A0A077ZIP4_TRITR Loading...

General transcription factor 3C

AlphaFold DB , UniProt , Accession A0A077ZIP4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 770 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	38.8	Very low	34.9	Very low	241 Å²	241	125.5 Å²	125.5	100%	1.187	74%	0.744	S	S	*	*				0	102.1	0	-80.9	176.3	173.3	0	0	105.6
2	N	29.5	Very low	35	Very low	159 Å²	159	125.3 Å²	125.3	85%	0.85	73%	0.73	S	S	*	*			trans	-93.3	120.2	-169.3	-70	-12	0	0	0	109.2
3	I	39.7	Very low	35.1	Very low	159 Å²	159	123.7 Å²	123.7	82%	0.815	72%	0.717	S	S	*	*			trans	-135.5	79.2	160.8	-56.6	175.8	0	0	0	102.9
4	S	31.5	Very low	35.2	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	71%	0.711	S	S	*	*				35.4	102.1	97	66.6	0	0	0	0	111.1
5	G	32.6	Very low	35.3	Very low	86 Å²	86	128 Å²	128	89%	0.887	71%	0.71	S	S	*	*				106.9	24.3	52.9	0	0	0	0	0	112.2
6	A	34.5	Very low	35.4	Very low	75 Å²	75	128.1 Å²	128.1	62%	0.62	70%	0.703	S	S	*	*			trans	-140.5	-3.4	-172	0	0	0	0	0	116.8
7	D	32.6	Very low	35.3	Very low	130 Å²	130	127.1 Å²	127.1	70%	0.695	69%	0.691	S	S	*	*	S	Bend	trans	-119.3	7.7	-173.7	-69.4	-32.8	0	0	0	115
8	V	37.1	Very low	35.3	Very low	101 Å²	101	125.9 Å²	125.9	61%	0.612	68%	0.683	S	S	*	*	S	Bend	trans	-79.4	-30	176.4	-178.7	0	0	0	0	111.2	V10 L11 E12	V8-V10 VanDerWaalsContact C-N 3.31Å; V8-V10 PolarHBondContact O-N 2.91Å; V8-L11 PolarHBondContact O-N 2.98Å; V8-E12 PolarHBondContact O-N 3.3Å
9	D	35.2	Very low	35.9	Very low	112 Å²	112	122.6 Å²	122.6	60%	0.599	67%	0.67	S	S	*	*	H	α-helix	trans	-68.6	-26.9	-177.8	-60.4	-13.6	0	0	0	112.7	D13	D9-D13 VanDerWaalsContact O-CG 3.32Å; D9-D13 PolarHBondContact O-N 3.45Å
10	V	37.4	Very low	36.4	Very low	84 Å²	84	119.7 Å²	119.7	51%	0.509	66%	0.656	S	S	.	*	H	α-helix	trans	-78.9	-23	-178.2	-173.4	0	0	0	0	112.9	V8 Y14	V8-V10 VanDerWaalsContact C-N 3.31Å; V8-V10 PolarHBondContact O-N 2.91Å; V10-Y14 PolarHBondContact O-N 3Å
11	L	34.9	Very low	36.6	Very low	127 Å²	127	119 Å²	119	67%	0.665	65%	0.649	S	S	*	*	H	α-helix	trans	-83.9	-34.3	175.9	-85	156.9	0	0	0	111.8	V8 Y14 E15	V8-L11 PolarHBondContact O-N 2.98Å; L11-Y14 PolarHBondContact O-N 3.38Å; L11-E15 PolarHBondContact O-N 3.49Å; L11-E15 VanDerWaalsContact O-N 3.14Å
12	E	35.6	Very low	36.9	Very low	124 Å²	124	110.8 Å²	110.8	58%	0.579	61%	0.612	S	S	*	*	H	α-helix	trans	-65.8	-41.3	171.8	-73.7	-176.4	168.9	0	0	111	V8 Y14 E15 E16	V8-E12 PolarHBondContact O-N 3.3Å; E12-Y14 VanDerWaalsContact C-N 3.28Å; E12-Y14 PolarHBondContact O-N 3.24Å; E12-E15 PolarHBondContact O-N 3.04Å; E12-E16 WeakPolarHBondContact O-CB 2.82Å; E12-E16 PolarHBondContact O-N 3.16Å
13	D	36.7	Very low	37.7	Very low	104 Å²	104	106.1 Å²	106.1	56%	0.556	59%	0.592	S	S	*	*	H	α-helix	trans	-62.6	-31.5	175.1	-75.4	-14.1	0	0	0	113	D9 F17	D9-D13 VanDerWaalsContact O-CG 3.32Å; D9-D13 PolarHBondContact O-N 3.45Å; D13-F17 VanDerWaalsContact O-CB 3.31Å; D13-F17 WeakPolarHBondContact O-CB 3.36Å; D13-F17 PolarHBondContact O-N 3.18Å
14	Y	37.1	Very low	38.3	Very low	162 Å²	162	102.8 Å²	102.8	64%	0.635	58%	0.576	S	S	*	*	H	α-helix	trans	-79.2	-35.7	179.4	-112.6	-86.2	0	0	0	113.4	V10 L11 E12 L18	V10-Y14 PolarHBondContact O-N 3Å; L11-Y14 PolarHBondContact O-N 3.38Å; E12-Y14 VanDerWaalsContact C-N 3.28Å; E12-Y14 PolarHBondContact O-N 3.24Å; Y14-L18 PolarHBondContact O-N 3Å
15	E	35.6	Very low	39.2	Very low	150 Å²	150	102 Å²	102	70%	0.701	56%	0.563	S	S	*	*	H	α-helix	trans	-72.8	-34.9	173.1	-73.7	-168.3	165	0	0	111.7	L11 E12 S19	L11-E15 PolarHBondContact O-N 3.49Å; L11-E15 VanDerWaalsContact O-N 3.14Å; E12-E15 PolarHBondContact O-N 3.04Å; E15-S19 PolarHBondContact O-N 3.13Å; E15-S19 VanDerWaalsContact O-N 3.16Å
16	E	37.6	Very low	39.9	Very low	129 Å²	129	99.8 Å²	99.8	60%	0.603	53%	0.532	S	S	*	.	H	α-helix	trans	-66.1	-41.5	173.3	-154.1	172.1	-152.4	0	0	110.8	E12 L18 S19 T20	E12-E16 WeakPolarHBondContact O-CB 2.82Å; E12-E16 PolarHBondContact O-N 3.16Å; E16-L18 PolarHBondContact O-N 3.27Å; E16-S19 PolarHBondContact O-N 3.21Å; E16-S19 PolarHBondContact O-OG 3.28Å; E16-T20 WeakPolarHBondContact O-CG2 3.44Å; E16-T20 PolarHBondContact O-N 2.81Å; E16-T20 VanDerWaalsContact O-N 3.14Å
17	F	33	Very low	40.8	Very low	112 Å²	112	101.5 Å²	101.5	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-59.3	-44.7	175.2	-171.2	-96.6	0	0	0	113.2	D13 S19 T20 E21	D13-F17 VanDerWaalsContact O-CB 3.31Å; D13-F17 WeakPolarHBondContact O-CB 3.36Å; D13-F17 PolarHBondContact O-N 3.18Å; F17-S19 VanDerWaalsContact C-N 3.35Å; F17-S19 PolarHBondContact O-N 2.95Å; F17-T20 PolarHBondContact O-N 3.2Å; F17-T20 PolarHBondContact O-OG1 3.49Å; F17-E21 HydrophobicContact CE1-CG 4.27Å; F17-E21 WeakPolarHBondContact CE1-OE1 3.47Å; F17-E21 HydrophobicContact CZ-CG 4.43Å; F17-E21 WeakPolarHBondContact CZ-OE1 3.32Å; F17-E21 PolarHBondContact O-N 3.25Å
18	L	36.6	Very low	42.1	Very low	105 Å²	105	101.1 Å²	101.1	55%	0.55	52%	0.521	S	S	.	.	H	α-helix	trans	-69.6	-29.1	178.1	-75.2	165.9	0	0	0	113.5	Y14 E16 T22	Y14-L18 PolarHBondContact O-N 3Å; E16-L18 PolarHBondContact O-N 3.27Å; L18-T22 PolarHBondContact O-OG1 3.09Å
19	S	46.2	Very low	42.7	Very low	63 Å²	63	100.1 Å²	100.1	44%	0.441	51%	0.512	S	S	.	.	H	α-helix	trans	-69.4	-34.5	173.8	79.2	0	0	0	0	112.2	E15 E16 F17 T22 S23	E15-S19 PolarHBondContact O-N 3.13Å; E15-S19 VanDerWaalsContact O-N 3.16Å; E16-S19 PolarHBondContact O-N 3.21Å; E16-S19 PolarHBondContact O-OG 3.28Å; F17-S19 VanDerWaalsContact C-N 3.35Å; F17-S19 PolarHBondContact O-N 2.95Å; S19-T22 PolarHBondContact O-OG1 3.44Å; S19-S23 WeakPolarHBondContact O-CB 3.49Å; S19-S23 PolarHBondContact O-N 3.25Å
20	T	45.5	Very low	43.2	Very low	64 Å²	64	98 Å²	98	39%	0.393	50%	0.499	S	S	.	.	H	α-helix	trans	-73.6	-44.2	178.8	57.8	0	0	0	0	113.2	E16 F17 T22 S23 D24	E16-T20 WeakPolarHBondContact O-CG2 3.44Å; E16-T20 PolarHBondContact O-N 2.81Å; E16-T20 VanDerWaalsContact O-N 3.14Å; F17-T20 PolarHBondContact O-N 3.2Å; F17-T20 PolarHBondContact O-OG1 3.49Å; T20-T22 PolarHBondContact O-N 3.44Å; T20-S23 PolarHBondContact O-N 3.38Å; T20-D24 VanDerWaalsContact O-CB 3.28Å; T20-D24 WeakPolarHBondContact O-CB 3.46Å; T20-D24 PolarHBondContact O-N 2.84Å
21	E	41.5	Very low	44.2	Very low	107 Å²	107	98.4 Å²	98.4	50%	0.5	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-35.5	-178.5	-75.2	-168.7	159.2	0	0	113	F17 L25	F17-E21 HydrophobicContact CE1-CG 4.27Å; F17-E21 WeakPolarHBondContact CE1-OE1 3.47Å; F17-E21 HydrophobicContact CZ-CG 4.43Å; F17-E21 WeakPolarHBondContact CZ-OE1 3.32Å; F17-E21 PolarHBondContact O-N 3.25Å; E21-L25 WeakPolarHBondContact O-CB 3.38Å; E21-L25 PolarHBondContact O-N 3.47Å
22	T	45.3	Very low	45.2	Very low	68 Å²	68	97 Å²	97	42%	0.417	49%	0.488	S	S	.	.	H	α-helix	trans	-72.1	-41.7	176.6	53.1	0	0	0	0	111.4	L18 S19 T20 V26	L18-T22 PolarHBondContact O-OG1 3.09Å; S19-T22 PolarHBondContact O-OG1 3.44Å; T20-T22 PolarHBondContact O-N 3.44Å; T22-V26 WeakPolarHBondContact O-CB 3.23Å; T22-V26 WeakPolarHBondContact O-CG2 3.46Å; T22-V26 PolarHBondContact O-N 2.87Å; T22-V26 VanDerWaalsContact O-N 3.09Å
23	S	44.6	Very low	45.7	Very low	60 Å²	60	96.7 Å²	96.7	42%	0.42	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-42	173	-169.9	0	0	0	0	111.8	S19 T20 V26 Q27	S19-S23 WeakPolarHBondContact O-CB 3.49Å; S19-S23 PolarHBondContact O-N 3.25Å; T20-S23 PolarHBondContact O-N 3.38Å; S23-V26 PolarHBondContact O-N 2.96Å; S23-Q27 WeakPolarHBondContact O-CB 3.25Å; S23-Q27 PolarHBondContact O-N 3.34Å
24	D	52.7	Low	46	Very low	89 Å²	89	94.8 Å²	94.8	48%	0.476	48%	0.475	S	S	.	.	H	α-helix	trans	-68.2	-40	179.5	-81	-12.1	0	0	0	112.3	T20 V26 Q27 Q28	T20-D24 VanDerWaalsContact O-CB 3.28Å; T20-D24 WeakPolarHBondContact O-CB 3.46Å; T20-D24 PolarHBondContact O-N 2.84Å; D24-V26 VanDerWaalsContact C-N 3.3Å; D24-V26 PolarHBondContact O-N 3.18Å; D24-Q27 PolarHBondContact O-N 2.85Å; D24-Q28 VanDerWaalsContact O-CB 3.27Å; D24-Q28 WeakPolarHBondContact O-CB 3.3Å; D24-Q28 WeakPolarHBondContact O-CG 3.48Å; D24-Q28 PolarHBondContact O-N 2.76Å
25	L	51.8	Low	46.5	Very low	91 Å²	91	90.4 Å²	90.4	48%	0.476	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-38.4	174.6	-167.5	75.6	0	0	0	111	E21 L29	E21-L25 WeakPolarHBondContact O-CB 3.38Å; E21-L25 PolarHBondContact O-N 3.47Å; L25-L29 HydrophobicContact CG-CD1 4.26Å; L25-L29 WeakPolarHBondContact O-CB 3.41Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3Å
26	V	46.8	Very low	46.9	Very low	39 Å²	39	90.9 Å²	90.9	24%	0.236	46%	0.464	C	S	.	.	H	α-helix	trans	-66	-43.5	174.9	171.6	0	0	0	0	111	T22 S23 D24 M30 L163	T22-V26 WeakPolarHBondContact O-CB 3.23Å; T22-V26 WeakPolarHBondContact O-CG2 3.46Å; T22-V26 PolarHBondContact O-N 2.87Å; T22-V26 VanDerWaalsContact O-N 3.09Å; S23-V26 PolarHBondContact O-N 2.96Å; D24-V26 VanDerWaalsContact C-N 3.3Å; D24-V26 PolarHBondContact O-N 3.18Å; V26-M30 VanDerWaalsContact O-CB 3.3Å; V26-M30 WeakPolarHBondContact O-CB 3.43Å; V26-M30 WeakPolarHBondContact O-CG 3.27Å; V26-M30 PolarHBondContact O-N 3.11Å; V26-L163 HydrophobicContact CG2-CD1 3.86Å; V26-L163 HydrophobicContact CG2-CD2 4.23Å; V26-L163 HydrophobicContact CG2-CG 4.45Å
27	Q	52.7	Low	46.8	Very low	111 Å²	111	91.3 Å²	91.3	52%	0.519	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-47.3	175.6	-146.1	95.1	-0.6	0	0	110.9	S23 D24 L29 M30 D31	S23-Q27 WeakPolarHBondContact O-CB 3.25Å; S23-Q27 PolarHBondContact O-N 3.34Å; D24-Q27 PolarHBondContact O-N 2.85Å; Q27-L29 PolarHBondContact O-N 3.44Å; Q27-M30 WeakPolarHBondContact O-CB 3.29Å; Q27-M30 PolarHBondContact O-N 3.36Å; Q27-D31 WeakPolarHBondContact O-CB 3.48Å; Q27-D31 VanDerWaalsContact O-CG 3.26Å; Q27-D31 PolarHBondContact O-N 3.05Å
28	Q	60.5	Low	47.1	Very low	122 Å²	122	90 Å²	90	57%	0.57	46%	0.458	S	S	*	.	H	α-helix	trans	-62.5	-43.7	179.1	-76.5	175.6	13	0	0	112.1	D24 M30 D31 E32	D24-Q28 VanDerWaalsContact O-CB 3.27Å; D24-Q28 WeakPolarHBondContact O-CB 3.3Å; D24-Q28 WeakPolarHBondContact O-CG 3.48Å; D24-Q28 PolarHBondContact O-N 2.76Å; Q28-M30 VanDerWaalsContact C-N 3.34Å; Q28-D31 PolarHBondContact O-N 3.25Å; Q28-E32 WeakPolarHBondContact O-CB 3.45Å; Q28-E32 PolarHBondContact O-N 3.29Å
29	L	48.6	Very low	47.4	Very low	79 Å²	79	89 Å²	89	41%	0.414	46%	0.457	S	S	.	.	H	α-helix	trans	-68.9	-34.5	177.1	-71.9	172.8	0	0	0	111.9	L25 Q27 Y33	L25-L29 HydrophobicContact CG-CD1 4.26Å; L25-L29 WeakPolarHBondContact O-CB 3.41Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3Å; Q27-L29 PolarHBondContact O-N 3.44Å; L29-Y33 VanDerWaalsContact O-CB 3.26Å; L29-Y33 WeakPolarHBondContact O-CB 3.48Å; L29-Y33 PolarHBondContact O-N 3.1Å; L29-Y33 VanDerWaalsContact O-N 3.09Å
30	M	47.5	Very low	46.8	Very low	67 Å²	67	93 Å²	93	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-65.7	-43.7	172	-76.5	-87.7	-81.6	0	0	111.4	V26 Q27 Q28 Y33 T34 M166	V26-M30 VanDerWaalsContact O-CB 3.3Å; V26-M30 WeakPolarHBondContact O-CB 3.43Å; V26-M30 WeakPolarHBondContact O-CG 3.27Å; V26-M30 PolarHBondContact O-N 3.11Å; Q27-M30 WeakPolarHBondContact O-CB 3.29Å; Q27-M30 PolarHBondContact O-N 3.36Å; Q28-M30 VanDerWaalsContact C-N 3.34Å; M30-Y33 PolarHBondContact O-N 3.39Å; M30-T34 WeakPolarHBondContact O-CG2 3.35Å; M30-T34 PolarHBondContact O-N 3.2Å; M30-T34 PolarHBondContact O-OG1 2.85Å; M30-M166 HydrophobicContact SD-CE 3.92Å; M30-M166 HydrophobicContact SD-SD 4.2Å
31	D	58.2	Low	46.4	Very low	94 Å²	94	96.4 Å²	96.4	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-69.4	-38	179.4	-73.8	-17	0	0	0	112.6	Q27 Q28 Y33 T34 S35	Q27-D31 WeakPolarHBondContact O-CB 3.48Å; Q27-D31 VanDerWaalsContact O-CG 3.26Å; Q27-D31 PolarHBondContact O-N 3.05Å; Q28-D31 PolarHBondContact O-N 3.25Å; D31-Y33 VanDerWaalsContact C-N 3.3Å; D31-Y33 PolarHBondContact O-N 3.42Å; D31-T34 VanDerWaalsContact CA-OG1 3.31Å; D31-T34 WeakPolarHBondContact CA-OG1 3.44Å; D31-T34 PolarHBondContact O-OG1 3.35Å; D31-S35 VanDerWaalsContact O-CB 3.26Å; D31-S35 WeakPolarHBondContact O-CB 3.41Å; D31-S35 PolarHBondContact O-N 3.19Å; D31-S35 PolarHBondContact O-OG 3.41Å
32	E	54.6	Low	46.1	Very low	96 Å²	96	100.2 Å²	100.2	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-66.9	-36.5	174.1	-154.4	-166.8	164.6	0	0	110.6	Q28 R36	Q28-E32 WeakPolarHBondContact O-CB 3.45Å; Q28-E32 PolarHBondContact O-N 3.29Å; E32-R36 WeakPolarHBondContact O-CG 3.38Å; E32-R36 PolarHBondContact O-N 2.93Å; E32-R36 VanDerWaalsContact O-N 3.1Å; E32-R36 IonicContact OE1-CZ 3.5Å; E32-R36 IonicContact OE1-NE 3.71Å; E32-R36 IonicContact OE1-NH2 2.71Å; E32-R36 PolarHBondContact OE1-NH2 2.97Å
33	Y	45.7	Very low	45.6	Very low	119 Å²	119	105.9 Å²	105.9	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-70.9	-43.3	176.9	-171.2	-88	0	0	0	112.7	L29 M30 D31 R36 R37 R198	L29-Y33 VanDerWaalsContact O-CB 3.26Å; L29-Y33 WeakPolarHBondContact O-CB 3.48Å; L29-Y33 PolarHBondContact O-N 3.1Å; L29-Y33 VanDerWaalsContact O-N 3.09Å; M30-Y33 PolarHBondContact O-N 3.39Å; D31-Y33 VanDerWaalsContact C-N 3.3Å; D31-Y33 PolarHBondContact O-N 3.42Å; Y33-R36 PolarHBondContact O-N 3.3Å; Y33-R37 PolarHBondContact O-N 2.94Å; Y33-R198 PolarHBondContact OH-NH2 3.19Å
34	T	43.8	Very low	45	Very low	64 Å²	64	106 Å²	106	39%	0.393	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-41.5	175.6	52.5	0	0	0	0	111.1	M30 D31 R36 R37 D38	M30-T34 WeakPolarHBondContact O-CG2 3.35Å; M30-T34 PolarHBondContact O-N 3.2Å; M30-T34 PolarHBondContact O-OG1 2.85Å; D31-T34 VanDerWaalsContact CA-OG1 3.31Å; D31-T34 WeakPolarHBondContact CA-OG1 3.44Å; D31-T34 PolarHBondContact O-OG1 3.35Å; T34-R36 PolarHBondContact O-N 3.04Å; T34-R37 WeakPolarHBondContact O-CB 3.49Å; T34-R37 PolarHBondContact O-N 3.28Å; T34-D38 PolarHBondContact O-N 3.46Å
35	S	48.1	Very low	44.2	Very low	70 Å²	70	107 Å²	107	49%	0.49	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-40.6	175.3	-63.4	0	0	0	0	112.8	D31 R37 T39	D31-S35 VanDerWaalsContact O-CB 3.26Å; D31-S35 WeakPolarHBondContact O-CB 3.41Å; D31-S35 PolarHBondContact O-N 3.19Å; D31-S35 PolarHBondContact O-OG 3.41Å; S35-R37 VanDerWaalsContact C-N 3.32Å; S35-R37 PolarHBondContact O-N 3.34Å; S35-T39 WeakPolarHBondContact O-CG2 3.5Å; S35-T39 PolarHBondContact O-N 2.99Å; S35-T39 PolarHBondContact O-OG1 3.1Å
36	R	43.1	Very low	43.4	Very low	159 Å²	159	105.4 Å²	105.4	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-67.5	-30.5	173.6	-74.8	179.8	-173	-177.2	7.3	112.8	E32 Y33 T34 T39 M40	E32-R36 WeakPolarHBondContact O-CG 3.38Å; E32-R36 PolarHBondContact O-N 2.93Å; E32-R36 VanDerWaalsContact O-N 3.1Å; E32-R36 IonicContact OE1-CZ 3.5Å; E32-R36 IonicContact OE1-NE 3.71Å; E32-R36 IonicContact OE1-NH2 2.71Å; E32-R36 PolarHBondContact OE1-NH2 2.97Å; Y33-R36 PolarHBondContact O-N 3.3Å; T34-R36 PolarHBondContact O-N 3.04Å; R36-T39 WeakPolarHBondContact CA-OG1 3.24Å; R36-T39 PolarHBondContact O-OG1 3.41Å; R36-M40 PolarHBondContact O-N 3.47Å
37	R	35.6	Very low	43	Very low	138 Å²	138	109.9 Å²	109.9	52%	0.521	52%	0.517	S	S	.	.	H	α-helix	trans	-72.1	-44.4	176.3	-169.7	-179.9	-177.8	173.7	-0	111.7	Y33 T34 S35 T39 M40 R41 E197	Y33-R37 PolarHBondContact O-N 2.94Å; T34-R37 WeakPolarHBondContact O-CB 3.49Å; T34-R37 PolarHBondContact O-N 3.28Å; S35-R37 VanDerWaalsContact C-N 3.32Å; S35-R37 PolarHBondContact O-N 3.34Å; R37-T39 VanDerWaalsContact C-N 3.33Å; R37-T39 PolarHBondContact O-N 3.26Å; R37-M40 PolarHBondContact O-N 2.9Å; R37-R41 PolarHBondContact O-N 3.26Å; R37-E197 IonicContact NH1-OE2 3.25Å; R37-E197 IonicContact NH2-OE2 2.74Å
38	D	40.6	Very low	42.1	Very low	85 Å²	85	107.5 Å²	107.5	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-67.2	-34.3	-179.9	-75.5	-16.6	0	0	0	112.4	T34 R41 R42	T34-D38 PolarHBondContact O-N 3.46Å; D38-R41 PolarHBondContact O-N 3.1Å; D38-R42 WeakPolarHBondContact O-CG 3.43Å; D38-R42 PolarHBondContact O-N 3.45Å
39	T	42	Very low	41.1	Very low	85 Å²	85	105.5 Å²	105.5	52%	0.521	51%	0.512	S	S	.	.	H	α-helix	trans	-67.2	-37.4	172.8	48.1	0	0	0	0	112.9	S35 R36 R37 R43	S35-T39 WeakPolarHBondContact O-CG2 3.5Å; S35-T39 PolarHBondContact O-N 2.99Å; S35-T39 PolarHBondContact O-OG1 3.1Å; R36-T39 WeakPolarHBondContact CA-OG1 3.24Å; R36-T39 PolarHBondContact O-OG1 3.41Å; R37-T39 VanDerWaalsContact C-N 3.33Å; R37-T39 PolarHBondContact O-N 3.26Å; T39-R43 PolarHBondContact O-N 3Å
40	M	34.4	Very low	40.5	Very low	147 Å²	147	108.9 Å²	108.9	72%	0.724	53%	0.527	S	S	*	.	H	α-helix	trans	-67.3	-39.1	171.4	-77.3	-149.3	-178.9	0	0	112.3	R36 R37 R43 S44	R36-M40 PolarHBondContact O-N 3.47Å; R37-M40 PolarHBondContact O-N 2.9Å; M40-R43 PolarHBondContact O-N 3.27Å; M40-S44 PolarHBondContact O-N 2.98Å; M40-S44 VanDerWaalsContact O-N 3.11Å; M40-S44 PolarHBondContact O-OG 3.48Å
41	R	35.8	Very low	39.9	Very low	134 Å²	134	113 Å²	113	51%	0.506	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-42.5	-179.2	-145.7	178.4	-171.6	172.9	0.2	112.4	R37 D38 R43 S44 E45	R37-R41 PolarHBondContact O-N 3.26Å; D38-R41 PolarHBondContact O-N 3.1Å; R41-R43 VanDerWaalsContact C-N 3.29Å; R41-R43 PolarHBondContact O-N 3.49Å; R41-S44 WeakPolarHBondContact CA-OG 3.33Å; R41-S44 PolarHBondContact O-N 3.12Å; R41-S44 PolarHBondContact O-OG 3.06Å; R41-E45 WeakPolarHBondContact O-CG 3.22Å; R41-E45 PolarHBondContact O-N 2.99Å
42	R	36.7	Very low	38.8	Very low	188 Å²	188	115.9 Å²	115.9	71%	0.709	56%	0.561	S	S	*	*	H	α-helix	trans	-61.7	-33.8	174.3	-74	-178.4	-175.3	171.9	4	112.9	D38 S46	D38-R42 WeakPolarHBondContact O-CG 3.43Å; D38-R42 PolarHBondContact O-N 3.45Å; R42-S46 PolarHBondContact O-N 3.11Å; R42-S46 VanDerWaalsContact O-N 3.12Å; R42-S46 PolarHBondContact O-OG 3.5Å
43	R	33.6	Very low	37.9	Very low	187 Å²	187	115.7 Å²	115.7	71%	0.706	57%	0.571	S	S	*	*	H	α-helix	trans	-68.8	-44.3	174	-80.9	-177.5	172.6	168.8	-1.3	112.2	T39 M40 R41 E45 S46 E47	T39-R43 PolarHBondContact O-N 3Å; M40-R43 PolarHBondContact O-N 3.27Å; R41-R43 VanDerWaalsContact C-N 3.29Å; R41-R43 PolarHBondContact O-N 3.49Å; R43-E45 VanDerWaalsContact C-N 3.35Å; R43-E45 PolarHBondContact O-N 3.33Å; R43-S46 WeakPolarHBondContact CA-OG 3.37Å; R43-S46 PolarHBondContact O-N 3.38Å; R43-S46 PolarHBondContact O-OG 2.91Å; R43-E47 WeakPolarHBondContact O-CG 3.29Å; R43-E47 PolarHBondContact O-N 3.28Å; R43-E47 VanDerWaalsContact O-N 3.11Å
44	S	32.6	Very low	37.3	Very low	62 Å²	62	119.2 Å²	119.2	43%	0.434	59%	0.589	S	S	.	*	H	α-helix	trans	-66.1	-34	176.8	47.5	0	0	0	0	113.4	M40 R41 E47 S48	M40-S44 PolarHBondContact O-N 2.98Å; M40-S44 VanDerWaalsContact O-N 3.11Å; M40-S44 PolarHBondContact O-OG 3.48Å; R41-S44 WeakPolarHBondContact CA-OG 3.33Å; R41-S44 PolarHBondContact O-N 3.12Å; R41-S44 PolarHBondContact O-OG 3.06Å; S44-E47 PolarHBondContact O-N 2.77Å; S44-S48 PolarHBondContact O-N 3.06Å; S44-S48 VanDerWaalsContact O-N 3.1Å; S44-S48 PolarHBondContact O-OG 3.44Å
45	E	36	Very low	36.6	Very low	109 Å²	109	122.7 Å²	122.7	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-74.2	-31.5	177	-73.1	170.4	-177.2	0	0	112.3	R41 R43 S48 S49	R41-E45 WeakPolarHBondContact O-CG 3.22Å; R41-E45 PolarHBondContact O-N 2.99Å; R43-E45 VanDerWaalsContact C-N 3.35Å; R43-E45 PolarHBondContact O-N 3.33Å; E45-S48 PolarHBondContact O-OG 2.74Å; E45-S49 WeakPolarHBondContact O-CB 3.28Å; E45-S49 PolarHBondContact O-N 3.35Å; E45-S49 PolarHBondContact O-OG 3.18Å
46	S	34.6	Very low	35.7	Very low	59 Å²	59	123.8 Å²	123.8	41%	0.413	62%	0.623	S	S	.	*	H	α-helix	trans	-69.9	-34.2	171.4	56.6	0	0	0	0	113	R42 R43 S49	R42-S46 PolarHBondContact O-N 3.11Å; R42-S46 VanDerWaalsContact O-N 3.12Å; R42-S46 PolarHBondContact O-OG 3.5Å; R43-S46 WeakPolarHBondContact CA-OG 3.37Å; R43-S46 PolarHBondContact O-N 3.38Å; R43-S46 PolarHBondContact O-OG 2.91Å; S46-S49 PolarHBondContact O-OG 3.16Å
47	E	37.7	Very low	35.4	Very low	132 Å²	132	121.3 Å²	121.3	62%	0.617	63%	0.63	S	S	*	*	H	α-helix	trans	-72.8	-39.7	177.7	-73.6	173.6	175.1	0	0	111.6	R43 S44 S49 M50	R43-E47 WeakPolarHBondContact O-CG 3.29Å; R43-E47 PolarHBondContact O-N 3.28Å; R43-E47 VanDerWaalsContact O-N 3.11Å; S44-E47 PolarHBondContact O-N 2.77Å; E47-S49 VanDerWaalsContact C-N 3.34Å; E47-S49 PolarHBondContact O-N 3.24Å; E47-M50 PolarHBondContact O-N 3.46Å
48	S	34.8	Very low	35.2	Very low	61 Å²	61	120.7 Å²	120.7	43%	0.427	64%	0.642	S	S	.	*	H	α-helix	trans	-69.8	-28	176.2	65.4	0	0	0	0	113.7	S44 E45 M50 E51	S44-S48 PolarHBondContact O-N 3.06Å; S44-S48 VanDerWaalsContact O-N 3.1Å; S44-S48 PolarHBondContact O-OG 3.44Å; E45-S48 PolarHBondContact O-OG 2.74Å; S48-M50 VanDerWaalsContact C-N 3.32Å; S48-M50 PolarHBondContact O-N 3.3Å; S48-E51 PolarHBondContact O-N 2.9Å
49	S	38.1	Very low	34.7	Very low	81 Å²	81	121.1 Å²	121.1	57%	0.566	65%	0.652	S	S	*	*	H	α-helix	trans	-74.6	-17.2	178.6	68.8	0	0	0	0	114.5	E45 S46 E47	E45-S49 WeakPolarHBondContact O-CB 3.28Å; E45-S49 PolarHBondContact O-N 3.35Å; E45-S49 PolarHBondContact O-OG 3.18Å; S46-S49 PolarHBondContact O-OG 3.16Å; E47-S49 VanDerWaalsContact C-N 3.34Å; E47-S49 PolarHBondContact O-N 3.24Å
50	M	36.9	Very low	34.5	Very low	150 Å²	150	124.1 Å²	124.1	74%	0.739	67%	0.665	S	S	*	*	H	α-helix	trans	-87.2	-26.3	173.4	-76.7	-176.5	-174.8	0	0	112.5	E47 S48 S53	E47-M50 PolarHBondContact O-N 3.46Å; S48-M50 VanDerWaalsContact C-N 3.32Å; S48-M50 PolarHBondContact O-N 3.3Å; M50-S53 PolarHBondContact O-OG 3.26Å
51	E	35.6	Very low	34.5	Very low	153 Å²	153	121.2 Å²	121.2	72%	0.715	66%	0.659	S	S	*	*	H	α-helix	trans	-76.8	-23.6	-177.2	-70.7	-177.6	161.2	0	0	113.7	S48 S53	S48-E51 PolarHBondContact O-N 2.9Å; E51-S53 PolarHBondContact O-N 3.11Å; E51-S53 VanDerWaalsContact O-N 3.13Å
52	D	34.1	Very low	34.6	Very low	154 Å²	154	121.8 Å²	121.8	82%	0.824	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	10.4	178.8	-77.4	-23.3	0	0	0	114.8
53	S	36.6	Very low	34.5	Very low	93 Å²	93	121.3 Å²	121.3	65%	0.65	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	4.6	-176.8	66.5	0	0	0	0	115.5	M50 E51	M50-S53 PolarHBondContact O-OG 3.26Å; E51-S53 PolarHBondContact O-N 3.11Å; E51-S53 VanDerWaalsContact O-N 3.13Å
54	F	32.5	Very low	34.4	Very low	192 Å²	192	121 Å²	121	84%	0.842	68%	0.684	S	S	*	*			trans	-139.3	66.3	-173	-138.5	-92	0	0	0	113.6
55	T	29.3	Very low	34.3	Very low	138 Å²	138	127.6 Å²	127.6	85%	0.847	70%	0.701	S	S	*	*			trans	-134.2	98.1	164.3	57.6	0	0	0	0	111
56	A	30.2	Very low	34.1	Very low	93 Å²	93	130.7 Å²	130.7	77%	0.769	71%	0.713	S	S	*	*			trans	-150.4	133.9	158.3	0	0	0	0	0	110
57	S	35.3	Very low	34.2	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	72%	0.724	S	S	*	*			trans	78.7	94.8	166.7	60.2	0	0	0	0	120.7
58	T	32.9	Very low	33.8	Very low	124 Å²	124	131.5 Å²	131.5	76%	0.761	73%	0.731	S	S	*	*				66.9	120.5	117	49.9	0	0	0	0	123.3
59	S	29.5	Very low	33.6	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	75%	0.746	S	S	*	*			trans	32	137.2	130.2	59	0	0	0	0	119.2
60	D	36.5	Very low	33.1	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	76%	0.757	S	S	*	*			cis	179.2	153.5	48.7	-123.2	-7.4	0	0	0	110.5
61	S	34.9	Very low	32.6	Very low	85 Å²	85	143.1 Å²	143.1	59%	0.594	76%	0.761	S	S	*	*			trans	59.1	130.5	149.1	8.6	0	0	0	0	127.3
62	D	37.9	Very low	32.1	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	77%	0.769	S	S	*	*			trans	70.3	108.5	131.8	-50.2	-17.4	0	0	0	120.8
63	E	34.8	Very low	31.7	Very low	179 Å²	179	145 Å²	145	84%	0.836	77%	0.766	S	S	*	*				83.4	123.8	81.5	-83.7	-150.8	171.6	0	0	116.3
64	E	32.5	Very low	31.2	Very low	179 Å²	179	147 Å²	147	84%	0.836	78%	0.775	S	S	*	*			trans	126.4	103.1	145	-65	-160	150.2	0	0	119.8
65	Y	30.5	Very low	31	Very low	201 Å²	201	147.7 Å²	147.7	79%	0.788	78%	0.777	S	S	*	*				68.6	96.6	120.3	-152.7	-101	0	0	0	123.7
66	F	30.2	Very low	30.9	Very low	175 Å²	175	150.6 Å²	150.6	77%	0.768	78%	0.779	S	S	*	*				37.8	159.1	120.2	-76.4	-78	0	0	0	123
67	P	36.8	Very low	30.8	Very low	100 Å²	100	154.7 Å²	154.7	65%	0.649	79%	0.786	S	S	*	*				-146	-176.1	-61.3	40	-18.7	0	0	0	114.7
68	S	30.1	Very low	30.5	Very low	107 Å²	107	153.8 Å²	153.8	75%	0.748	78%	0.784	S	S	*	*			trans	120.9	118.9	136.9	76.1	0	0	0	0	121.4
69	S	29.8	Very low	30.3	Very low	106 Å²	106	153.8 Å²	153.8	74%	0.741	79%	0.79	S	S	*	*			trans	77.9	132.4	152.1	99.1	0	0	0	0	116.6
70	R	28.5	Very low	30.4	Very low	213 Å²	213	152.3 Å²	152.3	80%	0.804	79%	0.789	S	S	*	*			cis	-159.4	144.3	25.9	-84.1	174	179.7	177.3	-0.8	111.3
71	R	26.4	Very low	30.3	Very low	218 Å²	218	153.3 Å²	153.3	82%	0.823	79%	0.793	S	S	*	*			trans	67.7	111.8	137.1	-67.9	-179.5	177.4	-177.9	-0.6	122.3
72	R	25.4	Very low	30.2	Very low	237 Å²	237	153.4 Å²	153.4	89%	0.894	79%	0.791	S	S	*	*				81.6	126.3	129.8	-76.8	-175.3	176.4	174.6	-1.4	120.4
73	S	24.5	Very low	30	Very low	108 Å²	108	149.6 Å²	149.6	76%	0.755	78%	0.777	S	S	*	*			trans	61.4	101.1	161.4	68.9	0	0	0	0	117
74	T	27.3	Very low	30.2	Very low	135 Å²	135	146.8 Å²	146.8	83%	0.828	77%	0.767	S	S	*	*				175.7	145.1	102.6	37.1	0	0	0	0	109	K76	T74-K76 PolarHBondContact O-N 2.91Å
75	K	27.6	Very low	30.7	Very low	207 Å²	207	143.4 Å²	143.4	90%	0.9	75%	0.754	S	S	*	*			trans	-25.1	113	172.5	-68.3	167.1	174	176.3	0	114.4
76	K	28.2	Very low	31.3	Very low	200 Å²	200	136.7 Å²	136.7	87%	0.87	73%	0.734	S	S	*	*			trans	-136.4	112.6	148.8	-79.6	-169.3	177.4	179.7	0	109.1	T74 A78	T74-K76 PolarHBondContact O-N 2.91Å; K76-A78 PolarHBondContact O-N 3.45Å
77	I	27.5	Very low	31.7	Very low	179 Å²	179	130.9 Å²	130.9	92%	0.918	72%	0.718	S	S	*	*			trans	-68.8	115.6	168.2	-65	159.8	0	0	0	105.1
78	A	29	Very low	32	Very low	87 Å²	87	129.4 Å²	129.4	72%	0.719	70%	0.702	S	S	*	*			trans	-139.8	106.2	172.7	0	0	0	0	0	108.4	K76 G80	K76-A78 PolarHBondContact O-N 3.45Å; A78-G80 PolarHBondContact O-N 2.91Å
79	S	28.6	Very low	32.4	Very low	125 Å²	125	131.4 Å²	131.4	87%	0.874	70%	0.697	S	S	*	*			trans	-27.7	114.8	163.9	46.5	0	0	0	0	115.5
80	G	31.8	Very low	32.6	Very low	64 Å²	64	131.8 Å²	131.8	66%	0.66	69%	0.69	S	S	*	*			trans	-152.4	116.6	157.7	0	0	0	0	0	107.3	A78 P82	A78-G80 PolarHBondContact O-N 2.91Å; G80-P82 WeakPolarHBondContact O-CD 3.35Å
81	I	33.9	Very low	33.1	Very low	168 Å²	168	125.9 Å²	125.9	86%	0.862	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-57.8	121.2	179.9	-61.9	164.3	0	0	0	107.8	S83	I81-S83 PolarHBondContact O-N 3.4Å
82	P	32.4	Very low	33.8	Very low	87 Å²	87	125.7 Å²	125.7	57%	0.565	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-62.9	129.9	174.7	-12.4	25.7	0	0	0	108.3	G80	G80-P82 WeakPolarHBondContact O-CD 3.35Å
83	S	33.9	Very low	34	Very low	67 Å²	67	124.8 Å²	124.8	47%	0.469	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-51.6	145	172.9	60.2	0	0	0	0	110.9	I81 D85 T86 A87	I81-S83 PolarHBondContact O-N 3.4Å; S83-D85 PolarHBondContact O-N 3.41Å; S83-T86 PolarHBondContact N-OG1 3.35Å; S83-T86 PolarHBondContact O-N 3.33Å; S83-T86 PolarHBondContact O-OG1 2.63Å; S83-T86 PolarHBondContact OG-OG1 2.92Å; S83-A87 PolarHBondContact O-N 3.48Å
84	L	40.5	Very low	34.5	Very low	120 Å²	120	126.7 Å²	126.7	63%	0.628	68%	0.679	S	S	*	*	H	α-helix	trans	-51.2	-30.8	178.9	-145.4	92.9	0	0	0	112.1	K88	L84-K88 HydrophobicContact CD2-CD 4.37Å; L84-K88 WeakPolarHBondContact O-CB 3.45Å; L84-K88 VanDerWaalsContact O-CG 3.27Å; L84-K88 WeakPolarHBondContact O-CG 3.45Å; L84-K88 PolarHBondContact O-N 2.81Å
85	D	41	Very low	35.1	Very low	107 Å²	107	125.4 Å²	125.4	57%	0.572	66%	0.66	S	S	*	*	H	α-helix	trans	-69.1	-34.7	176	-70.6	-26	0	0	0	114.1	S83 K89	S83-D85 PolarHBondContact O-N 3.41Å; D85-K89 WeakPolarHBondContact O-CB 3.41Å; D85-K89 VanDerWaalsContact O-CG 3.3Å; D85-K89 WeakPolarHBondContact O-CG 3.38Å; D85-K89 PolarHBondContact O-N 3.33Å
86	T	43.1	Very low	35.6	Very low	60 Å²	60	124.7 Å²	124.7	37%	0.368	66%	0.657	S	S	.	*	H	α-helix	trans	-75.1	-37.5	175.2	40.5	0	0	0	0	111.4	S83 K89 L90	S83-T86 PolarHBondContact N-OG1 3.35Å; S83-T86 PolarHBondContact O-N 3.33Å; S83-T86 PolarHBondContact O-OG1 2.63Å; S83-T86 PolarHBondContact OG-OG1 2.92Å; T86-K89 PolarHBondContact O-N 3.41Å; T86-L90 WeakPolarHBondContact O-CB 3.44Å; T86-L90 WeakPolarHBondContact O-CD1 3.29Å; T86-L90 VanDerWaalsContact O-CG 3.25Å; T86-L90 WeakPolarHBondContact O-CG 3.48Å; T86-L90 PolarHBondContact O-N 2.96Å
87	A	39.5	Very low	36.5	Very low	53 Å²	53	118.9 Å²	118.9	44%	0.438	64%	0.639	S	S	.	*	H	α-helix	trans	-64.3	-42	171.7	0	0	0	0	0	112.5	S83 L90 S91	S83-A87 PolarHBondContact O-N 3.48Å; A87-L90 PolarHBondContact O-N 2.92Å; A87-S91 PolarHBondContact O-N 3.47Å
88	K	42.4	Very low	37.9	Very low	70 Å²	70	118.7 Å²	118.7	30%	0.304	63%	0.627	S	S	.	*	H	α-helix	trans	-66.4	-38	174.8	-77.3	175.1	173.9	-178	0	112.9	L84 S91 R92 D205	L84-K88 HydrophobicContact CD2-CD 4.37Å; L84-K88 WeakPolarHBondContact O-CB 3.45Å; L84-K88 VanDerWaalsContact O-CG 3.27Å; L84-K88 WeakPolarHBondContact O-CG 3.45Å; L84-K88 PolarHBondContact O-N 2.81Å; K88-S91 PolarHBondContact O-N 3.01Å; K88-R92 WeakPolarHBondContact O-CB 3.27Å; K88-R92 WeakPolarHBondContact O-CG 3.3Å; K88-R92 PolarHBondContact O-N 2.92Å; K88-D205 IonicContact NZ-OD1 2.71Å; K88-D205 PolarHBondContact NZ-OD1 3.31Å; K88-D205 IonicContact NZ-OD2 2.95Å; K88-D205 PolarHBondContact NZ-OD2 3.38Å
89	K	38.5	Very low	39.4	Very low	149 Å²	149	124.8 Å²	124.8	65%	0.648	63%	0.632	S	S	*	*	H	α-helix	trans	-68.2	-33.2	174.2	-80.6	174.7	179.4	173	0	112.8	D85 T86 R93	D85-K89 WeakPolarHBondContact O-CB 3.41Å; D85-K89 VanDerWaalsContact O-CG 3.3Å; D85-K89 WeakPolarHBondContact O-CG 3.38Å; D85-K89 PolarHBondContact O-N 3.33Å; T86-K89 PolarHBondContact O-N 3.41Å; K89-R93 PolarHBondContact O-N 2.95Å
90	L	34.2	Very low	41.4	Very low	114 Å²	114	120.2 Å²	120.2	60%	0.597	60%	0.597	S	S	*	*	H	α-helix	trans	-73	-37.7	175.1	-73.3	162.3	0	0	0	112	T86 A87 R93	T86-L90 WeakPolarHBondContact O-CB 3.44Å; T86-L90 WeakPolarHBondContact O-CD1 3.29Å; T86-L90 VanDerWaalsContact O-CG 3.25Å; T86-L90 WeakPolarHBondContact O-CG 3.48Å; T86-L90 PolarHBondContact O-N 2.96Å; A87-L90 PolarHBondContact O-N 2.92Å; L90-R93 PolarHBondContact O-N 3.21Å
91	S	40.1	Very low	43.7	Very low	89 Å²	89	120.4 Å²	120.4	62%	0.622	59%	0.587	S	S	*	*	H	α-helix	trans	-65.6	-43.2	173.7	173.5	0	0	0	0	112.6	A87 K88 R93 N94	A87-S91 PolarHBondContact O-N 3.47Å; K88-S91 PolarHBondContact O-N 3.01Å; S91-R93 VanDerWaalsContact C-N 3.28Å; S91-R93 PolarHBondContact O-N 3.26Å; S91-N94 PolarHBondContact O-N 3.45Å
92	R	39.7	Very low	46.1	Very low	214 Å²	214	118.7 Å²	118.7	81%	0.808	58%	0.579	S	S	*	*	H	α-helix	trans	-66	-23.2	177.3	-76.9	179.8	169.5	169.7	-2.2	114.4	K88	K88-R92 WeakPolarHBondContact O-CB 3.27Å; K88-R92 WeakPolarHBondContact O-CG 3.3Å; K88-R92 PolarHBondContact O-N 2.92Å
93	R	30.7	Very low	48.6	Very low	218 Å²	218	118.2 Å²	118.2	82%	0.823	58%	0.583	S	S	*	*	H	α-helix	trans	-79.4	-16.3	178	-96.3	-179.5	166.2	169.4	-3.5	114.2	K89 L90 S91	K89-R93 PolarHBondContact O-N 2.95Å; L90-R93 PolarHBondContact O-N 3.21Å; S91-R93 VanDerWaalsContact C-N 3.28Å; S91-R93 PolarHBondContact O-N 3.26Å
