBondContact O-N 3.28Å; D458-K461 PolarHBondContact O-N 3.18Å
462	Y	67.9	Low	84.1	Confident	127 Å²	127	61.8 Å²	61.8	50%	0.498	31%	0.314	S	S	.	.			trans	-106.5	123.8	-170.2	-58.9	-71.3	0	0	0	111.9	D458 G464 K465	D458-Y462 HydrophobicContact CB-CD2 4.47Å; D458-Y462 WeakPolarHBondContact O-CB 3.38Å; D458-Y462 PolarHBondContact O-N 3Å; Y462-G464 VanDerWaalsContact C-N 3.31Å; Y462-G464 PolarHBondContact O-N 3.02Å; Y462-K465 PolarHBondContact O-N 3.42Å
463	S	61.9	Low	84.2	Confident	54 Å²	54	63.1 Å²	63.1	38%	0.378	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.6	177.5	53.3	0	0	0	0	114.7	P158 K465	P158-S463 WeakPolarHBondContact CD-OG 3.43Å; S463-K465 VanDerWaalsContact C-N 3.3Å; S463-K465 PolarHBondContact O-N 3.07Å
464	G	67.6	Low	84.4	Confident	75 Å²	75	63.4 Å²	63.4	77%	0.773	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-6.9	-178.7	0	0	0	0	0	114.9	Y462	Y462-G464 VanDerWaalsContact C-N 3.31Å; Y462-G464 PolarHBondContact O-N 3.02Å
465	K	75.5	Confident	84.6	Confident	105 Å²	105	58 Å²	58	46%	0.457	31%	0.307	S	S	.	.			trans	-109	104.9	178.8	-75.6	-174.1	172.6	177.9	0	109.5	D458 W459 Y462 S463	D458-K465 HydrophobicContact CB-CD 3.77Å; D458-K465 IonicContact OD2-NZ 3.59Å; D458-K465 PolarHBondContact OD2-NZ 2.05Å; W459-K465 WeakPolarHBondContact CA-O 3.19Å; Y462-K465 PolarHBondContact O-N 3.42Å; S463-K465 VanDerWaalsContact C-N 3.3Å; S463-K465 PolarHBondContact O-N 3.07Å
466	Q	83.5	Confident	84.8	Confident	141 Å²	141	56.2 Å²	56.2	66%	0.659	30%	0.297	S	S	*	.			trans	-102.4	150.8	175.9	-69.4	-177	-9.1	0	0	111.6
467	P	91.2	Very high	85.3	Confident	12 Å²	12	57.7 Å²	57.7	8%	0.078	31%	0.307	C	S	.	.			trans	-64.5	142.6	171.5	24.3	-31.4	0	0	0	111.8	L183 F184 W459 Y469 F472	L183-P467 HydrophobicContact CB-CG 3.93Å; L183-P467 HydrophobicContact CD1-CG 4.49Å; L183-P467 HydrophobicContact CD2-CG 4.4Å; F184-P467 HydrophobicContact CE1-CB 4.29Å; F184-P467 HydrophobicContact CE1-CG 3.8Å; F184-P467 HydrophobicContact CE2-CG 4.06Å; F184-P467 HydrophobicContact CZ-CB 3.95Å; F184-P467 HydrophobicContact CZ-CG 3.47Å; F184-P467 VanDerWaalsContact CZ-CG 3.47Å; W459-P467 HydrophobicContact CD2-CB 3.91Å; W459-P467 HydrophobicContact CD2-CG 4.45Å; W459-P467 HydrophobicContact CE3-CB 4.05Å; W459-P467 HydrophobicContact CH2-CB 3.98Å; W459-P467 HydrophobicContact CZ2-CB 3.84Å; W459-P467 HydrophobicContact CZ3-CB 4.09Å; P467-Y469 PolarHBondContact O-N 3.49Å; P467-F472 HydrophobicContact CB-CE2 3.72Å; P467-F472 HydrophobicContact CB-CZ 4.36Å
468	S	93.5	Very high	86.1	Confident	44 Å²	44	55.5 Å²	55.5	31%	0.308	30%	0.297	S	S	.	.			trans	-70.8	108.7	171.4	172.5	0	0	0	0	110.3	Y451 E470 T471 F472	Y451-S468 VanDerWaalsContact OH-CB 3.27Å; Y451-S468 WeakPolarHBondContact OH-CB 3.41Å; Y451-S468 PolarHBondContact OH-N 3.47Å; S468-E470 PolarHBondContact O-N 3.12Å; S468-T471 WeakPolarHBondContact CB-OG1 3.08Å; S468-T471 WeakPolarHBondContact O-CB 3.03Å; S468-T471 PolarHBondContact O-N 2.79Å; S468-T471 PolarHBondContact OG-OG1 2.91Å; S468-F472 WeakPolarHBondContact O-CD2 3.37Å
469	Y	94.4	Very high	86.8	Confident	40 Å²	40	55 Å²	55	16%	0.157	30%	0.295	C	S	.	.	H	α-helix	trans	-51.8	-41.4	174.7	171.8	-103.3	0	0	0	112.7	F184 Q188 N191 L340 P467 T471 F472 V473	F184-Y469 HydrophobicContact CD1-CD2 4.41Å; Q188-Y469 HydrophobicContact CB-CD2 3.76Å; Q188-Y469 HydrophobicContact CB-CE2 3.71Å; Q188-Y469 HydrophobicContact CG-CD2 3.77Å; Q188-Y469 HydrophobicContact CG-CE2 4Å; Q188-Y469 HydrophobicContact CG-CG 4.06Å; N191-Y469 WeakPolarHBondContact CB-OH 3.49Å; L340-Y469 HydrophobicContact CD1-CD2 4.22Å; L340-Y469 HydrophobicContact CD1-CE2 4.09Å; L340-Y469 HydrophobicContact CD2-CD2 4.33Å; L340-Y469 HydrophobicContact CD2-CE2 4.46Å; P467-Y469 PolarHBondContact O-N 3.49Å; Y469-T471 PolarHBondContact O-N 3.28Å; Y469-F472 WeakPolarHBondContact O-CB 3.48Å; Y469-F472 PolarHBondContact O-N 3.19Å; Y469-V473 HydrophobicContact CD1-CG2 3.94Å; Y469-V473 HydrophobicContact CE1-CG2 3.41Å; Y469-V473 VanDerWaalsContact CE1-CG2 3.41Å; Y469-V473 HydrophobicContact CE2-CG2 4.13Å; Y469-V473 HydrophobicContact CG-CG2 4.5Å; Y469-V473 PolarHBondContact O-N 3.23Å
470	E	95.1	Very high	87.5	Confident	121 Å²	121	54.7 Å²	54.7	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-57.4	-34	178.6	-58.9	-52.6	142.5	0	0	112.8	S468 F472 V473 V474	S468-E470 PolarHBondContact O-N 3.12Å; E470-F472 VanDerWaalsContact C-N 3.3Å; E470-F472 PolarHBondContact O-N 3.39Å; E470-V473 WeakPolarHBondContact O-CB 3.07Å; E470-V473 PolarHBondContact O-N 3.12Å; E470-V474 WeakPolarHBondContact O-CG2 3.43Å; E470-V474 PolarHBondContact O-N 3.41Å