94	N	35	Very low	51.1	Low	147 Å²	147	116 Å²	116	79%	0.786	57%	0.565	S	S	*	*	S	Bend	trans	-103.3	3.3	-173.4	-79.2	-12.3	0	0	0	115.1	S91	S91-N94 PolarHBondContact O-N 3.45Å
95	Y	39.8	Very low	53.3	Low	109 Å²	109	116.8 Å²	116.8	43%	0.427	56%	0.564	S	S	.	*			trans	-97.8	105	175.1	-168.5	-98.9	0	0	0	111.3	P97 N169	Y95-P97 HydrophobicContact CE1-CB 4.33Å; Y95-N169 WeakPolarHBondContact CE2-ND2 3.48Å
96	K	37.6	Very low	55.5	Low	192 Å²	192	114.2 Å²	114.2	84%	0.835	56%	0.558	S	S	*	*			trans	-86.9	116.2	164.6	-72.3	-179.5	179.8	177.8	0	107.8	R98	K96-R98 PolarHBondContact O-N 2.95Å
97	P	46.9	Very low	57.8	Low	78 Å²	78	113.4 Å²	113.4	51%	0.506	55%	0.551	S	S	.	*			trans	-57.6	132.2	175.3	23.3	-31.6	0	0	0	109.2	Y95 R99	Y95-P97 HydrophobicContact CE1-CB 4.33Å; P97-R99 PolarHBondContact O-N 3.42Å
98	R	56.8	Low	60.2	Low	174 Å²	174	112.5 Å²	112.5	66%	0.657	54%	0.538	S	S	*	.			trans	-66.8	96.6	174	-69.5	-178.6	178.8	-174.2	-1.8	107.8	K96 H137	K96-R98 PolarHBondContact O-N 2.95Å; R98-H137 PolarHBondContact O-ND1 3.01Å
99	R	60.9	Low	62.4	Low	216 Å²	216	110.8 Å²	110.8	82%	0.815	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-70.1	134.1	177.4	-63.8	-176.5	178.7	-174.8	-1.8	108.9	P97	P97-R99 PolarHBondContact O-N 3.42Å
100	L	70.2	Confident	64.9	Low	28 Å²	28	109.1 Å²	109.1	15%	0.147	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-66.7	144.6	167.3	-73.3	107.4	0	0	0	109.7	L104 K105 V130 H137	L100-L104 HydrophobicContact CB-CB 4.48Å; L100-L104 HydrophobicContact CD2-CB 3.69Å; L100-L104 HydrophobicContact CD2-CD1 4.49Å; L100-K105 HydrophobicContact CB-CB 4.47Å; L100-V130 HydrophobicContact CD2-CG1 4.02Å; L100-H137 WeakPolarHBondContact CD1-CD2 3.31Å; L100-H137 VanDerWaalsContact CD1-CE1 3.45Å; L100-H137 WeakPolarHBondContact CD1-CE1 3.47Å; L100-H137 WeakPolarHBondContact CD1-NE2 3.31Å
101	P	81.5	Confident	67.7	Low	68 Å²	68	103.7 Å²	103.7	44%	0.442	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-51.8	144	159.9	-22.8	32.3	0	0	0	111.6	A103 L104 K105	P101-A103 PolarHBondContact O-N 2.87Å; P101-A103 VanDerWaalsContact O-N 3.16Å; P101-L104 HydrophobicContact CG-CD1 4.26Å; P101-L104 PolarHBondContact O-N 3.45Å; P101-K105 PolarHBondContact O-N 3.26Å
102	D	82.7	Confident	70	Confident	133 Å²	133	101.4 Å²	101.4	71%	0.711	49%	0.493	S	S	*	.	H	α-helix	trans	-58.9	-31.9	-175.9	-67.2	-35.1	0	0	0	112.9	K105 A106	D102-K105 PolarHBondContact O-N 3.37Å; D102-A106 WeakPolarHBondContact O-CB 3.5Å; D102-A106 PolarHBondContact O-N 3.12Å
103	A	85.5	Confident	72.5	Confident	77 Å²	77	96 Å²	96	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-63.5	-44.9	174.9	0	0	0	0	0	112.9	P101 K105 A106 L107	P101-A103 PolarHBondContact O-N 2.87Å; P101-A103 VanDerWaalsContact O-N 3.16Å; A103-K105 VanDerWaalsContact C-N 3.34Å; A103-A106 WeakPolarHBondContact O-CB 3.07Å; A103-A106 PolarHBondContact O-N 3.15Å; A103-L107 PolarHBondContact O-N 3.37Å
104	L	86.3	Confident	75.3	Confident	19 Å²	19	86.5 Å²	86.5	10%	0.099	45%	0.45	C	S	.	.	H	α-helix	trans	-72	-32.2	176.7	-66.3	-179	0	0	0	111.6	L100 P101 A106 L107 L108 V133 Q134	L100-L104 HydrophobicContact CB-CB 4.48Å; L100-L104 HydrophobicContact CD2-CB 3.69Å; L100-L104 HydrophobicContact CD2-CD1 4.49Å; P101-L104 HydrophobicContact CG-CD1 4.26Å; P101-L104 PolarHBondContact O-N 3.45Å; L104-A106 VanDerWaalsContact C-N 3.31Å; L104-L107 PolarHBondContact O-N 2.87Å; L104-L108 WeakPolarHBondContact O-CB 3.46Å; L104-L108 PolarHBondContact O-N 3.07Å; L104-V133 HydrophobicContact CD1-CB 3.96Å; L104-V133 HydrophobicContact CD1-CG1 3.66Å; L104-V133 HydrophobicContact CD2-CB 4.18Å; L104-V133 HydrophobicContact CD2-CG1 4.34Å; L104-V133 HydrophobicContact CD2-CG2 4.26Å; L104-Q134 HydrophobicContact CD1-CB 4.5Å
105	K	86.2	Confident	78	Confident	137 Å²	137	82.1 Å²	82.1	60%	0.596	43%	0.425	S	S	*	.	H	α-helix	trans	-64.1	-38.9	172.4	-166.5	-177.5	179.7	-173.4	0	111.3	L100 P101 D102 A103 G109	L100-K105 HydrophobicContact CB-CB 4.47Å; P101-K105 PolarHBondContact O-N 3.26Å; D102-K105 PolarHBondContact O-N 3.37Å; A103-K105 VanDerWaalsContact C-N 3.34Å; K105-G109 PolarHBondContact O-N 3.36Å
106	A	88.4	Confident	80.3	Confident	54 Å²	54	81.2 Å²	81.2	45%	0.446	44%	0.44	S	S	.	.	H	α-helix	trans	-65.9	-43.7	173.3	0	0	0	0	0	111.7	D102 A103 L104 L108 G109 Q110	D102-A106 WeakPolarHBondContact O-CB 3.5Å; D102-A106 PolarHBondContact O-N 3.12Å; A103-A106 WeakPolarHBondContact O-CB 3.07Å; A103-A106 PolarHBondContact O-N 3.15Å; L104-A106 VanDerWaalsContact C-N 3.31Å; A106-L108 PolarHBondContact O-N 3.23Å; A106-G109 CarbonylContact O-C 3.5Å; A106-G109 WeakPolarHBondContact O-CA 3.46Å; A106-G109 PolarHBondContact O-N 3.43Å; A106-Q110 WeakPolarHBondContact O-CG 3.25Å; A106-Q110 PolarHBondContact O-N 3.41Å
107	L	91.1	Very high	82.8	Confident	42 Å²	42	75.6 Å²	75.6	22%	0.22	42%	0.424	C	S	.	.	H	α-helix	trans	-61.7	-42.3	175.6	-170.3	68.1	0	0	0	112	A103 L104 G109 Q110 A111 M126 E129 V130	A103-L107 PolarHBondContact O-N 3.37Å; L104-L107 PolarHBondContact O-N 2.87Å; L107-G109 VanDerWaalsContact C-N 3.32Å; L107-G109 PolarHBondContact O-N 3.22Å; L107-Q110 WeakPolarHBondContact O-CB 3.48Å; L107-Q110 PolarHBondContact O-N 3.36Å; L107-A111 WeakPolarHBondContact O-CB 3.33Å; L107-A111 PolarHBondContact O-N 3.3Å; L107-M126 HydrophobicContact CD1-CB 4.29Å; L107-M126 HydrophobicContact CD1-CG 3.95Å; L107-M126 HydrophobicContact CD1-SD 4.09Å; L107-M126 HydrophobicContact CG-CB 4.3Å; L107-E129 HydrophobicContact CD2-CB 3.92Å; L107-V130 HydrophobicContact CB-CG2 4.35Å; L107-V130 HydrophobicContact CD2-CG2 3.87Å; L107-V130 HydrophobicContact CG-CG2 4.2Å
108	L	90	Very high	84.8	Confident	34 Å²	34	74.4 Å²	74.4	18%	0.178	43%	0.427	C	S	.	.	H	α-helix	trans	-67.4	-34	175	-165.9	122.7	0	0	0	112	L104 A106 A111 A112 V130 A139 L143	L104-L108 WeakPolarHBondContact O-CB 3.46Å; L104-L108 PolarHBondContact O-N 3.07Å; A106-L108 PolarHBondContact O-N 3.23Å; L108-A111 PolarHBondContact O-N 2.89Å; L108-A112 WeakPolarHBondContact O-CB 3.23Å; L108-A112 PolarHBondContact O-N 2.97Å; L108-V130 HydrophobicContact CB-CG2 4.35Å; L108-V130 HydrophobicContact CD1-CG1 3.97Å; L108-V130 HydrophobicContact CD1-CG2 4.4Å; L108-A139 HydrophobicContact CD1-CB 3.84Å; L108-A139 HydrophobicContact CD2-CB 4.04Å; L108-L143 HydrophobicContact CG-CD2 4.43Å
109	G	88	Confident	86.4	Confident	34 Å²	34	71.2 Å²	71.2	35%	0.351	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-43.5	170.1	0	0	0	0	0	112.3	K105 A106 L107 A112 V113	K105-G109 PolarHBondContact O-N 3.36Å; A106-G109 CarbonylContact O-C 3.5Å; A106-G109 WeakPolarHBondContact O-CA 3.46Å; A106-G109 PolarHBondContact O-N 3.43Å; L107-G109 VanDerWaalsContact C-N 3.32Å; L107-G109 PolarHBondContact O-N 3.22Å; G109-A112 PolarHBondContact O-N 3.3Å; G109-V113 VanDerWaalsContact O-CG2 3.29Å; G109-V113 WeakPolarHBondContact O-CG2 3.42Å; G109-V113 PolarHBondContact O-N 3.18Å
110	Q	91.5	Very high	87.8	Confident	114 Å²	114	63 Å²	63	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-42.1	173.4	-71.4	174.4	-5.3	0	0	111.5	A106 L107 A112 V113 C114 M126	A106-Q110 WeakPolarHBondContact O-CG 3.25Å; A106-Q110 PolarHBondContact O-N 3.41Å; L107-Q110 WeakPolarHBondContact O-CB 3.48Å; L107-Q110 PolarHBondContact O-N 3.36Å; Q110-A112 VanDerWaalsContact C-N 3.34Å; Q110-A112 PolarHBondContact O-N 3.33Å; Q110-V113 WeakPolarHBondContact O-CB 3.47Å; Q110-V113 PolarHBondContact O-N 3.29Å; Q110-V113 VanDerWaalsContact O-N 3.14Å; Q110-C114 PolarHBondContact O-N 3.44Å; Q110-M126 HydrophobicContact CB-SD 3.74Å
111	A	91.9	Very high	88.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-58.9	-43.9	174.8	0	0	0	0	0	112.1	L107 L108 V113 C114 F115 M126 L143	L107-A111 WeakPolarHBondContact O-CB 3.33Å; L107-A111 PolarHBondContact O-N 3.3Å; L108-A111 PolarHBondContact O-N 2.89Å; A111-V113 VanDerWaalsContact C-N 3.33Å; A111-V113 PolarHBondContact O-N 3.41Å; A111-C114 PolarHBondContact O-N 2.99Å; A111-F115 WeakPolarHBondContact O-CB 3.32Å; A111-F115 PolarHBondContact O-N 2.87Å; A111-M126 VanDerWaalsContact CA-CE 3.49Å; A111-M126 HydrophobicContact CB-CB 3.75Å; A111-M126 HydrophobicContact CB-CE 4.19Å; A111-M126 HydrophobicContact CB-SD 4.38Å; A111-L143 HydrophobicContact CB-CD2 3.64Å
112	A	89	Confident	89	Confident	42 Å²	42	69.2 Å²	69.2	35%	0.347	42%	0.416	S	S	.	.	H	α-helix	trans	-64.6	-36.5	175.5	0	0	0	0	0	112.5	L108 G109 Q110 A116 L143	L108-A112 WeakPolarHBondContact O-CB 3.23Å; L108-A112 PolarHBondContact O-N 2.97Å; G109-A112 PolarHBondContact O-N 3.3Å; Q110-A112 VanDerWaalsContact C-N 3.34Å; Q110-A112 PolarHBondContact O-N 3.33Å; A112-A116 WeakPolarHBondContact O-CB 3.49Å; A112-A116 PolarHBondContact O-N 3.17Å; A112-L143 HydrophobicContact CB-CD2 4.27Å
113	V	91.6	Very high	89.3	Confident	99 Å²	99	62.9 Å²	62.9	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-67.1	-42.9	173.7	173.7	0	0	0	0	111.1	G109 Q110 A111 F115 A116 S117	G109-V113 VanDerWaalsContact O-CG2 3.29Å; G109-V113 WeakPolarHBondContact O-CG2 3.42Å; G109-V113 PolarHBondContact O-N 3.18Å; Q110-V113 WeakPolarHBondContact O-CB 3.47Å; Q110-V113 PolarHBondContact O-N 3.29Å; Q110-V113 VanDerWaalsContact O-N 3.14Å; A111-V113 VanDerWaalsContact C-N 3.33Å; A111-V113 PolarHBondContact O-N 3.41Å; V113-F115 VanDerWaalsContact C-N 3.35Å; V113-A116 PolarHBondContact O-N 2.94Å; V113-S117 WeakPolarHBondContact O-CB 3.35Å; V113-S117 PolarHBondContact O-N 3.47Å; V113-S117 PolarHBondContact O-OG 3.01Å
114	C	90.3	Very high	89.5	Confident	19 Å²	19	60 Å²	60	13%	0.128	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-41	175.7	-75.5	0	0	0	0	111.6	Q110 A111 S117 G118 K119 A123 M126	Q110-C114 PolarHBondContact O-N 3.44Å; A111-C114 PolarHBondContact O-N 2.99Å; C114-S117 WeakPolarHBondContact CA-OG 3.03Å; C114-S117 CarbonylContact O-C 3.52Å; C114-S117 PolarHBondContact O-N 2.91Å; C114-S117 VanDerWaalsContact O-N 3.13Å; C114-S117 PolarHBondContact O-OG 3.44Å; C114-G118 PolarHBondContact O-N 3.15Å; C114-K119 HydrophobicContact CB-CB 4.42Å; C114-K119 PolarHBondContact O-N 3Å; C114-A123 HydrophobicContact CB-CB 4.17Å; C114-M126 HydrophobicContact CB-CE 3.57Å; C114-M126 WeakPolarHBondContact SG-CE 3.44Å
115	F	91.8	Very high	89.6	Confident	56 Å²	56	60.6 Å²	60.6	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-58.6	-47.5	171.9	177.2	-113.2	0	0	0	111.7	A111 V113 S117 G118 L120 A123 L143 A146 V147 E150	A111-F115 WeakPolarHBondContact O-CB 3.32Å; A111-F115 PolarHBondContact O-N 2.87Å; V113-F115 VanDerWaalsContact C-N 3.35Å; F115-S117 PolarHBondContact O-N 3.2Å; F115-G118 PolarHBondContact O-N 3.03Å; F115-G118 VanDerWaalsContact O-N 3.07Å; F115-L120 HydrophobicContact CD2-CD2 3.88Å; F115-L120 HydrophobicContact CE2-CD2 4.16Å; F115-A123 HydrophobicContact CB-CB 4.31Å; F115-L143 HydrophobicContact CB-CD1 4.38Å; F115-L143 HydrophobicContact CD1-CD1 4.24Å; F115-L143 HydrophobicContact CG-CD1 4.34Å; F115-A146 HydrophobicContact CE1-CB 4.3Å; F115-A146 HydrophobicContact CE2-CB 4.5Å; F115-A146 HydrophobicContact CZ-CB 3.96Å; F115-V147 HydrophobicContact CB-CG2 4.42Å; F115-V147 HydrophobicContact CD2-CB 4.33Å; F115-V147 HydrophobicContact CD2-CG2 3.56Å; F115-V147 HydrophobicContact CE2-CB 4.48Å; F115-V147 HydrophobicContact CE2-CG2 4.1Å; F115-V147 HydrophobicContact CG-CG2 4.19Å; F115-E150 HydrophobicContact CE2-CB 4.14Å; F115-E150 HydrophobicContact CE2-CG 3.54Å; F115-E150 HydrophobicContact CZ-CG 3.67Å
116	A	88.8	Confident	89.7	Confident	90 Å²	90	55.5 Å²	55.5	74%	0.744	35%	0.346	S	S	*	.	H	α-helix	trans	-63.7	-28.3	175.8	0	0	0	0	0	113.3	A112 V113 G118	A112-A116 WeakPolarHBondContact O-CB 3.49Å; A112-A116 PolarHBondContact O-N 3.17Å; V113-A116 PolarHBondContact O-N 2.94Å; A116-G118 VanDerWaalsContact C-N 3.3Å
117	S	89.9	Confident	89.7	Confident	73 Å²	73	53 Å²	53	51%	0.51	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-2.7	175.3	73.9	0	0	0	0	114.5	V113 C114 F115 K119	V113-S117 WeakPolarHBondContact O-CB 3.35Å; V113-S117 PolarHBondContact O-N 3.47Å; V113-S117 PolarHBondContact O-OG 3.01Å; C114-S117 WeakPolarHBondContact CA-OG 3.03Å; C114-S117 CarbonylContact O-C 3.52Å; C114-S117 PolarHBondContact O-N 2.91Å; C114-S117 VanDerWaalsContact O-N 3.13Å; C114-S117 PolarHBondContact O-OG 3.44Å; F115-S117 PolarHBondContact O-N 3.2Å; S117-K119 VanDerWaalsContact C-N 3.29Å; S117-K119 PolarHBondContact O-N 3.23Å
118	G	87.7	Confident	89.6	Confident	54 Å²	54	56 Å²	56	56%	0.557	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	4.7	-177.7	0	0	0	0	0	114.9	C114 F115 A116 L120	C114-G118 PolarHBondContact O-N 3.15Å; F115-G118 PolarHBondContact O-N 3.03Å; F115-G118 VanDerWaalsContact O-N 3.07Å; A116-G118 VanDerWaalsContact C-N 3.3Å; G118-L120 PolarHBondContact O-N 3.4Å; G118-L120 VanDerWaalsContact O-N 3.09Å
119	K	90.6	Very high	89.4	Confident	107 Å²	107	58.1 Å²	58.1	47%	0.465	35%	0.347	S	S	.	.			trans	-84.1	80	176	-64.8	-171.9	176	-166.3	0	110.6	C114 S117 E122 A123	C114-K119 HydrophobicContact CB-CB 4.42Å; C114-K119 PolarHBondContact O-N 3Å; S117-K119 VanDerWaalsContact C-N 3.29Å; S117-K119 PolarHBondContact O-N 3.23Å; K119-E122 HydrophobicContact CB-CB 4.42Å; K119-E122 WeakPolarHBondContact CD-OE1 3.39Å; K119-E122 WeakPolarHBondContact CD-OE2 3.41Å; K119-E122 IonicContact NZ-OE1 3.57Å; K119-E122 PolarHBondContact NZ-OE1 3.31Å; K119-E122 IonicContact NZ-OE2 3.87Å; K119-E122 PolarHBondContact NZ-OE2 2.85Å; K119-A123 PolarHBondContact O-N 3.43Å
120	L	89.7	Confident	89.3	Confident	42 Å²	42	56.6 Å²	56.6	22%	0.22	33%	0.331	C	S	.	.	H	α-helix	trans	-67.1	-41.9	-171.6	-56.6	176.5	0	0	0	112.2	F115 G118 A123 V124 V147 E150 Q151	F115-L120 HydrophobicContact CD2-CD2 3.88Å; F115-L120 HydrophobicContact CE2-CD2 4.16Å; G118-L120 PolarHBondContact O-N 3.4Å; G118-L120 VanDerWaalsContact O-N 3.09Å; L120-A123 WeakPolarHBondContact O-CB 3.33Å; L120-A123 PolarHBondContact O-N 3.42Å; L120-A123 VanDerWaalsContact O-N 3.16Å; L120-V124 WeakPolarHBondContact O-CG2 3.34Å; L120-V124 PolarHBondContact O-N 3.05Å; L120-V147 HydrophobicContact CB-CG1 4.2Å; L120-V147 HydrophobicContact CD2-CG1 4.3Å; L120-E150 HydrophobicContact CD1-CB 4.39Å; L120-E150 HydrophobicContact CD2-CB 4.28Å; L120-Q151 HydrophobicContact CB-CG 4.13Å; L120-Q151 HydrophobicContact CD1-CG 3.56Å; L120-Q151 HydrophobicContact CG-CG 4.4Å
121	D	88.5	Confident	89.1	Confident	131 Å²	131	52.5 Å²	52.5	70%	0.701	31%	0.312	S	S	*	.	H	α-helix	trans	-67.9	-40.8	-175.8	-56.4	-34	0	0	0	113	A123 V124 G125	D121-A123 VanDerWaalsContact C-N 3.28Å; D121-A123 PolarHBondContact O-N 3.37Å; D121-V124 PolarHBondContact O-N 3.17Å; D121-G125 PolarHBondContact O-N 3.32Å
122	E	88.4	Confident	88.7	Confident	97 Å²	97	60.8 Å²	60.8	45%	0.453	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-38.4	172.9	-69	-180	-165.4	0	0	110.9	K119 G125 M126	K119-E122 HydrophobicContact CB-CB 4.42Å; K119-E122 WeakPolarHBondContact CD-OE1 3.39Å; K119-E122 WeakPolarHBondContact CD-OE2 3.41Å; K119-E122 IonicContact NZ-OE1 3.57Å; K119-E122 PolarHBondContact NZ-OE1 3.31Å; K119-E122 IonicContact NZ-OE2 3.87Å; K119-E122 PolarHBondContact NZ-OE2 2.85Å; E122-G125 PolarHBondContact O-N 2.84Å; E122-M126 HydrophobicContact CB-CE 4.45Å; E122-M126 WeakPolarHBondContact O-CE 3.49Å; E122-M126 WeakPolarHBondContact O-CG 3.44Å; E122-M126 PolarHBondContact O-N 3.26Å; E122-M126 VanDerWaalsContact O-N 3.09Å
123	A	90.5	Very high	88.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-66.9	-40.5	176.9	0	0	0	0	0	112.2	C114 F115 K119 L120 D121 M126 C127 V147	C114-A123 HydrophobicContact CB-CB 4.17Å; F115-A123 HydrophobicContact CB-CB 4.31Å; K119-A123 PolarHBondContact O-N 3.43Å; L120-A123 WeakPolarHBondContact O-CB 3.33Å; L120-A123 PolarHBondContact O-N 3.42Å; L120-A123 VanDerWaalsContact O-N 3.16Å; D121-A123 VanDerWaalsContact C-N 3.28Å; D121-A123 PolarHBondContact O-N 3.37Å; A123-M126 PolarHBondContact O-N 3.18Å; A123-C127 WeakPolarHBondContact O-CB 3.21Å; A123-C127 PolarHBondContact O-N 3.49Å; A123-C127 PolarHBondContact O-SG 2.79Å; A123-V147 HydrophobicContact CB-CG2 4.11Å
124	V	88.9	Confident	87.9	Confident	17 Å²	17	60.6 Å²	60.6	10%	0.103	34%	0.335	C	S	.	.	H	α-helix	trans	-60.3	-48.8	173.8	174.7	0	0	0	0	110.5	L120 D121 M126 C127 Q128 M144 V147	L120-V124 WeakPolarHBondContact O-CG2 3.34Å; L120-V124 PolarHBondContact O-N 3.05Å; D121-V124 PolarHBondContact O-N 3.17Å; V124-M126 PolarHBondContact O-N 2.98Å; V124-C127 PolarHBondContact O-N 3.43Å; V124-Q128 HydrophobicContact CG1-CG 4.23Å; V124-Q128 WeakPolarHBondContact O-CB 3.5Å; V124-Q128 WeakPolarHBondContact O-CG 3.39Å; V124-Q128 PolarHBondContact O-N 3.48Å; V124-M144 HydrophobicContact CB-SD 4.3Å; V124-M144 HydrophobicContact CG1-CE 4.14Å; V124-M144 HydrophobicContact CG1-SD 3.99Å; V124-M144 HydrophobicContact CG2-SD 4.11Å; V124-V147 HydrophobicContact CG2-CG1 3.52Å
125	G	89.1	Confident	87.5	Confident	31 Å²	31	63.2 Å²	63.2	32%	0.32	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-43.9	179.8	0	0	0	0	0	112.9	D121 E122 Q128 E129	D121-G125 PolarHBondContact O-N 3.32Å; E122-G125 PolarHBondContact O-N 2.84Å; G125-Q128 PolarHBondContact O-N 3.2Å; G125-E129 PolarHBondContact O-N 3.26Å; G125-E129 VanDerWaalsContact O-N 3.1Å
126	M	88.4	Confident	86.8	Confident	30 Å²	30	62 Å²	62	15%	0.148	36%	0.355	C	S	.	.	H	α-helix	trans	-66.7	-40	176.2	-70.7	-173.1	-81.4	0	0	112.8	L107 Q110 A111 C114 E122 A123 V124 E129 V130	L107-M126 HydrophobicContact CD1-CB 4.29Å; L107-M126 HydrophobicContact CD1-CG 3.95Å; L107-M126 HydrophobicContact CD1-SD 4.09Å; L107-M126 HydrophobicContact CG-CB 4.3Å; Q110-M126 HydrophobicContact CB-SD 3.74Å; A111-M126 VanDerWaalsContact CA-CE 3.49Å; A111-M126 HydrophobicContact CB-CB 3.75Å; A111-M126 HydrophobicContact CB-CE 4.19Å; A111-M126 HydrophobicContact CB-SD 4.38Å; C114-M126 HydrophobicContact CB-CE 3.57Å; C114-M126 WeakPolarHBondContact SG-CE 3.44Å; E122-M126 HydrophobicContact CB-CE 4.45Å; E122-M126 WeakPolarHBondContact O-CE 3.49Å; E122-M126 WeakPolarHBondContact O-CG 3.44Å; E122-M126 PolarHBondContact O-N 3.26Å; E122-M126 VanDerWaalsContact O-N 3.09Å; A123-M126 PolarHBondContact O-N 3.18Å; V124-M126 PolarHBondContact O-N 2.98Å; M126-E129 PolarHBondContact O-N 3.29Å; M126-V130 WeakPolarHBondContact O-CG2 3.44Å; M126-V130 PolarHBondContact O-N 3.08Å; M126-V130 VanDerWaalsContact O-N 3.1Å
127	C	88.2	Confident	86.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.4	-38.4	175.6	-73.4	0	0	0	0	112.1	A123 V124 E129 V130 I131 L143 M144	A123-C127 WeakPolarHBondContact O-CB 3.21Å; A123-C127 PolarHBondContact O-N 3.49Å; A123-C127 PolarHBondContact O-SG 2.79Å; V124-C127 PolarHBondContact O-N 3.43Å; C127-E129 VanDerWaalsContact C-N 3.35Å; C127-V130 PolarHBondContact O-N 2.83Å; C127-I131 VanDerWaalsContact O-CG1 3.3Å; C127-I131 WeakPolarHBondContact O-CG1 3.5Å; C127-I131 PolarHBondContact O-N 3.09Å; C127-L143 VanDerWaalsContact SG-CD2 3.51Å; C127-M144 HydrophobicContact CB-CE 3.36Å; C127-M144 HydrophobicContact CB-SD 4.08Å
128	Q	88.6	Confident	86.3	Confident	105 Å²	105	58 Å²	58	49%	0.491	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-43.2	174.4	-77.1	175.3	-12.8	0	0	111.2	V124 G125 V130 I131 R132 M144	V124-Q128 HydrophobicContact CG1-CG 4.23Å; V124-Q128 WeakPolarHBondContact O-CB 3.5Å; V124-Q128 WeakPolarHBondContact O-CG 3.39Å; V124-Q128 PolarHBondContact O-N 3.48Å; G125-Q128 PolarHBondContact O-N 3.2Å; Q128-V130 PolarHBondContact O-N 2.7Å; Q128-I131 PolarHBondContact O-N 3.42Å; Q128-R132 VanDerWaalsContact O-CB 3.25Å; Q128-R132 WeakPolarHBondContact O-CB 3.38Å; Q128-R132 PolarHBondContact O-N 2.82Å; Q128-M144 HydrophobicContact CG-CE 3.77Å
129	E	85.8	Confident	86.1	Confident	79 Å²	79	56 Å²	56	37%	0.369	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-40.9	174.3	-74.9	-59.8	143	0	0	112.4	L107 G125 M126 C127 R132 V133	L107-E129 HydrophobicContact CD2-CB 3.92Å; G125-E129 PolarHBondContact O-N 3.26Å; G125-E129 VanDerWaalsContact O-N 3.1Å; M126-E129 PolarHBondContact O-N 3.29Å; C127-E129 VanDerWaalsContact C-N 3.35Å; E129-R132 PolarHBondContact O-N 3.45Å; E129-R132 IonicContact OE1-CZ 3.93Å; E129-R132 IonicContact OE1-NE 3.8Å; E129-R132 PolarHBondContact OE1-NE 2.9Å; E129-R132 IonicContact OE1-NH2 2.68Å; E129-R132 IonicContact OE2-CZ 3.24Å; E129-R132 VanDerWaalsContact OE2-CZ 3.25Å; E129-R132 IonicContact OE2-NE 3.82Å; E129-R132 PolarHBondContact OE2-NE 3.15Å; E129-R132 IonicContact OE2-NH2 3.08Å; E129-R132 PolarHBondContact OE2-NH2 3.06Å; E129-V133 WeakPolarHBondContact O-CG2 3.43Å; E129-V133 PolarHBondContact O-N 3.38Å; E129-V133 VanDerWaalsContact O-N 3.09Å
130	V	87.2	Confident	86	Confident	2 Å²	2	51 Å²	51	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-43.7	175.3	176	0	0	0	0	111.5	L100 L107 L108 M126 C127 Q128 Q134	L100-V130 HydrophobicContact CD2-CG1 4.02Å; L107-V130 HydrophobicContact CB-CG2 4.35Å; L107-V130 HydrophobicContact CD2-CG2 3.87Å; L107-V130 HydrophobicContact CG-CG2 4.2Å; L108-V130 HydrophobicContact CB-CG2 4.35Å; L108-V130 HydrophobicContact CD1-CG1 3.97Å; L108-V130 HydrophobicContact CD1-CG2 4.4Å; M126-V130 WeakPolarHBondContact O-CG2 3.44Å; M126-V130 PolarHBondContact O-N 3.08Å; M126-V130 VanDerWaalsContact O-N 3.1Å; C127-V130 PolarHBondContact O-N 2.83Å; Q128-V130 PolarHBondContact O-N 2.7Å; V130-Q134 PolarHBondContact O-N 3.41Å
131	I	85.8	Confident	86	Confident	28 Å²	28	49.6 Å²	49.6	14%	0.144	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-40.6	179.1	-67.7	165.7	0	0	0	110.6	C127 Q128 V133 Q134 P135 Y141 M144	C127-I131 VanDerWaalsContact O-CG1 3.3Å; C127-I131 WeakPolarHBondContact O-CG1 3.5Å; C127-I131 PolarHBondContact O-N 3.09Å; Q128-I131 PolarHBondContact O-N 3.42Å; I131-V133 PolarHBondContact O-N 3.46Å; I131-Q134 CarbonylContact O-C 3.38Å; I131-Q134 VanDerWaalsContact O-C 3.31Å; I131-Q134 PolarHBondContact O-N 2.97Å; I131-P135 WeakPolarHBondContact O-CA 3.47Å; I131-P135 VanDerWaalsContact O-CD 3.31Å; I131-P135 WeakPolarHBondContact O-CD 3.43Å; I131-P135 WeakPolarHBondContact O-CG 3.35Å; I131-P135 VanDerWaalsContact O-N 3.07Å; I131-Y141 HydrophobicContact CD1-CD1 3.91Å; I131-Y141 HydrophobicContact CD1-CE1 4Å; I131-Y141 HydrophobicContact CD1-CG 4.42Å; I131-Y141 HydrophobicContact CG1-CD1 4.4Å; I131-Y141 HydrophobicContact CG1-CE1 4.23Å; I131-Y141 HydrophobicContact CG2-CE1 3.91Å; I131-M144 HydrophobicContact CD1-CE 4.11Å
132	R	84.1	Confident	86	Confident	174 Å²	174	46.4 Å²	46.4	66%	0.657	25%	0.246	S	C	*	.	H	α-helix	trans	-60	-43.4	177.9	-171.8	179.9	73.2	105.1	-1.5	111.9	Q128 E129	Q128-R132 VanDerWaalsContact O-CB 3.25Å; Q128-R132 WeakPolarHBondContact O-CB 3.38Å; Q128-R132 PolarHBondContact O-N 2.82Å; E129-R132 PolarHBondContact O-N 3.45Å; E129-R132 IonicContact OE1-CZ 3.93Å; E129-R132 IonicContact OE1-NE 3.8Å; E129-R132 PolarHBondContact OE1-NE 2.9Å; E129-R132 IonicContact OE1-NH2 2.68Å; E129-R132 IonicContact OE2-CZ 3.24Å; E129-R132 VanDerWaalsContact OE2-CZ 3.25Å; E129-R132 IonicContact OE2-NE 3.82Å; E129-R132 PolarHBondContact OE2-NE 3.15Å; E129-R132 IonicContact OE2-NH2 3.08Å; E129-R132 PolarHBondContact OE2-NH2 3.06Å
133	V	83.9	Confident	86	Confident	85 Å²	85	42.8 Å²	42.8	52%	0.515	23%	0.23	S	C	.	.	H	α-helix	trans	-76.4	-37.4	179.9	-177.6	0	0	0	0	111.6	L104 E129 I131	L104-V133 HydrophobicContact CD1-CB 3.96Å; L104-V133 HydrophobicContact CD1-CG1 3.66Å; L104-V133 HydrophobicContact CD2-CB 4.18Å; L104-V133 HydrophobicContact CD2-CG1 4.34Å; L104-V133 HydrophobicContact CD2-CG2 4.26Å; E129-V133 WeakPolarHBondContact O-CG2 3.43Å; E129-V133 PolarHBondContact O-N 3.38Å; E129-V133 VanDerWaalsContact O-N 3.09Å; I131-V133 PolarHBondContact O-N 3.46Å
134	Q	79.4	Confident	86	Confident	53 Å²	53	42.9 Å²	42.9	25%	0.248	23%	0.23	C	C	.	.			trans	-139.5	82.5	-178.8	-157.6	148.9	2.8	0	0	113.5	L104 V130 I131 G136 H137	L104-Q134 HydrophobicContact CD1-CB 4.5Å; V130-Q134 PolarHBondContact O-N 3.41Å; I131-Q134 CarbonylContact O-C 3.38Å; I131-Q134 VanDerWaalsContact O-C 3.31Å; I131-Q134 PolarHBondContact O-N 2.97Å; Q134-G136 PolarHBondContact O-N 3.15Å; Q134-G136 VanDerWaalsContact O-N 3.07Å; Q134-H137 HydrophobicContact CG-CB 4.31Å; Q134-H137 PolarHBondContact O-N 3.09Å
135	P	82	Confident	86	Confident	74 Å²	74	42.7 Å²	42.7	48%	0.481	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.7	-176.3	-24.3	32.7	0	0	0	114.7	I131 Y141	I131-P135 WeakPolarHBondContact O-CA 3.47Å; I131-P135 VanDerWaalsContact O-CD 3.31Å; I131-P135 WeakPolarHBondContact O-CD 3.43Å; I131-P135 WeakPolarHBondContact O-CG 3.35Å; I131-P135 VanDerWaalsContact O-N 3.07Å; P135-Y141 VanDerWaalsContact O-CE2 3.23Å; P135-Y141 WeakPolarHBondContact O-CE2 2.91Å; P135-Y141 PolarHBondContact O-OH 2.82Å
136	G	77.9	Confident	86	Confident	30 Å²	30	42.8 Å²	42.8	31%	0.309	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	6.5	-177	0	0	0	0	0	115.3	Q134	Q134-G136 PolarHBondContact O-N 3.15Å; Q134-G136 VanDerWaalsContact O-N 3.07Å
137	H	83.2	Confident	86.1	Confident	24 Å²	24	41.3 Å²	41.3	11%	0.111	22%	0.22	C	C	.	.			trans	-105.7	130.8	-179.1	-171.7	73.6	0	0	0	111.8	R98 L100 Q134 A139 Y141	R98-H137 PolarHBondContact O-ND1 3.01Å; L100-H137 WeakPolarHBondContact CD1-CD2 3.31Å; L100-H137 VanDerWaalsContact CD1-CE1 3.45Å; L100-H137 WeakPolarHBondContact CD1-CE1 3.47Å; L100-H137 WeakPolarHBondContact CD1-NE2 3.31Å; Q134-H137 HydrophobicContact CG-CB 4.31Å; Q134-H137 PolarHBondContact O-N 3.09Å; H137-A139 VanDerWaalsContact CD2-CB 3.48Å; H137-A139 WeakPolarHBondContact CD2-CB 3.49Å; H137-A139 PolarHBondContact CD2-N 3.4Å; H137-A139 WeakPolarHBondContact NE2-CB 3.06Å; H137-A139 PolarHBondContact NE2-N 2.9Å; H137-A139 PolarHBondContact O-N 2.91Å; H137-Y141 VanDerWaalsContact O-CD2 3.32Å; H137-Y141 WeakPolarHBondContact O-CD2 3.33Å
138	H	83.9	Confident	86.2	Confident	54 Å²	54	42.1 Å²	42.1	25%	0.25	22%	0.224	C	C	.	.	H	α-helix	trans	-70.6	-31.1	-171.3	71.4	85.9	0	0	0	114.7	G140 Y141 T142 G164 L167 N168	H138-G140 VanDerWaalsContact C-N 3.3Å; H138-G140 PolarHBondContact O-N 3.48Å; H138-Y141 PolarHBondContact O-N 3.21Å; H138-Y141 VanDerWaalsContact O-N 3.13Å; H138-T142 PolarHBondContact O-N 3.26Å; H138-T142 PolarHBondContact O-OG1 3.38Å; H138-G164 WeakPolarHBondContact CB-O 3.42Å; H138-L167 HydrophobicContact CB-CB 4.04Å; H138-N168 HydrophobicContact CB-CB 3.83Å
139	A	85	Confident	86.2	Confident	14 Å²	14	41.7 Å²	41.7	12%	0.116	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-34.9	-167.2	0	0	0	0	0	113.9	L108 H137 T142 L143	L108-A139 HydrophobicContact CD1-CB 3.84Å; L108-A139 HydrophobicContact CD2-CB 4.04Å; H137-A139 VanDerWaalsContact CD2-CB 3.48Å; H137-A139 WeakPolarHBondContact CD2-CB 3.49Å; H137-A139 PolarHBondContact CD2-N 3.4Å; H137-A139 WeakPolarHBondContact NE2-CB 3.06Å; H137-A139 PolarHBondContact NE2-N 2.9Å; H137-A139 PolarHBondContact O-N 2.91Å; A139-T142 VanDerWaalsContact CA-OG1 3.3Å; A139-T142 WeakPolarHBondContact CA-OG1 3.49Å; A139-T142 PolarHBondContact O-N 2.78Å; A139-T142 PolarHBondContact O-OG1 2.74Å; A139-L143 PolarHBondContact O-N 3.49Å; A139-L143 VanDerWaalsContact O-N 3.11Å
140	G	87.7	Confident	86.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-47.1	176.5	0	0	0	0	0	111.5	H138 L143 M144	H138-G140 VanDerWaalsContact C-N 3.3Å; H138-G140 PolarHBondContact O-N 3.48Å; G140-L143 PolarHBondContact O-N 3.12Å; G140-M144 VanDerWaalsContact O-CB 3.32Å; G140-M144 WeakPolarHBondContact O-CB 3.39Å; G140-M144 PolarHBondContact O-N 3.18Å
141	Y	90.1	Very high	86.4	Confident	13 Å²	13	47.1 Å²	47.1	5%	0.051	25%	0.246	C	C	.	.	H	α-helix	trans	-65.6	-38.9	177.9	-58.9	-76.4	0	0	0	112.9	I131 P135 H137 H138 M144 S145 Y160 L163 L167	I131-Y141 HydrophobicContact CD1-CD1 3.91Å; I131-Y141 HydrophobicContact CD1-CE1 4Å; I131-Y141 HydrophobicContact CD1-CG 4.42Å; I131-Y141 HydrophobicContact CG1-CD1 4.4Å; I131-Y141 HydrophobicContact CG1-CE1 4.23Å; I131-Y141 HydrophobicContact CG2-CE1 3.91Å; P135-Y141 VanDerWaalsContact O-CE2 3.23Å; P135-Y141 WeakPolarHBondContact O-CE2 2.91Å; P135-Y141 PolarHBondContact O-OH 2.82Å; H137-Y141 VanDerWaalsContact O-CD2 3.32Å; H137-Y141 WeakPolarHBondContact O-CD2 3.33Å; H138-Y141 PolarHBondContact O-N 3.21Å; H138-Y141 VanDerWaalsContact O-N 3.13Å; Y141-M144 PolarHBondContact O-N 2.62Å; Y141-S145 WeakPolarHBondContact O-CB 3.44Å; Y141-S145 PolarHBondContact O-N 3.23Å; Y141-Y160 AromaticContact CD1-CD1 3.99Å; Y141-Y160 HydrophobicContact CD1-CD1 3.99Å; Y141-L163 HydrophobicContact CD1-CB 4.14Å; Y141-L163 HydrophobicContact CD1-CD1 4.22Å; Y141-L163 HydrophobicContact CE1-CD1 4.21Å; Y141-L163 HydrophobicContact CG-CB 4.32Å; Y141-L167 HydrophobicContact CD2-CD1 3.51Å; Y141-L167 HydrophobicContact CE2-CD1 3.29Å
142	T	87.9	Confident	86.3	Confident	65 Å²	65	48.3 Å²	48.3	40%	0.399	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-40.1	178	51.5	0	0	0	0	112.3	H138 A139 A146	H138-T142 PolarHBondContact O-N 3.26Å; H138-T142 PolarHBondContact O-OG1 3.38Å; A139-T142 VanDerWaalsContact CA-OG1 3.3Å; A139-T142 WeakPolarHBondContact CA-OG1 3.49Å; A139-T142 PolarHBondContact O-N 2.78Å; A139-T142 PolarHBondContact O-OG1 2.74Å; T142-A146 PolarHBondContact O-N 3.45Å
143	L	88.8	Confident	86.5	Confident	21 Å²	21	43.9 Å²	43.9	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-70.1	-40.1	175.9	-174.9	58.1	0	0	0	110.8	L108 A111 A112 F115 C127 A139 G140 S145 A146 V147	L108-L143 HydrophobicContact CG-CD2 4.43Å; A111-L143 HydrophobicContact CB-CD2 3.64Å; A112-L143 HydrophobicContact CB-CD2 4.27Å; F115-L143 HydrophobicContact CB-CD1 4.38Å; F115-L143 HydrophobicContact CD1-CD1 4.24Å; F115-L143 HydrophobicContact CG-CD1 4.34Å; C127-L143 VanDerWaalsContact SG-CD2 3.51Å; A139-L143 PolarHBondContact O-N 3.49Å; A139-L143 VanDerWaalsContact O-N 3.11Å; G140-L143 PolarHBondContact O-N 3.12Å; L143-S145 VanDerWaalsContact C-N 3.34Å; L143-S145 PolarHBondContact O-N 3.05Å; L143-A146 WeakPolarHBondContact O-CB 3.2Å; L143-A146 PolarHBondContact O-N 3.49Å; L143-A146 VanDerWaalsContact O-N 3.16Å; L143-V147 VanDerWaalsContact O-CG2 3.29Å; L143-V147 WeakPolarHBondContact O-CG2 3.38Å; L143-V147 PolarHBondContact O-N 3.25Å
144	M	90.4	Very high	86.6	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-42.3	175.2	-164.5	67.8	86.6	0	0	112.4	V124 C127 Q128 I131 G140 Y141 A146 V147 F148 Y160	V124-M144 HydrophobicContact CB-SD 4.3Å; V124-M144 HydrophobicContact CG1-CE 4.14Å; V124-M144 HydrophobicContact CG1-SD 3.99Å; V124-M144 HydrophobicContact CG2-SD 4.11Å; C127-M144 HydrophobicContact CB-CE 3.36Å; C127-M144 HydrophobicContact CB-SD 4.08Å; Q128-M144 HydrophobicContact CG-CE 3.77Å; I131-M144 HydrophobicContact CD1-CE 4.11Å; G140-M144 VanDerWaalsContact O-CB 3.32Å; G140-M144 WeakPolarHBondContact O-CB 3.39Å; G140-M144 PolarHBondContact O-N 3.18Å; Y141-M144 PolarHBondContact O-N 2.62Å; M144-A146 VanDerWaalsContact C-N 3.31Å; M144-A146 PolarHBondContact O-N 2.89Å; M144-V147 PolarHBondContact O-N 2.98Å; M144-F148 HydrophobicContact CG-CD2 3.68Å; M144-F148 HydrophobicContact CG-CE2 3.43Å; M144-F148 VanDerWaalsContact CG-CE2 3.43Å; M144-F148 VanDerWaalsContact O-CD2 3.28Å; M144-F148 WeakPolarHBondContact O-CD2 3.46Å; M144-F148 PolarHBondContact O-N 2.94Å; M144-F148 HydrophobicContact SD-CD2 4.16Å; M144-F148 HydrophobicContact SD-CE2 3.58Å; M144-F148 VanDerWaalsContact SD-CE2 3.58Å; M144-F148 HydrophobicContact SD-CZ 4.32Å; M144-Y160 HydrophobicContact CB-CG 4.36Å; M144-Y160 HydrophobicContact CG-CD1 4.3Å; M144-Y160 HydrophobicContact CG-CD2 3.86Å; M144-Y160 HydrophobicContact CG-CE2 4.11Å; M144-Y160 HydrophobicContact CG-CG 3.96Å
145	S	88.6	Confident	86.8	Confident	13 Å²	13	47.6 Å²	47.6	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-58.6	-42.5	174.7	-179.2	0	0	0	0	111.9	Y141 L143 K149 S157 G161	Y141-S145 WeakPolarHBondContact O-CB 3.44Å; Y141-S145 PolarHBondContact O-N 3.23Å; L143-S145 VanDerWaalsContact C-N 3.34Å; L143-S145 PolarHBondContact O-N 3.05Å; S145-K149 WeakPolarHBondContact O-CB 3.38Å; S145-K149 PolarHBondContact O-N 3.45Å; S145-S157 PolarHBondContact O-OG 3.44Å; S145-S157 PolarHBondContact OG-O 3Å; S145-S157 PolarHBondContact OG-OG 3.14Å; S145-G161 VanDerWaalsContact OG-CA 3.31Å; S145-G161 WeakPolarHBondContact OG-CA 3.25Å; S145-G161 PolarHBondContact OG-N 3Å
146	A	88.8	Confident	86.9	Confident	33 Å²	33	48.6 Å²	48.6	27%	0.273	26%	0.259	S	S	.	.	H	α-helix	trans	-66.5	-42	176	0	0	0	0	0	112.3	F115 T142 L143 M144 K149 E150	F115-A146 HydrophobicContact CE1-CB 4.3Å; F115-A146 HydrophobicContact CE2-CB 4.5Å; F115-A146 HydrophobicContact CZ-CB 3.96Å; T142-A146 PolarHBondContact O-N 3.45Å; L143-A146 WeakPolarHBondContact O-CB 3.2Å; L143-A146 PolarHBondContact O-N 3.49Å; L143-A146 VanDerWaalsContact O-N 3.16Å; M144-A146 VanDerWaalsContact C-N 3.31Å; M144-A146 PolarHBondContact O-N 2.89Å; A146-K149 WeakPolarHBondContact O-CB 3.18Å; A146-K149 PolarHBondContact O-N 3.47Å; A146-E150 PolarHBondContact O-N 2.94Å; A146-E150 VanDerWaalsContact O-N 3.13Å
147	V	90.7	Very high	87.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-47.6	176.8	176.3	0	0	0	0	111.1	F115 L120 A123 V124 L143 M144 K149 E150 Q151	F115-V147 HydrophobicContact CB-CG2 4.42Å; F115-V147 HydrophobicContact CD2-CB 4.33Å; F115-V147 HydrophobicContact CD2-CG2 3.56Å; F115-V147 HydrophobicContact CE2-CB 4.48Å; F115-V147 HydrophobicContact CE2-CG2 4.1Å; F115-V147 HydrophobicContact CG-CG2 4.19Å; L120-V147 HydrophobicContact CB-CG1 4.2Å; L120-V147 HydrophobicContact CD2-CG1 4.3Å; A123-V147 HydrophobicContact CB-CG2 4.11Å; V124-V147 HydrophobicContact CG2-CG1 3.52Å; L143-V147 VanDerWaalsContact O-CG2 3.29Å; L143-V147 WeakPolarHBondContact O-CG2 3.38Å; L143-V147 PolarHBondContact O-N 3.25Å; M144-V147 PolarHBondContact O-N 2.98Å; V147-K149 VanDerWaalsContact C-N 3.29Å; V147-K149 PolarHBondContact O-N 3.41Å; V147-E150 PolarHBondContact O-N 2.77Å; V147-Q151 PolarHBondContact O-N 3.3Å
148	F	91.2	Very high	87.4	Confident	16 Å²	16	46.1 Å²	46.1	7%	0.07	24%	0.239	C	C	.	.	H	α-helix	trans	-68.7	-27.5	177.7	-77.7	-60.6	0	0	0	113.5	M144 Q151 G152 Q153 K156 Y160	M144-F148 HydrophobicContact CG-CD2 3.68Å; M144-F148 HydrophobicContact CG-CE2 3.43Å; M144-F148 VanDerWaalsContact CG-CE2 3.43Å; M144-F148 VanDerWaalsContact O-CD2 3.28Å; M144-F148 WeakPolarHBondContact O-CD2 3.46Å; M144-F148 PolarHBondContact O-N 2.94Å; M144-F148 HydrophobicContact SD-CD2 4.16Å; M144-F148 HydrophobicContact SD-CE2 3.58Å; M144-F148 VanDerWaalsContact SD-CE2 3.58Å; M144-F148 HydrophobicContact SD-CZ 4.32Å; F148-Q151 VanDerWaalsContact CD1-OE1 3.29Å; F148-Q151 PolarHBondContact O-N 3.16Å; F148-G152 PolarHBondContact O-N 3.1Å; F148-Q153 HydrophobicContact CD1-CB 4.19Å; F148-Q153 PolarHBondContact O-N 2.87Å; F148-Q153 VanDerWaalsContact O-N 3.09Å; F148-K156 HydrophobicContact CD1-CB 4.37Å; F148-K156 HydrophobicContact CD2-CB 4.35Å; F148-K156 HydrophobicContact CE1-CD 4.23Å; F148-K156 HydrophobicContact CG-CB 4.18Å; F148-K156 HydrophobicContact CZ-CD 4.46Å; F148-Y160 AromaticContact CD2-CD2 3.47Å; F148-Y160 HydrophobicContact CD2-CD2 3.47Å; F148-Y160 VanDerWaalsContact CD2-CD2 3.47Å; F148-Y160 AromaticContact CD2-CE2 3.66Å; F148-Y160 HydrophobicContact CD2-CE2 3.66Å; F148-Y160 AromaticContact CE2-CD2 3.55Å; F148-Y160 HydrophobicContact CE2-CD2 3.55Å; F148-Y160 AromaticContact CE2-CE2 3.22Å; F148-Y160 HydrophobicContact CE2-CE2 3.22Å; F148-Y160 HydrophobicContact CZ-CE2 4.11Å
149	K	88.4	Confident	87.4	Confident	97 Å²	97	47.9 Å²	47.9	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-42.6	173.3	-165.9	175.4	177.1	178	0	111	S145 A146 V147 G152 S157 L182	S145-K149 WeakPolarHBondContact O-CB 3.38Å; S145-K149 PolarHBondContact O-N 3.45Å; A146-K149 WeakPolarHBondContact O-CB 3.18Å; A146-K149 PolarHBondContact O-N 3.47Å; V147-K149 VanDerWaalsContact C-N 3.29Å; V147-K149 PolarHBondContact O-N 3.41Å; K149-G152 PolarHBondContact O-N 2.97Å; K149-S157 WeakPolarHBondContact CB-OG 3.41Å; K149-L182 HydrophobicContact CD-CD1 4.39Å
150	E	87.5	Confident	87.5	Confident	135 Å²	135	49.4 Å²	49.4	63%	0.631	25%	0.251	S	S	*	.	H	α-helix	trans	-70.8	-33.7	175.4	-68.5	-61.6	140.2	0	0	112.8	F115 L120 A146 V147 G152	F115-E150 HydrophobicContact CE2-CB 4.14Å; F115-E150 HydrophobicContact CE2-CG 3.54Å; F115-E150 HydrophobicContact CZ-CG 3.67Å; L120-E150 HydrophobicContact CD1-CB 4.39Å; L120-E150 HydrophobicContact CD2-CB 4.28Å; A146-E150 PolarHBondContact O-N 2.94Å; A146-E150 VanDerWaalsContact O-N 3.13Å; V147-E150 PolarHBondContact O-N 2.77Å; E150-G152 PolarHBondContact O-N 3.23Å
151	Q	88.2	Confident	87.4	Confident	59 Å²	59	49.7 Å²	49.7	28%	0.276	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.9	173	-70.2	-175.6	-15	0	0	113.7	L120 V147 F148 Q153	L120-Q151 HydrophobicContact CB-CG 4.13Å; L120-Q151 HydrophobicContact CD1-CG 3.56Å; L120-Q151 HydrophobicContact CG-CG 4.4Å; V147-Q151 PolarHBondContact O-N 3.3Å; F148-Q151 VanDerWaalsContact CD1-OE1 3.29Å; F148-Q151 PolarHBondContact O-N 3.16Å; Q151-Q153 VanDerWaalsContact C-N 3.3Å; Q151-Q153 PolarHBondContact O-N 2.94Å
152	G	85.4	Confident	87.1	Confident	53 Å²	53	49.7 Å²	49.7	55%	0.546	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-1.4	-177.8	0	0	0	0	0	115	F148 K149 E150 K154	F148-G152 PolarHBondContact O-N 3.1Å; K149-G152 PolarHBondContact O-N 2.97Å; E150-G152 PolarHBondContact O-N 3.23Å; G152-K154 VanDerWaalsContact C-N 3.3Å; G152-K154 PolarHBondContact O-N 3.21Å
153	Q	88.4	Confident	86.9	Confident	82 Å²	82	47.4 Å²	47.4	38%	0.383	24%	0.239	S	C	.	.			trans	-80.6	75.2	176.3	-63.9	-174	10.2	0	0	110.3	F148 Q151 E155 K156 S157	F148-Q153 HydrophobicContact CD1-CB 4.19Å; F148-Q153 PolarHBondContact O-N 2.87Å; F148-Q153 VanDerWaalsContact O-N 3.09Å; Q151-Q153 VanDerWaalsContact C-N 3.3Å; Q151-Q153 PolarHBondContact O-N 2.94Å; Q153-E155 VanDerWaalsContact C-N 3.33Å; Q153-E155 PolarHBondContact O-N 2.99Å; Q153-K156 VanDerWaalsContact OE1-NZ 3.12Å; Q153-S157 WeakPolarHBondContact O-CB 3.48Å; Q153-S157 PolarHBondContact O-N 3.28Å
154	K	84	Confident	86.6	Confident	92 Å²	92	46.4 Å²	46.4	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-60	-36.1	-174.7	-67.4	-170.7	179.5	-167.9	0	113.8	G152 S157 L158 E185 L186	G152-K154 VanDerWaalsContact C-N 3.3Å; G152-K154 PolarHBondContact O-N 3.21Å; K154-S157 WeakPolarHBondContact O-CB 3.48Å; K154-S157 PolarHBondContact O-N 2.96Å; K154-L158 WeakPolarHBondContact O-CB 3.24Å; K154-L158 PolarHBondContact O-N 3.48Å; K154-E185 IonicContact NZ-OE2 3.48Å; K154-E185 PolarHBondContact NZ-OE2 3.44Å; K154-L186 HydrophobicContact CB-CD1 4.15Å; K154-L186 HydrophobicContact CB-CD2 3.93Å; K154-L186 HydrophobicContact CB-CG 4.34Å
155	E	83.7	Confident	86.2	Confident	123 Å²	123	46.6 Å²	46.6	58%	0.575	24%	0.236	S	C	*	.	H	α-helix	trans	-65.5	-52	-178.5	-66.3	-178.8	163.3	0	0	111.8	Q153 S157 L158 E159 L186	Q153-E155 VanDerWaalsContact C-N 3.33Å; Q153-E155 PolarHBondContact O-N 2.99Å; E155-S157 VanDerWaalsContact C-N 3.3Å; E155-S157 PolarHBondContact O-N 3.44Å; E155-L158 WeakPolarHBondContact O-CB 3.19Å; E155-L158 PolarHBondContact O-N 3.11Å; E155-L158 VanDerWaalsContact O-N 3.09Å; E155-E159 PolarHBondContact O-N 3.24Å; E155-L186 HydrophobicContact CG-CD1 4.2Å; E155-L186 HydrophobicContact CG-CD2 3.99Å
156	K	84.7	Confident	85.6	Confident	96 Å²	96	48.3 Å²	48.3	42%	0.417	24%	0.243	S	C	.	.	H	α-helix	trans	-62.1	-39.5	174.1	-63.2	-170.8	-168.6	164.1	0	111.9	F148 Q153 L158 E159 Y160	F148-K156 HydrophobicContact CD1-CB 4.37Å; F148-K156 HydrophobicContact CD2-CB 4.35Å; F148-K156 HydrophobicContact CE1-CD 4.23Å; F148-K156 HydrophobicContact CG-CB 4.18Å; F148-K156 HydrophobicContact CZ-CD 4.46Å; Q153-K156 VanDerWaalsContact OE1-NZ 3.12Å; K156-L158 PolarHBondContact O-N 3.15Å; K156-E159 PolarHBondContact O-N 3.36Å; K156-Y160 HydrophobicContact CB-CD2 4.38Å; K156-Y160 HydrophobicContact CB-CE2 4.32Å; K156-Y160 WeakPolarHBondContact O-CD2 3.07Å; K156-Y160 PolarHBondContact O-N 3.17Å
157	S	86.8	Confident	85.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.1	-40.7	174.5	179.2	0	0	0	0	111.6	S145 K149 Q153 K154 E155 G161	S145-S157 PolarHBondContact O-OG 3.44Å; S145-S157 PolarHBondContact OG-O 3Å; S145-S157 PolarHBondContact OG-OG 3.14Å; K149-S157 WeakPolarHBondContact CB-OG 3.41Å; Q153-S157 WeakPolarHBondContact O-CB 3.48Å; Q153-S157 PolarHBondContact O-N 3.28Å; K154-S157 WeakPolarHBondContact O-CB 3.48Å; K154-S157 PolarHBondContact O-N 2.96Å; E155-S157 VanDerWaalsContact C-N 3.3Å; E155-S157 PolarHBondContact O-N 3.44Å; S157-G161 WeakPolarHBondContact O-CA 3.43Å; S157-G161 PolarHBondContact O-N 3.47Å
158	L	85.4	Confident	84.5	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-47.3	176.5	174.2	63.5	0	0	0	111.7	K154 E155 K156 G161 L162 V183 L186	K154-L158 WeakPolarHBondContact O-CB 3.24Å; K154-L158 PolarHBondContact O-N 3.48Å; E155-L158 WeakPolarHBondContact O-CB 3.19Å; E155-L158 PolarHBondContact O-N 3.11Å; E155-L158 VanDerWaalsContact O-N 3.09Å; K156-L158 PolarHBondContact O-N 3.15Å; L158-G161 PolarHBondContact O-N 2.86Å; L158-L162 HydrophobicContact CD1-CD1 3.99Å; L158-L162 HydrophobicContact CD1-CG 3.93Å; L158-L162 HydrophobicContact CG-CD1 3.97Å; L158-L162 HydrophobicContact CG-CG 4.35Å; L158-L162 WeakPolarHBondContact O-CB 3.1Å; L158-L162 VanDerWaalsContact O-CG 3.29Å; L158-L162 WeakPolarHBondContact O-CG 3.49Å; L158-L162 PolarHBondContact O-N 2.85Å; L158-V183 HydrophobicContact CD1-CB 4.42Å; L158-V183 HydrophobicContact CD1-CG2 3.27Å; L158-V183 HydrophobicContact CD2-CB 4.47Å; L158-V183 HydrophobicContact CD2-CG2 3.87Å; L158-V183 HydrophobicContact CG-CG2 4.2Å; L158-L186 HydrophobicContact CB-CD1 3.99Å; L158-L186 HydrophobicContact CD2-CD1 3.84Å
159	E	83.9	Confident	83.3	Confident	91 Å²	91	56 Å²	56	43%	0.425	28%	0.28	S	S	.	.	H	α-helix	trans	-59.6	-51.1	-179.9	-69.9	171	-179.1	0	0	112	E155 K156 G161 L162 L163	E155-E159 PolarHBondContact O-N 3.24Å; K156-E159 PolarHBondContact O-N 3.36Å; E159-G161 VanDerWaalsContact C-N 3.3Å; E159-G161 PolarHBondContact O-N 2.85Å; E159-L162 PolarHBondContact O-N 3.17Å; E159-L163 WeakPolarHBondContact O-CG 3.33Å; E159-L163 PolarHBondContact O-N 3.45Å
160	Y	87.9	Confident	82.4	Confident	47 Å²	47	58.1 Å²	58.1	18%	0.184	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-34.9	176.1	-69.3	-58.9	0	0	0	112.4	Y141 M144 F148 K156 L163 G164	Y141-Y160 AromaticContact CD1-CD1 3.99Å; Y141-Y160 HydrophobicContact CD1-CD1 3.99Å; M144-Y160 HydrophobicContact CB-CG 4.36Å; M144-Y160 HydrophobicContact CG-CD1 4.3Å; M144-Y160 HydrophobicContact CG-CD2 3.86Å; M144-Y160 HydrophobicContact CG-CE2 4.11Å; M144-Y160 HydrophobicContact CG-CG 3.96Å; F148-Y160 AromaticContact CD2-CD2 3.47Å; F148-Y160 HydrophobicContact CD2-CD2 3.47Å; F148-Y160 VanDerWaalsContact CD2-CD2 3.47Å; F148-Y160 AromaticContact CD2-CE2 3.66Å; F148-Y160 HydrophobicContact CD2-CE2 3.66Å; F148-Y160 AromaticContact CE2-CD2 3.55Å; F148-Y160 HydrophobicContact CE2-CD2 3.55Å; F148-Y160 AromaticContact CE2-CE2 3.22Å; F148-Y160 HydrophobicContact CE2-CE2 3.22Å; F148-Y160 HydrophobicContact CZ-CE2 4.11Å; K156-Y160 HydrophobicContact CB-CD2 4.38Å; K156-Y160 HydrophobicContact CB-CE2 4.32Å; K156-Y160 WeakPolarHBondContact O-CD2 3.07Å; K156-Y160 PolarHBondContact O-N 3.17Å; Y160-L163 HydrophobicContact CD1-CD1 4.23Å; Y160-L163 PolarHBondContact O-N 3.36Å; Y160-G164 PolarHBondContact O-N 3.15Å
161	G	85.6	Confident	81.4	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-46	175.7	0	0	0	0	0	112	S145 S157 L158 E159 G164 A165 L179	S145-G161 VanDerWaalsContact OG-CA 3.31Å; S145-G161 WeakPolarHBondContact OG-CA 3.25Å; S145-G161 PolarHBondContact OG-N 3Å; S157-G161 WeakPolarHBondContact O-CA 3.43Å; S157-G161 PolarHBondContact O-N 3.47Å; L158-G161 PolarHBondContact O-N 2.86Å; E159-G161 VanDerWaalsContact C-N 3.3Å; E159-G161 PolarHBondContact O-N 2.85Å; G161-G164 PolarHBondContact O-N 2.78Å; G161-A165 WeakPolarHBondContact O-CB 3.12Å; G161-A165 PolarHBondContact O-N 3.38Å; G161-L179 WeakPolarHBondContact O-CD1 3.43Å
162	L	83.4	Confident	80.5	Confident	14 Å²	14	54.9 Å²	54.9	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-52.8	174.1	-75.2	171	0	0	0	110.5	L158 E159 G164 A165 M166 H191 C195	L158-L162 HydrophobicContact CD1-CD1 3.99Å; L158-L162 HydrophobicContact CD1-CG 3.93Å; L158-L162 HydrophobicContact CG-CD1 3.97Å; L158-L162 HydrophobicContact CG-CG 4.35Å; L158-L162 WeakPolarHBondContact O-CB 3.1Å; L158-L162 VanDerWaalsContact O-CG 3.29Å; L158-L162 WeakPolarHBondContact O-CG 3.49Å; L158-L162 PolarHBondContact O-N 2.85Å; E159-L162 PolarHBondContact O-N 3.17Å; L162-G164 PolarHBondContact O-N 3.02Å; L162-A165 PolarHBondContact O-N 3.32Å; L162-A165 VanDerWaalsContact O-N 3.09Å; L162-M166 HydrophobicContact CB-CE 4.33Å; L162-M166 WeakPolarHBondContact O-CG 3.49Å; L162-M166 PolarHBondContact O-N 3.5Å; L162-H191 HydrophobicContact CD1-CB 4.18Å; L162-C195 WeakPolarHBondContact CD2-SG 3.02Å
163	L	84	Confident	79.7	Confident	17 Å²	17	54.9 Å²	54.9	9%	0.089	27%	0.268	C	S	.	.	H	α-helix	trans	-55.3	-47.9	178.5	-71.8	166.6	0	0	0	112.2	V26 Y141 E159 Y160 A165 M166 L167	V26-L163 HydrophobicContact CG2-CD1 3.86Å; V26-L163 HydrophobicContact CG2-CD2 4.23Å; V26-L163 HydrophobicContact CG2-CG 4.45Å; Y141-L163 HydrophobicContact CD1-CB 4.14Å; Y141-L163 HydrophobicContact CD1-CD1 4.22Å; Y141-L163 HydrophobicContact CE1-CD1 4.21Å; Y141-L163 HydrophobicContact CG-CB 4.32Å; E159-L163 WeakPolarHBondContact O-CG 3.33Å; E159-L163 PolarHBondContact O-N 3.45Å; Y160-L163 HydrophobicContact CD1-CD1 4.23Å; Y160-L163 PolarHBondContact O-N 3.36Å; L163-A165 VanDerWaalsContact C-N 3.3Å; L163-A165 PolarHBondContact O-N 3.35Å; L163-M166 HydrophobicContact CD2-CE 4.12Å; L163-M166 PolarHBondContact O-N 3.27Å; L163-L167 WeakPolarHBondContact O-CG 3.43Å; L163-L167 PolarHBondContact O-N 3Å
164	G	82.5	Confident	79	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.2	-42.9	176.2	0	0	0	0	0	112.2	H138 Y160 G161 L162 N168	H138-G164 WeakPolarHBondContact CB-O 3.42Å; Y160-G164 PolarHBondContact O-N 3.15Å; G161-G164 PolarHBondContact O-N 2.78Å; L162-G164 PolarHBondContact O-N 3.02Å; G164-N168 PolarHBondContact O-N 3.25Å
165	A	81.8	Confident	78.5	Confident	5 Å²	5	52.1 Å²	52.1	4%	0.041	27%	0.266	C	S	.	.	H	α-helix	trans	-70	-36.3	177.6	0	0	0	0	0	113.5	G161 L162 L163 T171 W176 L179	G161-A165 WeakPolarHBondContact O-CB 3.12Å; G161-A165 PolarHBondContact O-N 3.38Å; L162-A165 PolarHBondContact O-N 3.32Å; L162-A165 VanDerWaalsContact O-N 3.09Å; L163-A165 VanDerWaalsContact C-N 3.3Å; L163-A165 PolarHBondContact O-N 3.35Å; A165-T171 HydrophobicContact CB-CG2 3.82Å; A165-T171 PolarHBondContact O-OG1 3.03Å; A165-W176 HydrophobicContact CB-CE3 4.44Å; A165-W176 HydrophobicContact CB-CH2 3.62Å; A165-W176 HydrophobicContact CB-CZ2 3.77Å; A165-W176 HydrophobicContact CB-CZ3 3.99Å; A165-L179 HydrophobicContact CB-CD1 3.45Å; A165-L179 VanDerWaalsContact CB-CD1 3.45Å
166	M	76.1	Confident	78.3	Confident	49 Å²	49	46.7 Å²	46.7	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-69.4	-36.9	178.3	-40.9	-156.2	-123.8	0	0	112.6	M30 L162 L163 N168 R198	M30-M166 HydrophobicContact SD-CE 3.92Å; M30-M166 HydrophobicContact SD-SD 4.2Å; L162-M166 HydrophobicContact CB-CE 4.33Å; L162-M166 WeakPolarHBondContact O-CG 3.49Å; L162-M166 PolarHBondContact O-N 3.5Å; L163-M166 HydrophobicContact CD2-CE 4.12Å; L163-M166 PolarHBondContact O-N 3.27Å; M166-N168 VanDerWaalsContact C-N 3.34Å; M166-R198 PolarHBondContact SD-NH1 2.84Å
167	L	79.4	Confident	77.6	Confident	62 Å²	62	46 Å²	46	33%	0.325	24%	0.237	S	C	.	.	H	α-helix	trans	-74.5	-27.4	-179.2	-71.1	171	0	0	0	112.3	H138 Y141 L163 N169	H138-L167 HydrophobicContact CB-CB 4.04Å; Y141-L167 HydrophobicContact CD2-CD1 3.51Å; Y141-L167 HydrophobicContact CE2-CD1 3.29Å; L163-L167 WeakPolarHBondContact O-CG 3.43Å; L163-L167 PolarHBondContact O-N 3Å; L167-N169 PolarHBondContact O-N 3.12Å
168	N	77	Confident	77.1	Confident	36 Å²	36	51.4 Å²	51.4	19%	0.193	26%	0.262	C	S	.	.			trans	-86.7	102.5	176.9	-177	12	0	0	0	110.4	H138 G164 M166 Q170 T171	H138-N168 HydrophobicContact CB-CB 3.83Å; G164-N168 PolarHBondContact O-N 3.25Å; M166-N168 VanDerWaalsContact C-N 3.34Å; N168-Q170 PolarHBondContact O-N 2.89Å; N168-Q170 VanDerWaalsContact O-N 3.1Å; N168-Q170 WeakPolarHBondContact OD1-CA 3.35Å; N168-Q170 PolarHBondContact OD1-N 3.43Å; N168-T171 HydrophobicContact CB-CG2 4.08Å; N168-T171 PolarHBondContact O-N 3.22Å; N168-T171 PolarHBondContact O-OG1 3.4Å
169	N	65.7	Low	76.8	Confident	112 Å²	112	51.9 Å²	51.9	60%	0.599	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-11.1	172.9	-71.9	-8.4	0	0	0	114.3	Y95 L167	Y95-N169 WeakPolarHBondContact CE2-ND2 3.48Å; L167-N169 PolarHBondContact O-N 3.12Å
170	Q	69.1	Low	76.3	Confident	142 Å²	142	47.7 Å²	47.7	66%	0.664	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117	31.6	179.7	-62.5	-177.6	-10	0	0	111.4	N168 D172	N168-Q170 PolarHBondContact O-N 2.89Å; N168-Q170 VanDerWaalsContact O-N 3.1Å; N168-Q170 WeakPolarHBondContact OD1-CA 3.35Å; N168-Q170 PolarHBondContact OD1-N 3.43Å; Q170-D172 PolarHBondContact O-N 3.4Å
171	T	66.1	Low	75.7	Confident	13 Å²	13	49.1 Å²	49.1	8%	0.08	26%	0.259	C	S	.	.			trans	-63	127.4	178.2	11.7	0	0	0	0	111.4	A165 N168 S175 W176	A165-T171 HydrophobicContact CB-CG2 3.82Å; A165-T171 PolarHBondContact O-OG1 3.03Å; N168-T171 HydrophobicContact CB-CG2 4.08Å; N168-T171 PolarHBondContact O-N 3.22Å; N168-T171 PolarHBondContact O-OG1 3.4Å; T171-S175 VanDerWaalsContact CG2-OG 3.3Å; T171-S175 WeakPolarHBondContact CG2-OG 3.4Å; T171-W176 VanDerWaalsContact CB-NE1 3.33Å; T171-W176 PolarHBondContact OG1-NE1 3.32Å; T171-W176 VanDerWaalsContact OG1-NE1 3.13Å
172	D	69.3	Low	75.5	Confident	113 Å²	113	49.3 Å²	49.3	60%	0.604	26%	0.259	S	S	*	.			trans	-68.8	150.7	177	-67.2	-37.2	0	0	0	111.4	Q170 T174 S175 W176	Q170-D172 PolarHBondContact O-N 3.4Å; D172-T174 WeakPolarHBondContact CB-OG1 3.41Å; D172-T174 PolarHBondContact O-N 2.79Å; D172-T174 VanDerWaalsContact O-N 3.14Å; D172-S175 PolarHBondContact O-N 3.22Å; D172-S175 VanDerWaalsContact O-N 3.08Å; D172-S175 PolarHBondContact O-OG 2.77Å; D172-W176 PolarHBondContact O-N 3.24Å
173	L	68.5	Low	75.2	Confident	53 Å²	53	48.7 Å²	48.7	28%	0.277	26%	0.256	S	S	.	.	H	α-helix	trans	-56.2	-30.7	174.9	-179.3	66.1	0	0	0	112.4	W176 K177 L213	L173-W176 PolarHBondContact O-N 3.16Å; L173-K177 WeakPolarHBondContact O-CG 3.32Å; L173-K177 PolarHBondContact O-N 3.44Å; L173-L213 HydrophobicContact CD1-CD2 4.08Å; L173-L213 HydrophobicContact CD2-CD2 4.27Å
174	T	73.6	Confident	74.7	Confident	83 Å²	83	52 Å²	52	51%	0.509	28%	0.276	S	S	.	.	H	α-helix	trans	-61.8	-46.8	175.9	47.3	0	0	0	0	111.6	D172 W176 K177 E178	D172-T174 WeakPolarHBondContact CB-OG1 3.41Å; D172-T174 PolarHBondContact O-N 2.79Å; D172-T174 VanDerWaalsContact O-N 3.14Å; T174-W176 PolarHBondContact O-N 3.45Å; T174-K177 WeakPolarHBondContact O-CB 3.33Å; T174-K177 PolarHBondContact O-N 3.01Å; T174-K177 VanDerWaalsContact O-N 3.11Å; T174-E178 PolarHBondContact O-N 3.39Å
175	S	74.4	Confident	74.6	Confident	33 Å²	33	57.4 Å²	57.4	23%	0.231	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-41	177.6	66.9	0	0	0	0	112.3	T171 D172 K177 E178 L179	T171-S175 VanDerWaalsContact CG2-OG 3.3Å; T171-S175 WeakPolarHBondContact CG2-OG 3.4Å; D172-S175 PolarHBondContact O-N 3.22Å; D172-S175 VanDerWaalsContact O-N 3.08Å; D172-S175 PolarHBondContact O-OG 2.77Å; S175-K177 VanDerWaalsContact C-N 3.31Å; S175-K177 PolarHBondContact O-N 3.44Å; S175-E178 PolarHBondContact O-N 2.88Å; S175-L179 WeakPolarHBondContact O-CG 3.26Å; S175-L179 PolarHBondContact O-N 3.34Å
176	W	79.1	Confident	74.4	Confident	8 Å²	8	59.2 Å²	59.2	3%	0.03	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-33.8	174	-74.7	109.4	0	0	0	112.9	A165 T171 D172 L173 T174 L179 A180 C195 R198	A165-W176 HydrophobicContact CB-CE3 4.44Å; A165-W176 HydrophobicContact CB-CH2 3.62Å; A165-W176 HydrophobicContact CB-CZ2 3.77Å; A165-W176 HydrophobicContact CB-CZ3 3.99Å; T171-W176 VanDerWaalsContact CB-NE1 3.33Å; T171-W176 PolarHBondContact OG1-NE1 3.32Å; T171-W176 VanDerWaalsContact OG1-NE1 3.13Å; D172-W176 PolarHBondContact O-N 3.24Å; L173-W176 PolarHBondContact O-N 3.16Å; T174-W176 PolarHBondContact O-N 3.45Å; W176-L179 HydrophobicContact CE3-CD1 4.41Å; W176-L179 HydrophobicContact CZ3-CD1 4.49Å; W176-A180 VanDerWaalsContact O-CB 3.28Å; W176-A180 WeakPolarHBondContact O-CB 3.34Å; W176-A180 PolarHBondContact O-N 2.96Å; W176-C195 HydrophobicContact CE3-CB 4.04Å; W176-C195 HydrophobicContact CZ3-CB 4.37Å; W176-R198 HydrophobicContact CD2-CB 4.3Å; W176-R198 HydrophobicContact CE3-CB 4.38Å; W176-R198 HydrophobicContact CH2-CB 3.82Å; W176-R198 VanDerWaalsContact CH2-CD 3.48Å; W176-R198 HydrophobicContact CH2-CG 4.3Å; W176-R198 HydrophobicContact CZ2-CB 3.69Å; W176-R198 HydrophobicContact CZ2-CG 4.4Å; W176-R198 HydrophobicContact CZ3-CB 4.16Å
177	K	69.7	Low	74.3	Confident	83 Å²	83	62.9 Å²	62.9	36%	0.361	33%	0.331	S	S	.	.	H	α-helix	trans	-66.8	-44.6	173.7	-74.9	174.6	-179.7	-176.8	0	111.8	L173 T174 S175 L179 A180 T181 L217	L173-K177 WeakPolarHBondContact O-CG 3.32Å; L173-K177 PolarHBondContact O-N 3.44Å; T174-K177 WeakPolarHBondContact O-CB 3.33Å; T174-K177 PolarHBondContact O-N 3.01Å; T174-K177 VanDerWaalsContact O-N 3.11Å; S175-K177 VanDerWaalsContact C-N 3.31Å; S175-K177 PolarHBondContact O-N 3.44Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 2.91Å; K177-A180 PolarHBondContact O-N 3.39Å; K177-T181 WeakPolarHBondContact O-CG2 3.35Å; K177-T181 PolarHBondContact O-N 3.28Å; K177-T181 PolarHBondContact O-OG1 3.22Å; K177-L217 HydrophobicContact CD-CD2 4.37Å; K177-L217 VanDerWaalsContact CE-CD2 3.41Å; K177-L217 VanDerWaalsContact NZ-CD2 3.34Å
178	E	75.8	Confident	73.9	Confident	112 Å²	112	62.8 Å²	62.8	52%	0.523	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-40.4	179	-71.5	173.9	-164.2	0	0	111.7	T174 S175 T181 L182	T174-E178 PolarHBondContact O-N 3.39Å; S175-E178 PolarHBondContact O-N 2.88Å; E178-T181 WeakPolarHBondContact CA-OG1 3.26Å; E178-T181 PolarHBondContact O-OG1 2.95Å; E178-L182 WeakPolarHBondContact O-CG 3.4Å; E178-L182 PolarHBondContact O-N 2.92Å; E178-L182 VanDerWaalsContact O-N 3.13Å
179	L	80.2	Confident	73	Confident	12 Å²	12	66.2 Å²	66.2	6%	0.063	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-45.8	172.8	-66.2	175	0	0	0	111.2	G161 A165 S175 W176 K177 T181 L182 V183	G161-L179 WeakPolarHBondContact O-CD1 3.43Å; A165-L179 HydrophobicContact CB-CD1 3.45Å; A165-L179 VanDerWaalsContact CB-CD1 3.45Å; S175-L179 WeakPolarHBondContact O-CG 3.26Å; S175-L179 PolarHBondContact O-N 3.34Å; W176-L179 HydrophobicContact CE3-CD1 4.41Å; W176-L179 HydrophobicContact CZ3-CD1 4.49Å; K177-L179 VanDerWaalsContact C-N 3.32Å; K177-L179 PolarHBondContact O-N 2.91Å; L179-T181 VanDerWaalsContact C-N 3.29Å; L179-T181 PolarHBondContact O-N 3.32Å; L179-L182 WeakPolarHBondContact O-CB 3.34Å; L179-L182 PolarHBondContact O-N 3.45Å; L179-L182 VanDerWaalsContact O-N 3.1Å; L179-V183 VanDerWaalsContact O-CG2 3.29Å; L179-V183 WeakPolarHBondContact O-CG2 3.43Å; L179-V183 PolarHBondContact O-N 2.99Å
180	A	73	Confident	72.6	Confident	2 Å²	2	71 Å²	71	2%	0.017	36%	0.357	C	S	.	.	H	α-helix	trans	-60	-39.1	178	0	0	0	0	0	112.3	W176 K177 V183 V184 C195 Y196	W176-A180 VanDerWaalsContact O-CB 3.28Å; W176-A180 WeakPolarHBondContact O-CB 3.34Å; W176-A180 PolarHBondContact O-N 2.96Å; K177-A180 PolarHBondContact O-N 3.39Å; A180-V183 PolarHBondContact O-N 3.38Å; A180-V184 VanDerWaalsContact O-CG2 3.25Å; A180-V184 WeakPolarHBondContact O-CG2 3.13Å; A180-V184 PolarHBondContact O-N 2.97Å; A180-C195 HydrophobicContact CB-CB 4.27Å; A180-Y196 HydrophobicContact CB-CD1 4.36Å; A180-Y196 HydrophobicContact CB-CE1 3.72Å; A180-Y196 HydrophobicContact CB-CE2 4.45Å
181	T	76.5	Confident	72.4	Confident	77 Å²	77	67.3 Å²	67.3	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174	47.7	0	0	0	0	111.8	K177 E178 L179 V183 V184 E185	K177-T181 WeakPolarHBondContact O-CG2 3.35Å; K177-T181 PolarHBondContact O-N 3.28Å; K177-T181 PolarHBondContact O-OG1 3.22Å; E178-T181 WeakPolarHBondContact CA-OG1 3.26Å; E178-T181 PolarHBondContact O-OG1 2.95Å; L179-T181 VanDerWaalsContact C-N 3.29Å; L179-T181 PolarHBondContact O-N 3.32Å; T181-V183 PolarHBondContact O-N 3.01Å; T181-V184 PolarHBondContact O-N 3.23Å; T181-E185 WeakPolarHBondContact O-CG 3.27Å; T181-E185 PolarHBondContact O-N 3.39Å
182	L	80.5	Confident	72.3	Confident	10 Å²	10	67 Å²	67	5%	0.052	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-38.6	175.7	-74.1	171.6	0	0	0	112.3	K149 E178 L179 E185 L186	K149-L182 HydrophobicContact CD-CD1 4.39Å; E178-L182 WeakPolarHBondContact O-CG 3.4Å; E178-L182 PolarHBondContact O-N 2.92Å; E178-L182 VanDerWaalsContact O-N 3.13Å; L179-L182 WeakPolarHBondContact O-CB 3.34Å; L179-L182 PolarHBondContact O-N 3.45Å; L179-L182 VanDerWaalsContact O-N 3.1Å; L182-E185 PolarHBondContact O-N 3.1Å; L182-L186 WeakPolarHBondContact O-CG 3.33Å; L182-L186 PolarHBondContact O-N 3.38Å; L182-L186 VanDerWaalsContact O-N 3.1Å
183	V	76.1	Confident	71.5	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-41.6	177.1	-176.3	0	0	0	0	111.7	L158 L179 A180 T181 E185 L186 N187 Q188 H191 A192	L158-V183 HydrophobicContact CD1-CB 4.42Å; L158-V183 HydrophobicContact CD1-CG2 3.27Å; L158-V183 HydrophobicContact CD2-CB 4.47Å; L158-V183 HydrophobicContact CD2-CG2 3.87Å; L158-V183 HydrophobicContact CG-CG2 4.2Å; L179-V183 VanDerWaalsContact O-CG2 3.29Å; L179-V183 WeakPolarHBondContact O-CG2 3.43Å; L179-V183 PolarHBondContact O-N 2.99Å; A180-V183 PolarHBondContact O-N 3.38Å; T181-V183 PolarHBondContact O-N 3.01Å; V183-E185 VanDerWaalsContact C-N 3.31Å; V183-L186 CarbonylContact O-C 3.58Å; V183-L186 PolarHBondContact O-N 3.37Å; V183-N187 PolarHBondContact O-N 2.79Å; V183-Q188 HydrophobicContact CG1-CB 3.98Å; V183-Q188 WeakPolarHBondContact CG1-O 3.16Å; V183-Q188 PolarHBondContact O-N 3.48Å; V183-H191 HydrophobicContact CG1-CB 3.88Å; V183-H191 HydrophobicContact CG2-CB 4.09Å; V183-A192 HydrophobicContact CB-CB 4.21Å; V183-A192 HydrophobicContact CG1-CB 3.66Å; V183-A192 VanDerWaalsContact CG1-N 3.33Å
184	V	74.3	Confident	71.3	Confident	86 Å²	86	64.2 Å²	64.2	52%	0.521	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-39.7	177.9	170.8	0	0	0	0	110.3	A180 T181 L186 N187	A180-V184 VanDerWaalsContact O-CG2 3.25Å; A180-V184 WeakPolarHBondContact O-CG2 3.13Å; A180-V184 PolarHBondContact O-N 2.97Å; T181-V184 PolarHBondContact O-N 3.23Å; V184-L186 VanDerWaalsContact C-N 3.3Å; V184-L186 PolarHBondContact O-N 3.4Å; V184-N187 PolarHBondContact O-N 3.45Å
185	E	80.2	Confident	71	Confident	115 Å²	115	60.3 Å²	60.3	54%	0.537	30%	0.301	S	S	.	.	H	α-helix	trans	-61.5	-35.6	173.6	-74.4	179.2	-159.6	0	0	113	K154 T181 L182 V183	K154-E185 IonicContact NZ-OE2 3.48Å; K154-E185 PolarHBondContact NZ-OE2 3.44Å; T181-E185 WeakPolarHBondContact O-CG 3.27Å; T181-E185 PolarHBondContact O-N 3.39Å; L182-E185 PolarHBondContact O-N 3.1Å; V183-E185 VanDerWaalsContact C-N 3.31Å
186	L	79	Confident	70.4	Confident	43 Å²	43	62.7 Å²	62.7	23%	0.225	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1	178.9	-68.5	172.7	0	0	0	114.2	K154 E155 L158 L182 V183 V184 Q188	K154-L186 HydrophobicContact CB-CD1 4.15Å; K154-L186 HydrophobicContact CB-CD2 3.93Å; K154-L186 HydrophobicContact CB-CG 4.34Å; E155-L186 HydrophobicContact CG-CD1 4.2Å; E155-L186 HydrophobicContact CG-CD2 3.99Å; L158-L186 HydrophobicContact CB-CD1 3.99Å; L158-L186 HydrophobicContact CD2-CD1 3.84Å; L182-L186 WeakPolarHBondContact O-CG 3.33Å; L182-L186 PolarHBondContact O-N 3.38Å; L182-L186 VanDerWaalsContact O-N 3.1Å; V183-L186 CarbonylContact O-C 3.58Å; V183-L186 PolarHBondContact O-N 3.37Å; V184-L186 VanDerWaalsContact C-N 3.3Å; V184-L186 PolarHBondContact O-N 3.4Å; L186-Q188 HydrophobicContact CB-CG 4.39Å; L186-Q188 PolarHBondContact O-N 3.16Å; L186-Q188 VanDerWaalsContact O-N 3.12Å
187	N	72.6	Confident	69.4	Low	125 Å²	125	66.7 Å²	66.7	67%	0.668	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	23.2	179.5	-156.4	24.2	0	0	0	115.1	V183 V184 L189	V183-N187 PolarHBondContact O-N 2.79Å; V184-N187 PolarHBondContact O-N 3.45Å; N187-L189 PolarHBondContact O-N 3.21Å; N187-L189 VanDerWaalsContact O-N 3.12Å
188	Q	70.4	Confident	69.3	Low	60 Å²	60	65.2 Å²	65.2	28%	0.28	32%	0.317	S	S	.	.			trans	-88.1	74.3	178.4	-64.6	-174.8	-0.7	0	0	111.3	V183 L186 R190 H191 A192	V183-Q188 HydrophobicContact CG1-CB 3.98Å; V183-Q188 WeakPolarHBondContact CG1-O 3.16Å; V183-Q188 PolarHBondContact O-N 3.48Å; L186-Q188 HydrophobicContact CB-CG 4.39Å; L186-Q188 PolarHBondContact O-N 3.16Å; L186-Q188 VanDerWaalsContact O-N 3.12Å; Q188-R190 PolarHBondContact O-N 3.01Å; Q188-H191 HydrophobicContact CB-CB 4.49Å; Q188-H191 PolarHBondContact O-N 3.2Å; Q188-H191 PolarHBondContact OE1-ND1 3.39Å; Q188-A192 PolarHBondContact O-N 3.29Å
189	L	58.3	Low	68.7	Low	108 Å²	108	60.1 Å²	60.1	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-53.1	-34.4	-171.5	-61.7	173.8	0	0	0	114.5	N187 A192 L193	N187-L189 PolarHBondContact O-N 3.21Å; N187-L189 VanDerWaalsContact O-N 3.12Å; L189-A192 WeakPolarHBondContact O-CB 3.16Å; L189-A192 PolarHBondContact O-N 3Å; L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 3.5Å; L189-L193 VanDerWaalsContact O-N 3.12Å