471	T	95.2	Very high	88.7	Confident	29 Å²	29	53.6 Å²	53.6	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-65.8	-36.4	177.2	-55	0	0	0	0	111.5	C448 Y451 S468 Y469 K475	C448-T471 HydrophobicContact CB-CG2 4.02Å; C448-T471 PolarHBondContact SG-O 2.8Å; C448-T471 VanDerWaalsContact SG-O 3.33Å; Y451-T471 HydrophobicContact CD1-CG2 3.54Å; Y451-T471 HydrophobicContact CE1-CG2 4.05Å; Y451-T471 HydrophobicContact CG-CG2 4.05Å; S468-T471 WeakPolarHBondContact CB-OG1 3.08Å; S468-T471 WeakPolarHBondContact O-CB 3.03Å; S468-T471 PolarHBondContact O-N 2.79Å; S468-T471 PolarHBondContact OG-OG1 2.91Å; Y469-T471 PolarHBondContact O-N 3.28Å; T471-K475 PolarHBondContact O-N 3.05Å
472	F	95.1	Very high	90.1	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-73.5	-33.5	176.3	-70.1	-96.7	0	0	0	112	F184 L340 E452 W459 P467 S468 Y469 E470 K475 I476	F184-F472 HydrophobicContact CE1-CD2 4.2Å; F184-F472 HydrophobicContact CE1-CE2 4.42Å; F184-F472 AromaticContact CZ-CD2 3.91Å; F184-F472 HydrophobicContact CZ-CD2 3.91Å; F184-F472 HydrophobicContact CZ-CE1 4.41Å; F184-F472 AromaticContact CZ-CE2 3.8Å; F184-F472 HydrophobicContact CZ-CE2 3.8Å; F184-F472 HydrophobicContact CZ-CG 4.32Å; F184-F472 HydrophobicContact CZ-CZ 4.05Å; L340-F472 HydrophobicContact CD2-CB 3.45Å; L340-F472 VanDerWaalsContact CD2-CB 3.45Å; L340-F472 HydrophobicContact CD2-CD1 4.02Å; L340-F472 HydrophobicContact CD2-CG 3.78Å; E452-F472 HydrophobicContact CG-CE1 4.34Å; E452-F472 HydrophobicContact CG-CZ 3.94Å; W459-F472 HydrophobicContact CZ3-CZ 4.37Å; P467-F472 HydrophobicContact CB-CE2 3.72Å; P467-F472 HydrophobicContact CB-CZ 4.36Å; S468-F472 WeakPolarHBondContact O-CD2 3.37Å; Y469-F472 WeakPolarHBondContact O-CB 3.48Å; Y469-F472 PolarHBondContact O-N 3.19Å; E470-F472 VanDerWaalsContact C-N 3.3Å; E470-F472 PolarHBondContact O-N 3.39Å; F472-K475 WeakPolarHBondContact O-CB 3.37Å; F472-K475 PolarHBondContact O-N 3.03Å; F472-I476 VanDerWaalsContact O-CG1 3.32Å; F472-I476 WeakPolarHBondContact O-CG1 3.43Å; F472-I476 PolarHBondContact O-N 2.79Å
473	V	96.8	Very high	91.5	Very high	30 Å²	30	41.8 Å²	41.8	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-49.2	171.2	172	0	0	0	0	110.5	L195 Y469 E470 K475 I476 V477	L195-V473 HydrophobicContact CD2-CB 4.41Å; L195-V473 HydrophobicContact CD2-CG1 3.81Å; L195-V473 HydrophobicContact CD2-CG2 4.47Å; Y469-V473 HydrophobicContact CD1-CG2 3.94Å; Y469-V473 HydrophobicContact CE1-CG2 3.41Å; Y469-V473 VanDerWaalsContact CE1-CG2 3.41Å; Y469-V473 HydrophobicContact CE2-CG2 4.13Å; Y469-V473 HydrophobicContact CG-CG2 4.5Å; Y469-V473 PolarHBondContact O-N 3.23Å; E470-V473 WeakPolarHBondContact O-CB 3.07Å; E470-V473 PolarHBondContact O-N 3.12Å; V473-K475 VanDerWaalsContact C-N 3.3Å; V473-K475 PolarHBondContact O-N 3.48Å; V473-I476 PolarHBondContact O-N 3.19Å; V473-V477 WeakPolarHBondContact O-CG2 3.35Å; V473-V477 PolarHBondContact O-N 3.43Å
474	V	97.1	Very high	93.3	Very high	66 Å²	66	41.1 Å²	41.1	40%	0.4	23%	0.232	S	C	.	.	H	α-helix	trans	-57.9	-44.4	176.4	172.4	0	0	0	0	110.9	C444 E470 V477 A478	C444-V474 HydrophobicContact CB-CG1 4.05Å; E470-V474 WeakPolarHBondContact O-CG2 3.43Å; E470-V474 PolarHBondContact O-N 3.41Å; V474-V477 PolarHBondContact O-N 3.47Å; V474-A478 WeakPolarHBondContact O-CB 3.42Å; V474-A478 PolarHBondContact O-N 3.41Å
475	K	96.6	Very high	94.7	Very high	26 Å²	26	38.8 Å²	38.8	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-49	175.6	173.9	179.4	162.2	-177.1	0	111.8	L445 C448 Y449 E452 T471 F472 V473 V477 A478 V479	L445-K475 HydrophobicContact CD2-CG 4.15Å; L445-K475 WeakPolarHBondContact CD2-O 3.12Å; C448-K475 HydrophobicContact CB-CB 4.03Å; Y449-K475 HydrophobicContact CE1-CD 4.26Å; E452-K475 VanDerWaalsContact OE1-CD 3.31Å; E452-K475 WeakPolarHBondContact OE1-CD 3.17Å; E452-K475 IonicContact OE1-NZ 2.88Å; E452-K475 PolarHBondContact OE1-NZ 3.35Å; E452-K475 IonicContact OE2-NZ 3.25Å; E452-K475 PolarHBondContact OE2-NZ 3.02Å; T471-K475 PolarHBondContact O-N 3.05Å; F472-K475 WeakPolarHBondContact O-CB 3.37Å; F472-K475 PolarHBondContact O-N 3.03Å; V473-K475 VanDerWaalsContact C-N 3.3Å; V473-K475 PolarHBondContact O-N 3.48Å; K475-V477 PolarHBondContact O-N 3.32Å; K475-A478 PolarHBondContact O-N 2.78Å; K475-V479 WeakPolarHBondContact O-CG2 3.04Å; K475-V479 PolarHBondContact O-N 3.4Å; K475-V479 VanDerWaalsContact O-N 3.13Å
476	I	96.3	Very high	95.7	Very high	11 Å²	11	33.8 Å²	33.8	6%	0.056	18%	0.184	C	C	.	.	H	α-helix	trans	-56.4	-50	178.2	-71.3	162.9	0	0	0	110.6	A192 L195 M196 T341 F472 V473 V479 F480	A192-I476 HydrophobicContact CB-CD1 4.03Å; L195-I476 HydrophobicContact CD2-CB 4.12Å; L195-I476 HydrophobicContact CD2-CD1 4.29Å; L195-I476 HydrophobicContact CD2-CG2 3.82Å; L195-I476 HydrophobicContact CG-CG2 3.86Å; M196-I476 HydrophobicContact CB-CG2 4.43Å; M196-I476 HydrophobicContact CG-CB 4.4Å; M196-I476 HydrophobicContact CG-CD1 3.98Å; M196-I476 HydrophobicContact CG-CG1 3.92Å; M196-I476 HydrophobicContact CG-CG2 3.57Å; M196-I476 HydrophobicContact SD-CD1 4.47Å; M196-I476 HydrophobicContact SD-CG1 4.44Å; T341-I476 HydrophobicContact CG2-CD1 4.25Å; F472-I476 VanDerWaalsContact O-CG1 3.32Å; F472-I476 WeakPolarHBondContact O-CG1 3.43Å; F472-I476 PolarHBondContact O-N 2.79Å; V473-I476 PolarHBondContact O-N 3.19Å; I476-V479 PolarHBondContact O-N 2.82Å; I476-F480 WeakPolarHBondContact O-CD2 3.43Å