190	R	57.9	Low	67.4	Low	214 Å²	214	61.9 Å²	61.9	81%	0.808	30%	0.303	S	S	*	.	H	α-helix	trans	-64.3	-42.4	178.7	-70	-175.7	179.6	174.8	0.7	112.8	Q188 A192 L193 T194	Q188-R190 PolarHBondContact O-N 3.01Å; R190-A192 VanDerWaalsContact C-N 3.29Å; R190-L193 WeakPolarHBondContact O-CB 3.46Å; R190-L193 PolarHBondContact O-N 3.48Å; R190-T194 PolarHBondContact O-N 3.28Å
191	H	64.9	Low	66.8	Low	63 Å²	63	65.6 Å²	65.6	29%	0.292	33%	0.334	S	S	.	.	H	α-helix	trans	-70.6	-28.6	176.3	-64.8	116.2	0	0	0	111.6	L162 V183 Q188 L193 T194 C195	L162-H191 HydrophobicContact CD1-CB 4.18Å; V183-H191 HydrophobicContact CG1-CB 3.88Å; V183-H191 HydrophobicContact CG2-CB 4.09Å; Q188-H191 HydrophobicContact CB-CB 4.49Å; Q188-H191 PolarHBondContact O-N 3.2Å; Q188-H191 PolarHBondContact OE1-ND1 3.39Å; H191-L193 VanDerWaalsContact C-N 3.31Å; H191-T194 PolarHBondContact O-N 2.87Å; H191-T194 PolarHBondContact O-OG1 3.12Å; H191-C195 PolarHBondContact O-N 3.15Å; H191-C195 PolarHBondContact O-SG 2.9Å
192	A	63.2	Low	65.9	Low	8 Å²	8	65.7 Å²	65.7	7%	0.066	33%	0.334	C	S	.	.	H	α-helix	trans	-66.7	-42.6	177.4	0	0	0	0	0	109.1	V183 Q188 L189 R190 T194 C195 Y196	V183-A192 HydrophobicContact CB-CB 4.21Å; V183-A192 HydrophobicContact CG1-CB 3.66Å; V183-A192 VanDerWaalsContact CG1-N 3.33Å; Q188-A192 PolarHBondContact O-N 3.29Å; L189-A192 WeakPolarHBondContact O-CB 3.16Å; L189-A192 PolarHBondContact O-N 3Å; R190-A192 VanDerWaalsContact C-N 3.29Å; A192-T194 PolarHBondContact O-N 3.41Å; A192-C195 PolarHBondContact O-N 2.68Å; A192-Y196 HydrophobicContact CB-CD2 4.36Å; A192-Y196 HydrophobicContact CB-CE2 4.13Å; A192-Y196 WeakPolarHBondContact O-CD2 3.44Å; A192-Y196 PolarHBondContact O-N 3.3Å
193	L	53.9	Low	64.4	Low	56 Å²	56	67.4 Å²	67.4	29%	0.293	35%	0.347	S	S	.	.	H	α-helix	trans	-58.5	-46.6	175.3	-65.8	172.7	0	0	0	112	L189 R190 H191 C195 Y196 E197 L231	L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 3.5Å; L189-L193 VanDerWaalsContact O-N 3.12Å; R190-L193 WeakPolarHBondContact O-CB 3.46Å; R190-L193 PolarHBondContact O-N 3.48Å; H191-L193 VanDerWaalsContact C-N 3.31Å; L193-C195 PolarHBondContact O-N 3.39Å; L193-Y196 PolarHBondContact O-N 3.11Å; L193-E197 WeakPolarHBondContact O-CB 3.29Å; L193-E197 VanDerWaalsContact O-CG 3.32Å; L193-E197 WeakPolarHBondContact O-CG 3.31Å; L193-E197 PolarHBondContact O-N 3.21Å; L193-L231 HydrophobicContact CD1-CD2 3.94Å; L193-L231 HydrophobicContact CD2-CD1 3.45Å; L193-L231 VanDerWaalsContact CD2-CD1 3.45Å; L193-L231 HydrophobicContact CD2-CD2 3.92Å; L193-L231 HydrophobicContact CD2-CG 4.18Å
194	T	64.7	Low	62.5	Low	50 Å²	50	69.7 Å²	69.7	31%	0.307	36%	0.362	S	S	.	.	H	α-helix	trans	-66.8	-36.8	179.4	57.8	0	0	0	0	112.4	R190 H191 A192 E197 R198	R190-T194 PolarHBondContact O-N 3.28Å; H191-T194 PolarHBondContact O-N 2.87Å; H191-T194 PolarHBondContact O-OG1 3.12Å; A192-T194 PolarHBondContact O-N 3.41Å; T194-E197 PolarHBondContact O-N 3.07Å; T194-R198 PolarHBondContact O-N 3.13Å
195	C	66.5	Low	61.1	Low	1 Å²	1	72.2 Å²	72.2	1%	0.007	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-46.1	173.4	-69	0	0	0	0	111.8	L162 W176 A180 H191 A192 L193 G199	L162-C195 WeakPolarHBondContact CD2-SG 3.02Å; W176-C195 HydrophobicContact CE3-CB 4.04Å; W176-C195 HydrophobicContact CZ3-CB 4.37Å; A180-C195 HydrophobicContact CB-CB 4.27Å; H191-C195 PolarHBondContact O-N 3.15Å; H191-C195 PolarHBondContact O-SG 2.9Å; A192-C195 PolarHBondContact O-N 2.68Å; L193-C195 PolarHBondContact O-N 3.39Å; C195-G199 PolarHBondContact O-N 3.45Å
196	Y	61	Low	59.2	Low	83 Å²	83	68.6 Å²	68.6	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-67	-45.8	176.7	-69.1	-54.9	0	0	0	111	A180 A192 L193 R198 G199 I200	A180-Y196 HydrophobicContact CB-CD1 4.36Å; A180-Y196 HydrophobicContact CB-CE1 3.72Å; A180-Y196 HydrophobicContact CB-CE2 4.45Å; A192-Y196 HydrophobicContact CB-CD2 4.36Å; A192-Y196 HydrophobicContact CB-CE2 4.13Å; A192-Y196 WeakPolarHBondContact O-CD2 3.44Å; A192-Y196 PolarHBondContact O-N 3.3Å; L193-Y196 PolarHBondContact O-N 3.11Å; Y196-R198 VanDerWaalsContact C-N 3.29Å; Y196-R198 PolarHBondContact O-N 3.45Å; Y196-G199 PolarHBondContact O-N 3.09Å; Y196-I200 WeakPolarHBondContact O-CB 3.4Å; Y196-I200 VanDerWaalsContact O-CD1 3.26Å; Y196-I200 WeakPolarHBondContact O-CD1 3.48Å; Y196-I200 WeakPolarHBondContact O-CG1 3.35Å; Y196-I200 PolarHBondContact O-N 3.04Å
197	E	59.7	Low	57.5	Low	93 Å²	93	71 Å²	71	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-54.5	-43.1	176.8	-80.1	-174.4	-175.7	0	0	112.6	R37 L193 T194 I200 A201	R37-E197 IonicContact NH1-OE2 3.25Å; R37-E197 IonicContact NH2-OE2 2.74Å; L193-E197 WeakPolarHBondContact O-CB 3.29Å; L193-E197 VanDerWaalsContact O-CG 3.32Å; L193-E197 WeakPolarHBondContact O-CG 3.31Å; L193-E197 PolarHBondContact O-N 3.21Å; T194-E197 PolarHBondContact O-N 3.07Å; E197-I200 WeakPolarHBondContact O-CB 3.24Å; E197-A201 PolarHBondContact O-N 3.28Å; E197-A201 VanDerWaalsContact O-N 3.13Å
198	R	65.7	Low	56.1	Low	51 Å²	51	68.8 Å²	68.8	19%	0.192	37%	0.371	C	S	.	.	H	α-helix	trans	-77.7	-37.5	178.6	-73.7	-171.5	174.3	147.5	-5.1	113	Y33 M166 W176 T194 Y196 I200 A201 V202	Y33-R198 PolarHBondContact OH-NH2 3.19Å; M166-R198 PolarHBondContact SD-NH1 2.84Å; W176-R198 HydrophobicContact CD2-CB 4.3Å; W176-R198 HydrophobicContact CE3-CB 4.38Å; W176-R198 HydrophobicContact CH2-CB 3.82Å; W176-R198 VanDerWaalsContact CH2-CD 3.48Å; W176-R198 HydrophobicContact CH2-CG 4.3Å; W176-R198 HydrophobicContact CZ2-CB 3.69Å; W176-R198 HydrophobicContact CZ2-CG 4.4Å; W176-R198 HydrophobicContact CZ3-CB 4.16Å; T194-R198 PolarHBondContact O-N 3.13Å; Y196-R198 VanDerWaalsContact C-N 3.29Å; Y196-R198 PolarHBondContact O-N 3.45Å; R198-I200 PolarHBondContact O-N 3.28Å; R198-A201 PolarHBondContact O-N 3.28Å; R198-A201 VanDerWaalsContact O-N 3.12Å; R198-V202 WeakPolarHBondContact O-CG2 3.27Å; R198-V202 PolarHBondContact O-N 3.13Å; R198-V202 VanDerWaalsContact O-N 3.08Å
199	G	63.4	Low	54.7	Low	5 Å²	5	69.1 Å²	69.1	5%	0.052	38%	0.375	C	S	.	.	H	α-helix	trans	-57.5	-38.6	169.8	0	0	0	0	0	112	C195 Y196 V202 S203	C195-G199 PolarHBondContact O-N 3.45Å; Y196-G199 PolarHBondContact O-N 3.09Å; G199-V202 PolarHBondContact O-N 3.02Å; G199-S203 PolarHBondContact O-N 3.16Å; G199-S203 PolarHBondContact O-OG 3.22Å
200	I	52.9	Low	54	Low	50 Å²	50	64.1 Å²	64.1	26%	0.256	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-43.3	174.8	-68.4	162.2	0	0	0	111	Y196 E197 R198 V202 S203 C204	Y196-I200 WeakPolarHBondContact O-CB 3.4Å; Y196-I200 VanDerWaalsContact O-CD1 3.26Å; Y196-I200 WeakPolarHBondContact O-CD1 3.48Å; Y196-I200 WeakPolarHBondContact O-CG1 3.35Å; Y196-I200 PolarHBondContact O-N 3.04Å; E197-I200 WeakPolarHBondContact O-CB 3.24Å; R198-I200 PolarHBondContact O-N 3.28Å; I200-V202 VanDerWaalsContact C-N 3.34Å; I200-V202 PolarHBondContact O-N 2.78Å; I200-S203 PolarHBondContact O-N 3.28Å; I200-S203 PolarHBondContact O-OG 3.22Å; I200-C204 PolarHBondContact O-N 3.21Å
201	A	60.6	Low	53.4	Low	79 Å²	79	56.2 Å²	56.2	65%	0.653	32%	0.323	S	S	*	.	H	α-helix	trans	-67.7	-29.4	179.7	0	0	0	0	0	113.8	E197 R198	E197-A201 PolarHBondContact O-N 3.28Å; E197-A201 VanDerWaalsContact O-N 3.13Å; R198-A201 PolarHBondContact O-N 3.28Å; R198-A201 VanDerWaalsContact O-N 3.12Å
202	V	59.2	Low	52.7	Low	79 Å²	79	55.6 Å²	55.6	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-75	-33.3	175.5	175.7	0	0	0	0	111.4	R198 G199 I200	R198-V202 WeakPolarHBondContact O-CG2 3.27Å; R198-V202 PolarHBondContact O-N 3.13Å; R198-V202 VanDerWaalsContact O-N 3.08Å; G199-V202 PolarHBondContact O-N 3.02Å; I200-V202 VanDerWaalsContact C-N 3.34Å; I200-V202 PolarHBondContact O-N 2.78Å
203	S	47.4	Very low	51.8	Low	46 Å²	46	57 Å²	57	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-89.2	-36.3	-172.4	65.8	0	0	0	0	115.6	G199 I200	G199-S203 PolarHBondContact O-N 3.16Å; G199-S203 PolarHBondContact O-OG 3.22Å; I200-S203 PolarHBondContact O-N 3.28Å; I200-S203 PolarHBondContact O-OG 3.22Å
204	C	36.7	Very low	51.5	Low	48 Å²	48	55.9 Å²	55.9	32%	0.324	33%	0.33	S	S	.	.			trans	-153.5	138.5	-168.2	-61.3	0	0	0	0	113.9	I200 S206 D209	I200-C204 PolarHBondContact O-N 3.21Å; C204-S206 PolarHBondContact O-N 3.2Å; C204-D209 HydrophobicContact CB-CB 3.39Å
205	D	44.7	Very low	50.9	Low	140 Å²	140	54.5 Å²	54.5	75%	0.749	32%	0.321	S	S	*	.	S	Bend	trans	-69.5	8.9	179.8	-72.5	-53.7	0	0	0	114.9	K88	K88-D205 IonicContact NZ-OD1 2.71Å; K88-D205 PolarHBondContact NZ-OD1 3.31Å; K88-D205 IonicContact NZ-OD2 2.95Å; K88-D205 PolarHBondContact NZ-OD2 3.38Å
206	S	40.8	Very low	50.1	Low	38 Å²	38	61.5 Å²	61.5	27%	0.266	35%	0.351	S	S	.	.	S	Bend	trans	-143.3	135.8	-176.2	90	0	0	0	0	113.6	C204 S208 D209	C204-S206 PolarHBondContact O-N 3.2Å; S206-S208 WeakPolarHBondContact CB-OG 3.46Å; S206-S208 PolarHBondContact O-N 3.05Å; S206-S208 VanDerWaalsContact O-N 3.11Å; S206-S208 PolarHBondContact OG-OG 3.27Å; S206-D209 PolarHBondContact O-N 2.88Å; S206-D209 PolarHBondContact OG-OD2 3.34Å
207	V	42.2	Very low	49.6	Very low	95 Å²	95	61.5 Å²	61.5	58%	0.576	36%	0.356	S	S	*	.	H	α-helix	trans	-59.2	-22.9	176.6	179.3	0	0	0	0	112.1	D209	V207-D209 VanDerWaalsContact C-N 3.34Å
208	S	43.8	Very low	49.4	Very low	78 Å²	78	60.7 Å²	60.7	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-65.6	-32.7	174.3	23.1	0	0	0	0	113.5	S206 C212	S206-S208 WeakPolarHBondContact CB-OG 3.46Å; S206-S208 PolarHBondContact O-N 3.05Å; S206-S208 VanDerWaalsContact O-N 3.11Å; S206-S208 PolarHBondContact OG-OG 3.27Å; S208-C212 PolarHBondContact O-N 3.32Å
209	D	40.7	Very low	48.8	Very low	67 Å²	67	65.5 Å²	65.5	36%	0.358	37%	0.374	S	S	.	.	H	α-helix	trans	-81.8	-27.6	-175.4	-64.2	-36.1	0	0	0	112.4	C204 S206 V207 C212 L213	C204-D209 HydrophobicContact CB-CB 3.39Å; S206-D209 PolarHBondContact O-N 2.88Å; S206-D209 PolarHBondContact OG-OD2 3.34Å; V207-D209 VanDerWaalsContact C-N 3.34Å; D209-C212 CarbonylContact O-C 3.31Å; D209-C212 WeakPolarHBondContact O-CA 3.12Å; D209-C212 WeakPolarHBondContact O-CB 3.31Å; D209-C212 PolarHBondContact O-N 3.19Å; D209-C212 VanDerWaalsContact O-N 3.16Å; D209-L213 PolarHBondContact O-N 3.12Å
210	G	43.1	Very low	48.4	Very low	3 Å²	3	70.3 Å²	70.3	3%	0.031	39%	0.393	C	S	.	.	H	α-helix	trans	-66.3	-37.6	175.9	0	0	0	0	0	113.8	C212 L213 A214	G210-C212 VanDerWaalsContact C-N 3.32Å; G210-L213 PolarHBondContact O-N 3.15Å; G210-A214 PolarHBondContact O-N 3.3Å
211	I	47.2	Very low	48.9	Very low	48 Å²	48	71 Å²	71	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-66.4	-38.7	171.6	-59.5	171.2	0	0	0	109.7	L213 V215	I211-L213 VanDerWaalsContact C-N 3.34Å; I211-L213 PolarHBondContact O-N 3.44Å; I211-V215 WeakPolarHBondContact O-CB 3.26Å; I211-V215 WeakPolarHBondContact O-CG2 3.46Å; I211-V215 PolarHBondContact O-N 3.19Å; I211-V215 VanDerWaalsContact O-N 3.09Å
212	C	48.3	Very low	49.2	Very low	50 Å²	50	70.1 Å²	70.1	34%	0.338	38%	0.379	S	S	.	.	H	α-helix	trans	-66.4	-31	173.6	-88.9	0	0	0	0	113.2	S208 D209 G210 K216	S208-C212 PolarHBondContact O-N 3.32Å; D209-C212 CarbonylContact O-C 3.31Å; D209-C212 WeakPolarHBondContact O-CA 3.12Å; D209-C212 WeakPolarHBondContact O-CB 3.31Å; D209-C212 PolarHBondContact O-N 3.19Å; D209-C212 VanDerWaalsContact O-N 3.16Å; G210-C212 VanDerWaalsContact C-N 3.32Å; C212-K216 WeakPolarHBondContact O-CB 3.42Å; C212-K216 WeakPolarHBondContact O-CG 3.48Å; C212-K216 PolarHBondContact O-N 2.78Å
213	L	45.8	Very low	49.4	Very low	38 Å²	38	69.5 Å²	69.5	20%	0.199	38%	0.378	C	S	.	.	H	α-helix	trans	-78.8	-39.4	178.8	-159.2	76.8	0	0	0	112.1	L173 D209 G210 I211 V215 K216 L217	L173-L213 HydrophobicContact CD1-CD2 4.08Å; L173-L213 HydrophobicContact CD2-CD2 4.27Å; D209-L213 PolarHBondContact O-N 3.12Å; G210-L213 PolarHBondContact O-N 3.15Å; I211-L213 VanDerWaalsContact C-N 3.34Å; I211-L213 PolarHBondContact O-N 3.44Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 3.46Å; L213-K216 PolarHBondContact O-N 3.13Å; L213-K216 VanDerWaalsContact O-N 3.13Å; L213-L217 HydrophobicContact CG-CD1 4.25Å; L213-L217 WeakPolarHBondContact O-CG 3.23Å; L213-L217 PolarHBondContact O-N 2.9Å
214	A	47.4	Very low	50	Low	32 Å²	32	69.3 Å²	69.3	26%	0.264	37%	0.373	S	S	.	.	H	α-helix	trans	-61.7	-39.7	171.7	0	0	0	0	0	111.6	G210 L217	G210-A214 PolarHBondContact O-N 3.3Å; A214-L217 PolarHBondContact O-N 3.23Å
215	V	50.8	Low	51.3	Low	21 Å²	21	67.5 Å²	67.5	13%	0.127	36%	0.359	C	S	.	.	H	α-helix	trans	-68.8	-30.6	173.1	170.9	0	0	0	0	112.4	I211 L213 R219 Y225 E251	I211-V215 WeakPolarHBondContact O-CB 3.26Å; I211-V215 WeakPolarHBondContact O-CG2 3.46Å; I211-V215 PolarHBondContact O-N 3.19Å; I211-V215 VanDerWaalsContact O-N 3.09Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 3.46Å; V215-R219 VanDerWaalsContact O-CG 3.31Å; V215-R219 WeakPolarHBondContact O-CG 3.39Å; V215-Y225 HydrophobicContact CG2-CE1 4.02Å; V215-E251 HydrophobicContact CG1-CG 4.1Å
216	K	51.4	Low	52.3	Low	147 Å²	147	62.8 Å²	62.8	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-74.4	-28.9	176.1	-85.2	172.9	180	178.7	0	113.7	C212 L213	C212-K216 WeakPolarHBondContact O-CB 3.42Å; C212-K216 WeakPolarHBondContact O-CG 3.48Å; C212-K216 PolarHBondContact O-N 2.78Å; L213-K216 PolarHBondContact O-N 3.13Å; L213-K216 VanDerWaalsContact O-N 3.13Å
217	L	49.7	Very low	53.1	Low	83 Å²	83	63.2 Å²	63.2	44%	0.435	34%	0.338	S	S	.	.	H	α-helix	trans	-85.1	-25.3	-171.8	-73.2	167.1	0	0	0	113.5	K177 L213 A214	K177-L217 HydrophobicContact CD-CD2 4.37Å; K177-L217 VanDerWaalsContact CE-CD2 3.41Å; K177-L217 VanDerWaalsContact NZ-CD2 3.34Å; L213-L217 HydrophobicContact CG-CD1 4.25Å; L213-L217 WeakPolarHBondContact O-CG 3.23Å; L213-L217 PolarHBondContact O-N 2.9Å; A214-L217 PolarHBondContact O-N 3.23Å
218	D	54.6	Low	54	Low	77 Å²	77	59.8 Å²	59.8	41%	0.412	32%	0.316	S	S	.	.			trans	-154.5	86.3	170.2	-150.1	-0.7	0	0	0	112.2	K220 N221 L224	D218-K220 PolarHBondContact O-N 3.28Å; D218-N221 PolarHBondContact O-N 3.26Å; D218-L224 HydrophobicContact CB-CD1 4.03Å
219	R	53.3	Low	55.3	Low	152 Å²	152	57.2 Å²	57.2	57%	0.574	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-12.6	-175	-73.7	-174.9	177.7	176.9	-2.8	114.6	V215 E251	V215-R219 VanDerWaalsContact O-CG 3.31Å; V215-R219 WeakPolarHBondContact O-CG 3.39Å; R219-E251 IonicContact NE-OE2 3.96Å
220	K	55.6	Low	56.4	Low	105 Å²	105	60.5 Å²	60.5	46%	0.457	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-10.9	-168.1	-62.4	-175.4	177.7	-174.9	0	114.6	D218 F222 D257	D218-K220 PolarHBondContact O-N 3.28Å; K220-F222 PolarHBondContact O-N 3.49Å; K220-D257 WeakPolarHBondContact CB-OD2 3.5Å
221	N	62.9	Low	56.8	Low	64 Å²	64	63 Å²	63	34%	0.342	32%	0.321	S	S	.	.			trans	-92.9	101.2	-169.3	-158	-19	0	0	0	112.4	D218 S223 L224	D218-N221 PolarHBondContact O-N 3.26Å; N221-S223 VanDerWaalsContact CG-OG 3.31Å; N221-S223 PolarHBondContact O-N 3.22Å; N221-S223 WeakPolarHBondContact OD1-CB 3.16Å; N221-S223 PolarHBondContact OD1-N 2.91Å; N221-S223 PolarHBondContact OD1-OG 3.08Å; N221-L224 HydrophobicContact CB-CD1 3.9Å; N221-L224 HydrophobicContact CB-CG 4.25Å; N221-L224 PolarHBondContact O-N 3.2Å
222	F	67.2	Low	57.5	Low	62 Å²	62	61.3 Å²	61.3	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-29.3	177.9	-176.2	-109.3	0	0	0	113.1	K220 L224 Y225 C226 L252 L258 F266	K220-F222 PolarHBondContact O-N 3.49Å; F222-L224 VanDerWaalsContact C-N 3.29Å; F222-L224 PolarHBondContact O-N 2.73Å; F222-Y225 WeakPolarHBondContact O-CB 3.43Å; F222-Y225 PolarHBondContact O-N 2.77Å; F222-Y225 VanDerWaalsContact O-N 3.08Å; F222-C226 WeakPolarHBondContact CE1-SG 3.32Å; F222-C226 PolarHBondContact O-N 2.74Å; F222-C226 VanDerWaalsContact O-N 3.07Å; F222-L252 HydrophobicContact CD2-CD1 3.7Å; F222-L252 HydrophobicContact CE2-CD1 4.27Å; F222-L258 HydrophobicContact CB-CD1 4.4Å; F222-L258 HydrophobicContact CD1-CD1 4.35Å; F222-L258 HydrophobicContact CD2-CD2 4.42Å; F222-L258 HydrophobicContact CG-CD1 4.24Å; F222-F266 HydrophobicContact CE2-CD1 4.5Å; F222-F266 HydrophobicContact CE2-CD2 4.21Å; F222-F266 HydrophobicContact CE2-CE2 4.26Å; F222-F266 HydrophobicContact CE2-CG 4.33Å; F222-F266 HydrophobicContact CE2-CZ 4.43Å; F222-F266 HydrophobicContact CZ-CD2 4.31Å
223	S	63.3	Low	58.3	Low	65 Å²	65	61.5 Å²	61.5	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-35.6	179.9	68.5	0	0	0	0	112.8	N221 C226 T227	N221-S223 VanDerWaalsContact CG-OG 3.31Å; N221-S223 PolarHBondContact O-N 3.22Å; N221-S223 WeakPolarHBondContact OD1-CB 3.16Å; N221-S223 PolarHBondContact OD1-N 2.91Å; N221-S223 PolarHBondContact OD1-OG 3.08Å; S223-C226 PolarHBondContact O-N 3.45Å; S223-T227 PolarHBondContact O-N 3.38Å; S223-T227 VanDerWaalsContact O-N 3.15Å
224	L	60	Low	59	Low	43 Å²	43	64.1 Å²	64.1	23%	0.225	34%	0.339	C	S	.	.	H	α-helix	trans	-65.6	-37.8	174	-69	169.9	0	0	0	111.5	D218 N221 F222 T227 I228	D218-L224 HydrophobicContact CB-CD1 4.03Å; N221-L224 HydrophobicContact CB-CD1 3.9Å; N221-L224 HydrophobicContact CB-CG 4.25Å; N221-L224 PolarHBondContact O-N 3.2Å; F222-L224 VanDerWaalsContact C-N 3.29Å; F222-L224 PolarHBondContact O-N 2.73Å; L224-T227 PolarHBondContact O-OG1 3.21Å; L224-I228 WeakPolarHBondContact O-CB 3.41Å; L224-I228 WeakPolarHBondContact O-CD1 3.23Å; L224-I228 WeakPolarHBondContact O-CG1 3.47Å; L224-I228 PolarHBondContact O-N 2.85Å; L224-I228 VanDerWaalsContact O-N 3.07Å
225	Y	64.3	Low	59.4	Low	9 Å²	9	67.2 Å²	67.2	4%	0.035	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-39.6	175.5	-76.9	-77.7	0	0	0	111.9	V215 F222 T227 I228 F229 A248 E251 L252	V215-Y225 HydrophobicContact CG2-CE1 4.02Å; F222-Y225 WeakPolarHBondContact O-CB 3.43Å; F222-Y225 PolarHBondContact O-N 2.77Å; F222-Y225 VanDerWaalsContact O-N 3.08Å; Y225-T227 PolarHBondContact O-N 2.94Å; Y225-I228 PolarHBondContact O-N 2.89Å; Y225-F229 HydrophobicContact CD1-CE1 4.43Å; Y225-F229 HydrophobicContact CD1-CZ 4.28Å; Y225-F229 HydrophobicContact CG-CZ 4.47Å; Y225-F229 VanDerWaalsContact O-CD1 3.29Å; Y225-F229 WeakPolarHBondContact O-CD1 3.28Å; Y225-F229 WeakPolarHBondContact O-CD2 3.38Å; Y225-F229 WeakPolarHBondContact O-CG 3.29Å; Y225-F229 PolarHBondContact O-N 3.33Å; Y225-A248 HydrophobicContact CD1-CB 3.35Å; Y225-A248 HydrophobicContact CD2-CB 4.47Å; Y225-A248 HydrophobicContact CE1-CB 3.56Å; Y225-A248 HydrophobicContact CG-CB 3.84Å; Y225-E251 WeakPolarHBondContact OH-CB 3.34Å; Y225-L252 HydrophobicContact CD2-CD1 4.36Å; Y225-L252 HydrophobicContact CD2-CD2 4.43Å; Y225-L252 HydrophobicContact CE2-CD2 4.31Å; Y225-L252 HydrophobicContact CE2-CG 4.32Å
226	C	65.7	Low	59.7	Low	42 Å²	42	69.1 Å²	69.1	28%	0.284	37%	0.374	S	S	.	.	H	α-helix	trans	-60.3	-44.3	175.8	-69.9	0	0	0	0	112.6	F222 S223 F229 Q230	F222-C226 WeakPolarHBondContact CE1-SG 3.32Å; F222-C226 PolarHBondContact O-N 2.74Å; F222-C226 VanDerWaalsContact O-N 3.07Å; S223-C226 PolarHBondContact O-N 3.45Å; C226-F229 PolarHBondContact O-N 3.08Å; C226-Q230 WeakPolarHBondContact O-CG 3.5Å; C226-Q230 PolarHBondContact O-N 3.4Å
227	T	57.2	Low	60.3	Low	46 Å²	46	67 Å²	67	28%	0.282	36%	0.362	S	S	.	.	H	α-helix	trans	-66.4	-39.3	177.1	57.7	0	0	0	0	111.1	S223 L224 Y225 F229 Q230 L231	S223-T227 PolarHBondContact O-N 3.38Å; S223-T227 VanDerWaalsContact O-N 3.15Å; L224-T227 PolarHBondContact O-OG1 3.21Å; Y225-T227 PolarHBondContact O-N 2.94Å; T227-F229 VanDerWaalsContact C-N 3.31Å; T227-F229 PolarHBondContact O-N 3.13Å; T227-Q230 PolarHBondContact O-N 3.29Å; T227-L231 WeakPolarHBondContact O-CB 3.16Å; T227-L231 VanDerWaalsContact O-CG 3.23Å; T227-L231 WeakPolarHBondContact O-CG 3.39Å; T227-L231 PolarHBondContact O-N 3.26Å
228	I	62.1	Low	60.9	Low	23 Å²	23	68.5 Å²	68.5	12%	0.118	37%	0.369	C	S	.	.	H	α-helix	trans	-60.7	-37.9	173.2	-68.6	164.8	0	0	0	111.8	L224 Y225 N232 A244	L224-I228 WeakPolarHBondContact O-CB 3.41Å; L224-I228 WeakPolarHBondContact O-CD1 3.23Å; L224-I228 WeakPolarHBondContact O-CG1 3.47Å; L224-I228 PolarHBondContact O-N 2.85Å; L224-I228 VanDerWaalsContact O-N 3.07Å; Y225-I228 PolarHBondContact O-N 2.89Å; I228-N232 PolarHBondContact O-N 3.46Å; I228-N232 VanDerWaalsContact O-N 3.07Å; I228-N232 PolarHBondContact O-ND2 2.75Å; I228-A244 HydrophobicContact CG2-CB 4.28Å
229	F	69.9	Low	61.5	Low	25 Å²	25	70.1 Å²	70.1	11%	0.11	38%	0.377	C	S	.	.	H	α-helix	trans	-67.9	-44.6	176.9	-56.3	-28.3	0	0	0	111.7	Y225 C226 T227 L231 N232 A233 A244 Q245 A248 F266	Y225-F229 HydrophobicContact CD1-CE1 4.43Å; Y225-F229 HydrophobicContact CD1-CZ 4.28Å; Y225-F229 HydrophobicContact CG-CZ 4.47Å; Y225-F229 VanDerWaalsContact O-CD1 3.29Å; Y225-F229 WeakPolarHBondContact O-CD1 3.28Å; Y225-F229 WeakPolarHBondContact O-CD2 3.38Å; Y225-F229 WeakPolarHBondContact O-CG 3.29Å; Y225-F229 PolarHBondContact O-N 3.33Å; C226-F229 PolarHBondContact O-N 3.08Å; T227-F229 VanDerWaalsContact C-N 3.31Å; T227-F229 PolarHBondContact O-N 3.13Å; F229-L231 VanDerWaalsContact C-N 3.33Å; F229-L231 PolarHBondContact O-N 3.17Å; F229-N232 PolarHBondContact O-N 3.42Å; F229-A233 WeakPolarHBondContact O-CB 3.44Å; F229-A233 PolarHBondContact O-N 3.35Å; F229-A244 HydrophobicContact CD1-CB 4.19Å; F229-A244 HydrophobicContact CE1-CB 4.03Å; F229-Q245 HydrophobicContact CD1-CG 3.89Å; F229-Q245 HydrophobicContact CD2-CG 4.47Å; F229-Q245 HydrophobicContact CE1-CB 4.31Å; F229-Q245 HydrophobicContact CE1-CG 3.65Å; F229-Q245 HydrophobicContact CE2-CG 4.26Å; F229-Q245 HydrophobicContact CG-CG 4.32Å; F229-Q245 HydrophobicContact CZ-CB 4.45Å; F229-Q245 HydrophobicContact CZ-CG 3.85Å; F229-A248 HydrophobicContact CE1-CB 4.43Å; F229-A248 HydrophobicContact CZ-CB 3.8Å; F229-F266 AromaticContact CE2-CE2 3.96Å; F229-F266 HydrophobicContact CE2-CE2 3.96Å; F229-F266 AromaticContact CE2-CZ 3.92Å; F229-F266 HydrophobicContact CE2-CZ 3.92Å; F229-F266 HydrophobicContact CZ-CE2 4.41Å; F229-F266 AromaticContact CZ-CZ 3.92Å; F229-F266 HydrophobicContact CZ-CZ 3.92Å
230	Q	64.1	Low	62.3	Low	136 Å²	136	67.7 Å²	67.7	64%	0.636	37%	0.371	S	S	*	.	H	α-helix	trans	-61.4	-41.6	177.1	-72.5	175.7	-11.6	0	0	111.5	C226 T227 A233 S234	C226-Q230 WeakPolarHBondContact O-CG 3.5Å; C226-Q230 PolarHBondContact O-N 3.4Å; T227-Q230 PolarHBondContact O-N 3.29Å; Q230-A233 PolarHBondContact O-N 3.15Å; Q230-S234 WeakPolarHBondContact O-CB 3.39Å; Q230-S234 PolarHBondContact O-N 2.99Å; Q230-S234 PolarHBondContact O-OG 3.2Å
231	L	52.1	Low	63.1	Low	56 Å²	56	63.1 Å²	63.1	29%	0.293	35%	0.352	S	S	.	.	H	α-helix	trans	-65.2	-43.9	176.6	-70.8	166.4	0	0	0	113	L193 T227 F229 A233 S234 L235	L193-L231 HydrophobicContact CD1-CD2 3.94Å; L193-L231 HydrophobicContact CD2-CD1 3.45Å; L193-L231 VanDerWaalsContact CD2-CD1 3.45Å; L193-L231 HydrophobicContact CD2-CD2 3.92Å; L193-L231 HydrophobicContact CD2-CG 4.18Å; T227-L231 WeakPolarHBondContact O-CB 3.16Å; T227-L231 VanDerWaalsContact O-CG 3.23Å; T227-L231 WeakPolarHBondContact O-CG 3.39Å; T227-L231 PolarHBondContact O-N 3.26Å; F229-L231 VanDerWaalsContact C-N 3.33Å; F229-L231 PolarHBondContact O-N 3.17Å; L231-A233 VanDerWaalsContact C-N 3.27Å; L231-A233 PolarHBondContact O-N 3.44Å; L231-S234 WeakPolarHBondContact CA-OG 3.22Å; L231-S234 PolarHBondContact O-N 3.35Å; L231-S234 PolarHBondContact O-OG 2.89Å; L231-L235 WeakPolarHBondContact O-CB 3.49Å; L231-L235 WeakPolarHBondContact O-CD1 3.45Å; L231-L235 VanDerWaalsContact O-CG 3.25Å; L231-L235 WeakPolarHBondContact O-CG 3.36Å; L231-L235 PolarHBondContact O-N 3.26Å
232	N	61.5	Low	63.6	Low	11 Å²	11	60 Å²	60	6%	0.059	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-31.7	178	-78.2	-62.7	0	0	0	111.7	I228 F229 R237 V241	I228-N232 PolarHBondContact O-N 3.46Å; I228-N232 VanDerWaalsContact O-N 3.07Å; I228-N232 PolarHBondContact O-ND2 2.75Å; F229-N232 PolarHBondContact O-N 3.42Å; N232-R237 PolarHBondContact O-N 2.7Å; N232-R237 VanDerWaalsContact O-N 3.08Å; N232-V241 HydrophobicContact CB-CB 4.39Å; N232-V241 HydrophobicContact CB-CG2 3.48Å; N232-V241 VanDerWaalsContact CB-CG2 3.48Å
233	A	64.9	Low	64	Low	54 Å²	54	61.1 Å²	61.1	45%	0.446	34%	0.344	S	S	.	.	H	α-helix	trans	-68.6	-45.5	172.9	0	0	0	0	0	111.6	F229 Q230 L231 L235 G236	F229-A233 WeakPolarHBondContact O-CB 3.44Å; F229-A233 PolarHBondContact O-N 3.35Å; Q230-A233 PolarHBondContact O-N 3.15Å; L231-A233 VanDerWaalsContact C-N 3.27Å; L231-A233 PolarHBondContact O-N 3.44Å; A233-L235 VanDerWaalsContact C-N 3.27Å; A233-L235 PolarHBondContact O-N 3.4Å; A233-G236 PolarHBondContact O-N 3.04Å; A233-G236 VanDerWaalsContact O-N 3.09Å
234	S	60.4	Low	64.3	Low	94 Å²	94	58.4 Å²	58.4	66%	0.657	33%	0.325	S	S	*	.	H	α-helix	trans	-66.3	-28.6	178.7	65.6	0	0	0	0	113	Q230 L231 G236	Q230-S234 WeakPolarHBondContact O-CB 3.39Å; Q230-S234 PolarHBondContact O-N 2.99Å; Q230-S234 PolarHBondContact O-OG 3.2Å; L231-S234 WeakPolarHBondContact CA-OG 3.22Å; L231-S234 PolarHBondContact O-N 3.35Å; L231-S234 PolarHBondContact O-OG 2.89Å; S234-G236 VanDerWaalsContact C-N 3.26Å; S234-G236 PolarHBondContact O-N 3.39Å
235	L	57.3	Low	65.3	Low	96 Å²	96	57.1 Å²	57.1	50%	0.503	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	3.2	175.2	-70	167.4	0	0	0	113.7	L231 A233 R237	L231-L235 WeakPolarHBondContact O-CB 3.49Å; L231-L235 WeakPolarHBondContact O-CD1 3.45Å; L231-L235 VanDerWaalsContact O-CG 3.25Å; L231-L235 WeakPolarHBondContact O-CG 3.36Å; L231-L235 PolarHBondContact O-N 3.26Å; A233-L235 VanDerWaalsContact C-N 3.27Å; A233-L235 PolarHBondContact O-N 3.4Å; L235-R237 HydrophobicContact CB-CG 4.31Å; L235-R237 PolarHBondContact O-N 2.83Å
236	G	56.3	Low	65.9	Low	61 Å²	61	57 Å²	57	63%	0.629	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	12.2	-179.9	0	0	0	0	0	114.6	A233 S234 M238	A233-G236 PolarHBondContact O-N 3.04Å; A233-G236 VanDerWaalsContact O-N 3.09Å; S234-G236 VanDerWaalsContact C-N 3.26Å; S234-G236 PolarHBondContact O-N 3.39Å; G236-M238 PolarHBondContact O-N 2.65Å
237	R	64.1	Low	66.5	Low	102 Å²	102	59.8 Å²	59.8	39%	0.385	33%	0.325	S	S	.	.			trans	-94.4	62.5	-174.7	-63.3	-178.2	-178.9	164	-3.7	111.2	N232 L235 N239 K240 V241	N232-R237 PolarHBondContact O-N 2.7Å; N232-R237 VanDerWaalsContact O-N 3.08Å; L235-R237 HydrophobicContact CB-CG 4.31Å; L235-R237 PolarHBondContact O-N 2.83Å; R237-N239 VanDerWaalsContact C-N 3.28Å; R237-N239 PolarHBondContact O-N 3.32Å; R237-K240 HydrophobicContact CB-CB 4.14Å; R237-K240 HydrophobicContact CB-CD 4.39Å; R237-K240 HydrophobicContact CB-CG 4.25Å; R237-K240 PolarHBondContact O-N 2.68Å; R237-V241 PolarHBondContact O-N 3.38Å
238	M	61.8	Low	67.3	Low	115 Å²	115	57.6 Å²	57.6	57%	0.567	31%	0.312	S	S	*	.	H	α-helix	trans	-53.9	-40	-175.9	-68.4	-64.3	-81.6	0	0	113.5	G236 K240 V241 L242	G236-M238 PolarHBondContact O-N 2.65Å; M238-K240 VanDerWaalsContact C-N 3.28Å; M238-K240 PolarHBondContact O-N 3.06Å; M238-V241 WeakPolarHBondContact O-CB 3.32Å; M238-V241 PolarHBondContact O-N 3.42Å; M238-V241 VanDerWaalsContact O-N 3.11Å; M238-L242 PolarHBondContact O-N 3.17Å
239	N	68.1	Low	68.1	Low	112 Å²	112	56.5 Å²	56.5	60%	0.599	31%	0.306	S	S	*	.	H	α-helix	trans	-62	-33	176.7	-71.9	-15.7	0	0	0	113.2	R237 L243	R237-N239 VanDerWaalsContact C-N 3.28Å; R237-N239 PolarHBondContact O-N 3.32Å; N239-L243 PolarHBondContact O-N 3Å
240	K	68.9	Low	68.5	Low	101 Å²	101	59 Å²	59	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-79.3	-25.4	177.4	-61.4	-165.4	-173.6	-178.6	0	112.1	R237 M238 A244	R237-K240 HydrophobicContact CB-CB 4.14Å; R237-K240 HydrophobicContact CB-CD 4.39Å; R237-K240 HydrophobicContact CB-CG 4.25Å; R237-K240 PolarHBondContact O-N 2.68Å; M238-K240 VanDerWaalsContact C-N 3.28Å; M238-K240 PolarHBondContact O-N 3.06Å; K240-A244 WeakPolarHBondContact O-CB 3.43Å; K240-A244 PolarHBondContact O-N 3.34Å
241	V	72.2	Confident	68.8	Low	8 Å²	8	56.1 Å²	56.1	5%	0.048	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-49.1	172.5	-177.7	0	0	0	0	110.1	N232 R237 M238 L243 A244 Q245	N232-V241 HydrophobicContact CB-CB 4.39Å; N232-V241 HydrophobicContact CB-CG2 3.48Å; N232-V241 VanDerWaalsContact CB-CG2 3.48Å; R237-V241 PolarHBondContact O-N 3.38Å; M238-V241 WeakPolarHBondContact O-CB 3.32Å; M238-V241 PolarHBondContact O-N 3.42Å; M238-V241 VanDerWaalsContact O-N 3.11Å; V241-L243 PolarHBondContact O-N 3.3Å; V241-A244 PolarHBondContact O-N 2.86Å; V241-Q245 HydrophobicContact CG1-CG 4.43Å; V241-Q245 VanDerWaalsContact O-CG 3.3Å; V241-Q245 WeakPolarHBondContact O-CG 3.22Å; V241-Q245 PolarHBondContact O-N 3.13Å
242	L	75.2	Confident	69.8	Low	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-43.8	-179.4	-175.2	67.6	0	0	0	111.6	M238 A244 Q245 I246 V270 K273 E277 K279	M238-L242 PolarHBondContact O-N 3.17Å; L242-A244 VanDerWaalsContact C-N 3.3Å; L242-A244 PolarHBondContact O-N 3.45Å; L242-Q245 WeakPolarHBondContact O-CB 3.34Å; L242-Q245 PolarHBondContact O-N 2.91Å; L242-Q245 VanDerWaalsContact O-N 3.13Å; L242-I246 HydrophobicContact CD1-CD1 4.38Å; L242-I246 HydrophobicContact CD2-CD1 4.26Å; L242-I246 HydrophobicContact CG-CD1 3.79Å; L242-I246 HydrophobicContact CG-CG1 4.39Å; L242-I246 WeakPolarHBondContact O-CD1 3.47Å; L242-I246 VanDerWaalsContact O-CG1 3.3Å; L242-I246 WeakPolarHBondContact O-CG1 3.35Å; L242-I246 PolarHBondContact O-N 2.84Å; L242-V270 HydrophobicContact CD1-CG1 4.47Å; L242-K273 HydrophobicContact CD1-CB 4.12Å; L242-K273 HydrophobicContact CD1-CD 3.75Å; L242-K273 HydrophobicContact CD1-CG 3.86Å; L242-E277 HydrophobicContact CD2-CB 4.41Å; L242-E277 VanDerWaalsContact CD2-CD 3.42Å; L242-E277 HydrophobicContact CD2-CG 4.36Å; L242-E277 WeakPolarHBondContact CD2-OE2 3.44Å; L242-K279 HydrophobicContact CD2-CD 3.83Å
243	L	75.2	Confident	70	Confident	85 Å²	85	55.2 Å²	55.2	45%	0.445	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-38.1	176.9	-77.7	160.5	0	0	0	112.5	N239 V241 K247	N239-L243 PolarHBondContact O-N 3Å; V241-L243 PolarHBondContact O-N 3.3Å; L243-K247 WeakPolarHBondContact O-CG 3.41Å; L243-K247 PolarHBondContact O-N 3.08Å; L243-K247 VanDerWaalsContact O-N 3.11Å
244	A	70	Confident	70	Confident	8 Å²	8	59.5 Å²	59.5	7%	0.066	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-39.8	173.9	0	0	0	0	0	111.9	I228 F229 K240 V241 L242 K247 A248	I228-A244 HydrophobicContact CG2-CB 4.28Å; F229-A244 HydrophobicContact CD1-CB 4.19Å; F229-A244 HydrophobicContact CE1-CB 4.03Å; K240-A244 WeakPolarHBondContact O-CB 3.43Å; K240-A244 PolarHBondContact O-N 3.34Å; V241-A244 PolarHBondContact O-N 2.86Å; L242-A244 VanDerWaalsContact C-N 3.3Å; L242-A244 PolarHBondContact O-N 3.45Å; A244-K247 PolarHBondContact O-N 3.2Å; A244-A248 WeakPolarHBondContact O-CB 3.29Å; A244-A248 PolarHBondContact O-N 2.79Å
245	Q	79.3	Confident	70.1	Confident	15 Å²	15	55.1 Å²	55.1	7%	0.07	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-43.7	176.1	-74.6	173.6	-30	0	0	112	F229 V241 L242 A248 V249 V270	F229-Q245 HydrophobicContact CD1-CG 3.89Å; F229-Q245 HydrophobicContact CD2-CG 4.47Å; F229-Q245 HydrophobicContact CE1-CB 4.31Å; F229-Q245 HydrophobicContact CE1-CG 3.65Å; F229-Q245 HydrophobicContact CE2-CG 4.26Å; F229-Q245 HydrophobicContact CG-CG 4.32Å; F229-Q245 HydrophobicContact CZ-CB 4.45Å; F229-Q245 HydrophobicContact CZ-CG 3.85Å; V241-Q245 HydrophobicContact CG1-CG 4.43Å; V241-Q245 VanDerWaalsContact O-CG 3.3Å; V241-Q245 WeakPolarHBondContact O-CG 3.22Å; V241-Q245 PolarHBondContact O-N 3.13Å; L242-Q245 WeakPolarHBondContact O-CB 3.34Å; L242-Q245 PolarHBondContact O-N 2.91Å; L242-Q245 VanDerWaalsContact O-N 3.13Å; Q245-A248 WeakPolarHBondContact O-CB 3.31Å; Q245-A248 PolarHBondContact O-N 3.25Å; Q245-V249 WeakPolarHBondContact O-CG2 3.47Å; Q245-V249 PolarHBondContact O-N 3.06Å; Q245-V270 HydrophobicContact CB-CG1 4.3Å; Q245-V270 HydrophobicContact CB-CG2 3.91Å
246	I	77.8	Confident	70.2	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.041	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-44.8	177.3	-65	154.7	0	0	0	110.9	L242 A248 V249 Q250 V270 E282	L242-I246 HydrophobicContact CD1-CD1 4.38Å; L242-I246 HydrophobicContact CD2-CD1 4.26Å; L242-I246 HydrophobicContact CG-CD1 3.79Å; L242-I246 HydrophobicContact CG-CG1 4.39Å; L242-I246 WeakPolarHBondContact O-CD1 3.47Å; L242-I246 VanDerWaalsContact O-CG1 3.3Å; L242-I246 WeakPolarHBondContact O-CG1 3.35Å; L242-I246 PolarHBondContact O-N 2.84Å; I246-A248 VanDerWaalsContact C-N 3.27Å; I246-A248 PolarHBondContact O-N 3.23Å; I246-V249 PolarHBondContact O-N 3.2Å; I246-Q250 WeakPolarHBondContact O-CG 3.36Å; I246-Q250 PolarHBondContact O-N 3.33Å; I246-V270 HydrophobicContact CG1-CG1 3.99Å; I246-E282 HydrophobicContact CD1-CB 3.58Å; I246-E282 HydrophobicContact CD1-CG 3.79Å; I246-E282 HydrophobicContact CG1-CB 4.41Å
247	K	77.3	Confident	70.2	Confident	100 Å²	100	58.1 Å²	58.1	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-60.1	-37.8	174.4	-77.2	-176.5	177.1	-174.3	0	112	L243 A244 Q250 E251	L243-K247 WeakPolarHBondContact O-CG 3.41Å; L243-K247 PolarHBondContact O-N 3.08Å; L243-K247 VanDerWaalsContact O-N 3.11Å; A244-K247 PolarHBondContact O-N 3.2Å; K247-Q250 PolarHBondContact O-N 3.31Å; K247-E251 WeakPolarHBondContact O-CG 3.23Å; K247-E251 PolarHBondContact O-N 3.28Å
248	A	74.8	Confident	70.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-44.3	176.1	0	0	0	0	0	112	Y225 F229 A244 Q245 I246 Q250 E251 L252 F266	Y225-A248 HydrophobicContact CD1-CB 3.35Å; Y225-A248 HydrophobicContact CD2-CB 4.47Å; Y225-A248 HydrophobicContact CE1-CB 3.56Å; Y225-A248 HydrophobicContact CG-CB 3.84Å; F229-A248 HydrophobicContact CE1-CB 4.43Å; F229-A248 HydrophobicContact CZ-CB 3.8Å; A244-A248 WeakPolarHBondContact O-CB 3.29Å; A244-A248 PolarHBondContact O-N 2.79Å; Q245-A248 WeakPolarHBondContact O-CB 3.31Å; Q245-A248 PolarHBondContact O-N 3.25Å; I246-A248 VanDerWaalsContact C-N 3.27Å; I246-A248 PolarHBondContact O-N 3.23Å; A248-Q250 VanDerWaalsContact C-N 3.28Å; A248-Q250 PolarHBondContact O-N 3.44Å; A248-E251 PolarHBondContact O-N 2.91Å; A248-L252 HydrophobicContact CB-CD1 4.17Å; A248-L252 WeakPolarHBondContact O-CB 3.21Å; A248-L252 WeakPolarHBondContact O-CD1 3.28Å; A248-L252 WeakPolarHBondContact O-CG 3.22Å; A248-L252 PolarHBondContact O-N 3.32Å; A248-F266 HydrophobicContact CB-CE1 4.11Å; A248-F266 HydrophobicContact CB-CZ 4.16Å
249	V	78	Confident	70.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-41.4	176.3	175.3	0	0	0	0	111.2	Q245 I246 M253 Y263 F266 A267 V270 C289	Q245-V249 WeakPolarHBondContact O-CG2 3.47Å; Q245-V249 PolarHBondContact O-N 3.06Å; I246-V249 PolarHBondContact O-N 3.2Å; V249-M253 PolarHBondContact O-N 3.38Å; V249-Y263 PolarHBondContact O-OH 3.47Å; V249-Y263 VanDerWaalsContact O-OH 3.1Å; V249-F266 HydrophobicContact CG2-CD1 3.9Å; V249-F266 HydrophobicContact CG2-CE1 3.54Å; V249-F266 HydrophobicContact CG2-CZ 4.46Å; V249-A267 HydrophobicContact CG1-CB 4.29Å; V249-V270 HydrophobicContact CG2-CB 4.07Å; V249-V270 HydrophobicContact CG2-CG1 4.2Å; V249-V270 HydrophobicContact CG2-CG2 3.95Å; V249-C289 HydrophobicContact CG1-CB 3.76Å
250	Q	78.3	Confident	70.8	Confident	77 Å²	77	52 Å²	52	36%	0.36	26%	0.262	S	S	.	.	H	α-helix	trans	-67.2	-46.3	179.6	-66.6	-176.7	-41.7	0	0	113.1	I246 K247 A248 M253	I246-Q250 WeakPolarHBondContact O-CG 3.36Å; I246-Q250 PolarHBondContact O-N 3.33Å; K247-Q250 PolarHBondContact O-N 3.31Å; A248-Q250 VanDerWaalsContact C-N 3.28Å; A248-Q250 PolarHBondContact O-N 3.44Å; Q250-M253 VanDerWaalsContact O-CB 3.31Å; Q250-M253 WeakPolarHBondContact O-CB 3.17Å
251	E	71.7	Confident	71.1	Confident	76 Å²	76	53.8 Å²	53.8	36%	0.355	27%	0.272	S	S	.	.	H	α-helix	trans	-76.7	-34.2	-175.9	-67.5	-73.4	170	0	0	112.4	V215 R219 Y225 K247 A248 M253	V215-E251 HydrophobicContact CG1-CG 4.1Å; R219-E251 IonicContact NE-OE2 3.96Å; Y225-E251 WeakPolarHBondContact OH-CB 3.34Å; K247-E251 WeakPolarHBondContact O-CG 3.23Å; K247-E251 PolarHBondContact O-N 3.28Å; A248-E251 PolarHBondContact O-N 2.91Å; E251-M253 PolarHBondContact O-N 3.03Å
252	L	72.5	Confident	71.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-75.4	-7.5	178.6	-67.1	167.1	0	0	0	113.3	F222 Y225 A248 L254 S255 Y263	F222-L252 HydrophobicContact CD2-CD1 3.7Å; F222-L252 HydrophobicContact CE2-CD1 4.27Å; Y225-L252 HydrophobicContact CD2-CD1 4.36Å; Y225-L252 HydrophobicContact CD2-CD2 4.43Å; Y225-L252 HydrophobicContact CE2-CD2 4.31Å; Y225-L252 HydrophobicContact CE2-CG 4.32Å; A248-L252 HydrophobicContact CB-CD1 4.17Å; A248-L252 WeakPolarHBondContact O-CB 3.21Å; A248-L252 WeakPolarHBondContact O-CD1 3.28Å; A248-L252 WeakPolarHBondContact O-CG 3.22Å; A248-L252 PolarHBondContact O-N 3.32Å; L252-L254 PolarHBondContact O-N 3.23Å; L252-L254 VanDerWaalsContact O-N 3.11Å; L252-S255 WeakPolarHBondContact O-CB 3.18Å; L252-S255 PolarHBondContact O-N 3.3Å; L252-S255 PolarHBondContact O-OG 3.07Å; L252-Y263 HydrophobicContact CB-CD2 4.21Å; L252-Y263 HydrophobicContact CB-CE2 3.96Å
253	M	66	Low	71.7	Confident	48 Å²	48	58.9 Å²	58.9	24%	0.236	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-53	-34.3	-178.6	-174.7	-177	68.5	0	0	112.9	V249 Q250 E251 I292 R293	V249-M253 PolarHBondContact O-N 3.38Å; Q250-M253 VanDerWaalsContact O-CB 3.31Å; Q250-M253 WeakPolarHBondContact O-CB 3.17Å; E251-M253 PolarHBondContact O-N 3.03Å; M253-I292 HydrophobicContact SD-CB 4.31Å; M253-I292 HydrophobicContact SD-CD1 4.29Å; M253-I292 HydrophobicContact SD-CG2 3.95Å; M253-R293 VanDerWaalsContact O-CD 3.22Å; M253-R293 WeakPolarHBondContact O-CD 3.12Å; M253-R293 PolarHBondContact O-NH1 2.87Å
254	L	64.4	Low	71.9	Confident	143 Å²	143	55.6 Å²	55.6	75%	0.749	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-106.1	4.6	-178.5	-66.1	168.1	0	0	0	113.3	L252 T256	L252-L254 PolarHBondContact O-N 3.23Å; L252-L254 VanDerWaalsContact O-N 3.11Å; L254-T256 PolarHBondContact O-N 3.38Å
255	S	63.5	Low	72.5	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.014	30%	0.301	C	S	.	.			trans	-69.8	132	179.9	66.6	0	0	0	0	110.8	L252 D257 R293	L252-S255 WeakPolarHBondContact O-CB 3.18Å; L252-S255 PolarHBondContact O-N 3.3Å; L252-S255 PolarHBondContact O-OG 3.07Å; S255-D257 VanDerWaalsContact C-N 3.35Å; S255-R293 PolarHBondContact O-NH1 2.91Å; S255-R293 PolarHBondContact O-NH2 3.5Å
256	T	58.6	Low	72.7	Confident	110 Å²	110	61.7 Å²	61.7	68%	0.675	30%	0.303	S	S	*	.	S	Bend	trans	-81.7	-18.4	175	41.8	0	0	0	0	112.5	L254	L254-T256 PolarHBondContact O-N 3.38Å
257	D	56.4	Low	72.8	Confident	111 Å²	111	61.3 Å²	61.3	59%	0.594	30%	0.301	S	S	*	.	S	Bend	trans	-88.7	-17	-162.1	-52.1	-20.3	0	0	0	112.3	K220 S255	K220-D257 WeakPolarHBondContact CB-OD2 3.5Å; S255-D257 VanDerWaalsContact C-N 3.35Å
258	L	63.6	Low	73	Confident	23 Å²	23	60 Å²	60	12%	0.12	30%	0.297	C	S	.	.	S	Bend	trans	-96.4	121	176.6	-159.6	68	0	0	0	110.4	F222 L260 K262 Y263 R293	F222-L258 HydrophobicContact CB-CD1 4.4Å; F222-L258 HydrophobicContact CD1-CD1 4.35Å; F222-L258 HydrophobicContact CD2-CD2 4.42Å; F222-L258 HydrophobicContact CG-CD1 4.24Å; L258-L260 PolarHBondContact O-N 3.43Å; L258-K262 HydrophobicContact CD1-CB 4.17Å; L258-K262 HydrophobicContact CG-CB 4.15Å; L258-Y263 HydrophobicContact CD2-CD2 4.22Å; L258-R293 PolarHBondContact O-NH2 3.24Å
259	Q	71.4	Confident	73.4	Confident	123 Å²	123	65.6 Å²	65.6	58%	0.575	32%	0.321	S	S	*	.			trans	-49.6	131.7	169.6	-71.4	-172.1	-46.5	0	0	109.6	E261 K262 Y263	Q259-E261 PolarHBondContact O-N 3.33Å; Q259-E261 VanDerWaalsContact O-N 3.14Å; Q259-K262 HydrophobicContact CB-CD 4.34Å; Q259-K262 HydrophobicContact CB-CG 4.33Å; Q259-K262 WeakPolarHBondContact O-CB 3.41Å; Q259-K262 PolarHBondContact O-N 2.93Å; Q259-Y263 PolarHBondContact O-N 3.48Å; Q259-Y263 VanDerWaalsContact O-N 3.14Å
260	L	71.9	Confident	73.6	Confident	53 Å²	53	65.6 Å²	65.6	28%	0.277	32%	0.321	S	S	.	.	H	α-helix	trans	-48.8	-44.3	-175.1	179	73.5	0	0	0	112.4	L258 K262 Y263 L264 R293 A297 V299	L258-L260 PolarHBondContact O-N 3.43Å; L260-K262 PolarHBondContact O-N 2.94Å; L260-Y263 WeakPolarHBondContact O-CB 3.28Å; L260-Y263 PolarHBondContact O-N 3.07Å; L260-L264 HydrophobicContact CD1-CD1 4.34Å; L260-L264 HydrophobicContact CD1-CG 4.44Å; L260-L264 HydrophobicContact CD2-CD1 4.45Å; L260-L264 HydrophobicContact CG-CD1 3.97Å; L260-L264 HydrophobicContact CG-CG 4.39Å; L260-L264 WeakPolarHBondContact O-CG 3.42Å; L260-L264 PolarHBondContact O-N 3.03Å; L260-R293 HydrophobicContact CD1-CG 3.91Å; L260-A297 HydrophobicContact CD1-CB 3.65Å; L260-A297 HydrophobicContact CD2-CB 3.24Å; L260-A297 HydrophobicContact CG-CB 4.07Å; L260-V299 HydrophobicContact CD2-CG2 3.98Å
261	E	75.7	Confident	73.8	Confident	140 Å²	140	63.4 Å²	63.4	65%	0.654	31%	0.31	S	S	*	.	H	α-helix	trans	-59.4	-43.8	179.2	-64.7	176.9	179.7	0	0	112.5	Q259 Y263 L264 Q265	Q259-E261 PolarHBondContact O-N 3.33Å; Q259-E261 VanDerWaalsContact O-N 3.14Å; E261-Y263 VanDerWaalsContact C-N 3.33Å; E261-Y263 PolarHBondContact O-N 2.99Å; E261-L264 PolarHBondContact O-N 2.68Å; E261-Q265 WeakPolarHBondContact O-CB 3.19Å; E261-Q265 VanDerWaalsContact O-CG 3.32Å; E261-Q265 WeakPolarHBondContact O-CG 3.29Å; E261-Q265 PolarHBondContact O-N 3.38Å
262	K	78.1	Confident	74.3	Confident	115 Å²	115	64.4 Å²	64.4	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-66.9	-36.2	178.6	-65.4	-178.3	-178.6	174.6	0	111.6	L258 Q259 L260 F266	L258-K262 HydrophobicContact CD1-CB 4.17Å; L258-K262 HydrophobicContact CG-CB 4.15Å; Q259-K262 HydrophobicContact CB-CD 4.34Å; Q259-K262 HydrophobicContact CB-CG 4.33Å; Q259-K262 WeakPolarHBondContact O-CB 3.41Å; Q259-K262 PolarHBondContact O-N 2.93Å; L260-K262 PolarHBondContact O-N 2.94Å; K262-F266 WeakPolarHBondContact O-CB 3.29Å; K262-F266 PolarHBondContact O-N 2.82Å
263	Y	81.6	Confident	74.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.7	-47	173.7	177.8	-91.4	0	0	0	111.7	V249 L252 L258 Q259 L260 E261 Q265 F266 A267 R293	V249-Y263 PolarHBondContact O-OH 3.47Å; V249-Y263 VanDerWaalsContact O-OH 3.1Å; L252-Y263 HydrophobicContact CB-CD2 4.21Å; L252-Y263 HydrophobicContact CB-CE2 3.96Å; L258-Y263 HydrophobicContact CD2-CD2 4.22Å; Q259-Y263 PolarHBondContact O-N 3.48Å; Q259-Y263 VanDerWaalsContact O-N 3.14Å; L260-Y263 WeakPolarHBondContact O-CB 3.28Å; L260-Y263 PolarHBondContact O-N 3.07Å; E261-Y263 VanDerWaalsContact C-N 3.33Å; E261-Y263 PolarHBondContact O-N 2.99Å; Y263-Q265 PolarHBondContact O-N 3.4Å; Y263-F266 PolarHBondContact O-N 2.89Å; Y263-A267 HydrophobicContact CE1-CB 4.33Å; Y263-A267 WeakPolarHBondContact O-CB 3.38Å; Y263-A267 PolarHBondContact O-N 2.97Å; Y263-R293 HydrophobicContact CD1-CB 4.1Å; Y263-R293 HydrophobicContact CD1-CG 3.55Å; Y263-R293 HydrophobicContact CE1-CB 3.54Å; Y263-R293 VanDerWaalsContact CE1-CD 3.44Å; Y263-R293 HydrophobicContact CE1-CG 3.5Å; Y263-R293 HydrophobicContact CG-CG 4.43Å
264	L	79.5	Confident	75.4	Confident	16 Å²	16	64.1 Å²	64.1	8%	0.084	32%	0.315	C	S	.	.	H	α-helix	trans	-63.4	-43	-178.5	-68	174.3	0	0	0	111.2	L260 E261 F266 A267 E268 Y290 A294	L260-L264 HydrophobicContact CD1-CD1 4.34Å; L260-L264 HydrophobicContact CD1-CG 4.44Å; L260-L264 HydrophobicContact CD2-CD1 4.45Å; L260-L264 HydrophobicContact CG-CD1 3.97Å; L260-L264 HydrophobicContact CG-CG 4.39Å; L260-L264 WeakPolarHBondContact O-CG 3.42Å; L260-L264 PolarHBondContact O-N 3.03Å; E261-L264 PolarHBondContact O-N 2.68Å; L264-F266 VanDerWaalsContact C-N 3.34Å; L264-F266 PolarHBondContact O-N 2.99Å; L264-A267 PolarHBondContact O-N 3.1Å; L264-E268 WeakPolarHBondContact O-CB 3.45Å; L264-E268 WeakPolarHBondContact O-CG 3.29Å; L264-E268 PolarHBondContact O-N 3.07Å; L264-Y290 HydrophobicContact CB-CE2 4.12Å; L264-Y290 HydrophobicContact CD2-CD2 3.93Å; L264-Y290 HydrophobicContact CD2-CE2 3.62Å; L264-Y290 HydrophobicContact CG-CE2 4.43Å; L264-A294 HydrophobicContact CD2-CB 3.81Å
265	Q	82.6	Confident	76.2	Confident	126 Å²	126	59.6 Å²	59.6	59%	0.589	30%	0.295	S	S	*	.	H	α-helix	trans	-60.9	-41.2	173.1	-72.6	175	-2.1	0	0	112.3	E261 Y263 E268 F269	E261-Q265 WeakPolarHBondContact O-CB 3.19Å; E261-Q265 VanDerWaalsContact O-CG 3.32Å; E261-Q265 WeakPolarHBondContact O-CG 3.29Å; E261-Q265 PolarHBondContact O-N 3.38Å; Y263-Q265 PolarHBondContact O-N 3.4Å; Q265-E268 PolarHBondContact O-N 3.03Å; Q265-F269 WeakPolarHBondContact O-CB 3.45Å; Q265-F269 PolarHBondContact O-N 3.41Å
266	F	82.5	Confident	77	Confident	24 Å²	24	63.5 Å²	63.5	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-45.1	176.4	178.4	-107.7	0	0	0	111.9	F222 F229 A248 V249 K262 Y263 L264 E268 F269 V270	F222-F266 HydrophobicContact CE2-CD1 4.5Å; F222-F266 HydrophobicContact CE2-CD2 4.21Å; F222-F266 HydrophobicContact CE2-CE2 4.26Å; F222-F266 HydrophobicContact CE2-CG 4.33Å; F222-F266 HydrophobicContact CE2-CZ 4.43Å; F222-F266 HydrophobicContact CZ-CD2 4.31Å; F229-F266 AromaticContact CE2-CE2 3.96Å; F229-F266 HydrophobicContact CE2-CE2 3.96Å; F229-F266 AromaticContact CE2-CZ 3.92Å; F229-F266 HydrophobicContact CE2-CZ 3.92Å; F229-F266 HydrophobicContact CZ-CE2 4.41Å; F229-F266 AromaticContact CZ-CZ 3.92Å; F229-F266 HydrophobicContact CZ-CZ 3.92Å; A248-F266 HydrophobicContact CB-CE1 4.11Å; A248-F266 HydrophobicContact CB-CZ 4.16Å; V249-F266 HydrophobicContact CG2-CD1 3.9Å; V249-F266 HydrophobicContact CG2-CE1 3.54Å; V249-F266 HydrophobicContact CG2-CZ 4.46Å; K262-F266 WeakPolarHBondContact O-CB 3.29Å; K262-F266 PolarHBondContact O-N 2.82Å; Y263-F266 PolarHBondContact O-N 2.89Å; L264-F266 VanDerWaalsContact C-N 3.34Å; L264-F266 PolarHBondContact O-N 2.99Å; F266-E268 VanDerWaalsContact C-N 3.35Å; F266-E268 PolarHBondContact O-N 2.9Å; F266-F269 WeakPolarHBondContact O-CB 3.33Å; F266-F269 PolarHBondContact O-N 3.38Å; F266-V270 HydrophobicContact CE1-CG2 4.2Å; F266-V270 HydrophobicContact CE2-CG2 4.11Å; F266-V270 HydrophobicContact CZ-CG2 3.93Å; F266-V270 WeakPolarHBondContact O-CG2 3.15Å; F266-V270 PolarHBondContact O-N 3.47Å
267	A	81.1	Confident	77.9	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-38.4	177.7	0	0	0	0	0	112	V249 Y263 L264 V270 Y271 Y290	V249-A267 HydrophobicContact CG1-CB 4.29Å; Y263-A267 HydrophobicContact CE1-CB 4.33Å; Y263-A267 WeakPolarHBondContact O-CB 3.38Å; Y263-A267 PolarHBondContact O-N 2.97Å; L264-A267 PolarHBondContact O-N 3.1Å; A267-V270 PolarHBondContact O-N 3.3Å; A267-Y271 WeakPolarHBondContact O-CB 3.47Å; A267-Y271 PolarHBondContact O-N 2.96Å; A267-Y290 HydrophobicContact CB-CD2 3.94Å
268	E	80.6	Confident	78.8	Confident	71 Å²	71	65.2 Å²	65.2	33%	0.332	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-45.2	171.2	-78.5	175.6	-164.8	0	0	112.6	L264 Q265 F266 V270 Y271 N272 Y290 K304	L264-E268 WeakPolarHBondContact O-CB 3.45Å; L264-E268 WeakPolarHBondContact O-CG 3.29Å; L264-E268 PolarHBondContact O-N 3.07Å; Q265-E268 PolarHBondContact O-N 3.03Å; F266-E268 VanDerWaalsContact C-N 3.35Å; F266-E268 PolarHBondContact O-N 2.9Å; E268-V270 VanDerWaalsContact C-N 3.33Å; E268-V270 PolarHBondContact O-N 3.04Å; E268-Y271 WeakPolarHBondContact O-CB 3.35Å; E268-Y271 PolarHBondContact O-N 3.32Å; E268-N272 VanDerWaalsContact O-CG 3.3Å; E268-N272 PolarHBondContact O-N 3.03Å; E268-N272 PolarHBondContact O-ND2 3.48Å; E268-Y290 HydrophobicContact CG-CD2 4.44Å; E268-Y290 HydrophobicContact CG-CE2 3.87Å; E268-K304 IonicContact OE1-NZ 2.77Å; E268-K304 PolarHBondContact OE1-NZ 2.77Å
269	F	83.8	Confident	79.4	Confident	118 Å²	118	66.4 Å²	66.4	52%	0.518	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-45	178.2	173.6	-97.4	0	0	0	111.5	Q265 F266 N272 K273	Q265-F269 WeakPolarHBondContact O-CB 3.45Å; Q265-F269 PolarHBondContact O-N 3.41Å; F266-F269 WeakPolarHBondContact O-CB 3.33Å; F266-F269 PolarHBondContact O-N 3.38Å; F269-N272 PolarHBondContact O-N 2.83Å; F269-K273 PolarHBondContact O-N 3.27Å; F269-K273 VanDerWaalsContact O-N 3.12Å
270	V	82.8	Confident	79.3	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.3	-38.9	177.3	179	0	0	0	0	111.2	L242 Q245 I246 V249 F266 A267 E268 K273 C274	L242-V270 HydrophobicContact CD1-CG1 4.47Å; Q245-V270 HydrophobicContact CB-CG1 4.3Å; Q245-V270 HydrophobicContact CB-CG2 3.91Å; I246-V270 HydrophobicContact CG1-CG1 3.99Å; V249-V270 HydrophobicContact CG2-CB 4.07Å; V249-V270 HydrophobicContact CG2-CG1 4.2Å; V249-V270 HydrophobicContact CG2-CG2 3.95Å; F266-V270 HydrophobicContact CE1-CG2 4.2Å; F266-V270 HydrophobicContact CE2-CG2 4.11Å; F266-V270 HydrophobicContact CZ-CG2 3.93Å; F266-V270 WeakPolarHBondContact O-CG2 3.15Å; F266-V270 PolarHBondContact O-N 3.47Å; A267-V270 PolarHBondContact O-N 3.3Å; E268-V270 VanDerWaalsContact C-N 3.33Å; E268-V270 PolarHBondContact O-N 3.04Å; V270-K273 PolarHBondContact O-N 3.3Å; V270-C274 PolarHBondContact O-N 3.46Å; V270-C274 PolarHBondContact O-SG 3.45Å
271	Y	82.4	Confident	79.5	Confident	31 Å²	31	70.8 Å²	70.8	12%	0.122	34%	0.343	C	S	.	.	H	α-helix	trans	-58.5	-50.6	174.3	172.7	-108	0	0	0	111.8	A267 E268 K273 C274 C275 K283 L287	A267-Y271 WeakPolarHBondContact O-CB 3.47Å; A267-Y271 PolarHBondContact O-N 2.96Å; E268-Y271 WeakPolarHBondContact O-CB 3.35Å; E268-Y271 PolarHBondContact O-N 3.32Å; Y271-K273 PolarHBondContact O-N 2.74Å; Y271-C274 WeakPolarHBondContact O-CB 3.39Å; Y271-C274 PolarHBondContact O-N 3.36Å; Y271-C274 VanDerWaalsContact O-N 3.09Å; Y271-C275 PolarHBondContact O-N 3.07Å; Y271-C275 PolarHBondContact O-SG 2.64Å; Y271-K283 HydrophobicContact CD2-CG 3.88Å; Y271-K283 HydrophobicContact CE2-CD 4.08Å; Y271-K283 VanDerWaalsContact CE2-CE 3.46Å; Y271-K283 HydrophobicContact CE2-CG 3.45Å; Y271-K283 VanDerWaalsContact CE2-CG 3.45Å; Y271-K283 VanDerWaalsContact OH-CE 3.32Å; Y271-K283 WeakPolarHBondContact OH-CE 3.19Å; Y271-L287 HydrophobicContact CD2-CD1 4.2Å; Y271-L287 HydrophobicContact CD2-CD2 3.8Å; Y271-L287 HydrophobicContact CD2-CG 3.62Å; Y271-L287 HydrophobicContact CE2-CD1 3.44Å; Y271-L287 VanDerWaalsContact CE2-CD1 3.44Å; Y271-L287 HydrophobicContact CE2-CD2 3.53Å; Y271-L287 HydrophobicContact CE2-CG 3.36Å; Y271-L287 HydrophobicContact CG-CD2 4.41Å
272	N	81.4	Confident	79.3	Confident	98 Å²	98	66.2 Å²	66.2	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-35.4	179.1	-70.2	-22	0	0	0	112.2	E268 F269 C275 A276	E268-N272 VanDerWaalsContact O-CG 3.3Å; E268-N272 PolarHBondContact O-N 3.03Å; E268-N272 PolarHBondContact O-ND2 3.48Å; F269-N272 PolarHBondContact O-N 2.83Å; N272-C275 WeakPolarHBondContact O-CB 3.26Å; N272-C275 PolarHBondContact O-N 2.81Å; N272-A276 PolarHBondContact O-N 3.2Å
273	K	83	Confident	79.2	Confident	42 Å²	42	62.9 Å²	62.9	18%	0.183	31%	0.307	C	S	.	.	H	α-helix	trans	-70.5	-38.8	175.1	-164.7	175.5	168.3	-172	0	112.7	L242 F269 V270 Y271 C275 A276 E277	L242-K273 HydrophobicContact CD1-CB 4.12Å; L242-K273 HydrophobicContact CD1-CD 3.75Å; L242-K273 HydrophobicContact CD1-CG 3.86Å; F269-K273 PolarHBondContact O-N 3.27Å; F269-K273 VanDerWaalsContact O-N 3.12Å; V270-K273 PolarHBondContact O-N 3.3Å; Y271-K273 PolarHBondContact O-N 2.74Å; K273-C275 VanDerWaalsContact C-N 3.31Å; K273-C275 PolarHBondContact O-N 3.29Å; K273-A276 PolarHBondContact O-N 2.87Å; K273-E277 PolarHBondContact O-N 3.27Å
274	C	79.5	Confident	78.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-37.5	172.9	-65.1	0	0	0	0	111.7	V270 Y271 E277 K278 K279 K283	V270-C274 PolarHBondContact O-N 3.46Å; V270-C274 PolarHBondContact O-SG 3.45Å; Y271-C274 WeakPolarHBondContact O-CB 3.39Å; Y271-C274 PolarHBondContact O-N 3.36Å; Y271-C274 VanDerWaalsContact O-N 3.09Å; C274-E277 PolarHBondContact O-N 3.13Å; C274-K278 PolarHBondContact O-N 2.85Å; C274-K279 PolarHBondContact O-N 2.87Å; C274-K283 HydrophobicContact CB-CB 4.18Å
275	C	79.1	Confident	78.6	Confident	48 Å²	48	67 Å²	67	32%	0.324	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-44.4	173.2	-67.9	0	0	0	0	111.7	Y271 N272 K273 E277 K278 K283	Y271-C275 PolarHBondContact O-N 3.07Å; Y271-C275 PolarHBondContact O-SG 2.64Å; N272-C275 WeakPolarHBondContact O-CB 3.26Å; N272-C275 PolarHBondContact O-N 2.81Å; K273-C275 VanDerWaalsContact C-N 3.31Å; K273-C275 PolarHBondContact O-N 3.29Å; C275-E277 VanDerWaalsContact C-N 3.34Å; C275-E277 PolarHBondContact O-N 2.66Å; C275-K278 PolarHBondContact O-N 3.44Å; C275-K283 WeakPolarHBondContact SG-CE 3.38Å
276	A	81.4	Confident	78.2	Confident	83 Å²	83	61.1 Å²	61.1	69%	0.686	30%	0.298	S	S	*	.	H	α-helix	trans	-63.6	-37.1	177.3	0	0	0	0	0	112.8	N272 K273 K278	N272-A276 PolarHBondContact O-N 3.2Å; K273-A276 PolarHBondContact O-N 2.87Å; A276-K278 VanDerWaalsContact C-N 3.34Å; A276-K278 PolarHBondContact O-N 2.92Å
277	E	77.5	Confident	77.8	Confident	66 Å²	66	60.1 Å²	60.1	31%	0.308	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	2.9	179.1	-71.1	-172.2	-155.5	0	0	114.5	L242 K273 C274 C275 K279	L242-E277 HydrophobicContact CD2-CB 4.41Å; L242-E277 VanDerWaalsContact CD2-CD 3.42Å; L242-E277 HydrophobicContact CD2-CG 4.36Å; L242-E277 WeakPolarHBondContact CD2-OE2 3.44Å; K273-E277 PolarHBondContact O-N 3.27Å; C274-E277 PolarHBondContact O-N 3.13Å; C275-E277 VanDerWaalsContact C-N 3.34Å; C275-E277 PolarHBondContact O-N 2.66Å; E277-K279 HydrophobicContact CB-CD 4.39Å; E277-K279 HydrophobicContact CB-CG 4.49Å; E277-K279 PolarHBondContact O-N 3.5Å; E277-K279 IonicContact OE2-NZ 3.84Å; E277-K279 PolarHBondContact OE2-NZ 3.42Å
278	K	75.3	Confident	77.4	Confident	191 Å²	191	63.3 Å²	63.3	83%	0.83	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	33.7	-178.9	-60.4	-175.3	178.3	-178.4	0	114.7	C274 C275 A276 T280	C274-K278 PolarHBondContact O-N 2.85Å; C275-K278 PolarHBondContact O-N 3.44Å; A276-K278 VanDerWaalsContact C-N 3.34Å; A276-K278 PolarHBondContact O-N 2.92Å; K278-T280 PolarHBondContact O-N 3.06Å
279	K	75.3	Confident	77.1	Confident	49 Å²	49	60.5 Å²	60.5	21%	0.213	30%	0.295	C	S	.	.			trans	-92.7	92.3	179.7	-86.5	177.5	-177.8	158.4	0	111.6	L242 C274 E277 E282 K283	L242-K279 HydrophobicContact CD2-CD 3.83Å; C274-K279 PolarHBondContact O-N 2.87Å; E277-K279 HydrophobicContact CB-CD 4.39Å; E277-K279 HydrophobicContact CB-CG 4.49Å; E277-K279 PolarHBondContact O-N 3.5Å; E277-K279 IonicContact OE2-NZ 3.84Å; E277-K279 PolarHBondContact OE2-NZ 3.42Å; K279-E282 HydrophobicContact CB-CB 4.41Å; K279-E282 VanDerWaalsContact CB-OE2 3.27Å; K279-E282 WeakPolarHBondContact CB-OE2 3.45Å; K279-K283 WeakPolarHBondContact O-CB 3.34Å; K279-K283 PolarHBondContact O-N 3.4Å; K279-K283 VanDerWaalsContact O-N 3.08Å
280	T	70.8	Confident	76.7	Confident	93 Å²	93	55.7 Å²	55.7	57%	0.571	27%	0.274	S	S	*	.	H	α-helix	trans	-64.5	-47.9	-172.3	55.8	0	0	0	0	113	K278 E282 K283 L284	K278-T280 PolarHBondContact O-N 3.06Å; T280-E282 PolarHBondContact O-N 2.69Å; T280-K283 WeakPolarHBondContact O-CB 3.28Å; T280-K283 PolarHBondContact O-N 2.79Å; T280-L284 PolarHBondContact O-N 3.07Å; T280-L284 VanDerWaalsContact O-N 3.15Å
281	R	74.6	Confident	76.1	Confident	175 Å²	175	56.4 Å²	56.4	66%	0.66	28%	0.278	S	S	*	.	H	α-helix	trans	-66.2	-40	-176.9	-166.3	177.7	-175.7	-175.3	3.4	112.9	K285	R281-K285 WeakPolarHBondContact O-CG 3.35Å; R281-K285 PolarHBondContact O-N 3.28Å
282	E	72.5	Confident	75.6	Confident	44 Å²	44	58.8 Å²	58.8	21%	0.206	29%	0.292	C	S	.	.	H	α-helix	trans	-75.6	-31.9	178.4	-61.6	105.5	138.8	0	0	112.8	I246 K279 T280 K285 C286	I246-E282 HydrophobicContact CD1-CB 3.58Å; I246-E282 HydrophobicContact CD1-CG 3.79Å; I246-E282 HydrophobicContact CG1-CB 4.41Å; K279-E282 HydrophobicContact CB-CB 4.41Å; K279-E282 VanDerWaalsContact CB-OE2 3.27Å; K279-E282 WeakPolarHBondContact CB-OE2 3.45Å; T280-E282 PolarHBondContact O-N 2.69Å; E282-K285 PolarHBondContact O-N 3.25Å; E282-C286 PolarHBondContact O-N 2.93Å; E282-C286 VanDerWaalsContact O-N 3.07Å; E282-C286 PolarHBondContact O-SG 3.46Å
283	K	76.6	Confident	75.1	Confident	44 Å²	44	55.5 Å²	55.5	19%	0.191	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-48.3	171.5	-179.5	-172.8	179.4	-169	0	111.4	Y271 C274 C275 K279 T280 K285 C286 L287 Q311	Y271-K283 HydrophobicContact CD2-CG 3.88Å; Y271-K283 HydrophobicContact CE2-CD 4.08Å; Y271-K283 VanDerWaalsContact CE2-CE 3.46Å; Y271-K283 HydrophobicContact CE2-CG 3.45Å; Y271-K283 VanDerWaalsContact CE2-CG 3.45Å; Y271-K283 VanDerWaalsContact OH-CE 3.32Å; Y271-K283 WeakPolarHBondContact OH-CE 3.19Å; C274-K283 HydrophobicContact CB-CB 4.18Å; C275-K283 WeakPolarHBondContact SG-CE 3.38Å; K279-K283 WeakPolarHBondContact O-CB 3.34Å; K279-K283 PolarHBondContact O-N 3.4Å; K279-K283 VanDerWaalsContact O-N 3.08Å; T280-K283 WeakPolarHBondContact O-CB 3.28Å; T280-K283 PolarHBondContact O-N 2.79Å; K283-K285 PolarHBondContact O-N 3.4Å; K283-C286 PolarHBondContact O-N 2.92Å; K283-L287 HydrophobicContact CG-CD1 4.39Å; K283-L287 PolarHBondContact O-N 3.21Å; K283-Q311 VanDerWaalsContact CE-CD 3.45Å; K283-Q311 VanDerWaalsContact CE-NE2 3.27Å; K283-Q311 VanDerWaalsContact NZ-OE1 3.12Å
284	L	73.2	Confident	74.5	Confident	18 Å²	18	53.5 Å²	53.5	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-39.9	177.6	-74.3	169	0	0	0	112.7	T280 L287 K288 Y308 Q311 L312 E315	T280-L284 PolarHBondContact O-N 3.07Å; T280-L284 VanDerWaalsContact O-N 3.15Å; L284-L287 PolarHBondContact O-N 2.76Å; L284-K288 WeakPolarHBondContact O-CB 3.24Å; L284-K288 PolarHBondContact O-N 2.99Å; L284-Y308 HydrophobicContact CD2-CD2 4.21Å; L284-Y308 HydrophobicContact CD2-CE2 4.16Å; L284-Q311 HydrophobicContact CD2-CB 3.87Å; L284-L312 HydrophobicContact CD2-CD2 4.37Å; L284-L312 HydrophobicContact CD2-CG 4.34Å; L284-E315 VanDerWaalsContact CD1-CD 3.42Å; L284-E315 HydrophobicContact CD1-CG 4.44Å; L284-E315 WeakPolarHBondContact CD1-OE2 3.37Å
285	K	73.9	Confident	73.6	Confident	85 Å²	85	57.5 Å²	57.5	37%	0.37	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-41.6	175.3	-73.3	173.5	178.1	179.8	0	112.6	R281 E282 K283 C289	R281-K285 WeakPolarHBondContact O-CG 3.35Å; R281-K285 PolarHBondContact O-N 3.28Å; E282-K285 PolarHBondContact O-N 3.25Å; K283-K285 PolarHBondContact O-N 3.4Å; K285-C289 PolarHBondContact O-N 3.39Å; K285-C289 VanDerWaalsContact O-N 3.17Å; K285-C289 PolarHBondContact O-SG 3.22Å
286	C	74.6	Confident	73	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-67.8	-44	178.1	-64.3	0	0	0	0	111.4	E282 K283 K288 C289 Y290	E282-C286 PolarHBondContact O-N 2.93Å; E282-C286 VanDerWaalsContact O-N 3.07Å; E282-C286 PolarHBondContact O-SG 3.46Å; K283-C286 PolarHBondContact O-N 2.92Å; C286-K288 PolarHBondContact O-N 3.36Å; C286-C289 PolarHBondContact O-N 2.92Å; C286-Y290 WeakPolarHBondContact O-CB 3.5Å; C286-Y290 PolarHBondContact O-N 3.43Å
287	L	74.1	Confident	72.3	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-60	-44.6	174.6	-79.4	172.1	0	0	0	111.9	Y271 K283 L284 C289 Y290 V291 Y308	Y271-L287 HydrophobicContact CD2-CD1 4.2Å; Y271-L287 HydrophobicContact CD2-CD2 3.8Å; Y271-L287 HydrophobicContact CD2-CG 3.62Å; Y271-L287 HydrophobicContact CE2-CD1 3.44Å; Y271-L287 VanDerWaalsContact CE2-CD1 3.44Å; Y271-L287 HydrophobicContact CE2-CD2 3.53Å; Y271-L287 HydrophobicContact CE2-CG 3.36Å; Y271-L287 HydrophobicContact CG-CD2 4.41Å; K283-L287 HydrophobicContact CG-CD1 4.39Å; K283-L287 PolarHBondContact O-N 3.21Å; L284-L287 PolarHBondContact O-N 2.76Å; L287-C289 VanDerWaalsContact C-N 3.35Å; L287-C289 PolarHBondContact O-N 3.24Å; L287-Y290 WeakPolarHBondContact O-CB 3.08Å; L287-Y290 PolarHBondContact O-N 3.48Å; L287-V291 WeakPolarHBondContact O-CG2 3.48Å; L287-V291 PolarHBondContact O-N 3.49Å; L287-Y308 HydrophobicContact CB-CD2 3.43Å; L287-Y308 VanDerWaalsContact CB-CD2 3.43Å; L287-Y308 HydrophobicContact CB-CE2 4.05Å; L287-Y308 HydrophobicContact CB-CG 4.17Å; L287-Y308 HydrophobicContact CD1-CD2 4.06Å; L287-Y308 HydrophobicContact CG-CD2 4.37Å
288	K	73.7	Confident	71.6	Confident	69 Å²	69	58.3 Å²	58.3	30%	0.3	30%	0.304	S	S	.	.	H	α-helix	trans	-55.3	-48.3	175.5	-174	172.3	-174.6	165.2	0	111.9	L284 C286 V291 I292 Y308 L321	L284-K288 WeakPolarHBondContact O-CB 3.24Å; L284-K288 PolarHBondContact O-N 2.99Å; C286-K288 PolarHBondContact O-N 3.36Å; K288-V291 PolarHBondContact O-N 3.04Å; K288-I292 HydrophobicContact CG-CD1 3.88Å; K288-I292 WeakPolarHBondContact O-CD1 3.18Å; K288-I292 VanDerWaalsContact O-CG1 3.22Å; K288-I292 WeakPolarHBondContact O-CG1 3.32Å; K288-I292 PolarHBondContact O-N 3.24Å; K288-Y308 HydrophobicContact CB-CE2 4.11Å; K288-L321 VanDerWaalsContact NZ-CD2 3.28Å
289	C	73.4	Confident	71.1	Confident	11 Å²	11	52 Å²	52	7%	0.074	28%	0.282	C	S	.	.	H	α-helix	trans	-69	-33.6	179.8	-60.4	0	0	0	0	112.8	V249 K285 C286 L287 R293	V249-C289 HydrophobicContact CG1-CB 3.76Å; K285-C289 PolarHBondContact O-N 3.39Å; K285-C289 VanDerWaalsContact O-N 3.17Å; K285-C289 PolarHBondContact O-SG 3.22Å; C286-C289 PolarHBondContact O-N 2.92Å; L287-C289 VanDerWaalsContact C-N 3.35Å; L287-C289 PolarHBondContact O-N 3.24Å; C289-R293 WeakPolarHBondContact O-CB 3.45Å; C289-R293 PolarHBondContact O-N 3.4Å
290	Y	75.8	Confident	70.4	Confident	17 Å²	17	57.3 Å²	57.3	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-51.4	174.1	177.9	-82.1	0	0	0	110.8	L264 A267 E268 C286 L287 R293 A294 C301 K304	L264-Y290 HydrophobicContact CB-CE2 4.12Å; L264-Y290 HydrophobicContact CD2-CD2 3.93Å; L264-Y290 HydrophobicContact CD2-CE2 3.62Å; L264-Y290 HydrophobicContact CG-CE2 4.43Å; A267-Y290 HydrophobicContact CB-CD2 3.94Å; E268-Y290 HydrophobicContact CG-CD2 4.44Å; E268-Y290 HydrophobicContact CG-CE2 3.87Å; C286-Y290 WeakPolarHBondContact O-CB 3.5Å; C286-Y290 PolarHBondContact O-N 3.43Å; L287-Y290 WeakPolarHBondContact O-CB 3.08Å; L287-Y290 PolarHBondContact O-N 3.48Å; Y290-R293 PolarHBondContact O-N 2.93Å; Y290-A294 HydrophobicContact CE1-CB 4.2Å; Y290-A294 WeakPolarHBondContact O-CB 3.31Å; Y290-A294 PolarHBondContact O-N 3.26Å; Y290-C301 HydrophobicContact CE1-CB 4.39Å; Y290-K304 HydrophobicContact CD1-CD 4.1Å; Y290-K304 HydrophobicContact CE1-CB 4.21Å; Y290-K304 HydrophobicContact CE1-CD 3.39Å; Y290-K304 HydrophobicContact CE1-CG 4.46Å; Y290-K304 HydrophobicContact CE2-CD 4.25Å; Y290-K304 VanDerWaalsContact CZ-CD 3.49Å; Y290-K304 PolarHBondContact OH-NZ 3.2Å