477	V	97.1	Very high	96.3	Very high	41 Å²	41	27.1 Å²	27.1	25%	0.248	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-48.8	-179	173.8	0	0	0	0	110.7	L195 F199 V473 V474 K475 V479 F480 V481	L195-V477 HydrophobicContact CD1-CG2 4.49Å; L195-V477 HydrophobicContact CD2-CG2 4.32Å; F199-V477 HydrophobicContact CE1-CG1 3.92Å; F199-V477 HydrophobicContact CE1-CG2 4.48Å; F199-V477 HydrophobicContact CE2-CG2 3.94Å; F199-V477 HydrophobicContact CZ-CB 4.43Å; F199-V477 HydrophobicContact CZ-CG1 3.95Å; F199-V477 HydrophobicContact CZ-CG2 3.9Å; V473-V477 WeakPolarHBondContact O-CG2 3.35Å; V473-V477 PolarHBondContact O-N 3.43Å; V474-V477 PolarHBondContact O-N 3.47Å; K475-V477 PolarHBondContact O-N 3.32Å; V477-V479 PolarHBondContact O-N 3.1Å; V477-F480 PolarHBondContact O-N 3.4Å; V477-F480 VanDerWaalsContact O-N 3.08Å; V477-V481 HydrophobicContact CG1-CG2 3.65Å; V477-V481 VanDerWaalsContact O-CG2 3.26Å; V477-V481 WeakPolarHBondContact O-CG2 3.33Å; V477-V481 PolarHBondContact O-N 2.87Å
478	A	97.1	Very high	96.5	Very high	7 Å²	7	27.8 Å²	27.8	6%	0.058	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-27.6	-174.8	0	0	0	0	0	113.3	P441 C444 L445 V474 K475 F480	P441-A478 HydrophobicContact CB-CB 4.25Å; C444-A478 HydrophobicContact CB-CB 4.16Å; L445-A478 HydrophobicContact CD1-CB 4.46Å; L445-A478 HydrophobicContact CD2-CB 3.77Å; L445-A478 HydrophobicContact CG-CB 3.68Å; V474-A478 WeakPolarHBondContact O-CB 3.42Å; V474-A478 PolarHBondContact O-N 3.41Å; K475-A478 PolarHBondContact O-N 2.78Å; A478-F480 VanDerWaalsContact C-N 3.34Å; A478-F480 PolarHBondContact O-N 3.45Å
479	V	96.8	Very high	96.6	Very high	31 Å²	31	26.5 Å²	26.5	19%	0.188	15%	0.151	C	C	.	.	H	α-helix	trans	-59.2	-42.6	173.1	168.2	0	0	0	0	111.6	Y236 L445 K475 I476 V477	Y236-V479 VanDerWaalsContact CE1-O 3.28Å; Y236-V479 WeakPolarHBondContact CE1-O 3.49Å; L445-V479 HydrophobicContact CD1-CG2 4.43Å; L445-V479 HydrophobicContact CD2-CG2 3.7Å; K475-V479 WeakPolarHBondContact O-CG2 3.04Å; K475-V479 PolarHBondContact O-N 3.4Å; K475-V479 VanDerWaalsContact O-N 3.13Å; I476-V479 PolarHBondContact O-N 2.82Å; V477-V479 PolarHBondContact O-N 3.1Å
480	F	97.9	Very high	96.4	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.013	15%	0.145	C	C	.	.	H	α-helix	trans	-95.6	-27.5	-169.7	-64.5	-74.4	0	0	0	114.8	F199 A200 C203 T240 Y243 I476 V477 A478 Y482 G483 I484	F199-F480 HydrophobicContact CB-CB 3.93Å; F199-F480 HydrophobicContact CB-CD2 3.44Å; F199-F480 VanDerWaalsContact CB-CD2 3.44Å; F199-F480 HydrophobicContact CB-CE2 4.1Å; F199-F480 HydrophobicContact CB-CG 3.79Å; F199-F480 HydrophobicContact CD1-CB 4.16Å; F199-F480 HydrophobicContact CG-CD2 4.4Å; A200-F480 HydrophobicContact CB-CE1 3.81Å; A200-F480 HydrophobicContact CB-CZ 3.82Å; C203-F480 HydrophobicContact CB-CB 4.37Å; C203-F480 HydrophobicContact CB-CD1 3.87Å; T240-F480 HydrophobicContact CG2-CD1 4.39Å; T240-F480 HydrophobicContact CG2-CE1 4.07Å; Y243-F480 AromaticContact CD1-CZ 3.84Å; Y243-F480 HydrophobicContact CD1-CZ 3.84Å; Y243-F480 HydrophobicContact CD2-CE1 4.17Å; Y243-F480 AromaticContact CD2-CZ 3.97Å; Y243-F480 HydrophobicContact CD2-CZ 3.97Å; Y243-F480 HydrophobicContact CE1-CE2 4.22Å; Y243-F480 AromaticContact CE1-CZ 3.63Å; Y243-F480 HydrophobicContact CE1-CZ 3.63Å; Y243-F480 AromaticContact CE2-CE1 3.99Å; Y243-F480 HydrophobicContact CE2-CE1 3.99Å; Y243-F480 AromaticContact CE2-CZ 3.74Å; Y243-F480 HydrophobicContact CE2-CZ 3.74Å; Y243-F480 AromaticContact CG-CZ 4Å; Y243-F480 HydrophobicContact CG-CZ 4Å; Y243-F480 AromaticContact CZ-CZ 3.57Å; I476-F480 WeakPolarHBondContact O-CD2 3.43Å; V477-F480 PolarHBondContact O-N 3.4Å; V477-F480 VanDerWaalsContact O-N 3.08Å; A478-F480 VanDerWaalsContact C-N 3.34Å; A478-F480 PolarHBondContact O-N 3.45Å; F480-Y482 PolarHBondContact O-N 3.33Å; F480-Y482 VanDerWaalsContact O-N 3.13Å; F480-G483 PolarHBondContact O-N 3.27Å; F480-I484 HydrophobicContact CB-CD1 4.2Å; F480-I484 PolarHBondContact O-N 2.86Å
481	V	97.8	Very high	96.2	Very high	36 Å²	36	20.9 Å²	20.9	22%	0.218	13%	0.128	C	C	.	.	H	α-helix	trans	-52.5	-41.4	-170.2	161.9	0	0	0	0	112.8	F199 F437 P441 V477 A485	F199-V481 HydrophobicContact CE1-CG2 4.46Å; F437-V481 HydrophobicContact CE1-CG1 3.72Å; F437-V481 HydrophobicContact CZ-CG1 3.45Å; F437-V481 VanDerWaalsContact CZ-CG1 3.45Å; P441-V481 HydrophobicContact CB-CB 4.39Å; P441-V481 HydrophobicContact CB-CG1 4.36Å; P441-V481 HydrophobicContact CG-CG1 4.39Å; V477-V481 HydrophobicContact CG1-CG2 3.65Å; V477-V481 VanDerWaalsContact O-CG2 3.26Å; V477-V481 WeakPolarHBondContact O-CG2 3.33Å; V477-V481 PolarHBondContact O-N 2.87Å; V481-A485 WeakPolarHBondContact O-CB 3.24Å; V481-A485 PolarHBondContact O-N 3.25Å
482	Y	97.9	Very high	96	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-72	-37.8	-179.1	-171.7	-118.4	0	0	0	113.7	I232 Y236 W296 L434 F437 Y438 F480 I484 A485 C486	I232-Y482 HydrophobicContact CD1-CE1 4.25Å; I232-Y482 HydrophobicContact CG2-CD1 4.26Å; I232-Y482 HydrophobicContact CG2-CE1 3.93Å; Y236-Y482 AromaticContact CE2-CD1 3.85Å; Y236-Y482 HydrophobicContact CE2-CD1 3.85Å; W296-Y482 AromaticContact CD1-CZ 3.94Å; L434-Y482 HydrophobicContact CD1-CE2 4.38Å; L434-Y482 HydrophobicContact CG-CE2 4.41Å; L434-Y482 WeakPolarHBondContact O-CE2 3.35Å; F437-Y482 AromaticContact CD1-CD2 3.99Å; F437-Y482 HydrophobicContact CD1-CD2 3.99Å; F437-Y482 HydrophobicContact CD1-CE2 4.46Å; F437-Y482 HydrophobicContact CE1-CD2 4.45Å; Y438-Y482 AromaticContact CD2-CD1 3.25Å; Y438-Y482 HydrophobicContact CD2-CD1 3.25Å; Y438-Y482 AromaticContact CD2-CD2 3.65Å; Y438-Y482 HydrophobicContact CD2-CD2 3.65Å; Y438-Y482 AromaticContact CD2-CE1 3.42Å; Y438-Y482 HydrophobicContact CD2-CE1 3.42Å; Y438-Y482 VanDerWaalsContact CD2-CE1 3.42Å; Y438-Y482 AromaticContact CD2-CE2 3.84Å; Y438-Y482 HydrophobicContact CD2-CE2 3.84Å; Y438-Y482 AromaticContact CD2-CG 3.36Å; Y438-Y482 HydrophobicContact CD2-CG 3.36Å; Y438-Y482 AromaticContact CD2-CZ 3.73Å; Y438-Y482 AromaticContact CE2-CD1 3.55Å; Y438-Y482 HydrophobicContact CE2-CD1 3.55Å; Y438-Y482 AromaticContact CE2-CE1 3.9Å; Y438-Y482 HydrophobicContact CE2-CE1 3.9Å; Y438-Y482 AromaticContact CE2-CG 3.96Å; Y438-Y482 HydrophobicContact CE2-CG 3.96Å; Y438-Y482 HydrophobicContact CG-CD1 4.37Å; Y438-Y482 HydrophobicContact CG-CD2 4.33Å; Y438-Y482 HydrophobicContact CG-CE1 4.21Å; Y438-Y482 HydrophobicContact CG-CE2 4.21Å; Y438-Y482 HydrophobicContact CG-CG 4.42Å; F480-Y482 PolarHBondContact O-N 3.33Å; F480-Y482 VanDerWaalsContact O-N 3.13Å; Y482-I484 VanDerWaalsContact C-N 3.35Å; Y482-A485 PolarHBondContact O-N 3.38Å; Y482-C486 VanDerWaalsContact CE1-SG 3.55Å; Y482-C486 VanDerWaalsContact CZ-SG 3.51Å; Y482-C486 PolarHBondContact O-N 2.84Å; Y482-C486 PolarHBondContact O-SG 2.04Å
483	G	97.9	Very high	95.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-43.7	174.1	0	0	0	0	0	111.8	C207 F480 A485 C486 G487	C207-G483 PolarHBondContact SG-O 3.5Å; C207-G483 VanDerWaalsContact SG-O 3.4Å; F480-G483 PolarHBondContact O-N 3.27Å; G483-A485 PolarHBondContact O-N 3.3Å; G483-C486 PolarHBondContact O-N 3.02Å; G483-G487 PolarHBondContact O-N 3.44Å
484	I	98.1	Very high	94.4	Very high	39 Å²	39	30.1 Å²	30.1	20%	0.2	16%	0.156	C	C	.	.	H	α-helix	trans	-56.9	-48.9	173	-69.7	170.5	0	0	0	110.6	F199 A202 C203 L206 F480 Y482 C486 G487 G488	F199-I484 HydrophobicContact CD1-CD1 3.9Å; F199-I484 HydrophobicContact CE1-CD1 4.49Å; A202-I484 HydrophobicContact CB-CD1 3.94Å; A202-I484 HydrophobicContact CB-CG1 4.35Å; C203-I484 HydrophobicContact CB-CD1 4.47Å; C203-I484 HydrophobicContact CB-CG1 3.85Å; L206-I484 HydrophobicContact CD1-CB 4.24Å; L206-I484 HydrophobicContact CD1-CG1 4.47Å; L206-I484 HydrophobicContact CD1-CG2 3.63Å; F480-I484 HydrophobicContact CB-CD1 4.2Å; F480-I484 PolarHBondContact O-N 2.86Å; Y482-I484 VanDerWaalsContact C-N 3.35Å; I484-C486 PolarHBondContact O-N 3.4Å; I484-G487 PolarHBondContact O-N 3.37Å; I484-G488 PolarHBondContact O-N 2.84Å
485	A	97.7	Very high	93.6	Very high	27 Å²	27	30.6 Å²	30.6	22%	0.223	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-42.2	178.7	0	0	0	0	0	112.5	L434 F437 V481 Y482 G483 F489	L434-A485 HydrophobicContact CD1-CB 3.99Å; F437-A485 HydrophobicContact CD1-CB 3.92Å; F437-A485 HydrophobicContact CE1-CB 3.61Å; V481-A485 WeakPolarHBondContact O-CB 3.24Å; V481-A485 PolarHBondContact O-N 3.25Å; Y482-A485 PolarHBondContact O-N 3.38Å; G483-A485 PolarHBondContact O-N 3.3Å; A485-F489 WeakPolarHBondContact O-CB 3.47Å; A485-F489 PolarHBondContact O-N 3.2Å
486	C	97.2	Very high	92.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-46.4	177.6	-69.1	0	0	0	0	112.4	I229 I232 Y482 G483 I484 F489 L490	I229-C486 HydrophobicContact CG2-CB 3.96Å; I232-C486 HydrophobicContact CG2-CB 4.34Å; Y482-C486 VanDerWaalsContact CE1-SG 3.55Å; Y482-C486 VanDerWaalsContact CZ-SG 3.51Å; Y482-C486 PolarHBondContact O-N 2.84Å; Y482-C486 PolarHBondContact O-SG 2.04Å; G483-C486 PolarHBondContact O-N 3.02Å; I484-C486 PolarHBondContact O-N 3.4Å; C486-F489 PolarHBondContact O-N 3.23Å; C486-L490 PolarHBondContact O-N 3.07Å
487	G	96.4	Very high	91	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-46.6	176.7	0	0	0	0	0	111.7	G483 I484 F489 L490 L491	G483-G487 PolarHBondContact O-N 3.44Å; I484-G487 PolarHBondContact O-N 3.37Å; G487-F489 PolarHBondContact O-N 3.47Å; G487-L490 PolarHBondContact O-N 3.15Å; G487-L491 WeakPolarHBondContact O-CG 3.3Å; G487-L491 PolarHBondContact O-N 3.23Å; G487-L491 VanDerWaalsContact O-N 3.11Å