291	V	70.5	Confident	69.9	Low	15 Å²	15	53.5 Å²	53.5	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-47.8	-177.9	173.1	0	0	0	0	110.5	L287 K288 R293 A294 H295 I305 Y308	L287-V291 WeakPolarHBondContact O-CG2 3.48Å; L287-V291 PolarHBondContact O-N 3.49Å; K288-V291 PolarHBondContact O-N 3.04Å; V291-R293 VanDerWaalsContact C-N 3.34Å; V291-R293 PolarHBondContact O-N 3.38Å; V291-A294 PolarHBondContact O-N 3.42Å; V291-H295 WeakPolarHBondContact O-CB 3.5Å; V291-H295 PolarHBondContact O-N 3.4Å; V291-I305 HydrophobicContact CG1-CD1 4.45Å; V291-I305 HydrophobicContact CG1-CG1 4Å; V291-I305 HydrophobicContact CG2-CG1 4.07Å; V291-Y308 HydrophobicContact CG2-CD1 4.43Å
292	I	71.7	Confident	69	Low	81 Å²	81	48.5 Å²	48.5	42%	0.415	28%	0.281	S	S	.	.	H	α-helix	trans	-57.5	-46.3	179.7	-68.4	166.1	0	0	0	111.5	M253 K288 S296	M253-I292 HydrophobicContact SD-CB 4.31Å; M253-I292 HydrophobicContact SD-CD1 4.29Å; M253-I292 HydrophobicContact SD-CG2 3.95Å; K288-I292 HydrophobicContact CG-CD1 3.88Å; K288-I292 WeakPolarHBondContact O-CD1 3.18Å; K288-I292 VanDerWaalsContact O-CG1 3.22Å; K288-I292 WeakPolarHBondContact O-CG1 3.32Å; K288-I292 PolarHBondContact O-N 3.24Å; I292-S296 WeakPolarHBondContact O-CB 3.06Å; I292-S296 PolarHBondContact O-N 3.07Å
293	R	70.6	Confident	68.4	Low	29 Å²	29	54.1 Å²	54.1	11%	0.109	31%	0.307	C	S	.	.	H	α-helix	trans	-71	-45.9	-178.2	-175.2	120.5	172.5	136.6	-1.3	112.2	M253 S255 L258 L260 Y263 C289 Y290 V291 H295 S296 A297	M253-R293 VanDerWaalsContact O-CD 3.22Å; M253-R293 WeakPolarHBondContact O-CD 3.12Å; M253-R293 PolarHBondContact O-NH1 2.87Å; S255-R293 PolarHBondContact O-NH1 2.91Å; S255-R293 PolarHBondContact O-NH2 3.5Å; L258-R293 PolarHBondContact O-NH2 3.24Å; L260-R293 HydrophobicContact CD1-CG 3.91Å; Y263-R293 HydrophobicContact CD1-CB 4.1Å; Y263-R293 HydrophobicContact CD1-CG 3.55Å; Y263-R293 HydrophobicContact CE1-CB 3.54Å; Y263-R293 VanDerWaalsContact CE1-CD 3.44Å; Y263-R293 HydrophobicContact CE1-CG 3.5Å; Y263-R293 HydrophobicContact CG-CG 4.43Å; C289-R293 WeakPolarHBondContact O-CB 3.45Å; C289-R293 PolarHBondContact O-N 3.4Å; Y290-R293 PolarHBondContact O-N 2.93Å; V291-R293 VanDerWaalsContact C-N 3.34Å; V291-R293 PolarHBondContact O-N 3.38Å; R293-H295 VanDerWaalsContact C-N 3.25Å; R293-H295 PolarHBondContact O-N 3.27Å; R293-S296 PolarHBondContact O-N 3.08Å; R293-S296 PolarHBondContact O-OG 3.4Å; R293-A297 PolarHBondContact O-N 3.18Å
294	A	69.7	Low	67.7	Low	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-36.4	179.7	0	0	0	0	0	111.8	L264 Y290 V291 A297 G298 V299 C301	L264-A294 HydrophobicContact CD2-CB 3.81Å; Y290-A294 HydrophobicContact CE1-CB 4.2Å; Y290-A294 WeakPolarHBondContact O-CB 3.31Å; Y290-A294 PolarHBondContact O-N 3.26Å; V291-A294 PolarHBondContact O-N 3.42Å; A294-A297 PolarHBondContact O-N 3.35Å; A294-G298 PolarHBondContact O-N 3.46Å; A294-V299 PolarHBondContact O-N 3.11Å; A294-V299 VanDerWaalsContact O-N 3.09Å; A294-C301 WeakPolarHBondContact CB-SG 3.22Å
295	H	61.7	Low	66.9	Low	85 Å²	85	54 Å²	54	39%	0.394	31%	0.306	S	S	.	.	H	α-helix	trans	-69.1	-40.1	176.1	-149.5	66.6	0	0	0	112.3	V291 R293 A297 G298 N327	V291-H295 WeakPolarHBondContact O-CB 3.5Å; V291-H295 PolarHBondContact O-N 3.4Å; R293-H295 VanDerWaalsContact C-N 3.25Å; R293-H295 PolarHBondContact O-N 3.27Å; H295-A297 PolarHBondContact O-N 3.49Å; H295-A297 VanDerWaalsContact O-N 3.13Å; H295-G298 PolarHBondContact O-N 2.85Å; H295-G298 VanDerWaalsContact O-N 3.13Å; H295-N327 PolarHBondContact NE2-ND2 3.02Å
296	S	66.9	Low	66.2	Low	98 Å²	98	52.4 Å²	52.4	69%	0.685	31%	0.31	S	S	*	.	H	α-helix	trans	-60.8	-22	174.6	73.9	0	0	0	0	113.6	I292 R293	I292-S296 WeakPolarHBondContact O-CB 3.06Å; I292-S296 PolarHBondContact O-N 3.07Å; R293-S296 PolarHBondContact O-N 3.08Å; R293-S296 PolarHBondContact O-OG 3.4Å
297	A	65.4	Low	65.6	Low	48 Å²	48	55.5 Å²	55.5	40%	0.397	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	1.5	179.8	0	0	0	0	0	114.4	L260 R293 A294 H295 V299	L260-A297 HydrophobicContact CD1-CB 3.65Å; L260-A297 HydrophobicContact CD2-CB 3.24Å; L260-A297 HydrophobicContact CG-CB 4.07Å; R293-A297 PolarHBondContact O-N 3.18Å; A294-A297 PolarHBondContact O-N 3.35Å; H295-A297 PolarHBondContact O-N 3.49Å; H295-A297 VanDerWaalsContact O-N 3.13Å; A297-V299 VanDerWaalsContact C-N 3.35Å; A297-V299 HydrophobicContact CB-CG2 4.28Å; A297-V299 PolarHBondContact O-N 3.17Å
298	G	62.3	Low	65	Low	67 Å²	67	56.8 Å²	56.8	69%	0.691	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	26.6	179	0	0	0	0	0	114.8	A294 H295	A294-G298 PolarHBondContact O-N 3.46Å; H295-G298 PolarHBondContact O-N 2.85Å; H295-G298 VanDerWaalsContact O-N 3.13Å
299	V	66.5	Low	64.2	Low	60 Å²	60	54 Å²	54	36%	0.364	32%	0.319	S	S	.	.			trans	-88.8	126.6	177.1	-177.9	0	0	0	0	109.9	L260 A294 A297 C301	L260-V299 HydrophobicContact CD2-CG2 3.98Å; A294-V299 PolarHBondContact O-N 3.11Å; A294-V299 VanDerWaalsContact O-N 3.09Å; A297-V299 VanDerWaalsContact C-N 3.35Å; A297-V299 HydrophobicContact CB-CG2 4.28Å; A297-V299 PolarHBondContact O-N 3.17Å; V299-C301 PolarHBondContact O-N 3.41Å; V299-C301 VanDerWaalsContact O-N 3.1Å; V299-C301 PolarHBondContact O-SG 2.92Å; V299-C301 VanDerWaalsContact O-SG 3.34Å
300	D	58.9	Low	63.7	Low	160 Å²	160	59.4 Å²	59.4	86%	0.856	34%	0.343	S	S	*	.			trans	-60.7	111.2	176.9	-79.4	-29.9	0	0	0	111.5
301	C	60.2	Low	62.9	Low	13 Å²	13	60.3 Å²	60.3	9%	0.088	35%	0.348	C	S	.	.			trans	-119.1	32.6	-178	-69.6	0	0	0	0	113.2	Y290 A294 V299 E303 K304 I305	Y290-C301 HydrophobicContact CE1-CB 4.39Å; A294-C301 WeakPolarHBondContact CB-SG 3.22Å; V299-C301 PolarHBondContact O-N 3.41Å; V299-C301 VanDerWaalsContact O-N 3.1Å; V299-C301 PolarHBondContact O-SG 2.92Å; V299-C301 VanDerWaalsContact O-SG 3.34Å; C301-E303 VanDerWaalsContact C-N 3.34Å; C301-E303 PolarHBondContact O-N 3.13Å; C301-K304 PolarHBondContact O-N 2.69Å; C301-I305 HydrophobicContact CB-CD1 4.02Å; C301-I305 HydrophobicContact CB-CG1 4.24Å; C301-I305 WeakPolarHBondContact O-CB 3.2Å; C301-I305 WeakPolarHBondContact O-CD1 3.3Å; C301-I305 WeakPolarHBondContact O-CG1 3.49Å; C301-I305 PolarHBondContact O-N 3.03Å
302	S	56.1	Low	62.2	Low	70 Å²	70	60.9 Å²	60.9	49%	0.49	35%	0.35	S	S	.	.	H	α-helix	trans	-55.2	-42.7	-173.1	49.6	0	0	0	0	114.1	A306	S302-A306 PolarHBondContact O-N 2.92Å
303	E	59.8	Low	61.2	Low	161 Å²	161	58.3 Å²	58.3	75%	0.752	34%	0.339	S	S	*	.	H	α-helix	trans	-68.4	-43.5	-177.8	-65.5	-179	167.7	0	0	112	C301 A306 D307	C301-E303 VanDerWaalsContact C-N 3.34Å; C301-E303 PolarHBondContact O-N 3.13Å; E303-A306 WeakPolarHBondContact O-CB 3.47Å; E303-A306 PolarHBondContact O-N 3.01Å; E303-D307 PolarHBondContact O-N 2.88Å
304	K	62	Low	60.5	Low	54 Å²	54	64.3 Å²	64.3	24%	0.235	37%	0.369	C	S	.	.	H	α-helix	trans	-77.3	-25.9	-179.3	-67.4	177.3	-174.9	171.6	0	113.4	E268 Y290 C301 Y308	E268-K304 IonicContact OE1-NZ 2.77Å; E268-K304 PolarHBondContact OE1-NZ 2.77Å; Y290-K304 HydrophobicContact CD1-CD 4.1Å; Y290-K304 HydrophobicContact CE1-CB 4.21Å; Y290-K304 HydrophobicContact CE1-CD 3.39Å; Y290-K304 HydrophobicContact CE1-CG 4.46Å; Y290-K304 HydrophobicContact CE2-CD 4.25Å; Y290-K304 VanDerWaalsContact CZ-CD 3.49Å; Y290-K304 PolarHBondContact OH-NZ 3.2Å; C301-K304 PolarHBondContact O-N 2.69Å; K304-Y308 WeakPolarHBondContact O-CB 3.18Å; K304-Y308 PolarHBondContact O-N 3.07Å
305	I	57.7	Low	59.7	Low	5 Å²	5	68.4 Å²	68.4	3%	0.026	39%	0.388	C	S	.	.	H	α-helix	trans	-67.7	-41.7	169.1	-69.7	166.1	0	0	0	109.3	V291 C301 D307 Y308 L309 L330	V291-I305 HydrophobicContact CG1-CD1 4.45Å; V291-I305 HydrophobicContact CG1-CG1 4Å; V291-I305 HydrophobicContact CG2-CG1 4.07Å; C301-I305 HydrophobicContact CB-CD1 4.02Å; C301-I305 HydrophobicContact CB-CG1 4.24Å; C301-I305 WeakPolarHBondContact O-CB 3.2Å; C301-I305 WeakPolarHBondContact O-CD1 3.3Å; C301-I305 WeakPolarHBondContact O-CG1 3.49Å; C301-I305 PolarHBondContact O-N 3.03Å; I305-D307 PolarHBondContact O-N 3.38Å; I305-Y308 PolarHBondContact O-N 3.42Å; I305-L309 HydrophobicContact CG2-CD1 3.62Å; I305-L309 HydrophobicContact CG2-CG 4.08Å; I305-L309 WeakPolarHBondContact O-CB 3.42Å; I305-L309 WeakPolarHBondContact O-CG 3.48Å; I305-L309 PolarHBondContact O-N 3.21Å; I305-L330 HydrophobicContact CG2-CD1 4.34Å
306	A	57.4	Low	59.3	Low	53 Å²	53	70.7 Å²	70.7	44%	0.438	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-45.2	174.2	0	0	0	0	0	111.5	S302 E303 Y308 L309 Q310	S302-A306 PolarHBondContact O-N 2.92Å; E303-A306 WeakPolarHBondContact O-CB 3.47Å; E303-A306 PolarHBondContact O-N 3.01Å; A306-Y308 VanDerWaalsContact C-N 3.33Å; A306-Y308 PolarHBondContact O-N 3.12Å; A306-L309 PolarHBondContact O-N 3.07Å; A306-Q310 VanDerWaalsContact O-CB 3.26Å; A306-Q310 WeakPolarHBondContact O-CB 3.42Å; A306-Q310 PolarHBondContact O-N 3.06Å
307	D	63	Low	58.3	Low	66 Å²	66	74.3 Å²	74.3	35%	0.353	41%	0.405	S	S	.	.	H	α-helix	trans	-61.4	-38.3	175	-80	-5.3	0	0	0	113.2	E303 I305 Q311	E303-D307 PolarHBondContact O-N 2.88Å; I305-D307 PolarHBondContact O-N 3.38Å; D307-Q311 VanDerWaalsContact O-CD 3.31Å; D307-Q311 VanDerWaalsContact O-CG 3.3Å; D307-Q311 WeakPolarHBondContact O-CG 3.37Å; D307-Q311 PolarHBondContact O-N 3.44Å; D307-Q311 PolarHBondContact O-NE2 2.73Å
308	Y	60.6	Low	57.7	Low	30 Å²	30	75.7 Å²	75.7	12%	0.118	41%	0.405	C	S	.	.	H	α-helix	trans	-69.4	-43.4	177.4	-179.7	-120.1	0	0	0	112	L284 L287 K288 V291 K304 I305 A306 Q311 L312	L284-Y308 HydrophobicContact CD2-CD2 4.21Å; L284-Y308 HydrophobicContact CD2-CE2 4.16Å; L287-Y308 HydrophobicContact CB-CD2 3.43Å; L287-Y308 VanDerWaalsContact CB-CD2 3.43Å; L287-Y308 HydrophobicContact CB-CE2 4.05Å; L287-Y308 HydrophobicContact CB-CG 4.17Å; L287-Y308 HydrophobicContact CD1-CD2 4.06Å; L287-Y308 HydrophobicContact CG-CD2 4.37Å; K288-Y308 HydrophobicContact CB-CE2 4.11Å; V291-Y308 HydrophobicContact CG2-CD1 4.43Å; K304-Y308 WeakPolarHBondContact O-CB 3.18Å; K304-Y308 PolarHBondContact O-N 3.07Å; I305-Y308 PolarHBondContact O-N 3.42Å; A306-Y308 VanDerWaalsContact C-N 3.33Å; A306-Y308 PolarHBondContact O-N 3.12Å; Y308-Q311 PolarHBondContact O-N 3.5Å; Y308-L312 HydrophobicContact CD1-CD1 3.75Å; Y308-L312 HydrophobicContact CD2-CD1 4.29Å; Y308-L312 HydrophobicContact CD2-CG 4.42Å; Y308-L312 HydrophobicContact CE1-CD1 3.36Å; Y308-L312 HydrophobicContact CE1-CG 4.38Å; Y308-L312 HydrophobicContact CE2-CD1 3.94Å; Y308-L312 HydrophobicContact CE2-CD2 4.43Å; Y308-L312 HydrophobicContact CE2-CG 4.1Å; Y308-L312 HydrophobicContact CG-CD1 4.21Å; Y308-L312 VanDerWaalsContact CZ-CD1 3.46Å; Y308-L312 WeakPolarHBondContact O-CB 3.3Å; Y308-L312 WeakPolarHBondContact O-CG 3.26Å; Y308-L312 PolarHBondContact O-N 2.85Å
309	L	57.1	Low	57.2	Low	10 Å²	10	76.9 Å²	76.9	5%	0.052	39%	0.393	C	S	.	.	H	α-helix	trans	-70.6	-36.9	179.4	-67.6	175.6	0	0	0	111.8	I305 A306 Q311 L312 S313 K333 Y334	I305-L309 HydrophobicContact CG2-CD1 3.62Å; I305-L309 HydrophobicContact CG2-CG 4.08Å; I305-L309 WeakPolarHBondContact O-CB 3.42Å; I305-L309 WeakPolarHBondContact O-CG 3.48Å; I305-L309 PolarHBondContact O-N 3.21Å; A306-L309 PolarHBondContact O-N 3.07Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 3.24Å; L309-L312 HydrophobicContact CD2-CD1 4.38Å; L309-L312 PolarHBondContact O-N 3.41Å; L309-S313 PolarHBondContact O-N 2.83Å; L309-K333 HydrophobicContact CD1-CB 4.44Å; L309-Y334 HydrophobicContact CD2-CD2 3.97Å
310	Q	62.8	Low	56.4	Low	126 Å²	126	81.5 Å²	81.5	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-61.7	-41	174.8	-170.7	172	2.7	0	0	111.4	A306 S313	A306-Q310 VanDerWaalsContact O-CB 3.26Å; A306-Q310 WeakPolarHBondContact O-CB 3.42Å; A306-Q310 PolarHBondContact O-N 3.06Å; Q310-S313 PolarHBondContact O-OG 3.36Å
311	Q	59.7	Low	55.9	Low	35 Å²	35	78.5 Å²	78.5	16%	0.164	39%	0.394	C	S	.	.	H	α-helix	trans	-78.5	-29.6	179.7	-69.5	165.2	32.8	0	0	113.6	K283 L284 D307 Y308 L309 S313 E314	K283-Q311 VanDerWaalsContact CE-CD 3.45Å; K283-Q311 VanDerWaalsContact CE-NE2 3.27Å; K283-Q311 VanDerWaalsContact NZ-OE1 3.12Å; L284-Q311 HydrophobicContact CD2-CB 3.87Å; D307-Q311 VanDerWaalsContact O-CD 3.31Å; D307-Q311 VanDerWaalsContact O-CG 3.3Å; D307-Q311 WeakPolarHBondContact O-CG 3.37Å; D307-Q311 PolarHBondContact O-N 3.44Å; D307-Q311 PolarHBondContact O-NE2 2.73Å; Y308-Q311 PolarHBondContact O-N 3.5Å; L309-Q311 VanDerWaalsContact C-N 3.32Å; L309-Q311 PolarHBondContact O-N 3.24Å; Q311-S313 VanDerWaalsContact C-N 3.27Å; Q311-S313 PolarHBondContact O-N 3.18Å; Q311-E314 PolarHBondContact O-N 3.19Å
312	L	55.5	Low	55.7	Low	27 Å²	27	79 Å²	79	14%	0.141	40%	0.395	C	S	.	.	H	α-helix	trans	-67	-30	172.3	-80.9	170.4	0	0	0	112.6	L284 Y308 L309 E314 E315 I322	L284-L312 HydrophobicContact CD2-CD2 4.37Å; L284-L312 HydrophobicContact CD2-CG 4.34Å; Y308-L312 HydrophobicContact CD1-CD1 3.75Å; Y308-L312 HydrophobicContact CD2-CD1 4.29Å; Y308-L312 HydrophobicContact CD2-CG 4.42Å; Y308-L312 HydrophobicContact CE1-CD1 3.36Å; Y308-L312 HydrophobicContact CE1-CG 4.38Å; Y308-L312 HydrophobicContact CE2-CD1 3.94Å; Y308-L312 HydrophobicContact CE2-CD2 4.43Å; Y308-L312 HydrophobicContact CE2-CG 4.1Å; Y308-L312 HydrophobicContact CG-CD1 4.21Å; Y308-L312 VanDerWaalsContact CZ-CD1 3.46Å; Y308-L312 WeakPolarHBondContact O-CB 3.3Å; Y308-L312 WeakPolarHBondContact O-CG 3.26Å; Y308-L312 PolarHBondContact O-N 2.85Å; L309-L312 HydrophobicContact CD2-CD1 4.38Å; L309-L312 PolarHBondContact O-N 3.41Å; L312-E314 PolarHBondContact O-N 3.4Å; L312-E315 PolarHBondContact O-N 3.3Å; L312-I322 HydrophobicContact CD1-CD1 4.41Å
313	S	52.2	Low	55.5	Low	27 Å²	27	78.6 Å²	78.6	19%	0.189	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.8	-180	79.5	0	0	0	0	114	L309 Q310 Q311	L309-S313 PolarHBondContact O-N 2.83Å; Q310-S313 PolarHBondContact O-OG 3.36Å; Q311-S313 VanDerWaalsContact C-N 3.27Å; Q311-S313 PolarHBondContact O-N 3.18Å
314	E	55.3	Low	55.1	Low	155 Å²	155	78.7 Å²	78.7	72%	0.724	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-20.6	177.2	-64.7	-178.9	167.5	0	0	113.5	Q311 L312	Q311-E314 PolarHBondContact O-N 3.19Å; L312-E314 PolarHBondContact O-N 3.4Å
315	E	53.4	Low	54.8	Low	87 Å²	87	78.7 Å²	78.7	41%	0.407	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	1.1	-169.6	-71.8	-167.8	176.1	0	0	115.9	L284 L312 Q317	L284-E315 VanDerWaalsContact CD1-CD 3.42Å; L284-E315 HydrophobicContact CD1-CG 4.44Å; L284-E315 WeakPolarHBondContact CD1-OE2 3.37Å; L312-E315 PolarHBondContact O-N 3.3Å; E315-Q317 WeakPolarHBondContact O-CG 3.47Å; E315-Q317 PolarHBondContact O-N 3.18Å
316	H	51.6	Low	54.8	Low	132 Å²	132	82 Å²	82	61%	0.611	43%	0.427	S	S	*	.			trans	51.3	7	165.7	-82.6	-59.6	0	0	0	119.7
317	Q	47.9	Very low	55.3	Low	174 Å²	174	82.1 Å²	82.1	81%	0.813	42%	0.421	S	S	*	.			trans	-112.9	-7.8	-165.4	-77	-173.4	-10.7	0	0	117.6	E315	E315-Q317 WeakPolarHBondContact O-CG 3.47Å; E315-Q317 PolarHBondContact O-N 3.18Å
318	D	52	Low	55.7	Low	77 Å²	77	80 Å²	80	41%	0.412	41%	0.411	S	S	.	.			trans	-119.1	20.8	-171.1	-79.7	-3.9	0	0	0	114.7	E320 L321	D318-E320 VanDerWaalsContact C-N 3.31Å; D318-E320 PolarHBondContact O-N 3.03Å; D318-L321 PolarHBondContact O-N 2.95Å
319	E	51.1	Low	56	Low	93 Å²	93	83 Å²	83	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-58.8	-37.4	-177.5	-72.5	-179.3	179.5	0	0	113.3	L321 I322 L323	E319-L321 VanDerWaalsContact C-N 3.34Å; E319-L321 PolarHBondContact O-N 3.15Å; E319-I322 PolarHBondContact O-N 2.91Å; E319-L323 WeakPolarHBondContact O-CD1 3.37Å; E319-L323 WeakPolarHBondContact O-CG 3.18Å; E319-L323 PolarHBondContact O-N 3.01Å
320	E	49.8	Very low	56.5	Low	157 Å²	157	84 Å²	84	73%	0.734	43%	0.434	S	S	*	.	H	α-helix	trans	-67.3	-32.7	-179	-67.8	-177.2	164.2	0	0	112.9	D318 H324	D318-E320 VanDerWaalsContact C-N 3.31Å; D318-E320 PolarHBondContact O-N 3.03Å; E320-H324 PolarHBondContact O-CD2 3.15Å; E320-H324 PolarHBondContact O-N 3.25Å
321	L	48.5	Very low	57.1	Low	97 Å²	97	78.2 Å²	78.2	51%	0.508	41%	0.407	S	S	.	.	H	α-helix	trans	-74.2	-31.6	-177	-157.5	80.5	0	0	0	111.6	K288 D318 E319 T325	K288-L321 VanDerWaalsContact NZ-CD2 3.28Å; D318-L321 PolarHBondContact O-N 2.95Å; E319-L321 VanDerWaalsContact C-N 3.34Å; E319-L321 PolarHBondContact O-N 3.15Å; L321-T325 PolarHBondContact O-N 3.43Å
322	I	55.4	Low	57.9	Low	22 Å²	22	77 Å²	77	11%	0.113	40%	0.402	C	S	.	.	H	α-helix	trans	-75.1	-39.7	-179.7	-59	172.9	0	0	0	110.2	L312 E319 H324 T325 L331 Y334	L312-I322 HydrophobicContact CD1-CD1 4.41Å; E319-I322 PolarHBondContact O-N 2.91Å; I322-H324 VanDerWaalsContact C-N 3.25Å; I322-H324 PolarHBondContact O-N 3.33Å; I322-T325 WeakPolarHBondContact O-CB 3.46Å; I322-T325 PolarHBondContact O-N 3.17Å; I322-T325 PolarHBondContact O-OG1 3.04Å; I322-L331 HydrophobicContact CG2-CD2 3.83Å; I322-Y334 HydrophobicContact CG2-CD1 4.28Å
323	L	53.5	Low	58.8	Low	62 Å²	62	80.2 Å²	80.2	33%	0.325	41%	0.414	S	S	.	.	H	α-helix	trans	-62.2	-32	176.3	-68.9	161.8	0	0	0	112.6	E319 T325	E319-L323 WeakPolarHBondContact O-CD1 3.37Å; E319-L323 WeakPolarHBondContact O-CG 3.18Å; E319-L323 PolarHBondContact O-N 3.01Å; L323-T325 VanDerWaalsContact C-N 3.32Å
324	H	50.9	Low	59.8	Low	164 Å²	164	80.2 Å²	80.2	76%	0.759	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-9.8	174.8	-72.6	-49.6	0	0	0	114.5	E320 I322 G326	E320-H324 PolarHBondContact O-CD2 3.15Å; E320-H324 PolarHBondContact O-N 3.25Å; I322-H324 VanDerWaalsContact C-N 3.25Å; I322-H324 PolarHBondContact O-N 3.33Å; H324-G326 PolarHBondContact O-N 3.43Å; H324-G326 VanDerWaalsContact O-N 3.12Å
325	T	55.5	Low	60.9	Low	54 Å²	54	72.8 Å²	72.8	33%	0.331	38%	0.376	S	S	.	.			trans	-74.5	105.3	168.4	63.4	0	0	0	0	108.3	L321 I322 L323 N327	L321-T325 PolarHBondContact O-N 3.43Å; I322-T325 WeakPolarHBondContact O-CB 3.46Å; I322-T325 PolarHBondContact O-N 3.17Å; I322-T325 PolarHBondContact O-OG1 3.04Å; L323-T325 VanDerWaalsContact C-N 3.32Å; T325-N327 PolarHBondContact O-N 3Å
326	G	58	Low	62	Low	74 Å²	74	72.4 Å²	72.4	76%	0.763	38%	0.377	S	S	*	.			trans	-66.2	27.3	176.5	0	0	0	0	0	114.4	H324	H324-G326 PolarHBondContact O-N 3.43Å; H324-G326 VanDerWaalsContact O-N 3.12Å
327	N	66.9	Low	62.9	Low	55 Å²	55	67.4 Å²	67.4	29%	0.294	36%	0.358	S	S	.	.			trans	-105	95.9	179.6	-157.1	-31.8	0	0	0	109.8	H295 T325 D329 L330 L331	H295-N327 PolarHBondContact NE2-ND2 3.02Å; T325-N327 PolarHBondContact O-N 3Å; N327-D329 PolarHBondContact O-N 3.02Å; N327-L330 HydrophobicContact CB-CB 4.45Å; N327-L330 PolarHBondContact O-N 3.14Å; N327-L331 PolarHBondContact O-N 3.4Å
328	T	71.5	Confident	64.3	Low	23 Å²	23	59.4 Å²	59.4	14%	0.141	32%	0.321	C	S	.	.	H	α-helix	trans	-55.4	-36.7	-177.9	50.5	0	0	0	0	112.7	L330 L331 V332 I354 V357 D358	T328-L330 VanDerWaalsContact C-N 3.34Å; T328-L330 PolarHBondContact O-N 2.85Å; T328-L331 PolarHBondContact O-N 3.01Å; T328-V332 WeakPolarHBondContact O-CG2 3.36Å; T328-V332 PolarHBondContact O-N 3.21Å; T328-I354 HydrophobicContact CG2-CG2 4.3Å; T328-V357 HydrophobicContact CG2-CG1 4.34Å; T328-D358 HydrophobicContact CG2-CB 3.87Å
329	D	67.4	Low	65.5	Low	91 Å²	91	57 Å²	57	49%	0.487	31%	0.31	S	S	.	.	H	α-helix	trans	-69.7	-31.2	-176.1	-67.5	-10.4	0	0	0	113	N327 K333 H361	N327-D329 PolarHBondContact O-N 3.02Å; D329-K333 PolarHBondContact O-N 2.62Å; D329-H361 IonicContact OD1-CE1 3.71Å; D329-H361 PolarHBondContact OD1-CE1 3.32Å
330	L	67	Low	66.7	Low	32 Å²	32	56.9 Å²	56.9	17%	0.168	32%	0.319	C	S	.	.	H	α-helix	trans	-72.9	-42.3	175.1	-167.5	95	0	0	0	110.4	I305 N327 T328 V332 K333 Y334	I305-L330 HydrophobicContact CG2-CD1 4.34Å; N327-L330 HydrophobicContact CB-CB 4.45Å; N327-L330 PolarHBondContact O-N 3.14Å; T328-L330 VanDerWaalsContact C-N 3.34Å; T328-L330 PolarHBondContact O-N 2.85Å; L330-V332 VanDerWaalsContact C-N 3.31Å; L330-V332 PolarHBondContact O-N 2.6Å; L330-K333 PolarHBondContact O-N 3.3Å; L330-Y334 PolarHBondContact O-N 3.47Å
331	L	75.6	Confident	68	Low	4 Å²	4	53 Å²	53	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-36.3	178.1	-71.7	168.5	0	0	0	112	I322 N327 T328 Y334 G335 I350 I354	I322-L331 HydrophobicContact CG2-CD2 3.83Å; N327-L331 PolarHBondContact O-N 3.4Å; T328-L331 PolarHBondContact O-N 3.01Å; L331-Y334 WeakPolarHBondContact O-CB 3.32Å; L331-Y334 PolarHBondContact O-N 2.85Å; L331-G335 PolarHBondContact O-N 2.93Å; L331-I350 HydrophobicContact CB-CG2 4.41Å; L331-I350 HydrophobicContact CD2-CG2 4.45Å; L331-I354 HydrophobicContact CB-CD1 3.57Å; L331-I354 HydrophobicContact CB-CG1 3.58Å; L331-I354 HydrophobicContact CD1-CG1 4.12Å; L331-I354 HydrophobicContact CG-CG1 4.48Å
332	V	78	Confident	69.3	Low	10 Å²	10	54 Å²	54	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-49.1	173.9	170.7	0	0	0	0	111.3	T328 L330 Y334 G335 D336 F351 I354 H361 L363 A364	T328-V332 WeakPolarHBondContact O-CG2 3.36Å; T328-V332 PolarHBondContact O-N 3.21Å; L330-V332 VanDerWaalsContact C-N 3.31Å; L330-V332 PolarHBondContact O-N 2.6Å; V332-Y334 PolarHBondContact O-N 3.24Å; V332-G335 PolarHBondContact O-N 3.47Å; V332-G335 VanDerWaalsContact O-N 3.13Å; V332-D336 PolarHBondContact O-N 3.1Å; V332-F351 HydrophobicContact CG1-CE1 4.48Å; V332-I354 HydrophobicContact CG2-CD1 3.82Å; V332-H361 VanDerWaalsContact CG2-NE2 3.33Å; V332-H361 WeakPolarHBondContact CG2-NE2 3.4Å; V332-L363 HydrophobicContact CG1-CB 4.38Å; V332-A364 HydrophobicContact CG2-CB 4.05Å
333	K	73	Confident	70.4	Confident	94 Å²	94	56 Å²	56	41%	0.409	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-34.7	178.3	-68.5	176.7	-177.7	174.2	0	111.9	L309 D329 L330 A337	L309-K333 HydrophobicContact CD1-CB 4.44Å; D329-K333 PolarHBondContact O-N 2.62Å; L330-K333 PolarHBondContact O-N 3.3Å; K333-A337 WeakPolarHBondContact O-CB 3.48Å; K333-A337 PolarHBondContact O-N 3.45Å
334	Y	73	Confident	71.8	Confident	27 Å²	27	55.4 Å²	55.4	11%	0.106	31%	0.312	C	S	.	.	H	α-helix	trans	-67.3	-44.4	173.7	-178.6	-124.2	0	0	0	112.1	L309 I322 L330 L331 V332 D336 A337 L338 I350	L309-Y334 HydrophobicContact CD2-CD2 3.97Å; I322-Y334 HydrophobicContact CG2-CD1 4.28Å; L330-Y334 PolarHBondContact O-N 3.47Å; L331-Y334 WeakPolarHBondContact O-CB 3.32Å; L331-Y334 PolarHBondContact O-N 2.85Å; V332-Y334 PolarHBondContact O-N 3.24Å; Y334-D336 VanDerWaalsContact C-N 3.33Å; Y334-D336 PolarHBondContact O-N 2.96Å; Y334-A337 WeakPolarHBondContact O-CB 3.26Å; Y334-A337 PolarHBondContact O-N 3.34Å; Y334-L338 HydrophobicContact CD1-CD1 4.11Å; Y334-L338 HydrophobicContact CE1-CD1 3.68Å; Y334-L338 HydrophobicContact CE2-CD1 4.13Å; Y334-L338 HydrophobicContact CE2-CG 4.23Å; Y334-L338 PolarHBondContact O-N 3.41Å; Y334-I350 HydrophobicContact CD1-CD1 3.49Å; Y334-I350 VanDerWaalsContact CD1-CD1 3.49Å; Y334-I350 HydrophobicContact CD1-CG1 4.31Å; Y334-I350 HydrophobicContact CD1-CG2 4.41Å; Y334-I350 HydrophobicContact CE1-CD1 3.26Å; Y334-I350 HydrophobicContact CE1-CG1 4.23Å
335	G	78.6	Confident	73.3	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-39.7	173.7	0	0	0	0	0	112.8	L331 V332 L338 S339	L331-G335 PolarHBondContact O-N 2.93Å; V332-G335 PolarHBondContact O-N 3.47Å; V332-G335 VanDerWaalsContact O-N 3.13Å; G335-L338 PolarHBondContact O-N 3.28Å; G335-S339 PolarHBondContact O-N 2.96Å
336	D	77.6	Confident	74.5	Confident	79 Å²	79	54.7 Å²	54.7	42%	0.422	31%	0.307	S	S	.	.	H	α-helix	trans	-65.1	-41.1	174.9	-71.6	-21.4	0	0	0	111.5	V332 Y334 S339 S340	V332-D336 PolarHBondContact O-N 3.1Å; Y334-D336 VanDerWaalsContact C-N 3.33Å; Y334-D336 PolarHBondContact O-N 2.96Å; D336-S339 WeakPolarHBondContact O-CB 3.25Å; D336-S339 PolarHBondContact O-N 3.45Å; D336-S340 PolarHBondContact O-N 3.26Å
337	A	70.7	Confident	75.8	Confident	26 Å²	26	51.1 Å²	51.1	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-43.6	174.8	0	0	0	0	0	111.5	K333 Y334 S339 S340 L341	K333-A337 WeakPolarHBondContact O-CB 3.48Å; K333-A337 PolarHBondContact O-N 3.45Å; Y334-A337 WeakPolarHBondContact O-CB 3.26Å; Y334-A337 PolarHBondContact O-N 3.34Å; A337-S339 VanDerWaalsContact C-N 3.34Å; A337-S339 PolarHBondContact O-N 3.27Å; A337-S340 WeakPolarHBondContact O-CB 3.36Å; A337-S340 PolarHBondContact O-N 2.94Å; A337-S340 PolarHBondContact O-OG 2.73Å; A337-L341 WeakPolarHBondContact O-CG 3.19Å; A337-L341 PolarHBondContact O-N 2.91Å
338	L	77.1	Confident	76.7	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-37.3	175.3	-73.5	167.6	0	0	0	112.6	Y334 G335 S340 L341 D342 K343 D346 A347 I350	Y334-L338 HydrophobicContact CD1-CD1 4.11Å; Y334-L338 HydrophobicContact CE1-CD1 3.68Å; Y334-L338 HydrophobicContact CE2-CD1 4.13Å; Y334-L338 HydrophobicContact CE2-CG 4.23Å; Y334-L338 PolarHBondContact O-N 3.41Å; G335-L338 PolarHBondContact O-N 3.28Å; L338-S340 PolarHBondContact O-N 3.02Å; L338-L341 CarbonylContact O-C 3.11Å; L338-L341 PolarHBondContact O-N 2.92Å; L338-L341 VanDerWaalsContact O-N 3.14Å; L338-D342 PolarHBondContact O-N 2.89Å; L338-K343 HydrophobicContact CD2-CB 4.08Å; L338-K343 HydrophobicContact CD2-CD 3.93Å; L338-K343 PolarHBondContact O-N 3.46Å; L338-K343 VanDerWaalsContact O-N 3.11Å; L338-D346 HydrophobicContact CD1-CB 4.36Å; L338-A347 HydrophobicContact CB-CB 3.91Å; L338-I350 HydrophobicContact CD1-CD1 3.03Å
339	S	77.4	Confident	77.4	Confident	26 Å²	26	54.4 Å²	54.4	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-62.2	-30.9	171.3	176.8	0	0	0	0	112.3	G335 D336 A337 L371	G335-S339 PolarHBondContact O-N 2.96Å; D336-S339 WeakPolarHBondContact O-CB 3.25Å; D336-S339 PolarHBondContact O-N 3.45Å; A337-S339 VanDerWaalsContact C-N 3.34Å; A337-S339 PolarHBondContact O-N 3.27Å; S339-L371 WeakPolarHBondContact OG-CD2 3.23Å
340	S	75.5	Confident	78.2	Confident	91 Å²	91	50.7 Å²	50.7	64%	0.636	26%	0.261	S	S	*	.	H	α-helix	trans	-79	-20.3	176.4	76.1	0	0	0	0	113.4	D336 A337 L338	D336-S340 PolarHBondContact O-N 3.26Å; A337-S340 WeakPolarHBondContact O-CB 3.36Å; A337-S340 PolarHBondContact O-N 2.94Å; A337-S340 PolarHBondContact O-OG 2.73Å; L338-S340 PolarHBondContact O-N 3.02Å
341	L	76.8	Confident	79.1	Confident	75 Å²	75	49.1 Å²	49.1	39%	0.393	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	13.5	178.4	-67.5	171.3	0	0	0	112.9	A337 L338 K343	A337-L341 WeakPolarHBondContact O-CG 3.19Å; A337-L341 PolarHBondContact O-N 2.91Å; L338-L341 CarbonylContact O-C 3.11Å; L338-L341 PolarHBondContact O-N 2.92Å; L338-L341 VanDerWaalsContact O-N 3.14Å; L341-K343 PolarHBondContact O-N 3.29Å; L341-K343 VanDerWaalsContact O-N 3.1Å
342	D	76.5	Confident	79.6	Confident	118 Å²	118	53.6 Å²	53.6	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	22.5	-177.8	-62.9	-29.1	0	0	0	114.8	L338 F344	L338-D342 PolarHBondContact O-N 2.89Å; D342-F344 VanDerWaalsContact C-CE2 3.48Å; D342-F344 VanDerWaalsContact CA-CE2 3.49Å; D342-F344 VanDerWaalsContact CA-CZ 3.45Å; D342-F344 HydrophobicContact CB-CE2 3.6Å; D342-F344 HydrophobicContact CB-CZ 3.69Å; D342-F344 WeakPolarHBondContact O-CD2 3.48Å; D342-F344 WeakPolarHBondContact O-CE2 3.33Å; D342-F344 PolarHBondContact O-N 3.23Å; D342-F344 VanDerWaalsContact OD1-CZ 3.28Å; D342-F344 WeakPolarHBondContact OD1-CZ 2.96Å
343	K	78.9	Confident	79.9	Confident	64 Å²	64	56.3 Å²	56.3	28%	0.278	29%	0.285	S	S	.	.			trans	-95	74	174.8	-70.1	-175.3	-180	177	0	110.6	L338 L341 A347	L338-K343 HydrophobicContact CD2-CB 4.08Å; L338-K343 HydrophobicContact CD2-CD 3.93Å; L338-K343 PolarHBondContact O-N 3.46Å; L338-K343 VanDerWaalsContact O-N 3.11Å; L341-K343 PolarHBondContact O-N 3.29Å; L341-K343 VanDerWaalsContact O-N 3.1Å; K343-A347 WeakPolarHBondContact O-CB 3.5Å; K343-A347 PolarHBondContact O-N 2.92Å; K343-A347 VanDerWaalsContact O-N 3.15Å
344	F	81.1	Confident	80.4	Confident	50 Å²	50	51.9 Å²	51.9	22%	0.219	27%	0.266	C	S	.	.	H	α-helix	trans	-71.7	-42.2	-166.9	-54.4	-74.9	0	0	0	114.4	D342 D346 A347 M348 L371 Y375	D342-F344 VanDerWaalsContact C-CE2 3.48Å; D342-F344 VanDerWaalsContact CA-CE2 3.49Å; D342-F344 VanDerWaalsContact CA-CZ 3.45Å; D342-F344 HydrophobicContact CB-CE2 3.6Å; D342-F344 HydrophobicContact CB-CZ 3.69Å; D342-F344 WeakPolarHBondContact O-CD2 3.48Å; D342-F344 WeakPolarHBondContact O-CE2 3.33Å; D342-F344 PolarHBondContact O-N 3.23Å; D342-F344 VanDerWaalsContact OD1-CZ 3.28Å; D342-F344 WeakPolarHBondContact OD1-CZ 2.96Å; F344-D346 VanDerWaalsContact C-N 3.3Å; F344-D346 PolarHBondContact O-N 2.68Å; F344-A347 PolarHBondContact O-N 2.8Å; F344-M348 WeakPolarHBondContact O-CG 3.33Å; F344-M348 PolarHBondContact O-N 3.05Å; F344-L371 HydrophobicContact CD1-CD2 4.13Å; F344-Y375 HydrophobicContact CB-CD2 4.47Å; F344-Y375 HydrophobicContact CB-CE1 4.41Å; F344-Y375 HydrophobicContact CB-CE2 3.68Å; F344-Y375 AromaticContact CD1-CE2 3.33Å; F344-Y375 HydrophobicContact CD1-CE2 3.33Å; F344-Y375 AromaticContact CD1-CZ 3.48Å; F344-Y375 VanDerWaalsContact CD1-CZ 3.48Å; F344-Y375 WeakPolarHBondContact CD1-OH 3.46Å; F344-Y375 HydrophobicContact CD2-CE1 4.2Å; F344-Y375 HydrophobicContact CD2-CE2 4.18Å; F344-Y375 AromaticContact CD2-CZ 3.48Å; F344-Y375 VanDerWaalsContact CD2-CZ 3.48Å; F344-Y375 WeakPolarHBondContact CD2-OH 3.4Å; F344-Y375 AromaticContact CE1-CE2 3.94Å; F344-Y375 HydrophobicContact CE1-CE2 3.94Å; F344-Y375 AromaticContact CE1-CZ 3.88Å; F344-Y375 WeakPolarHBondContact CE1-OH 3.3Å; F344-Y375 AromaticContact CE2-CZ 3.89Å; F344-Y375 WeakPolarHBondContact CE2-OH 3.44Å; F344-Y375 HydrophobicContact CG-CE1 4.2Å; F344-Y375 AromaticContact CG-CE2 3.44Å; F344-Y375 HydrophobicContact CG-CE2 3.44Å; F344-Y375 VanDerWaalsContact CG-CE2 3.44Å; F344-Y375 AromaticContact CG-CZ 3.23Å; F344-Y375 WeakPolarHBondContact CG-OH 3.29Å; F344-Y375 WeakPolarHBondContact CZ-OH 3.4Å
345	E	83.8	Confident	80.7	Confident	148 Å²	148	52 Å²	52	69%	0.692	27%	0.268	S	S	*	.	H	α-helix	trans	-62.7	-39.8	-179.6	-65.3	-175.7	179.8	0	0	111.7	M348 K349	E345-M348 PolarHBondContact O-N 3.22Å; E345-K349 WeakPolarHBondContact O-CG 3.3Å; E345-K349 PolarHBondContact O-N 3.45Å; E345-K349 VanDerWaalsContact O-N 3.08Å
346	D	79.8	Confident	80.9	Confident	55 Å²	55	56 Å²	56	29%	0.294	30%	0.301	S	S	.	.	H	α-helix	trans	-72.6	-40.6	-180	-58.2	-31.5	0	0	0	111	L338 F344 M348 K349 I350	L338-D346 HydrophobicContact CD1-CB 4.36Å; F344-D346 VanDerWaalsContact C-N 3.3Å; F344-D346 PolarHBondContact O-N 2.68Å; D346-M348 VanDerWaalsContact C-N 3.32Å; D346-M348 PolarHBondContact O-N 3.07Å; D346-K349 PolarHBondContact O-N 3.42Å; D346-K349 IonicContact OD1-NZ 2.58Å; D346-I350 VanDerWaalsContact O-CD1 3.29Å; D346-I350 WeakPolarHBondContact O-CD1 3.4Å; D346-I350 WeakPolarHBondContact O-CG1 3.22Å; D346-I350 PolarHBondContact O-N 3.45Å
347	A	84.8	Confident	81.1	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.1	-44.3	172.2	0	0	0	0	0	111.6	L338 K343 F344 I350 F351 L371	L338-A347 HydrophobicContact CB-CB 3.91Å; K343-A347 WeakPolarHBondContact O-CB 3.5Å; K343-A347 PolarHBondContact O-N 2.92Å; K343-A347 VanDerWaalsContact O-N 3.15Å; F344-A347 PolarHBondContact O-N 2.8Å; A347-I350 PolarHBondContact O-N 3.08Å; A347-F351 HydrophobicContact CB-CE2 4.29Å; A347-F351 WeakPolarHBondContact O-CD2 3.36Å; A347-F351 PolarHBondContact O-N 3.28Å; A347-L371 HydrophobicContact CB-CD1 3.93Å
348	M	86.6	Confident	81.1	Confident	28 Å²	28	57.1 Å²	57.1	14%	0.138	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-47.4	177.3	-73.7	-179.6	63	0	0	112.1	F344 E345 D346 I350 F351 E352 L368 Q372 L377	F344-M348 WeakPolarHBondContact O-CG 3.33Å; F344-M348 PolarHBondContact O-N 3.05Å; E345-M348 PolarHBondContact O-N 3.22Å; D346-M348 VanDerWaalsContact C-N 3.32Å; D346-M348 PolarHBondContact O-N 3.07Å; M348-I350 VanDerWaalsContact C-N 3.27Å; M348-I350 PolarHBondContact O-N 3.28Å; M348-F351 PolarHBondContact O-N 3.08Å; M348-E352 WeakPolarHBondContact O-CB 3.43Å; M348-E352 WeakPolarHBondContact O-CG 3.27Å; M348-E352 PolarHBondContact O-N 3.03Å; M348-L368 HydrophobicContact CB-CD1 4.13Å; M348-L368 HydrophobicContact CE-CD1 4.4Å; M348-L368 HydrophobicContact CG-CD1 3.98Å; M348-Q372 HydrophobicContact CE-CG 3.79Å; M348-L377 HydrophobicContact CE-CD1 3.91Å
349	K	86.7	Confident	80.9	Confident	119 Å²	119	60.4 Å²	60.4	52%	0.517	33%	0.328	S	S	.	.	H	α-helix	trans	-58.2	-39.1	177.1	-71.3	169	-168	159.1	0	112.4	E345 D346 H353	E345-K349 WeakPolarHBondContact O-CG 3.3Å; E345-K349 PolarHBondContact O-N 3.45Å; E345-K349 VanDerWaalsContact O-N 3.08Å; D346-K349 PolarHBondContact O-N 3.42Å; D346-K349 IonicContact OD1-NZ 2.58Å; K349-H353 WeakPolarHBondContact O-CB 3.41Å; K349-H353 PolarHBondContact O-N 3.07Å
350	I	83.6	Confident	80.3	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.062	34%	0.342	C	S	.	.	H	α-helix	trans	-68.4	-44.9	178.2	-70	155	0	0	0	110.7	L331 Y334 L338 D346 A347 M348 E352 H353 I354	L331-I350 HydrophobicContact CB-CG2 4.41Å; L331-I350 HydrophobicContact CD2-CG2 4.45Å; Y334-I350 HydrophobicContact CD1-CD1 3.49Å; Y334-I350 VanDerWaalsContact CD1-CD1 3.49Å; Y334-I350 HydrophobicContact CD1-CG1 4.31Å; Y334-I350 HydrophobicContact CD1-CG2 4.41Å; Y334-I350 HydrophobicContact CE1-CD1 3.26Å; Y334-I350 HydrophobicContact CE1-CG1 4.23Å; L338-I350 HydrophobicContact CD1-CD1 3.03Å; D346-I350 VanDerWaalsContact O-CD1 3.29Å; D346-I350 WeakPolarHBondContact O-CD1 3.4Å; D346-I350 WeakPolarHBondContact O-CG1 3.22Å; D346-I350 PolarHBondContact O-N 3.45Å; A347-I350 PolarHBondContact O-N 3.08Å; M348-I350 VanDerWaalsContact C-N 3.27Å; M348-I350 PolarHBondContact O-N 3.28Å; I350-E352 VanDerWaalsContact C-N 3.35Å; I350-E352 PolarHBondContact O-N 2.94Å; I350-H353 WeakPolarHBondContact O-CB 3.16Å; I350-H353 PolarHBondContact O-N 2.58Å; I350-I354 HydrophobicContact CG2-CD1 3.99Å; I350-I354 HydrophobicContact CG2-CG1 4.48Å; I350-I354 VanDerWaalsContact O-CG1 3.26Å; I350-I354 WeakPolarHBondContact O-CG1 3.14Å; I350-I354 PolarHBondContact O-N 2.94Å
351	F	86.4	Confident	80.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.8	-38	176.8	-66.3	-57.3	0	0	0	112.4	V332 A347 M348 H353 I354 I355 A364 S367 L368 L371	V332-F351 HydrophobicContact CG1-CE1 4.48Å; A347-F351 HydrophobicContact CB-CE2 4.29Å; A347-F351 WeakPolarHBondContact O-CD2 3.36Å; A347-F351 PolarHBondContact O-N 3.28Å; M348-F351 PolarHBondContact O-N 3.08Å; F351-H353 VanDerWaalsContact C-N 3.32Å; F351-H353 PolarHBondContact O-N 3.47Å; F351-I354 HydrophobicContact CD1-CD1 3.87Å; F351-I354 HydrophobicContact CE1-CD1 4.4Å; F351-I354 PolarHBondContact O-N 3.32Å; F351-I355 WeakPolarHBondContact O-CD1 3.48Å; F351-I355 VanDerWaalsContact O-CG1 3.26Å; F351-I355 WeakPolarHBondContact O-CG1 3.07Å; F351-I355 PolarHBondContact O-N 3.4Å; F351-A364 HydrophobicContact CD1-CB 3.98Å; F351-S367 WeakPolarHBondContact CD1-OG 3.47Å; F351-S367 WeakPolarHBondContact CE1-OG 3.22Å; F351-S367 VanDerWaalsContact CZ-CB 3.47Å; F351-S367 WeakPolarHBondContact CZ-OG 3.45Å; F351-L368 HydrophobicContact CB-CB 3.83Å; F351-L368 HydrophobicContact CB-CD1 4.19Å; F351-L368 HydrophobicContact CB-CD2 4.42Å; F351-L368 HydrophobicContact CB-CG 4.36Å; F351-L368 HydrophobicContact CG-CB 4.42Å; F351-L371 HydrophobicContact CD2-CD1 3.74Å; F351-L371 HydrophobicContact CE2-CD1 3.54Å
352	E	86.3	Confident	79.8	Confident	98 Å²	98	56.2 Å²	56.2	46%	0.458	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-42.3	171.3	-74.5	175.4	-179.2	0	0	111.6	M348 I350 I355 A356 L368	M348-E352 WeakPolarHBondContact O-CB 3.43Å; M348-E352 WeakPolarHBondContact O-CG 3.27Å; M348-E352 PolarHBondContact O-N 3.03Å; I350-E352 VanDerWaalsContact C-N 3.35Å; I350-E352 PolarHBondContact O-N 2.94Å; E352-I355 PolarHBondContact O-N 2.88Å; E352-A356 WeakPolarHBondContact O-CB 3.21Å; E352-A356 PolarHBondContact O-N 3.14Å; E352-L368 HydrophobicContact CG-CD2 3.9Å
353	H	84.3	Confident	79.7	Confident	67 Å²	67	54.5 Å²	54.5	31%	0.31	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-42.4	173.6	-174.7	-38.5	0	0	0	111.9	K349 I350 F351 I355 A356 V357	K349-H353 WeakPolarHBondContact O-CB 3.41Å; K349-H353 PolarHBondContact O-N 3.07Å; I350-H353 WeakPolarHBondContact O-CB 3.16Å; I350-H353 PolarHBondContact O-N 2.58Å; F351-H353 VanDerWaalsContact C-N 3.32Å; F351-H353 PolarHBondContact O-N 3.47Å; H353-I355 VanDerWaalsContact C-N 3.28Å; H353-I355 PolarHBondContact O-N 3.33Å; H353-A356 PolarHBondContact O-N 3.45Å; H353-V357 VanDerWaalsContact CE1-CG2 3.4Å; H353-V357 WeakPolarHBondContact CE1-CG2 3.32Å; H353-V357 WeakPolarHBondContact ND1-CG2 3.22Å; H353-V357 WeakPolarHBondContact O-CG2 3.46Å; H353-V357 PolarHBondContact O-N 3.39Å
354	I	83.3	Confident	79.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-42.1	177.9	-65	161.4	0	0	0	110.1	T328 L331 V332 I350 F351 A356 V357 D358 H361 A364	T328-I354 HydrophobicContact CG2-CG2 4.3Å; L331-I354 HydrophobicContact CB-CD1 3.57Å; L331-I354 HydrophobicContact CB-CG1 3.58Å; L331-I354 HydrophobicContact CD1-CG1 4.12Å; L331-I354 HydrophobicContact CG-CG1 4.48Å; V332-I354 HydrophobicContact CG2-CD1 3.82Å; I350-I354 HydrophobicContact CG2-CD1 3.99Å; I350-I354 HydrophobicContact CG2-CG1 4.48Å; I350-I354 VanDerWaalsContact O-CG1 3.26Å; I350-I354 WeakPolarHBondContact O-CG1 3.14Å; I350-I354 PolarHBondContact O-N 2.94Å; F351-I354 HydrophobicContact CD1-CD1 3.87Å; F351-I354 HydrophobicContact CE1-CD1 4.4Å; F351-I354 PolarHBondContact O-N 3.32Å; I354-A356 VanDerWaalsContact C-N 3.33Å; I354-A356 PolarHBondContact O-N 2.81Å; I354-V357 PolarHBondContact O-N 3.31Å; I354-D358 PolarHBondContact O-N 2.86Å; I354-H361 HydrophobicContact CG2-CB 4.16Å; I354-A364 HydrophobicContact CB-CB 3.9Å; I354-A364 HydrophobicContact CD1-CB 4.19Å; I354-A364 HydrophobicContact CG2-CB 3.48Å; I354-A364 VanDerWaalsContact CG2-CB 3.48Å
355	I	79.8	Confident	79.6	Confident	31 Å²	31	50.4 Å²	50.4	16%	0.159	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-34.7	178.1	-65.4	162.5	0	0	0	111.4	F351 E352 H353 V357 D358 P359 A364 R365 L368 T384	F351-I355 WeakPolarHBondContact O-CD1 3.48Å; F351-I355 VanDerWaalsContact O-CG1 3.26Å; F351-I355 WeakPolarHBondContact O-CG1 3.07Å; F351-I355 PolarHBondContact O-N 3.4Å; E352-I355 PolarHBondContact O-N 2.88Å; H353-I355 VanDerWaalsContact C-N 3.28Å; H353-I355 PolarHBondContact O-N 3.33Å; I355-V357 VanDerWaalsContact C-N 3.35Å; I355-D358 CarbonylContact O-C 3.57Å; I355-P359 WeakPolarHBondContact O-CA 3.32Å; I355-A364 HydrophobicContact CG1-CB 4.49Å; I355-R365 HydrophobicContact CD1-CG 3.77Å; I355-R365 HydrophobicContact CG1-CG 3.81Å; I355-L368 HydrophobicContact CD1-CB 4.4Å; I355-L368 HydrophobicContact CD1-CD2 3.43Å; I355-L368 VanDerWaalsContact CD1-CD2 3.43Å; I355-T384 HydrophobicContact CD1-CG2 4.03Å
356	A	83	Confident	79.2	Confident	83 Å²	83	44.4 Å²	44.4	69%	0.686	25%	0.247	S	C	*	.	H	α-helix	trans	-67	-34.6	175.1	0	0	0	0	0	112.7	E352 H353 I354	E352-A356 WeakPolarHBondContact O-CB 3.21Å; E352-A356 PolarHBondContact O-N 3.14Å; H353-A356 PolarHBondContact O-N 3.45Å; I354-A356 VanDerWaalsContact C-N 3.33Å; I354-A356 PolarHBondContact O-N 2.81Å
357	V	80.5	Confident	79.2	Confident	79 Å²	79	42.5 Å²	42.5	48%	0.479	24%	0.238	S	C	.	.	H	α-helix	trans	-80.4	-48.4	178.2	174.2	0	0	0	0	111.7	T328 H353 I354 I355	T328-V357 HydrophobicContact CG2-CG1 4.34Å; H353-V357 VanDerWaalsContact CE1-CG2 3.4Å; H353-V357 WeakPolarHBondContact CE1-CG2 3.32Å; H353-V357 WeakPolarHBondContact ND1-CG2 3.22Å; H353-V357 WeakPolarHBondContact O-CG2 3.46Å; H353-V357 PolarHBondContact O-N 3.39Å; I354-V357 PolarHBondContact O-N 3.31Å; I355-V357 VanDerWaalsContact C-N 3.35Å
358	D	71.8	Confident	79.3	Confident	50 Å²	50	42.6 Å²	42.6	27%	0.267	24%	0.238	S	C	.	.			trans	-125.7	91.1	178	-176.9	6.3	0	0	0	110.2	T328 I354 I355 C360 H361	T328-D358 HydrophobicContact CG2-CB 3.87Å; I354-D358 PolarHBondContact O-N 2.86Å; I355-D358 CarbonylContact O-C 3.57Å; D358-C360 PolarHBondContact O-N 3.24Å; D358-C360 WeakPolarHBondContact OD1-CA 3.42Å; D358-C360 WeakPolarHBondContact OD1-CB 3.47Å; D358-C360 PolarHBondContact OD1-N 3.08Å; D358-H361 HydrophobicContact CB-CB 4.06Å; D358-H361 WeakPolarHBondContact O-CB 3.43Å; D358-H361 PolarHBondContact O-N 3.45Å; D358-H361 IonicContact OD2-ND1 2.69Å
359	P	72.6	Confident	79	Confident	74 Å²	74	41.4 Å²	41.4	48%	0.481	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	5.5	173.7	-19.9	32	0	0	0	113.7	I355 R365	I355-P359 WeakPolarHBondContact O-CA 3.32Å; P359-R365 VanDerWaalsContact C-NH1 3.28Å; P359-R365 PolarHBondContact O-NH1 2.99Å; P359-R365 PolarHBondContact O-NH2 3.23Å
360	C	65.1	Low	78.7	Confident	70 Å²	70	38.2 Å²	38.2	47%	0.473	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-0.5	172.2	-61.9	0	0	0	0	112.3	D358 A362	D358-C360 PolarHBondContact O-N 3.24Å; D358-C360 WeakPolarHBondContact OD1-CA 3.42Å; D358-C360 WeakPolarHBondContact OD1-CB 3.47Å; D358-C360 PolarHBondContact OD1-N 3.08Å; C360-A362 PolarHBondContact O-N 3.19Å; C360-A362 VanDerWaalsContact O-N 3.09Å
361	H	72.6	Confident	78.8	Confident	21 Å²	21	37.8 Å²	37.8	10%	0.097	22%	0.221	C	C	.	.			trans	-74.9	103.9	-173.2	-158.5	80.6	0	0	0	112.8	D329 V332 I354 D358 A364 R365	D329-H361 IonicContact OD1-CE1 3.71Å; D329-H361 PolarHBondContact OD1-CE1 3.32Å; V332-H361 VanDerWaalsContact CG2-NE2 3.33Å; V332-H361 WeakPolarHBondContact CG2-NE2 3.4Å; I354-H361 HydrophobicContact CG2-CB 4.16Å; D358-H361 HydrophobicContact CB-CB 4.06Å; D358-H361 WeakPolarHBondContact O-CB 3.43Å; D358-H361 PolarHBondContact O-N 3.45Å; D358-H361 IonicContact OD2-ND1 2.69Å; H361-A364 PolarHBondContact CD2-N 3.5Å; H361-R365 PolarHBondContact O-N 3.13Å
362	A	68.3	Low	78.9	Confident	14 Å²	14	38 Å²	38	12%	0.116	22%	0.222	C	C	.	.	H	α-helix	trans	-72.8	-39.1	-171.3	0	0	0	0	0	114.6	C360 A364 R365 L366 D400	C360-A362 PolarHBondContact O-N 3.19Å; C360-A362 VanDerWaalsContact O-N 3.09Å; A362-A364 PolarHBondContact O-N 3.36Å; A362-R365 PolarHBondContact O-N 3.13Å; A362-L366 WeakPolarHBondContact O-CB 3.26Å; A362-L366 WeakPolarHBondContact O-CG 3.27Å; A362-L366 PolarHBondContact O-N 2.86Å; A362-D400 HydrophobicContact CB-CB 3.25Å; A362-D400 WeakPolarHBondContact CB-OD2 3.39Å
363	L	73.8	Confident	78.7	Confident	82 Å²	82	35.3 Å²	35.3	43%	0.429	21%	0.209	S	C	.	.	H	α-helix	trans	-65.4	-40.5	-177.8	-67.4	176.1	0	0	0	112	V332 L366 S367	V332-L363 HydrophobicContact CG1-CB 4.38Å; L363-L366 WeakPolarHBondContact O-CB 3.26Å; L363-L366 PolarHBondContact O-N 3.42Å; L363-S367 PolarHBondContact O-N 2.94Å; L363-S367 PolarHBondContact O-OG 3Å; L363-S367 VanDerWaalsContact O-OG 3.09Å
364	A	78.2	Confident	78.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-37.8	177.6	0	0	0	0	0	112.7	V332 F351 I354 I355 H361 A362 S367 L368	V332-A364 HydrophobicContact CG2-CB 4.05Å; F351-A364 HydrophobicContact CD1-CB 3.98Å; I354-A364 HydrophobicContact CB-CB 3.9Å; I354-A364 HydrophobicContact CD1-CB 4.19Å; I354-A364 HydrophobicContact CG2-CB 3.48Å; I354-A364 VanDerWaalsContact CG2-CB 3.48Å; I355-A364 HydrophobicContact CG1-CB 4.49Å; H361-A364 PolarHBondContact CD2-N 3.5Å; A362-A364 PolarHBondContact O-N 3.36Å; A364-S367 VanDerWaalsContact CA-OG 3.31Å; A364-S367 WeakPolarHBondContact CA-OG 3.08Å; A364-S367 PolarHBondContact O-OG 2.99Å; A364-L368 VanDerWaalsContact O-CB 3.23Å; A364-L368 WeakPolarHBondContact O-CB 3.23Å; A364-L368 PolarHBondContact O-N 3.45Å
365	R	81.2	Confident	78.7	Confident	28 Å²	28	44.4 Å²	44.4	11%	0.106	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-41.7	173.4	-75.9	-165.9	173.3	100.1	-2.9	112.2	I355 P359 H361 A362 L368 A369 T384 L403	I355-R365 HydrophobicContact CD1-CG 3.77Å; I355-R365 HydrophobicContact CG1-CG 3.81Å; P359-R365 VanDerWaalsContact C-NH1 3.28Å; P359-R365 PolarHBondContact O-NH1 2.99Å; P359-R365 PolarHBondContact O-NH2 3.23Å; H361-R365 PolarHBondContact O-N 3.13Å; A362-R365 PolarHBondContact O-N 3.13Å; R365-L368 PolarHBondContact O-N 3.43Å; R365-A369 VanDerWaalsContact O-CB 3.22Å; R365-A369 WeakPolarHBondContact O-CB 3.43Å; R365-A369 PolarHBondContact O-N 2.93Å; R365-T384 HydrophobicContact CB-CG2 4.4Å; R365-T384 WeakPolarHBondContact CD-O 3.42Å; R365-T384 HydrophobicContact CG-CG2 4.34Å; R365-L403 HydrophobicContact CB-CD1 3.61Å
366	L	74.9	Confident	78.8	Confident	22 Å²	22	44.6 Å²	44.6	12%	0.115	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-51.2	175.8	-81.9	173.7	0	0	0	110.8	A362 L363 L368 A369 T370 R402 L403 E406	A362-L366 WeakPolarHBondContact O-CB 3.26Å; A362-L366 WeakPolarHBondContact O-CG 3.27Å; A362-L366 PolarHBondContact O-N 2.86Å; L363-L366 WeakPolarHBondContact O-CB 3.26Å; L363-L366 PolarHBondContact O-N 3.42Å; L366-L368 PolarHBondContact O-N 3.34Å; L366-A369 PolarHBondContact O-N 3.48Å; L366-T370 WeakPolarHBondContact O-CB 3.26Å; L366-T370 WeakPolarHBondContact O-CG2 3.42Å; L366-T370 PolarHBondContact O-N 3.3Å; L366-T370 PolarHBondContact O-OG1 3.06Å; L366-R402 HydrophobicContact CD1-CB 3.81Å; L366-L403 HydrophobicContact CD2-CB 4.43Å; L366-L403 HydrophobicContact CD2-CD1 3.93Å; L366-L403 HydrophobicContact CG-CB 4.38Å; L366-L403 HydrophobicContact CG-CD1 3.72Å; L366-E406 HydrophobicContact CD2-CB 3.62Å; L366-E406 HydrophobicContact CD2-CG 3.58Å
367	S	80.4	Confident	78.8	Confident	14 Å²	14	44 Å²	44	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-43.6	178.3	57.5	0	0	0	0	111.4	F351 L363 A364 T370 L371	F351-S367 WeakPolarHBondContact CD1-OG 3.47Å; F351-S367 WeakPolarHBondContact CE1-OG 3.22Å; F351-S367 VanDerWaalsContact CZ-CB 3.47Å; F351-S367 WeakPolarHBondContact CZ-OG 3.45Å; L363-S367 PolarHBondContact O-N 2.94Å; L363-S367 PolarHBondContact O-OG 3Å; L363-S367 VanDerWaalsContact O-OG 3.09Å; A364-S367 VanDerWaalsContact CA-OG 3.31Å; A364-S367 WeakPolarHBondContact CA-OG 3.08Å; A364-S367 PolarHBondContact O-OG 2.99Å; S367-T370 WeakPolarHBondContact CA-OG1 3.12Å; S367-T370 PolarHBondContact O-N 3.43Å; S367-T370 PolarHBondContact O-OG1 2.92Å; S367-L371 WeakPolarHBondContact O-CB 3.18Å; S367-L371 WeakPolarHBondContact O-CG 3.09Å; S367-L371 PolarHBondContact O-N 2.89Å
368	L	85.4	Confident	78.6	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-60.7	-48.2	175.1	-176.3	56.6	0	0	0	112.4	M348 F351 E352 I355 A364 R365 L366 T370 L371 Q372 T384	M348-L368 HydrophobicContact CB-CD1 4.13Å; M348-L368 HydrophobicContact CE-CD1 4.4Å; M348-L368 HydrophobicContact CG-CD1 3.98Å; F351-L368 HydrophobicContact CB-CB 3.83Å; F351-L368 HydrophobicContact CB-CD1 4.19Å; F351-L368 HydrophobicContact CB-CD2 4.42Å; F351-L368 HydrophobicContact CB-CG 4.36Å; F351-L368 HydrophobicContact CG-CB 4.42Å; E352-L368 HydrophobicContact CG-CD2 3.9Å; I355-L368 HydrophobicContact CD1-CB 4.4Å; I355-L368 HydrophobicContact CD1-CD2 3.43Å; I355-L368 VanDerWaalsContact CD1-CD2 3.43Å; A364-L368 VanDerWaalsContact O-CB 3.23Å; A364-L368 WeakPolarHBondContact O-CB 3.23Å; A364-L368 PolarHBondContact O-N 3.45Å; R365-L368 PolarHBondContact O-N 3.43Å; L366-L368 PolarHBondContact O-N 3.34Å; L368-T370 VanDerWaalsContact C-N 3.33Å; L368-T370 PolarHBondContact O-N 2.92Å; L368-L371 PolarHBondContact O-N 3.2Å; L368-Q372 HydrophobicContact CD1-CG 4.13Å; L368-Q372 HydrophobicContact CG-CG 4.38Å; L368-Q372 WeakPolarHBondContact O-CB 3.31Å; L368-Q372 WeakPolarHBondContact O-CG 3.32Å; L368-Q372 PolarHBondContact O-N 3.47Å; L368-T384 HydrophobicContact CB-CG2 4.24Å; L368-T384 HydrophobicContact CD2-CG2 3.7Å; L368-T384 HydrophobicContact CG-CG2 4.05Å
369	A	80.6	Confident	78.9	Confident	2 Å²	2	48.3 Å²	48.3	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-38.5	179.5	0	0	0	0	0	111.9	R365 L366 Q373 A381 L385	R365-A369 VanDerWaalsContact O-CB 3.22Å; R365-A369 WeakPolarHBondContact O-CB 3.43Å; R365-A369 PolarHBondContact O-N 2.93Å; L366-A369 PolarHBondContact O-N 3.48Å; A369-Q373 VanDerWaalsContact O-CB 3.27Å; A369-Q373 WeakPolarHBondContact O-CB 3.25Å; A369-Q373 PolarHBondContact O-N 3.27Å; A369-A381 HydrophobicContact CB-CB 4.47Å; A369-L385 HydrophobicContact CB-CD1 3.85Å; A369-L385 HydrophobicContact CB-CD2 3.81Å; A369-L385 HydrophobicContact CB-CG 3.72Å
370	T	81.8	Confident	79.3	Confident	53 Å²	53	47.1 Å²	47.1	33%	0.325	24%	0.243	S	C	.	.	H	α-helix	trans	-67.6	-37.3	175.8	64.5	0	0	0	0	111.9	L366 S367 L368 K374	L366-T370 WeakPolarHBondContact O-CB 3.26Å; L366-T370 WeakPolarHBondContact O-CG2 3.42Å; L366-T370 PolarHBondContact O-N 3.3Å; L366-T370 PolarHBondContact O-OG1 3.06Å; S367-T370 WeakPolarHBondContact CA-OG1 3.12Å; S367-T370 PolarHBondContact O-N 3.43Å; S367-T370 PolarHBondContact O-OG1 2.92Å; L368-T370 VanDerWaalsContact C-N 3.33Å; L368-T370 PolarHBondContact O-N 2.92Å; T370-K374 WeakPolarHBondContact O-CG 3.48Å; T370-K374 PolarHBondContact O-N 3.32Å
371	L	85.4	Confident	79.8	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-53.6	172.4	-78.5	175.5	0	0	0	110.9	S339 F344 A347 F351 S367 L368 Q373 K374 Y375	S339-L371 WeakPolarHBondContact OG-CD2 3.23Å; F344-L371 HydrophobicContact CD1-CD2 4.13Å; A347-L371 HydrophobicContact CB-CD1 3.93Å; F351-L371 HydrophobicContact CD2-CD1 3.74Å; F351-L371 HydrophobicContact CE2-CD1 3.54Å; S367-L371 WeakPolarHBondContact O-CB 3.18Å; S367-L371 WeakPolarHBondContact O-CG 3.09Å; S367-L371 PolarHBondContact O-N 2.89Å; L368-L371 PolarHBondContact O-N 3.2Å; L371-Q373 PolarHBondContact O-N 3.38Å; L371-K374 WeakPolarHBondContact O-CA 3.31Å; L371-K374 WeakPolarHBondContact O-CB 3.48Å; L371-K374 PolarHBondContact O-N 3.35Å; L371-Y375 VanDerWaalsContact O-CD2 3.24Å; L371-Y375 WeakPolarHBondContact O-CD2 3.38Å; L371-Y375 PolarHBondContact O-N 3.46Å; L371-Y375 VanDerWaalsContact O-N 3.09Å
372	Q	87.3	Confident	79.8	Confident	6 Å²	6	43.7 Å²	43.7	3%	0.028	22%	0.22	C	C	.	.	H	α-helix	trans	-54.9	-38.3	176.9	-74.2	167.4	-21.8	0	0	111.8	M348 L368 Y375 G376 L377 D380 A381 T384	M348-Q372 HydrophobicContact CE-CG 3.79Å; L368-Q372 HydrophobicContact CD1-CG 4.13Å; L368-Q372 HydrophobicContact CG-CG 4.38Å; L368-Q372 WeakPolarHBondContact O-CB 3.31Å; L368-Q372 WeakPolarHBondContact O-CG 3.32Å; L368-Q372 PolarHBondContact O-N 3.47Å; Q372-Y375 CarbonylContact O-C 3.57Å; Q372-Y375 PolarHBondContact O-N 3.46Å; Q372-G376 PolarHBondContact O-N 3.29Å; Q372-G376 VanDerWaalsContact O-N 3.11Å; Q372-L377 HydrophobicContact CB-CB 4.1Å; Q372-L377 HydrophobicContact CG-CB 4.42Å; Q372-L377 PolarHBondContact O-N 3.2Å; Q372-D380 PolarHBondContact OE1-O 3.1Å; Q372-A381 HydrophobicContact CB-CB 3.91Å; Q372-T384 PolarHBondContact NE2-OG1 2.95Å; Q372-T384 PolarHBondContact OE1-OG1 3.11Å; Q372-T384 VanDerWaalsContact OE1-OG1 3.09Å
373	Q	82.6	Confident	80.2	Confident	40 Å²	40	50.9 Å²	50.9	19%	0.187	24%	0.244	C	C	.	.	H	α-helix	trans	-64.5	-43.4	174	-174.2	175.3	28	0	0	112.7	A369 L371 Y375 G376 Y378	A369-Q373 VanDerWaalsContact O-CB 3.27Å; A369-Q373 WeakPolarHBondContact O-CB 3.25Å; A369-Q373 PolarHBondContact O-N 3.27Å; L371-Q373 PolarHBondContact O-N 3.38Å; Q373-Y375 PolarHBondContact O-N 3.02Å; Q373-G376 PolarHBondContact O-N 2.81Å; Q373-G376 VanDerWaalsContact O-N 3.15Å; Q373-Y378 HydrophobicContact CG-CD1 4.37Å; Q373-Y378 HydrophobicContact CG-CE1 4.02Å
374	K	82.6	Confident	80.2	Confident	151 Å²	151	48.1 Å²	48.1	66%	0.657	23%	0.231	S	C	*	.	H	α-helix	trans	-59.7	-33.4	175.6	-73.9	174.1	-177.7	178.7	0	111.9	T370 L371	T370-K374 WeakPolarHBondContact O-CG 3.48Å; T370-K374 PolarHBondContact O-N 3.32Å; L371-K374 WeakPolarHBondContact O-CA 3.31Å; L371-K374 WeakPolarHBondContact O-CB 3.48Å; L371-K374 PolarHBondContact O-N 3.35Å
375	Y	84.1	Confident	79.7	Confident	108 Å²	108	48.2 Å²	48.2	42%	0.424	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	0.1	178.4	-75.9	-78	0	0	0	114.8	F344 L371 Q372 Q373 L377	F344-Y375 HydrophobicContact CB-CD2 4.47Å; F344-Y375 HydrophobicContact CB-CE1 4.41Å; F344-Y375 HydrophobicContact CB-CE2 3.68Å; F344-Y375 AromaticContact CD1-CE2 3.33Å; F344-Y375 HydrophobicContact CD1-CE2 3.33Å; F344-Y375 AromaticContact CD1-CZ 3.48Å; F344-Y375 VanDerWaalsContact CD1-CZ 3.48Å; F344-Y375 WeakPolarHBondContact CD1-OH 3.46Å; F344-Y375 HydrophobicContact CD2-CE1 4.2Å; F344-Y375 HydrophobicContact CD2-CE2 4.18Å; F344-Y375 AromaticContact CD2-CZ 3.48Å; F344-Y375 VanDerWaalsContact CD2-CZ 3.48Å; F344-Y375 WeakPolarHBondContact CD2-OH 3.4Å; F344-Y375 AromaticContact CE1-CE2 3.94Å; F344-Y375 HydrophobicContact CE1-CE2 3.94Å; F344-Y375 AromaticContact CE1-CZ 3.88Å; F344-Y375 WeakPolarHBondContact CE1-OH 3.3Å; F344-Y375 AromaticContact CE2-CZ 3.89Å; F344-Y375 WeakPolarHBondContact CE2-OH 3.44Å; F344-Y375 HydrophobicContact CG-CE1 4.2Å; F344-Y375 AromaticContact CG-CE2 3.44Å; F344-Y375 HydrophobicContact CG-CE2 3.44Å; F344-Y375 VanDerWaalsContact CG-CE2 3.44Å; F344-Y375 AromaticContact CG-CZ 3.23Å; F344-Y375 WeakPolarHBondContact CG-OH 3.29Å; F344-Y375 WeakPolarHBondContact CZ-OH 3.4Å; L371-Y375 VanDerWaalsContact O-CD2 3.24Å; L371-Y375 WeakPolarHBondContact O-CD2 3.38Å; L371-Y375 PolarHBondContact O-N 3.46Å; L371-Y375 VanDerWaalsContact O-N 3.09Å; Q372-Y375 CarbonylContact O-C 3.57Å; Q372-Y375 PolarHBondContact O-N 3.46Å; Q373-Y375 PolarHBondContact O-N 3.02Å; Y375-L377 VanDerWaalsContact C-N 3.25Å; Y375-L377 PolarHBondContact O-N 2.8Å
376	G	82.1	Confident	79	Confident	35 Å²	35	49 Å²	49	36%	0.361	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	11.5	-178.4	0	0	0	0	0	114.8	Q372 Q373 Y378	Q372-G376 PolarHBondContact O-N 3.29Å; Q372-G376 VanDerWaalsContact O-N 3.11Å; Q373-G376 PolarHBondContact O-N 2.81Å; Q373-G376 VanDerWaalsContact O-N 3.15Å; G376-Y378 WeakPolarHBondContact O-CD2 3.28Å; G376-Y378 PolarHBondContact O-N 3.48Å
377	L	84	Confident	78.2	Confident	70 Å²	70	49.5 Å²	49.5	37%	0.366	24%	0.24	S	C	.	.			trans	-79.9	61.5	172.7	-64.6	174.5	0	0	0	110.5	M348 Q372 Y375 D379 D380 A381	M348-L377 HydrophobicContact CE-CD1 3.91Å; Q372-L377 HydrophobicContact CB-CB 4.1Å; Q372-L377 HydrophobicContact CG-CB 4.42Å; Q372-L377 PolarHBondContact O-N 3.2Å; Y375-L377 VanDerWaalsContact C-N 3.25Å; Y375-L377 PolarHBondContact O-N 2.8Å; L377-D379 VanDerWaalsContact C-N 3.31Å; L377-D379 PolarHBondContact O-N 3.39Å; L377-D380 HydrophobicContact CB-CB 4.36Å; L377-D380 PolarHBondContact O-N 2.72Å; L377-A381 PolarHBondContact O-N 3.11Å
378	Y	76.4	Confident	76.9	Confident	113 Å²	113	52.1 Å²	52.1	44%	0.443	25%	0.25	S	S	.	.	H	α-helix	trans	-70.4	-26.5	-168.6	-61.2	-78.7	0	0	0	114.1	Q373 G376 M382 K414	Q373-Y378 HydrophobicContact CG-CD1 4.37Å; Q373-Y378 HydrophobicContact CG-CE1 4.02Å; G376-Y378 WeakPolarHBondContact O-CD2 3.28Å; G376-Y378 PolarHBondContact O-N 3.48Å; Y378-M382 WeakPolarHBondContact O-CG 3.42Å; Y378-M382 PolarHBondContact O-N 2.66Å; Y378-K414 VanDerWaalsContact C-NZ 3.26Å; Y378-K414 VanDerWaalsContact CB-NZ 3.33Å; Y378-K414 PolarHBondContact O-NZ 2.98Å
379	D	77.7	Confident	75.2	Confident	107 Å²	107	58.9 Å²	58.9	57%	0.572	29%	0.286	S	S	*	.	H	α-helix	trans	-81.9	-31.1	-178.7	-63.7	-24.8	0	0	0	111.6	L377 M382 R383 K414	L377-D379 VanDerWaalsContact C-N 3.31Å; L377-D379 PolarHBondContact O-N 3.39Å; D379-M382 PolarHBondContact O-N 2.99Å; D379-R383 PolarHBondContact O-N 2.94Å; D379-K414 IonicContact OD1-NZ 2.81Å; D379-K414 PolarHBondContact OD1-NZ 3.43Å
380	D	81.3	Confident	73.6	Confident	48 Å²	48	62.6 Å²	62.6	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-70.5	-38.4	170.3	-58.8	-41.6	0	0	0	110.7	Q372 L377 M382 R383 T384	Q372-D380 PolarHBondContact OE1-O 3.1Å; L377-D380 HydrophobicContact CB-CB 4.36Å; L377-D380 PolarHBondContact O-N 2.72Å; D380-M382 VanDerWaalsContact C-N 3.31Å; D380-M382 PolarHBondContact O-N 3.47Å; D380-R383 PolarHBondContact O-N 3.25Å; D380-R383 IonicContact OD1-CZ 3.29Å; D380-R383 IonicContact OD1-NE 3.2Å; D380-R383 IonicContact OD1-NH1 2.73Å; D380-R383 PolarHBondContact OD1-NH1 2.78Å; D380-R383 IonicContact OD1-NH2 2.95Å; D380-R383 PolarHBondContact OD1-NH2 3.21Å; D380-T384 WeakPolarHBondContact O-CB 3.46Å; D380-T384 PolarHBondContact O-N 3.29Å; D380-T384 PolarHBondContact O-OG1 2.81Å
381	A	76.3	Confident	71.7	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.008	34%	0.343	C	S	.	.	H	α-helix	trans	-59	-41.5	172.2	0	0	0	0	0	112.3	A369 Q372 L377 T384 L385	A369-A381 HydrophobicContact CB-CB 4.47Å; Q372-A381 HydrophobicContact CB-CB 3.91Å; L377-A381 PolarHBondContact O-N 3.11Å; A381-T384 PolarHBondContact O-N 3.02Å; A381-L385 WeakPolarHBondContact O-CB 3.28Å; A381-L385 VanDerWaalsContact O-CG 3.23Å; A381-L385 WeakPolarHBondContact O-CG 3.28Å; A381-L385 PolarHBondContact O-N 2.78Å; A381-L385 VanDerWaalsContact O-N 3.1Å
382	M	70.7	Confident	69.5	Low	18 Å²	18	74.8 Å²	74.8	9%	0.089	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-47.5	175.2	-76.5	-174.8	63.7	0	0	111.8	Y378 D379 D380 T384 L385 D386 I410 L411 K414 I416	Y378-M382 WeakPolarHBondContact O-CG 3.42Å; Y378-M382 PolarHBondContact O-N 2.66Å; D379-M382 PolarHBondContact O-N 2.99Å; D380-M382 VanDerWaalsContact C-N 3.31Å; D380-M382 PolarHBondContact O-N 3.47Å; M382-T384 VanDerWaalsContact C-N 3.25Å; M382-T384 PolarHBondContact O-N 3.4Å; M382-L385 CarbonylContact O-C 3.59Å; M382-L385 PolarHBondContact O-N 2.88Å; M382-L385 VanDerWaalsContact O-N 3.09Å; M382-D386 VanDerWaalsContact O-CB 3.31Å; M382-D386 WeakPolarHBondContact O-CB 3.38Å; M382-D386 PolarHBondContact O-N 3.21Å; M382-I410 HydrophobicContact CG-CG2 4.49Å; M382-L411 HydrophobicContact CE-CD2 3.69Å; M382-L411 HydrophobicContact SD-CD2 4.49Å; M382-K414 HydrophobicContact SD-CD 3.53Å; M382-K414 VanDerWaalsContact SD-CD 3.53Å; M382-K414 PolarHBondContact SD-NZ 3.23Å; M382-I416 HydrophobicContact CE-CD1 3.76Å; M382-I416 HydrophobicContact SD-CD1 3.81Å
383	R	77.2	Confident	67.7	Low	166 Å²	166	78.2 Å²	78.2	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-58.5	-37.7	176.3	-79	-177.2	-98.1	139.9	-1.2	112.8	D379 D380 L385 D386	D379-R383 PolarHBondContact O-N 2.94Å; D380-R383 PolarHBondContact O-N 3.25Å; D380-R383 IonicContact OD1-CZ 3.29Å; D380-R383 IonicContact OD1-NE 3.2Å; D380-R383 IonicContact OD1-NH1 2.73Å; D380-R383 PolarHBondContact OD1-NH1 2.78Å; D380-R383 IonicContact OD1-NH2 2.95Å; D380-R383 PolarHBondContact OD1-NH2 3.21Å; R383-L385 VanDerWaalsContact C-N 3.34Å; R383-D386 PolarHBondContact O-N 3.42Å
384	T	74.4	Confident	65.7	Low	24 Å²	24	83 Å²	83	15%	0.147	42%	0.419	C	S	.	.	H	α-helix	trans	-66.5	-36.5	177.4	-55.7	0	0	0	0	111.9	I355 R365 L368 Q372 D380 A381 M382	I355-T384 HydrophobicContact CD1-CG2 4.03Å; R365-T384 HydrophobicContact CB-CG2 4.4Å; R365-T384 WeakPolarHBondContact CD-O 3.42Å; R365-T384 HydrophobicContact CG-CG2 4.34Å; L368-T384 HydrophobicContact CB-CG2 4.24Å; L368-T384 HydrophobicContact CD2-CG2 3.7Å; L368-T384 HydrophobicContact CG-CG2 4.05Å; Q372-T384 PolarHBondContact NE2-OG1 2.95Å; Q372-T384 PolarHBondContact OE1-OG1 3.11Å; Q372-T384 VanDerWaalsContact OE1-OG1 3.09Å; D380-T384 WeakPolarHBondContact O-CB 3.46Å; D380-T384 PolarHBondContact O-N 3.29Å; D380-T384 PolarHBondContact O-OG1 2.81Å; A381-T384 PolarHBondContact O-N 3.02Å; M382-T384 VanDerWaalsContact C-N 3.25Å; M382-T384 PolarHBondContact O-N 3.4Å
385	L	67.2	Low	63.8	Low	1 Å²	1	82.6 Å²	82.6	1%	0.005	42%	0.424	C	S	.	.	H	α-helix	trans	-86.3	-20.1	178.9	-67.3	173.1	0	0	0	113.5	A369 A381 M382 R383 L387 L403 Q407 I410	A369-L385 HydrophobicContact CB-CD1 3.85Å; A369-L385 HydrophobicContact CB-CD2 3.81Å; A369-L385 HydrophobicContact CB-CG 3.72Å; A381-L385 WeakPolarHBondContact O-CB 3.28Å; A381-L385 VanDerWaalsContact O-CG 3.23Å; A381-L385 WeakPolarHBondContact O-CG 3.28Å; A381-L385 PolarHBondContact O-N 2.78Å; A381-L385 VanDerWaalsContact O-N 3.1Å; M382-L385 CarbonylContact O-C 3.59Å; M382-L385 PolarHBondContact O-N 2.88Å; M382-L385 VanDerWaalsContact O-N 3.09Å; R383-L385 VanDerWaalsContact C-N 3.34Å; L385-L387 VanDerWaalsContact C-N 3.3Å; L385-L387 PolarHBondContact O-N 3.14Å; L385-L403 HydrophobicContact CD2-CD1 3.39Å; L385-L403 HydrophobicContact CD2-CG 3.88Å; L385-Q407 HydrophobicContact CB-CB 4.4Å; L385-Q407 HydrophobicContact CB-CG 4.07Å; L385-Q407 HydrophobicContact CD1-CB 4.29Å; L385-Q407 HydrophobicContact CD1-CG 4.45Å; L385-I410 HydrophobicContact CD1-CD1 3.36Å
386	D	67.1	Low	61.9	Low	44 Å²	44	79.7 Å²	79.7	24%	0.235	42%	0.417	C	S	.	.			trans	-71.4	86.8	176.8	-77.2	-19.3	0	0	0	109.1	M382 R383 F388 Q407	M382-D386 VanDerWaalsContact O-CB 3.31Å; M382-D386 WeakPolarHBondContact O-CB 3.38Å; M382-D386 PolarHBondContact O-N 3.21Å; R383-D386 PolarHBondContact O-N 3.42Å; D386-F388 PolarHBondContact O-N 3.41Å; D386-Q407 PolarHBondContact OD1-NE2 2.88Å
387	L	58.5	Low	60.1	Low	34 Å²	34	80 Å²	80	18%	0.178	42%	0.421	C	S	.	.			trans	-63.5	-4.5	170.1	-72.1	165.4	0	0	0	113.4	L385 L399 L403	L385-L387 VanDerWaalsContact C-N 3.3Å; L385-L387 PolarHBondContact O-N 3.14Å; L387-L399 HydrophobicContact CD1-CD2 3.84Å; L387-L399 HydrophobicContact CD1-CG 3.91Å; L387-L403 HydrophobicContact CD1-CD2 3.59Å; L387-L403 HydrophobicContact CD2-CD2 4.35Å; L387-L403 HydrophobicContact CG-CD2 4.01Å
388	F	52.7	Low	58.6	Low	69 Å²	69	84.4 Å²	84.4	30%	0.303	44%	0.437	S	S	.	.			trans	-111.5	62	-167.1	-56.4	-78.2	0	0	0	111.6	D386 G390 L399 I426	D386-F388 PolarHBondContact O-N 3.41Å; F388-G390 PolarHBondContact O-N 2.92Å; F388-L399 HydrophobicContact CZ-CD2 4.41Å; F388-I426 HydrophobicContact CE1-CD1 3.71Å; F388-I426 HydrophobicContact CE2-CD1 4.04Å; F388-I426 HydrophobicContact CZ-CD1 3.23Å
389	D	48.9	Very low	57.9	Low	144 Å²	144	80.5 Å²	80.5	77%	0.77	42%	0.424	S	S	*	.	S	Bend	trans	-70.2	56.5	165.6	-89.8	-15.4	0	0	0	111.1	K391	D389-K391 PolarHBondContact O-N 3.27Å