488	G	95.5	Very high	88.8	Confident	27 Å²	27	39.9 Å²	39.9	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-60.1	-43	174.2	0	0	0	0	0	113	I484 L491 W492	I484-G488 PolarHBondContact O-N 2.84Å; G488-L491 PolarHBondContact O-N 2.73Å; G488-W492 VanDerWaalsContact O-CB 3.31Å; G488-W492 WeakPolarHBondContact O-CB 3.49Å; G488-W492 PolarHBondContact O-N 2.03Å
489	F	94	Very high	86.4	Confident	17 Å²	17	42.4 Å²	42.4	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-46.1	178.6	179.1	-95.1	0	0	0	112.5	I229 L434 A485 C486 G487 L491 W492 R493	I229-F489 HydrophobicContact CD1-CD1 3.9Å; I229-F489 HydrophobicContact CD1-CE1 3.61Å; L434-F489 HydrophobicContact CB-CD2 4.45Å; L434-F489 HydrophobicContact CD1-CB 4.38Å; L434-F489 HydrophobicContact CD2-CB 3.88Å; L434-F489 HydrophobicContact CD2-CD1 3.69Å; L434-F489 HydrophobicContact CD2-CD2 4.13Å; L434-F489 HydrophobicContact CD2-CE1 4.2Å; L434-F489 HydrophobicContact CD2-CG 3.65Å; A485-F489 WeakPolarHBondContact O-CB 3.47Å; A485-F489 PolarHBondContact O-N 3.2Å; C486-F489 PolarHBondContact O-N 3.23Å; G487-F489 PolarHBondContact O-N 3.47Å; F489-L491 PolarHBondContact O-N 3.17Å; F489-W492 HydrophobicContact CD2-CE3 4Å; F489-W492 HydrophobicContact CD2-CZ3 4.16Å; F489-W492 HydrophobicContact CE2-CE3 4.27Å; F489-W492 HydrophobicContact CE2-CZ3 4.05Å; F489-W492 PolarHBondContact O-N 3.15Å; F489-R493 WeakPolarHBondContact O-CB 3.27Å; F489-R493 PolarHBondContact O-N 3.2Å
490	L	91.6	Very high	84.1	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-39.8	177.7	-72.9	-179.1	0	0	0	112.1	A210 L222 I229 L230 C233 C486 G487 R494	A210-L490 HydrophobicContact CB-CB 3.89Å; A210-L490 HydrophobicContact CB-CD1 4.16Å; L222-L490 HydrophobicContact CD2-CD2 4.35Å; I229-L490 HydrophobicContact CB-CD2 4.31Å; I229-L490 HydrophobicContact CG2-CD1 4.04Å; I229-L490 HydrophobicContact CG2-CD2 4Å; I229-L490 HydrophobicContact CG2-CG 3.81Å; L230-L490 HydrophobicContact CD1-CD1 4.28Å; C233-L490 HydrophobicContact CB-CD1 4.47Å; C486-L490 PolarHBondContact O-N 3.07Å; G487-L490 PolarHBondContact O-N 3.15Å; L490-R494 WeakPolarHBondContact O-CG 3.48Å; L490-R494 PolarHBondContact O-N 3.14Å
491	L	91.3	Very high	81.4	Confident	39 Å²	39	52.1 Å²	52.1	20%	0.204	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-48.7	175.2	-71.8	171.2	0	0	0	111.2	L206 A209 A210 G487 G488 F489 R493 R494 T495	L206-L491 HydrophobicContact CD2-CD1 3.94Å; A209-L491 HydrophobicContact CB-CD1 4.12Å; A209-L491 HydrophobicContact CB-CD2 4.23Å; A210-L491 HydrophobicContact CB-CD2 4.45Å; A210-L491 HydrophobicContact CB-CG 4.16Å; G487-L491 WeakPolarHBondContact O-CG 3.3Å; G487-L491 PolarHBondContact O-N 3.23Å; G487-L491 VanDerWaalsContact O-N 3.11Å; G488-L491 PolarHBondContact O-N 2.73Å; F489-L491 PolarHBondContact O-N 3.17Å; L491-R493 VanDerWaalsContact C-N 3.35Å; L491-R493 PolarHBondContact O-N 3.09Å; L491-R494 PolarHBondContact O-N 3.39Å; L491-T495 WeakPolarHBondContact O-CG2 3.41Å; L491-T495 PolarHBondContact O-N 2.99Å; L491-T495 PolarHBondContact O-OG1 3.15Å
492	W	89	Confident	79.1	Confident	145 Å²	145	55.8 Å²	55.8	55%	0.549	30%	0.295	S	S	.	.	H	α-helix	trans	-55.8	-48.9	177.4	172	50.8	0	0	0	111.7	G488 F489 R494 T495 C496	G488-W492 VanDerWaalsContact O-CB 3.31Å; G488-W492 WeakPolarHBondContact O-CB 3.49Å; G488-W492 PolarHBondContact O-N 2.03Å; F489-W492 HydrophobicContact CD2-CE3 4Å; F489-W492 HydrophobicContact CD2-CZ3 4.16Å; F489-W492 HydrophobicContact CE2-CE3 4.27Å; F489-W492 HydrophobicContact CE2-CZ3 4.05Å; F489-W492 PolarHBondContact O-N 3.15Å; W492-R494 VanDerWaalsContact C-N 3.26Å; W492-R494 PolarHBondContact O-N 2.79Å; W492-T495 PolarHBondContact O-N 3.42Å; W492-T495 PolarHBondContact O-OG1 3.27Å; W492-C496 PolarHBondContact NE1-SG 2.99Å; W492-C496 WeakPolarHBondContact O-CB 3.17Å; W492-C496 PolarHBondContact O-N 3.16Å
493	R	82.4	Confident	76.6	Confident	72 Å²	72	66.1 Å²	66.1	27%	0.272	33%	0.334	S	S	.	.	H	α-helix	trans	-58.2	-40	-179.3	-170	168.2	-179.3	149.1	-8.1	112.1	D226 S427 T431 F489 L491 D497	D226-R493 VanDerWaalsContact CG-CZ 3.44Å; D226-R493 IonicContact OD1-CZ 2.72Å; D226-R493 IonicContact OD1-NH1 2.64Å; D226-R493 PolarHBondContact OD1-NH1 3.21Å; D226-R493 IonicContact OD1-NH2 2.83Å; D226-R493 IonicContact OD2-CZ 2.7Å; D226-R493 IonicContact OD2-NE 2.73Å; D226-R493 PolarHBondContact OD2-NE 3.09Å; D226-R493 IonicContact OD2-NH1 3.18Å; D226-R493 PolarHBondContact OD2-NH1 3.32Å; D226-R493 IonicContact OD2-NH2 3.63Å; D226-R493 PolarHBondContact OD2-NH2 2.86Å; S427-R493 PolarHBondContact OG-NH1 3.17Å; S427-R493 PolarHBondContact OG-NH2 3.35Å; T431-R493 PolarHBondContact OG1-NH1 3.05Å; F489-R493 WeakPolarHBondContact O-CB 3.27Å; F489-R493 PolarHBondContact O-N 3.2Å; L491-R493 VanDerWaalsContact C-N 3.35Å; L491-R493 PolarHBondContact O-N 3.09Å; R493-D497 WeakPolarHBondContact O-CB 3.18Å; R493-D497 PolarHBondContact O-N 2.72Å
494	R	77.6	Confident	73.6	Confident	40 Å²	40	69.7 Å²	69.7	15%	0.151	36%	0.364	C	S	.	.	H	α-helix	trans	-80.4	-31.6	-179.5	-68.1	-163.3	-166.1	120	13.3	114.5	A210 F213 Q214 L490 L491 W492	A210-R494 PolarHBondContact O-NH1 3.08Å; F213-R494 HydrophobicContact CD1-CB 4.24Å; F213-R494 HydrophobicContact CD1-CG 4.33Å; F213-R494 HydrophobicContact CE1-CB 3.8Å; F213-R494 HydrophobicContact CE1-CG 4.17Å; F213-R494 HydrophobicContact CZ-CB 4.19Å; Q214-R494 VanDerWaalsContact OE1-NE 3.15Å; L490-R494 WeakPolarHBondContact O-CG 3.48Å; L490-R494 PolarHBondContact O-N 3.14Å; L491-R494 PolarHBondContact O-N 3.39Å; W492-R494 VanDerWaalsContact C-N 3.26Å; W492-R494 PolarHBondContact O-N 2.79Å
495	T	80	Confident	71	Confident	76 Å²	76	73.6 Å²	73.6	47%	0.466	39%	0.392	S	S	.	.	H	α-helix	trans	-77.5	-38.8	178.2	53.6	0	0	0	0	111.5	L491 W492 R498 S499	L491-T495 WeakPolarHBondContact O-CG2 3.41Å; L491-T495 PolarHBondContact O-N 2.99Å; L491-T495 PolarHBondContact O-OG1 3.15Å; W492-T495 PolarHBondContact O-N 3.42Å; W492-T495 PolarHBondContact O-OG1 3.27Å; T495-R498 VanDerWaalsContact O-CB 3.23Å; T495-R498 WeakPolarHBondContact O-CB 2.92Å; T495-R498 PolarHBondContact O-N 3.43Å; T495-S499 PolarHBondContact O-N 3.34Å
496	C	73.6	Confident	68.3	Low	50 Å²	50	76.9 Å²	76.9	34%	0.338	42%	0.419	S	S	.	.	H	α-helix	trans	-74.4	-35.2	178.9	-76.7	0	0	0	0	113.3	W492 R498 S499 V500	W492-C496 PolarHBondContact NE1-SG 2.99Å; W492-C496 WeakPolarHBondContact O-CB 3.17Å; W492-C496 PolarHBondContact O-N 3.16Å; C496-R498 PolarHBondContact O-N 3.25Å; C496-S499 WeakPolarHBondContact O-CB 3.08Å; C496-S499 PolarHBondContact O-N 3.49Å; C496-S499 PolarHBondContact O-OG 2.78Å; C496-V500 PolarHBondContact O-N 3.19Å
497	D	63.6	Low	65.6	Low	85 Å²	85	86.5 Å²	86.5	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-35	172.8	-163.3	14	0	0	0	111.3	R493 S499 V500 L501	R493-D497 WeakPolarHBondContact O-CB 3.18Å; R493-D497 PolarHBondContact O-N 2.72Å; D497-S499 VanDerWaalsContact C-N 3.31Å; D497-S499 PolarHBondContact O-N 2.83Å; D497-V500 PolarHBondContact O-N 2.88Å; D497-L501 PolarHBondContact O-N 3.4Å
498	R	51.2	Low	62.9	Low	138 Å²	138	90.6 Å²	90.6	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-36	173.3	-144.1	174.2	-176.9	-164.1	-5.4	113	T495 C496 T502	T495-R498 VanDerWaalsContact O-CB 3.23Å; T495-R498 WeakPolarHBondContact O-CB 2.92Å; T495-R498 PolarHBondContact O-N 3.43Å; C496-R498 PolarHBondContact O-N 3.25Å; R498-T502 WeakPolarHBondContact O-CG2 3.28Å; R498-T502 PolarHBondContact O-N 2.92Å; R498-T502 PolarHBondContact O-OG1 2.94Å; R498-T502 VanDerWaalsContact O-OG1 3.13Å
499	S	47.6	Very low	60.4	Low	60 Å²	60	95.2 Å²	95.2	42%	0.42	52%	0.52	S	S	.	.	H	α-helix	trans	-73.7	-26.2	-179.2	69.2	0	0	0	0	113.5	T495 C496 D497 T502	T495-S499 PolarHBondContact O-N 3.34Å; C496-S499 WeakPolarHBondContact O-CB 3.08Å; C496-S499 PolarHBondContact O-N 3.49Å; C496-S499 PolarHBondContact O-OG 2.78Å; D497-S499 VanDerWaalsContact C-N 3.31Å; D497-S499 PolarHBondContact O-N 2.83Å; S499-T502 PolarHBondContact O-OG1 3.22Å
500	V	48.4	Very low	58.1	Low	104 Å²	104	99.6 Å²	99.6	63%	0.63	55%	0.552	S	S	*	*	H	α-helix	trans	-75.8	-40.9	175.9	178.1	0	0	0	0	110.8	C496 D497 T502 R503	C496-V500 PolarHBondContact O-N 3.19Å; D497-V500 PolarHBondContact O-N 2.88Å; V500-T502 PolarHBondContact O-N 2.95Å; V500-R503 PolarHBondContact O-N 3.43Å
501	L	41.5	Very low	55.9	Low	133 Å²	133	104.1 Å²	104.1	70%	0.696	59%	0.591	S	S	*	*	H	α-helix	trans	-68.4	-30.2	177.3	-84.7	151.7	0	0	0	113.6	D497	D497-L501 PolarHBondContact O-N 3.4Å
502	T	49.1	Very low	53.6	Low	113 Å²	113	109.7 Å²	109.7	69%	0.693	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-9.6	176.8	52	0	0	0	0	114.3	R498 S499 V500	R498-T502 WeakPolarHBondContact O-CG2 3.28Å; R498-T502 PolarHBondContact O-N 2.92Å; R498-T502 PolarHBondContact O-OG1 2.94Å; R498-T502 VanDerWaalsContact O-OG1 3.13Å; S499-T502 PolarHBondContact O-OG1 3.22Å; V500-T502 PolarHBondContact O-N 2.95Å
503	R	45.3	Very low	51.6	Low	220 Å²	220	108.4 Å²	108.4	83%	0.83	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	5.1	-179.1	-101.6	-175.3	-170.3	170.2	4.2	114.8	V500 P505	V500-R503 PolarHBondContact O-N 3.43Å; R503-P505 WeakPolarHBondContact O-CD 3.48Å; R503-P505 VanDerWaalsContact O-N 3.15Å
504	A	35.7	Very low	49.5	Very low	75 Å²	75	112.2 Å²	112.2	62%	0.62	66%	0.661	S	S	*	*	S	Bend	trans	-59.7	119.5	166.9	0	0	0	0	0	108.3	A506	A504-A506 PolarHBondContact O-N 3.29Å
505	P	42.5	Very low	47.9	Very low	121 Å²	121	114.9 Å²	114.9	79%	0.786	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.5	126.6	-176.3	24.2	-31.2	0	0	0	108.2	R503 K507	R503-P505 WeakPolarHBondContact O-CD 3.48Å; R503-P505 VanDerWaalsContact O-N 3.15Å; P505-K507 PolarHBondContact O-N 2.76Å
506	A	41.6	Very low	46	Very low	96 Å²	96	115.3 Å²	115.3	79%	0.793	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-47.7	120.7	162.3	0	0	0	0	0	106.7	A504 A508	A504-A506 PolarHBondContact O-N 3.29Å; A506-A508 PolarHBondContact O-N 3.3Å
507	K	41	Very low	44.2	Very low	201 Å²	201	116.6 Å²	116.6	87%	0.874	73%	0.733	S	S	*	*			trans	-38.8	118.2	177.8	-84.7	175.2	172.2	177.9	0	109	P505	P505-K507 PolarHBondContact O-N 2.76Å
508	A	39.4	Very low	43	Very low	86 Å²	86	123 Å²	123	71%	0.711	75%	0.75	S	S	*	*			trans	-52.2	134.9	168.8	0	0	0	0	0	108.2	A506 S510	A506-A508 PolarHBondContact O-N 3.3Å; A508-S510 PolarHBondContact O-N 2.04Å
509	P	42.8	Very low	42.2	Very low	125 Å²	125	126.4 Å²	126.4	81%	0.812	77%	0.765	S	S	*	*			trans	-61.6	118.3	173.4	25.9	-30.2	0	0	0	106.9	A511	P509-A511 PolarHBondContact O-N 2.95Å
510	S	46	Very low	41.8	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	78%	0.784	S	S	*	*			trans	-57.5	105.6	172.3	44.4	0	0	0	0	108.5	A508 L512	A508-S510 PolarHBondContact O-N 2.04Å; S510-L512 PolarHBondContact O-N 3.38Å; S510-L512 VanDerWaalsContact O-N 3.14Å
511	A	43.6	Very low	41.2	Very low	100 Å²	100	134 Å²	134	83%	0.826	80%	0.801	S	S	*	*			trans	-62.3	109.2	165.4	0	0	0	0	0	107.9	P509	P509-A511 PolarHBondContact O-N 2.95Å
512	L	43.5	Very low	41	Very low	155 Å²	155	131.2 Å²	131.2	81%	0.812	80%	0.804	S	S	*	*			trans	-70.4	131	170.1	-91	146.5	0	0	0	109	S510	S510-L512 PolarHBondContact O-N 3.38Å; S510-L512 VanDerWaalsContact O-N 3.14Å
513	P	47.3	Very low	40.6	Very low	119 Å²	119	131 Å²	131	77%	0.773	81%	0.808	S	S	*	*			trans	-74.1	129.5	170	30	-29.3	0	0	0	109.3	A515	P513-A515 PolarHBondContact O-N 2.88Å
514	V	38.3	Very low	40.4	Very low	152 Å²	152	127.2 Å²	127.2	92%	0.921	81%	0.809	S	S	*	*			trans	-67.2	114	170.3	173.3	0	0	0	0	108.7
515	A	43.8	Very low	40.4	Very low	96 Å²	96	128.5 Å²	128.5	79%	0.793	82%	0.82	S	S	*	*			trans	-153.2	124.3	158.2	0	0	0	0	0	109	P513	P513-A515 PolarHBondContact O-N 2.88Å
516	G	39.8	Very low	40.1	Very low	85 Å²	85	127.8 Å²	127.8	88%	0.876	82%	0.824	S	S	*	*			trans	-66.4	158.9	-166.2	0	0	0	0	0	115.8
517	G	36.2	Very low	39.7	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	83%	0.828	S	S	*	*			trans	165.1	105.7	172.6	0	0	0	0	0	110.6
518	R	38	Very low	39.4	Very low	218 Å²	218	123.7 Å²	123.7	82%	0.823	83%	0.828	S	S	*	*			trans	-53.9	143.3	176.4	-63.4	168.2	-175.6	-176	0.1	110.7
519	Y	36.3	Very low	39.3	Very low	211 Å²	211	125.4 Å²	125.4	83%	0.827	84%	0.835	S	S	*	*				156.7	132.4	119.2	-83.7	-70.6	0	0	0	112.9
520	A	39.2	Very low	39	Very low	100 Å²	100	128.8 Å²	128.8	83%	0.826	84%	0.84	S	S	*	*			trans	73.1	109.9	148.7	0	0	0	0	0	120.5
521	F	34.6	Very low	38.5	Very low	222 Å²	222	135.4 Å²	135.4	97%	0.974	85%	0.848	S	S	*	*			trans	-67.7	134.8	166.7	-155.8	-100.1	0	0	0	110.7
522	G	36.8	Very low	38.1	Very low	75 Å²	75	137.9 Å²	137.9	77%	0.773	85%	0.852	S	S	*	*			trans	-176.3	100.4	176.4	0	0	0	0	0	113.3
523	S	40.9	Very low	37.6	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	85%	0.85	S	S	*	*			trans	-49.1	136.9	179.8	-146.4	0	0	0	0	114.8
524	T	41.1	Very low	37	Very low	140 Å²	140	137.3 Å²	137.3	86%	0.859	86%	0.856	S	S	*	*				168.9	140.9	113.1	38.5	0	0	0	0	111.9
525	A	35.2	Very low	36.8	Very low	103 Å²	103	139 Å²	139	85%	0.851	86%	0.858	S	S	*	*			trans	-71.3	136.3	-176.8	0	0	0	0	0	113.4
526	A	36.1	Very low	36.3	Very low	105 Å²	105	139.4 Å²	139.4	87%	0.868	86%	0.856	S	S	*	*			trans	172.5	83.5	146.6	0	0	0	0	0	110.8
527	A	34.8	Very low	36.1	Very low	107 Å²	107	142.5 Å²	142.5	88%	0.884	85%	0.847	S	S	*	*			trans	-156.9	62.9	169.3	0	0	0	0	0	112.2
528	A	34.4	Very low	36	Very low	104 Å²	104	147.5 Å²	147.5	86%	0.86	85%	0.85	S	S	*	*	S	Bend	trans	-161.2	67.1	170.3	0	0	0	0	0	113.1
529	S	37.8	Very low	35.9	Very low	123 Å²	123	145.3 Å²	145.3	86%	0.86	85%	0.846	S	S	*	*			trans	-165.1	32.1	166.9	-158	0	0	0	0	116.9
530	Q	35.4	Very low	35.8	Very low	196 Å²	196	144.1 Å²	144.1	92%	0.916	84%	0.841	S	S	*	*			trans	-123.5	44.6	-169.2	-135.2	168.5	-3	0	0	116.2
531	R	34.7	Very low	35.3	Very low	246 Å²	246	143.1 Å²	143.1	93%	0.928	84%	0.841	S	S	*	*	S	Bend	trans	-138.1	21.5	176.1	-95.4	-168.9	-175	-171.1	1.8	118.2
532	V	35.9	Very low	35.3	Very low	152 Å²	152	138.6 Å²	138.6	92%	0.921	83%	0.831	S	S	*	*	S	Bend	trans	-130.2	33.8	178.7	-165.4	0	0	0	0	113.8
533	A	34	Very low	35.2	Very low	92 Å²	92	139.6 Å²	139.6	76%	0.76	83%	0.832	S	S	*	*			trans	-148.6	57.6	179.3	0	0	0	0	0	113.6
534	L	33.4	Very low	34.8	Very low	171 Å²	171	139.4 Å²	139.4	90%	0.895	83%	0.831	S	S	*	*			trans	-150.5	88.4	163.6	-80.9	177.3	0	0	0	107.4
535	L	33.9	Very low	34.4	Very low	186 Å²	186	137.6 Å²	137.6	97%	0.974	83%	0.83	S	S	*	*			trans	171.1	50	156.8	-88.7	166.7	0	0	0	108
536	S	33.2	Very low	34.3	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	82%	0.819	S	S	*	*			trans	-103.9	147.7	152.5	175.5	0	0	0	0	105.3
537	E	35.1	Very low	34	Very low	151 Å²	151	141.2 Å²	141.2	71%	0.706	82%	0.821	S	S	*	*			trans	89.6	70.3	-177	-54.6	-72.7	119.9	0	0	115.9
538	H	35.5	Very low	34	Very low	181 Å²	181	145.6 Å²	145.6	84%	0.838	81%	0.814	S	S	*	*			trans	-142.2	99	131.8	-137.7	-87.7	0	0	0	110.3	Y540	H538-Y540 PolarHBondContact O-N 2.85Å
539	K	35.3	Very low	33.9	Very low	172 Å²	172	149.4 Å²	149.4	75%	0.748	82%	0.816	S	S	*	*			trans	-41	125.9	171.5	-67.4	171	175.5	175.1	0	111.9
540	Y	33.9	Very low	33.8	Very low	186 Å²	186	150.7 Å²	150.7	73%	0.729	81%	0.809	S	S	*	*			trans	-161.6	114	134.6	-89.3	-66	0	0	0	108.7	H538	H538-Y540 PolarHBondContact O-N 2.85Å
541	G	28.9	Very low	33.7	Very low	79 Å²	79	146.7 Å²	146.7	81%	0.814	80%	0.803	S	S	*	*			trans	-75.5	136.6	-178.9	0	0	0	0	0	112.7
542	V	35.8	Very low	33.8	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	80%	0.796	S	S	*	*			trans	-137.6	122	151.1	-179	0	0	0	0	106.3	S544	V542-S544 PolarHBondContact O-N 3.43Å
543	A	33.4	Very low	33.5	Very low	96 Å²	96	138.1 Å²	138.1	79%	0.793	79%	0.787	S	S	*	*			trans	-58.5	124.5	-178.6	0	0	0	0	0	111	A545	A543-A545 PolarHBondContact O-N 2.86Å
544	S	33.3	Very low	33.5	Very low	104 Å²	104	139.5 Å²	139.5	73%	0.727	79%	0.788	S	S	*	*			trans	-76.4	99.5	163.1	-167.7	0	0	0	0	107.8	V542 T546	V542-S544 PolarHBondContact O-N 3.43Å; S544-T546 PolarHBondContact O-N 3.26Å; S544-T546 PolarHBondContact OG-OG1 2.77Å
545	A	31.6	Very low	33.7	Very low	102 Å²	102	136.1 Å²	136.1	84%	0.843	79%	0.785	S	S	*	*			trans	-76.3	79.7	162.4	0	0	0	0	0	107.9	A543 M547	A543-A545 PolarHBondContact O-N 2.86Å; A545-M547 PolarHBondContact O-N 3.46Å
546	T	34.3	Very low	33.6	Very low	103 Å²	103	131.4 Å²	131.4	63%	0.632	78%	0.781	S	S	*	*			trans	-80.9	99	165.6	-25.2	0	0	0	0	107.3	S544 R548	S544-T546 PolarHBondContact O-N 3.26Å; S544-T546 PolarHBondContact OG-OG1 2.77Å; T546-R548 VanDerWaalsContact C-N 3.28Å; T546-R548 PolarHBondContact O-N 2.94Å
547	M	29.6	Very low	33.5	Very low	181 Å²	181	130.1 Å²	130.1	89%	0.892	79%	0.785	S	S	*	*			trans	-70.9	88.5	169.7	-153.1	178.7	-145.7	0	0	107.7	A545 M549	A545-M547 PolarHBondContact O-N 3.46Å; M547-M549 PolarHBondContact O-N 3.13Å
548	R	35	Very low	33.1	Very low	199 Å²	199	131.4 Å²	131.4	75%	0.751	79%	0.79	S	S	*	*			trans	-76.2	108.1	164.6	-79.6	-174.2	-167.5	165.2	5.7	107.3	T546 H550	T546-R548 VanDerWaalsContact C-N 3.28Å; T546-R548 PolarHBondContact O-N 2.94Å; R548-H550 PolarHBondContact O-N 3.48Å
549	M	32	Very low	32.8	Very low	184 Å²	184	132.3 Å²	132.3	91%	0.906	79%	0.792	S	S	*	*			trans	-64.3	100.6	157.8	-76	-164.1	172.4	0	0	108	M547 S551	M547-M549 PolarHBondContact O-N 3.13Å; M549-S551 PolarHBondContact O-N 2.96Å
550	H	34.7	Very low	32.7	Very low	150 Å²	150	129 Å²	129	69%	0.694	79%	0.788	S	S	*	*			trans	-83.3	106	162.7	-100.3	-81.2	0	0	0	108	R548 T552	R548-H550 PolarHBondContact O-N 3.48Å; H550-T552 PolarHBondContact O-N 3.04Å
551	S	33.1	Very low	32.1	Very low	113 Å²	113	126 Å²	126	79%	0.79	79%	0.793	S	S	*	*			trans	-61.1	116.4	161.8	-177.5	0	0	0	0	108.7	M549	M549-S551 PolarHBondContact O-N 2.96Å
552	T	37.2	Very low	32.4	Very low	128 Å²	128	128.6 Å²	128.6	79%	0.785	79%	0.793	S	S	*	*			trans	-135.5	102.6	160.1	43.4	0	0	0	0	106.8	H550	H550-T552 PolarHBondContact O-N 3.04Å
553	A	30.4	Very low	32	Very low	89 Å²	89	129.7 Å²	129.7	74%	0.736	79%	0.794	S	S	*	*			trans	-77.2	148	157.2	0	0	0	0	0	107.6
554	P	34.7	Very low	32	Very low	122 Å²	122	132.5 Å²	132.5	79%	0.792	79%	0.791	S	S	*	*				-146.3	151.9	98.3	34.4	-16.9	0	0	0	115.6
555	A	37	Very low	32	Very low	100 Å²	100	135.3 Å²	135.3	83%	0.826	79%	0.794	S	S	*	*			trans	59.9	112.4	139.3	0	0	0	0	0	121
556	G	31.3	Very low	32.1	Very low	86 Å²	86	142.3 Å²	142.3	89%	0.887	82%	0.816	S	S	*	*				91.5	105.9	121.4	0	0	0	0	0	117.4
557	G	31.1	Very low	32	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	83%	0.826	S	S	*	*			trans	165.3	89.7	165.1	0	0	0	0	0	113.4
558	H	27.6	Very low	32.2	Very low	178 Å²	178	142.4 Å²	142.4	82%	0.824	82%	0.822	S	S	*	*			trans	-47	146.4	163.9	-98.3	-105.1	0	0	0	112.5
559	F	29.1	Very low	32	Very low	200 Å²	200	139.2 Å²	139.2	88%	0.877	83%	0.826	S	S	*	*				176.2	154.5	111.8	-103.5	-94.5	0	0	0	110.6
560	P	31.7	Very low	32	Very low	102 Å²	102	136.6 Å²	136.6	66%	0.662	82%	0.821	S	S	*	*			trans	-107	-177.1	-150.4	42	-33.7	0	0	0	115.3
561	C	23.3	Very low	31.8	Very low	123 Å²	123	135.8 Å²	135.8	83%	0.831	83%	0.829	S	S	*	*			trans	-18.3	137.7	169.1	-52.5	0	0	0	0	118.4
562	V	34.9	Very low	31.7	Very low	134 Å²	134	137.3 Å²	137.3	81%	0.812	83%	0.832	S	S	*	*			trans	-141.4	108.6	149.2	178.6	0	0	0	0	108.9
563	D	26.8	Very low	31.4	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	84%	0.835	S	S	*	*			trans	-61.9	135.3	146.8	-85.6	-50.5	0	0	0	108.8
564	H	34	Very low	31.4	Very low	155 Å²	155	141.7 Å²	141.7	72%	0.718	84%	0.843	S	S	*	*			trans	-172	114.7	138.9	-112.3	-78	0	0	0	112
565	M	32.9	Very low	31.2	Very low	163 Å²	163	143.3 Å²	143.3	80%	0.803	85%	0.847	S	S	*	*			trans	36	113.5	132.4	-58.7	-176.5	-167.3	0	0	119.5
566	L	34.3	Very low	30.6	Very low	250 Å²	250	147.3 Å²	147.3	100%	1.309	85%	0.849	S	S	*	*				-146.1	0	115.4	-104.6	164.6	0	0	0	109.1

Retrieved 566 of 566 residues in 484 ms (Link to these results)

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