390	G	46.9	Very low	57.5	Low	80 Å²	80	77 Å²	77	83%	0.825	41%	0.405	S	S	*	.	S	Bend	trans	61.1	3.4	173.6	0	0	0	0	0	116.7	F388	F388-G390 PolarHBondContact O-N 2.92Å
391	K	42.5	Very low	57.1	Low	164 Å²	164	74.8 Å²	74.8	71%	0.713	39%	0.394	S	S	*	.			trans	-85.1	137.1	176.9	-69	178.2	-177	175.5	0	110.3	D389	D389-K391 PolarHBondContact O-N 3.27Å
392	E	39.6	Very low	57.1	Low	148 Å²	148	80.1 Å²	80.1	69%	0.692	41%	0.413	S	S	*	.			trans	-59.4	150.1	-179.6	-63.5	-171.5	155.3	0	0	111.1	E394	E392-E394 PolarHBondContact O-N 3.06Å
393	V	48.3	Very low	57.3	Low	77 Å²	77	79.4 Å²	79.4	47%	0.467	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-3	-173.7	177.3	0	0	0	0	113.9
394	E	42.4	Very low	57.3	Low	142 Å²	142	71.5 Å²	71.5	66%	0.664	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-20.4	-170.2	-55.2	-161.9	155.7	0	0	114	E392	E392-E394 PolarHBondContact O-N 3.06Å
395	D	42.5	Very low	57.7	Low	141 Å²	141	71.1 Å²	71.1	75%	0.754	38%	0.378	S	S	*	.	S	Bend	trans	-106.1	-3.2	-172	-74.5	-25.6	0	0	0	115.9	G397	D395-G397 PolarHBondContact O-N 3.1Å
396	V	44.1	Very low	58.2	Low	47 Å²	47	74.7 Å²	74.7	29%	0.285	39%	0.394	S	S	.	.			trans	-95.6	79.7	-176.3	-165.2	0	0	0	0	110.9	F398 L399	V396-F398 PolarHBondContact O-N 3.31Å; V396-L399 HydrophobicContact CB-CD1 3.94Å; V396-L399 HydrophobicContact CG1-CD1 3.72Å; V396-L399 HydrophobicContact CG1-CG 4.39Å
397	G	44.2	Very low	58.7	Low	43 Å²	43	73 Å²	73	44%	0.443	39%	0.385	S	S	.	.			trans	-60.5	120.8	168	0	0	0	0	0	111.2	D395	D395-G397 PolarHBondContact O-N 3.1Å
398	F	52.6	Low	59.9	Low	162 Å²	162	71.4 Å²	71.4	71%	0.711	38%	0.377	S	S	*	.			trans	65.2	74.3	179.6	-70.3	-90.8	0	0	0	116.2	V396 D400 V492	V396-F398 PolarHBondContact O-N 3.31Å; F398-D400 PolarHBondContact O-N 3.03Å; F398-V492 HydrophobicContact CE1-CG1 4.46Å
399	L	61.3	Low	61.5	Low	31 Å²	31	70.1 Å²	70.1	16%	0.162	38%	0.375	C	S	.	.			trans	-63.6	126.8	153.6	-86.2	92.5	0	0	0	109.5	L387 F388 V396 L404 I426 M430	L387-L399 HydrophobicContact CD1-CD2 3.84Å; L387-L399 HydrophobicContact CD1-CG 3.91Å; F388-L399 HydrophobicContact CZ-CD2 4.41Å; V396-L399 HydrophobicContact CB-CD1 3.94Å; V396-L399 HydrophobicContact CG1-CD1 3.72Å; V396-L399 HydrophobicContact CG1-CG 4.39Å; L399-L404 HydrophobicContact CB-CD1 4.46Å; L399-L404 HydrophobicContact CD2-CD1 3.81Å; L399-L404 HydrophobicContact CD2-CD2 4.02Å; L399-L404 HydrophobicContact CD2-CG 4.18Å; L399-I426 HydrophobicContact CD2-CG2 3.83Å; L399-M430 HydrophobicContact CB-CE 4.31Å; L399-M430 HydrophobicContact CB-SD 4.17Å; L399-M430 WeakPolarHBondContact O-CE 3.36Å
400	D	68.2	Low	62.9	Low	33 Å²	33	63.6 Å²	63.6	18%	0.176	34%	0.34	C	S	.	.			trans	-83.1	134.8	172.9	-168.2	7.1	0	0	0	110.2	A362 F398 R402 L403	A362-D400 HydrophobicContact CB-CB 3.25Å; A362-D400 WeakPolarHBondContact CB-OD2 3.39Å; F398-D400 PolarHBondContact O-N 3.03Å; D400-R402 VanDerWaalsContact C-N 3.3Å; D400-R402 PolarHBondContact O-N 3.16Å; D400-L403 HydrophobicContact CB-CB 4.41Å; D400-L403 PolarHBondContact O-N 3.47Å
401	D	73.4	Confident	64.6	Low	2 Å²	2	59.9 Å²	59.9	1%	0.011	30%	0.301	C	S	.	.	H	α-helix	trans	-69.6	-32.6	-175.3	68.8	-15.4	0	0	0	111.4	L404 V405 L427 Y431 L494 I499	D401-L404 PolarHBondContact O-N 3.17Å; D401-V405 WeakPolarHBondContact O-CG2 3.48Å; D401-V405 PolarHBondContact O-N 3.44Å; D401-V405 VanDerWaalsContact O-N 3.16Å; D401-L427 HydrophobicContact CB-CD1 4.02Å; D401-Y431 HydrophobicContact CB-CE2 4.2Å; D401-Y431 PolarHBondContact OD2-OH 2.87Å; D401-L494 HydrophobicContact CB-CD1 4.26Å; D401-L494 HydrophobicContact CB-CD2 4.48Å; D401-I499 HydrophobicContact CB-CD1 3.51Å; D401-I499 HydrophobicContact CB-CG1 4.34Å; D401-I499 WeakPolarHBondContact OD2-CD1 3.41Å; D401-I499 WeakPolarHBondContact OD2-CG1 3.38Å
402	R	76.4	Confident	66.7	Low	112 Å²	112	54.3 Å²	54.3	42%	0.423	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-42.6	176.1	-67.6	-178	172.7	-175.2	-3	113.3	L366 D400 L404 V405 E406	L366-R402 HydrophobicContact CD1-CB 3.81Å; D400-R402 VanDerWaalsContact C-N 3.3Å; D400-R402 PolarHBondContact O-N 3.16Å; R402-L404 VanDerWaalsContact C-N 3.31Å; R402-L404 PolarHBondContact O-N 3.09Å; R402-V405 PolarHBondContact O-N 3.25Å; R402-E406 PolarHBondContact O-N 3.46Å; R402-E406 VanDerWaalsContact O-N 3.07Å
403	L	74.4	Confident	68.9	Low	3 Å²	3	54.5 Å²	54.5	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-45.3	178.8	-170.9	84.7	0	0	0	110.9	R365 L366 L385 L387 D400 V405 E406 Q407	R365-L403 HydrophobicContact CB-CD1 3.61Å; L366-L403 HydrophobicContact CD2-CB 4.43Å; L366-L403 HydrophobicContact CD2-CD1 3.93Å; L366-L403 HydrophobicContact CG-CB 4.38Å; L366-L403 HydrophobicContact CG-CD1 3.72Å; L385-L403 HydrophobicContact CD2-CD1 3.39Å; L385-L403 HydrophobicContact CD2-CG 3.88Å; L387-L403 HydrophobicContact CD1-CD2 3.59Å; L387-L403 HydrophobicContact CD2-CD2 4.35Å; L387-L403 HydrophobicContact CG-CD2 4.01Å; D400-L403 HydrophobicContact CB-CB 4.41Å; D400-L403 PolarHBondContact O-N 3.47Å; L403-V405 PolarHBondContact O-N 3.44Å; L403-E406 PolarHBondContact O-N 3.43Å; L403-Q407 WeakPolarHBondContact O-CB 3.08Å; L403-Q407 PolarHBondContact O-N 3.23Å
404	L	77.8	Confident	70.4	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.2	-35.1	179.4	-72.1	172.4	0	0	0	112.7	L399 D401 R402 C408 I426 L427 M430	L399-L404 HydrophobicContact CB-CD1 4.46Å; L399-L404 HydrophobicContact CD2-CD1 3.81Å; L399-L404 HydrophobicContact CD2-CD2 4.02Å; L399-L404 HydrophobicContact CD2-CG 4.18Å; D401-L404 PolarHBondContact O-N 3.17Å; R402-L404 VanDerWaalsContact C-N 3.31Å; R402-L404 PolarHBondContact O-N 3.09Å; L404-C408 WeakPolarHBondContact O-CB 3.28Å; L404-C408 PolarHBondContact O-N 3.44Å; L404-C408 PolarHBondContact O-SG 3.49Å; L404-I426 HydrophobicContact CD1-CG2 4.13Å; L404-L427 HydrophobicContact CB-CB 4.08Å; L404-L427 HydrophobicContact CB-CD1 4.03Å; L404-L427 HydrophobicContact CB-CG 4.44Å; L404-L427 HydrophobicContact CD1-CB 4Å; L404-L427 HydrophobicContact CD1-CD1 4.24Å; L404-M430 HydrophobicContact CD1-SD 3.8Å
405	V	82.8	Confident	72.3	Confident	16 Å²	16	48.7 Å²	48.7	10%	0.097	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-48.8	174	171.8	0	0	0	0	110.3	D401 R402 L403 Q407 C408 T409 L427 I499 I507	D401-V405 WeakPolarHBondContact O-CG2 3.48Å; D401-V405 PolarHBondContact O-N 3.44Å; D401-V405 VanDerWaalsContact O-N 3.16Å; R402-V405 PolarHBondContact O-N 3.25Å; L403-V405 PolarHBondContact O-N 3.44Å; V405-Q407 VanDerWaalsContact C-N 3.33Å; V405-Q407 PolarHBondContact O-N 3.07Å; V405-C408 CarbonylContact O-C 3.53Å; V405-C408 WeakPolarHBondContact O-CA 3.32Å; V405-C408 WeakPolarHBondContact O-CB 3.45Å; V405-C408 PolarHBondContact O-N 3.42Å; V405-C408 VanDerWaalsContact O-N 3.07Å; V405-T409 HydrophobicContact CG1-CG2 4.42Å; V405-T409 WeakPolarHBondContact O-CG2 3.43Å; V405-T409 PolarHBondContact O-N 3.08Å; V405-L427 HydrophobicContact CG2-CD1 4.37Å; V405-L427 HydrophobicContact CG2-CD2 3.67Å; V405-I499 HydrophobicContact CG2-CD1 3.37Å; V405-I499 HydrophobicContact CG2-CG1 4.06Å; V405-I499 HydrophobicContact CG2-CG2 4.22Å; V405-I507 HydrophobicContact CG2-CD1 4.26Å
406	E	77.8	Confident	74.2	Confident	77 Å²	77	44.6 Å²	44.6	36%	0.36	23%	0.228	S	C	.	.	H	α-helix	trans	-66.4	-35.1	178.8	-68.7	-60.6	167.1	0	0	112.6	L366 R402 L403 C408 T409 I410	L366-E406 HydrophobicContact CD2-CB 3.62Å; L366-E406 HydrophobicContact CD2-CG 3.58Å; R402-E406 PolarHBondContact O-N 3.46Å; R402-E406 VanDerWaalsContact O-N 3.07Å; L403-E406 PolarHBondContact O-N 3.43Å; E406-C408 VanDerWaalsContact C-N 3.3Å; E406-C408 PolarHBondContact O-N 3.07Å; E406-T409 WeakPolarHBondContact CA-OG1 3.45Å; E406-T409 PolarHBondContact O-N 2.91Å; E406-T409 PolarHBondContact O-OG1 2.88Å; E406-T409 PolarHBondContact OE2-OG1 3.46Å; E406-I410 WeakPolarHBondContact O-CG1 3.48Å; E406-I410 PolarHBondContact O-N 3.36Å
407	Q	77.7	Confident	76.2	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-59.2	-43.9	169.8	-167.3	-174.3	13.3	0	0	110.9	L385 D386 L403 V405 I410 L411	L385-Q407 HydrophobicContact CB-CB 4.4Å; L385-Q407 HydrophobicContact CB-CG 4.07Å; L385-Q407 HydrophobicContact CD1-CB 4.29Å; L385-Q407 HydrophobicContact CD1-CG 4.45Å; D386-Q407 PolarHBondContact OD1-NE2 2.88Å; L403-Q407 WeakPolarHBondContact O-CB 3.08Å; L403-Q407 PolarHBondContact O-N 3.23Å; V405-Q407 VanDerWaalsContact C-N 3.33Å; V405-Q407 PolarHBondContact O-N 3.07Å; Q407-I410 PolarHBondContact O-N 2.89Å; Q407-L411 HydrophobicContact CG-CD1 3.89Å; Q407-L411 HydrophobicContact CG-CG 4.4Å; Q407-L411 WeakPolarHBondContact O-CB 3.18Å; Q407-L411 WeakPolarHBondContact O-CG 3.47Å; Q407-L411 PolarHBondContact O-N 3.22Å
408	C	83.6	Confident	78	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-42	175.1	-68.1	0	0	0	0	111.9	L404 V405 E406 I410 L411 E412 Y420 I507	L404-C408 WeakPolarHBondContact O-CB 3.28Å; L404-C408 PolarHBondContact O-N 3.44Å; L404-C408 PolarHBondContact O-SG 3.49Å; V405-C408 CarbonylContact O-C 3.53Å; V405-C408 WeakPolarHBondContact O-CA 3.32Å; V405-C408 WeakPolarHBondContact O-CB 3.45Å; V405-C408 PolarHBondContact O-N 3.42Å; V405-C408 VanDerWaalsContact O-N 3.07Å; E406-C408 VanDerWaalsContact C-N 3.3Å; E406-C408 PolarHBondContact O-N 3.07Å; C408-I410 VanDerWaalsContact C-N 3.33Å; C408-I410 PolarHBondContact O-N 3.45Å; C408-L411 PolarHBondContact O-N 2.84Å; C408-E412 VanDerWaalsContact O-CB 3.3Å; C408-E412 WeakPolarHBondContact O-CB 3.32Å; C408-E412 PolarHBondContact O-N 2.96Å; C408-Y420 HydrophobicContact CB-CD2 4.15Å; C408-Y420 HydrophobicContact CB-CE2 3.74Å; C408-Y420 WeakPolarHBondContact O-CD2 3.41Å; C408-Y420 VanDerWaalsContact O-CE2 3.29Å; C408-Y420 WeakPolarHBondContact O-CE2 3.46Å; C408-I507 HydrophobicContact CB-CD1 4Å; C408-I507 HydrophobicContact CB-CG1 4.33Å
409	T	85.2	Confident	79.3	Confident	43 Å²	43	43.9 Å²	43.9	26%	0.264	22%	0.217	S	C	.	.	H	α-helix	trans	-64	-39.2	178.7	69.1	0	0	0	0	111.5	V405 E406 K413	V405-T409 HydrophobicContact CG1-CG2 4.42Å; V405-T409 WeakPolarHBondContact O-CG2 3.43Å; V405-T409 PolarHBondContact O-N 3.08Å; E406-T409 WeakPolarHBondContact CA-OG1 3.45Å; E406-T409 PolarHBondContact O-N 2.91Å; E406-T409 PolarHBondContact O-OG1 2.88Å; E406-T409 PolarHBondContact OE2-OG1 3.46Å; T409-K413 VanDerWaalsContact O-CG 3.32Å; T409-K413 WeakPolarHBondContact O-CG 3.29Å; T409-K413 PolarHBondContact O-N 3.44Å; T409-K413 VanDerWaalsContact O-N 3.08Å
410	I	79.6	Confident	80.5	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	-69	-46.6	177.4	-69.7	162.9	0	0	0	111.1	M382 L385 E406 Q407 C408 E412 K413 K414	M382-I410 HydrophobicContact CG-CG2 4.49Å; L385-I410 HydrophobicContact CD1-CD1 3.36Å; E406-I410 WeakPolarHBondContact O-CG1 3.48Å; E406-I410 PolarHBondContact O-N 3.36Å; Q407-I410 PolarHBondContact O-N 2.89Å; C408-I410 VanDerWaalsContact C-N 3.33Å; C408-I410 PolarHBondContact O-N 3.45Å; I410-E412 VanDerWaalsContact C-N 3.29Å; I410-E412 PolarHBondContact O-N 2.67Å; I410-K413 PolarHBondContact O-N 2.65Å; I410-K414 PolarHBondContact O-N 3.38Å
411	L	82.3	Confident	81.4	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-37	178.6	-72.7	171.1	0	0	0	112	M382 Q407 C408 K414 G415 I416 Q419 Y420 S423	M382-L411 HydrophobicContact CE-CD2 3.69Å; M382-L411 HydrophobicContact SD-CD2 4.49Å; Q407-L411 HydrophobicContact CG-CD1 3.89Å; Q407-L411 HydrophobicContact CG-CG 4.4Å; Q407-L411 WeakPolarHBondContact O-CB 3.18Å; Q407-L411 WeakPolarHBondContact O-CG 3.47Å; Q407-L411 PolarHBondContact O-N 3.22Å; C408-L411 PolarHBondContact O-N 2.84Å; L411-K414 PolarHBondContact O-N 2.96Å; L411-G415 PolarHBondContact O-N 3.04Å; L411-I416 HydrophobicContact CD2-CB 4.08Å; L411-I416 HydrophobicContact CD2-CG2 4.41Å; L411-I416 PolarHBondContact O-N 3.4Å; L411-I416 VanDerWaalsContact O-N 3.14Å; L411-Q419 HydrophobicContact CD1-CB 3.98Å; L411-Q419 HydrophobicContact CD2-CB 3.93Å; L411-Y420 HydrophobicContact CB-CD2 4.03Å; L411-S423 WeakPolarHBondContact CD1-OG 3.45Å
412	E	86.7	Confident	81.9	Confident	48 Å²	48	45.2 Å²	45.2	22%	0.224	23%	0.227	C	C	.	.	H	α-helix	trans	-66.8	-42.2	174.4	-179.1	161.9	-157.1	0	0	112	C408 I410 K414 G415 W417 Y420 H506 K510	C408-E412 VanDerWaalsContact O-CB 3.3Å; C408-E412 WeakPolarHBondContact O-CB 3.32Å; C408-E412 PolarHBondContact O-N 2.96Å; I410-E412 VanDerWaalsContact C-N 3.29Å; I410-E412 PolarHBondContact O-N 2.67Å; E412-K414 VanDerWaalsContact C-N 3.3Å; E412-K414 PolarHBondContact O-N 2.91Å; E412-G415 PolarHBondContact O-N 3.21Å; E412-W417 HydrophobicContact CG-CH2 4.22Å; E412-W417 HydrophobicContact CG-CZ3 4.21Å; E412-Y420 HydrophobicContact CB-CD2 4.27Å; E412-Y420 HydrophobicContact CB-CE2 3.91Å; E412-H506 IonicContact OE1-CE1 3.44Å; E412-H506 PolarHBondContact OE1-CE1 3.06Å; E412-H506 IonicContact OE2-CE1 2.64Å; E412-H506 PolarHBondContact OE2-CE1 3.47Å; E412-H506 VanDerWaalsContact OE2-CE1 3.23Å; E412-H506 IonicContact OE2-ND1 2.99Å; E412-K510 IonicContact OE1-NZ 3.46Å; E412-K510 PolarHBondContact OE1-NZ 3.24Å
413	K	84.6	Confident	82.2	Confident	152 Å²	152	40 Å²	40	66%	0.661	21%	0.208	S	C	*	.	H	α-helix	trans	-61.8	-36.9	174.5	-74.9	173	-177.8	175.1	0	112.3	T409 I410	T409-K413 VanDerWaalsContact O-CG 3.32Å; T409-K413 WeakPolarHBondContact O-CG 3.29Å; T409-K413 PolarHBondContact O-N 3.44Å; T409-K413 VanDerWaalsContact O-N 3.08Å; I410-K413 PolarHBondContact O-N 2.65Å
414	K	80.2	Confident	82.7	Confident	66 Å²	66	39.9 Å²	39.9	29%	0.287	21%	0.207	S	C	.	.	H	α-helix	trans	-80.1	-20.1	176.7	-74	-163.3	179.1	-172.3	0	114.2	Y378 D379 M382 I410 L411 E412 I416	Y378-K414 VanDerWaalsContact C-NZ 3.26Å; Y378-K414 VanDerWaalsContact CB-NZ 3.33Å; Y378-K414 PolarHBondContact O-NZ 2.98Å; D379-K414 IonicContact OD1-NZ 2.81Å; D379-K414 PolarHBondContact OD1-NZ 3.43Å; M382-K414 HydrophobicContact SD-CD 3.53Å; M382-K414 VanDerWaalsContact SD-CD 3.53Å; M382-K414 PolarHBondContact SD-NZ 3.23Å; I410-K414 PolarHBondContact O-N 3.38Å; L411-K414 PolarHBondContact O-N 2.96Å; E412-K414 VanDerWaalsContact C-N 3.3Å; E412-K414 PolarHBondContact O-N 2.91Å; K414-I416 HydrophobicContact CB-CD1 4.09Å; K414-I416 HydrophobicContact CB-CG1 4.05Å; K414-I416 HydrophobicContact CD-CD1 3.89Å
415	G	83.4	Confident	83.1	Confident	30 Å²	30	41 Å²	41	31%	0.309	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	24.4	-174.9	0	0	0	0	0	114.7	L411 E412 W417	L411-G415 PolarHBondContact O-N 3.04Å; E412-G415 PolarHBondContact O-N 3.21Å; G415-W417 VanDerWaalsContact O-CD1 3.29Å; G415-W417 PolarHBondContact O-N 3.26Å; G415-W417 PolarHBondContact O-NE1 3.46Å
416	I	82.4	Confident	83.2	Confident	56 Å²	56	41.7 Å²	41.7	29%	0.287	22%	0.217	S	C	.	.			trans	-89.9	87.1	177.5	-56.3	170.9	0	0	0	109.3	M382 L411 K414 Q419 Y420	M382-I416 HydrophobicContact CE-CD1 3.76Å; M382-I416 HydrophobicContact SD-CD1 3.81Å; L411-I416 HydrophobicContact CD2-CB 4.08Å; L411-I416 HydrophobicContact CD2-CG2 4.41Å; L411-I416 PolarHBondContact O-N 3.4Å; L411-I416 VanDerWaalsContact O-N 3.14Å; K414-I416 HydrophobicContact CB-CD1 4.09Å; K414-I416 HydrophobicContact CB-CG1 4.05Å; K414-I416 HydrophobicContact CD-CD1 3.89Å; I416-Q419 HydrophobicContact CG2-CB 4.26Å; I416-Q419 HydrophobicContact CG2-CG 4.35Å; I416-Y420 WeakPolarHBondContact O-CB 3.14Å; I416-Y420 PolarHBondContact O-N 3.1Å
417	W	86	Confident	83.6	Confident	89 Å²	89	38 Å²	38	34%	0.337	20%	0.2	S	C	.	.	H	α-helix	trans	-74.6	-28.3	-168.9	-54.3	114.9	0	0	0	115	E412 G415 Y420 I421 L514	E412-W417 HydrophobicContact CG-CH2 4.22Å; E412-W417 HydrophobicContact CG-CZ3 4.21Å; G415-W417 VanDerWaalsContact O-CD1 3.29Å; G415-W417 PolarHBondContact O-N 3.26Å; G415-W417 PolarHBondContact O-NE1 3.46Å; W417-Y420 HydrophobicContact CE3-CG 4.46Å; W417-Y420 WeakPolarHBondContact O-CB 3.31Å; W417-Y420 PolarHBondContact O-N 3.3Å; W417-I421 VanDerWaalsContact O-CG1 3.31Å; W417-I421 WeakPolarHBondContact O-CG1 3.1Å; W417-I421 PolarHBondContact O-N 3.27Å; W417-L514 HydrophobicContact CB-CD1 4.29Å; W417-L514 HydrophobicContact CB-CD2 4.11Å; W417-L514 HydrophobicContact CD2-CD1 4.22Å; W417-L514 HydrophobicContact CD2-CD2 3.79Å; W417-L514 HydrophobicContact CE3-CD1 3.62Å; W417-L514 HydrophobicContact CE3-CD2 3.95Å; W417-L514 HydrophobicContact CE3-CG 4.39Å; W417-L514 HydrophobicContact CG-CD2 3.87Å; W417-L514 HydrophobicContact CZ3-CD1 4.36Å
418	S	81.4	Confident	84	Confident	79 Å²	79	37.7 Å²	37.7	55%	0.552	20%	0.198	S	C	*	.	H	α-helix	trans	-64.1	-49.1	-178	53.5	0	0	0	0	112	I421 V422	S418-I421 PolarHBondContact O-N 2.76Å; S418-V422 PolarHBondContact O-N 3.04Å
419	Q	80.6	Confident	84.1	Confident	68 Å²	68	37.8 Å²	37.8	32%	0.318	20%	0.199	S	C	.	.	H	α-helix	trans	-70.5	-32.4	175.7	-70.7	175	-26.6	0	0	111.8	L411 I416 I421 V422 S423	L411-Q419 HydrophobicContact CD1-CB 3.98Å; L411-Q419 HydrophobicContact CD2-CB 3.93Å; I416-Q419 HydrophobicContact CG2-CB 4.26Å; I416-Q419 HydrophobicContact CG2-CG 4.35Å; Q419-I421 VanDerWaalsContact C-N 3.33Å; Q419-I421 PolarHBondContact O-N 3.09Å; Q419-V422 PolarHBondContact O-N 3.41Å; Q419-S423 PolarHBondContact O-N 3.06Å; Q419-S423 PolarHBondContact O-OG 2.96Å
420	Y	86.5	Confident	84	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-42.8	174.8	-177.2	-90.2	0	0	0	111.6	C408 L411 E412 I416 W417 V422 S423 G424 K510 I511 L514	C408-Y420 HydrophobicContact CB-CD2 4.15Å; C408-Y420 HydrophobicContact CB-CE2 3.74Å; C408-Y420 WeakPolarHBondContact O-CD2 3.41Å; C408-Y420 VanDerWaalsContact O-CE2 3.29Å; C408-Y420 WeakPolarHBondContact O-CE2 3.46Å; L411-Y420 HydrophobicContact CB-CD2 4.03Å; E412-Y420 HydrophobicContact CB-CD2 4.27Å; E412-Y420 HydrophobicContact CB-CE2 3.91Å; I416-Y420 WeakPolarHBondContact O-CB 3.14Å; I416-Y420 PolarHBondContact O-N 3.1Å; W417-Y420 HydrophobicContact CE3-CG 4.46Å; W417-Y420 WeakPolarHBondContact O-CB 3.31Å; W417-Y420 PolarHBondContact O-N 3.3Å; Y420-V422 VanDerWaalsContact C-N 3.34Å; Y420-V422 PolarHBondContact O-N 3.48Å; Y420-S423 WeakPolarHBondContact CA-OG 3.44Å; Y420-S423 PolarHBondContact O-OG 2.84Å; Y420-G424 PolarHBondContact O-N 3.43Å; Y420-K510 HydrophobicContact CE1-CB 4.09Å; Y420-K510 HydrophobicContact CE1-CG 3.83Å; Y420-I511 HydrophobicContact CD1-CG1 4.11Å; Y420-I511 HydrophobicContact CE1-CG1 3.73Å; Y420-L514 HydrophobicContact CD1-CD1 3.75Å; Y420-L514 HydrophobicContact CE1-CD1 4.13Å
421	I	86.7	Confident	84.2	Confident	19 Å²	19	36 Å²	36	10%	0.097	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-41.8	176.1	-66.6	165.1	0	0	0	110.4	W417 S418 Q419 T425 L514 L515	W417-I421 VanDerWaalsContact O-CG1 3.31Å; W417-I421 WeakPolarHBondContact O-CG1 3.1Å; W417-I421 PolarHBondContact O-N 3.27Å; S418-I421 PolarHBondContact O-N 2.76Å; Q419-I421 VanDerWaalsContact C-N 3.33Å; Q419-I421 PolarHBondContact O-N 3.09Å; I421-T425 HydrophobicContact CG2-CG2 4.23Å; I421-T425 VanDerWaalsContact O-CB 3.23Å; I421-T425 WeakPolarHBondContact O-CB 3.38Å; I421-T425 WeakPolarHBondContact O-CG2 3.34Å; I421-T425 PolarHBondContact O-N 3.4Å; I421-T425 PolarHBondContact O-OG1 3.49Å; I421-L514 HydrophobicContact CD1-CB 4.18Å; I421-L514 HydrophobicContact CG1-CB 4.42Å; I421-L514 HydrophobicContact CG1-CD1 4.19Å; I421-L515 HydrophobicContact CG2-CD2 4.37Å
422	V	84.5	Confident	84.3	Confident	76 Å²	76	36 Å²	36	46%	0.461	19%	0.188	S	C	.	.	H	α-helix	trans	-67.1	-55.5	-179.9	177.6	0	0	0	0	111.4	S418 Q419 Y420 G424 T425 I426	S418-V422 PolarHBondContact O-N 3.04Å; Q419-V422 PolarHBondContact O-N 3.41Å; Y420-V422 VanDerWaalsContact C-N 3.34Å; Y420-V422 PolarHBondContact O-N 3.48Å; V422-G424 PolarHBondContact O-N 3.47Å; V422-T425 PolarHBondContact O-N 3.21Å; V422-T425 PolarHBondContact O-OG1 3.09Å; V422-I426 HydrophobicContact CG1-CD1 4Å; V422-I426 VanDerWaalsContact O-CG1 3.32Å; V422-I426 WeakPolarHBondContact O-CG1 3.48Å; V422-I426 PolarHBondContact O-N 2.87Å
423	S	81.4	Confident	83.9	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-58.2	-47.2	179.3	50.9	0	0	0	0	112	L411 Q419 Y420 T425 I426 L427	L411-S423 WeakPolarHBondContact CD1-OG 3.45Å; Q419-S423 PolarHBondContact O-N 3.06Å; Q419-S423 PolarHBondContact O-OG 2.96Å; Y420-S423 WeakPolarHBondContact CA-OG 3.44Å; Y420-S423 PolarHBondContact O-OG 2.84Å; S423-T425 PolarHBondContact O-N 2.88Å; S423-I426 PolarHBondContact O-N 3.33Å; S423-L427 PolarHBondContact O-N 3Å
424	G	86.3	Confident	83.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.8	-34.6	178.8	0	0	0	0	0	113.7	Y420 V422 L427 L428	Y420-G424 PolarHBondContact O-N 3.43Å; V422-G424 PolarHBondContact O-N 3.47Å; G424-L427 PolarHBondContact O-N 3.39Å; G424-L428 WeakPolarHBondContact O-CB 3.3Å; G424-L428 WeakPolarHBondContact O-CG 3.32Å; G424-L428 PolarHBondContact O-N 2.92Å
425	T	86.3	Confident	83.2	Confident	25 Å²	25	28.2 Å²	28.2	15%	0.153	16%	0.155	C	C	.	.	H	α-helix	trans	-69.3	-33.7	174.4	52.2	0	0	0	0	112.5	I421 V422 S423 A429 I511	I421-T425 HydrophobicContact CG2-CG2 4.23Å; I421-T425 VanDerWaalsContact O-CB 3.23Å; I421-T425 WeakPolarHBondContact O-CB 3.38Å; I421-T425 WeakPolarHBondContact O-CG2 3.34Å; I421-T425 PolarHBondContact O-N 3.4Å; I421-T425 PolarHBondContact O-OG1 3.49Å; V422-T425 PolarHBondContact O-N 3.21Å; V422-T425 PolarHBondContact O-OG1 3.09Å; S423-T425 PolarHBondContact O-N 2.88Å; T425-A429 VanDerWaalsContact O-CB 3.22Å; T425-A429 WeakPolarHBondContact O-CB 3.41Å; T425-A429 PolarHBondContact O-N 3.49Å; T425-I511 HydrophobicContact CG2-CG2 4.43Å
426	I	83.8	Confident	82.9	Confident	30 Å²	30	30.5 Å²	30.5	15%	0.154	16%	0.155	C	C	.	.	H	α-helix	trans	-67.3	-47.3	174.3	-66.9	170.7	0	0	0	110.3	F388 L399 L404 V422 S423 L428 A429 M430	F388-I426 HydrophobicContact CE1-CD1 3.71Å; F388-I426 HydrophobicContact CE2-CD1 4.04Å; F388-I426 HydrophobicContact CZ-CD1 3.23Å; L399-I426 HydrophobicContact CD2-CG2 3.83Å; L404-I426 HydrophobicContact CD1-CG2 4.13Å; V422-I426 HydrophobicContact CG1-CD1 4Å; V422-I426 VanDerWaalsContact O-CG1 3.32Å; V422-I426 WeakPolarHBondContact O-CG1 3.48Å; V422-I426 PolarHBondContact O-N 2.87Å; S423-I426 PolarHBondContact O-N 3.33Å; I426-L428 VanDerWaalsContact C-N 3.35Å; I426-L428 PolarHBondContact O-N 2.83Å; I426-A429 WeakPolarHBondContact O-CB 3.4Å; I426-A429 PolarHBondContact O-N 3.47Å; I426-A429 VanDerWaalsContact O-N 3.13Å; I426-M430 WeakPolarHBondContact O-CG 3.41Å; I426-M430 PolarHBondContact O-N 2.93Å; I426-M430 VanDerWaalsContact O-N 3.13Å
427	L	85.8	Confident	82.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-53.5	-53.4	173.4	177.2	64.5	0	0	0	110.6	D401 L404 V405 S423 G424 A429 M430 Y431 I499 L504 I507	D401-L427 HydrophobicContact CB-CD1 4.02Å; L404-L427 HydrophobicContact CB-CB 4.08Å; L404-L427 HydrophobicContact CB-CD1 4.03Å; L404-L427 HydrophobicContact CB-CG 4.44Å; L404-L427 HydrophobicContact CD1-CB 4Å; L404-L427 HydrophobicContact CD1-CD1 4.24Å; V405-L427 HydrophobicContact CG2-CD1 4.37Å; V405-L427 HydrophobicContact CG2-CD2 3.67Å; S423-L427 PolarHBondContact O-N 3Å; G424-L427 PolarHBondContact O-N 3.39Å; L427-A429 VanDerWaalsContact C-N 3.28Å; L427-A429 PolarHBondContact O-N 3.49Å; L427-M430 WeakPolarHBondContact O-CB 3.48Å; L427-M430 PolarHBondContact O-N 2.88Å; L427-Y431 HydrophobicContact CD1-CD2 4.36Å; L427-Y431 HydrophobicContact CD1-CE2 3.97Å; L427-Y431 WeakPolarHBondContact O-CD2 3.23Å; L427-Y431 PolarHBondContact O-N 3.35Å; L427-I499 HydrophobicContact CD1-CD1 3.87Å; L427-L504 HydrophobicContact CD2-CD2 4.11Å; L427-L504 HydrophobicContact CG-CD2 4.22Å; L427-I507 HydrophobicContact CD2-CD1 3.67Å
428	L	87.4	Confident	81	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-35.5	179.7	-68.9	172.3	0	0	0	112.2	G424 I426 M430 Y431 F432 F508 I511 L527 I537	G424-L428 WeakPolarHBondContact O-CB 3.3Å; G424-L428 WeakPolarHBondContact O-CG 3.32Å; G424-L428 PolarHBondContact O-N 2.92Å; I426-L428 VanDerWaalsContact C-N 3.35Å; I426-L428 PolarHBondContact O-N 2.83Å; L428-M430 VanDerWaalsContact C-N 3.3Å; L428-M430 PolarHBondContact O-N 3.28Å; L428-Y431 PolarHBondContact O-N 3.22Å; L428-Y431 VanDerWaalsContact O-N 3.14Å; L428-F432 HydrophobicContact CB-CD2 4.24Å; L428-F432 HydrophobicContact CB-CE2 3.62Å; L428-F432 HydrophobicContact CB-CZ 3.87Å; L428-F432 HydrophobicContact CD2-CZ 4.41Å; L428-F432 WeakPolarHBondContact O-CB 3.46Å; L428-F432 WeakPolarHBondContact O-CD2 3.4Å; L428-F432 WeakPolarHBondContact O-CG 3.33Å; L428-F432 PolarHBondContact O-N 3.48Å; L428-F508 HydrophobicContact CD1-CB 4.29Å; L428-F508 HydrophobicContact CD1-CD2 4.1Å; L428-F508 HydrophobicContact CD2-CB 4.23Å; L428-F508 HydrophobicContact CD2-CD2 4.47Å; L428-I511 HydrophobicContact CD1-CD1 3.81Å; L428-L527 HydrophobicContact CD1-CD1 3.9Å; L428-I537 HydrophobicContact CD2-CD1 3.63Å
429	A	86	Confident	80	Confident	3 Å²	3	29.2 Å²	29.2	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-32.7	177.7	0	0	0	0	0	113.2	T425 I426 L427 F432 K433 V488 S491	T425-A429 VanDerWaalsContact O-CB 3.22Å; T425-A429 WeakPolarHBondContact O-CB 3.41Å; T425-A429 PolarHBondContact O-N 3.49Å; I426-A429 WeakPolarHBondContact O-CB 3.4Å; I426-A429 PolarHBondContact O-N 3.47Å; I426-A429 VanDerWaalsContact O-N 3.13Å; L427-A429 VanDerWaalsContact C-N 3.28Å; L427-A429 PolarHBondContact O-N 3.49Å; A429-F432 PolarHBondContact O-N 2.85Å; A429-K433 PolarHBondContact O-N 3.03Å; A429-V488 HydrophobicContact CB-CG2 3.75Å; A429-S491 PolarHBondContact O-OG 2.92Å; A429-S491 VanDerWaalsContact O-OG 3.1Å
430	M	82	Confident	78.9	Confident	9 Å²	9	26.5 Å²	26.5	4%	0.044	15%	0.149	C	C	.	.	H	α-helix	trans	-63.9	-42.3	172.3	-63	168.2	68.9	0	0	111.2	L399 L404 I426 L427 L428 L494	L399-M430 HydrophobicContact CB-CE 4.31Å; L399-M430 HydrophobicContact CB-SD 4.17Å; L399-M430 WeakPolarHBondContact O-CE 3.36Å; L404-M430 HydrophobicContact CD1-SD 3.8Å; I426-M430 WeakPolarHBondContact O-CG 3.41Å; I426-M430 PolarHBondContact O-N 2.93Å; I426-M430 VanDerWaalsContact O-N 3.13Å; L427-M430 WeakPolarHBondContact O-CB 3.48Å; L427-M430 PolarHBondContact O-N 2.88Å; L428-M430 VanDerWaalsContact C-N 3.3Å; L428-M430 PolarHBondContact O-N 3.28Å; M430-L494 HydrophobicContact CB-CD1 4.05Å; M430-L494 HydrophobicContact CB-CG 4.47Å; M430-L494 HydrophobicContact CE-CD1 4.08Å; M430-L494 HydrophobicContact CE-CD2 3.63Å; M430-L494 HydrophobicContact CE-CG 3.95Å
431	Y	83.3	Confident	77.6	Confident	3 Å²	3	27.5 Å²	27.5	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-73.1	-28.6	177.8	-79.1	-91.9	0	0	0	113.4	D401 L427 L428 K433 L494 K497 I499 L504 A536	D401-Y431 HydrophobicContact CB-CE2 4.2Å; D401-Y431 PolarHBondContact OD2-OH 2.87Å; L427-Y431 HydrophobicContact CD1-CD2 4.36Å; L427-Y431 HydrophobicContact CD1-CE2 3.97Å; L427-Y431 WeakPolarHBondContact O-CD2 3.23Å; L427-Y431 PolarHBondContact O-N 3.35Å; L428-Y431 PolarHBondContact O-N 3.22Å; L428-Y431 VanDerWaalsContact O-N 3.14Å; Y431-K433 VanDerWaalsContact C-N 3.31Å; Y431-K433 PolarHBondContact O-N 3.2Å; Y431-L494 HydrophobicContact CD2-CD1 4.13Å; Y431-L494 HydrophobicContact CE1-CD1 4.42Å; Y431-L494 HydrophobicContact CE2-CD1 3.71Å; Y431-K497 HydrophobicContact CD1-CD 4.41Å; Y431-K497 HydrophobicContact CE1-CB 4.32Å; Y431-K497 HydrophobicContact CE1-CD 4.14Å; Y431-K497 HydrophobicContact CE1-CG 4.12Å; Y431-I499 HydrophobicContact CE2-CD1 3.95Å; Y431-I499 WeakPolarHBondContact OH-CD1 3.46Å; Y431-L504 HydrophobicContact CD1-CD1 3.77Å; Y431-L504 HydrophobicContact CD2-CD1 4.41Å; Y431-L504 HydrophobicContact CD2-CD2 3.97Å; Y431-L504 HydrophobicContact CE1-CD1 3.49Å; Y431-L504 VanDerWaalsContact CE1-CD1 3.49Å; Y431-L504 HydrophobicContact CE2-CD1 4.22Å; Y431-L504 HydrophobicContact CE2-CD2 3.85Å; Y431-L504 HydrophobicContact CG-CD1 4.23Å; Y431-L504 HydrophobicContact CG-CD2 4.44Å; Y431-A536 HydrophobicContact CD1-CB 3.91Å
432	F	84.5	Confident	76.1	Confident	1 Å²	1	28.7 Å²	28.7	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-75.2	-15.1	179.3	-66.1	-29.3	0	0	0	114.5	L428 A429 D434 V435 L484 V488 F508 L527 Y530 I537	L428-F432 HydrophobicContact CB-CD2 4.24Å; L428-F432 HydrophobicContact CB-CE2 3.62Å; L428-F432 HydrophobicContact CB-CZ 3.87Å; L428-F432 HydrophobicContact CD2-CZ 4.41Å; L428-F432 WeakPolarHBondContact O-CB 3.46Å; L428-F432 WeakPolarHBondContact O-CD2 3.4Å; L428-F432 WeakPolarHBondContact O-CG 3.33Å; L428-F432 PolarHBondContact O-N 3.48Å; A429-F432 PolarHBondContact O-N 2.85Å; F432-D434 PolarHBondContact O-N 3.35Å; F432-D434 VanDerWaalsContact O-N 3.15Å; F432-V435 VanDerWaalsContact O-CB 3.22Å; F432-V435 WeakPolarHBondContact O-CB 3.22Å; F432-V435 VanDerWaalsContact O-CG2 3.3Å; F432-V435 WeakPolarHBondContact O-CG2 3.23Å; F432-V435 PolarHBondContact O-N 2.99Å; F432-L484 HydrophobicContact CD2-CD2 4.17Å; F432-L484 HydrophobicContact CE2-CD2 4.46Å; F432-V488 HydrophobicContact CB-CG1 4.02Å; F432-V488 HydrophobicContact CB-CG2 3.89Å; F432-V488 HydrophobicContact CD2-CG2 4.27Å; F432-F508 HydrophobicContact CZ-CD2 4.43Å; F432-F508 HydrophobicContact CZ-CE2 4.42Å; F432-L527 HydrophobicContact CE2-CD1 3.8Å; F432-L527 HydrophobicContact CZ-CD1 4.04Å; F432-Y530 HydrophobicContact CB-CD1 3.78Å; F432-Y530 HydrophobicContact CB-CE1 4.37Å; F432-Y530 HydrophobicContact CB-CG 4.22Å; F432-Y530 HydrophobicContact CD2-CD1 4.33Å; F432-Y530 HydrophobicContact CD2-CD2 4.45Å; F432-Y530 AromaticContact CD2-CG 3.9Å; F432-Y530 HydrophobicContact CD2-CG 3.9Å; F432-Y530 HydrophobicContact CE2-CG 4.37Å; F432-Y530 HydrophobicContact CG-CD1 4.03Å; F432-Y530 AromaticContact CG-CG 3.98Å; F432-Y530 HydrophobicContact CG-CG 3.98Å; F432-I537 HydrophobicContact CE1-CD1 3.55Å; F432-I537 HydrophobicContact CZ-CD1 3.99Å
433	K	79.7	Confident	74.2	Confident	60 Å²	60	29.8 Å²	29.8	26%	0.261	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-58	-30.4	178.1	-170.1	155.3	177.9	155.3	0	112.4	A429 Y431 V435 Y436 V488 K489 S491 P493	A429-K433 PolarHBondContact O-N 3.03Å; Y431-K433 VanDerWaalsContact C-N 3.31Å; Y431-K433 PolarHBondContact O-N 3.2Å; K433-V435 PolarHBondContact O-N 2.72Å; K433-V435 VanDerWaalsContact O-N 3.15Å; K433-Y436 PolarHBondContact O-N 3.09Å; K433-Y436 VanDerWaalsContact O-N 3.13Å; K433-V488 HydrophobicContact CB-CG1 4.43Å; K433-K489 PolarHBondContact NZ-O 2.95Å; K433-S491 WeakPolarHBondContact CD-O 3.46Å; K433-S491 WeakPolarHBondContact CE-O 3.45Å; K433-S491 PolarHBondContact NZ-O 3.41Å; K433-P493 HydrophobicContact CD-CB 4.2Å
434	D	74.7	Confident	72.5	Confident	43 Å²	43	38.1 Å²	38.1	23%	0.23	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-57.3	-27	173.8	-82	13.3	0	0	0	114.6	F432 Y436 S437 C440 Y450 K497	F432-D434 PolarHBondContact O-N 3.35Å; F432-D434 VanDerWaalsContact O-N 3.15Å; D434-Y436 PolarHBondContact O-N 3.39Å; D434-S437 WeakPolarHBondContact O-CB 3.45Å; D434-S437 PolarHBondContact O-N 3.4Å; D434-S437 PolarHBondContact O-OG 3.44Å; D434-C440 PolarHBondContact O-SG 3.24Å; D434-C440 VanDerWaalsContact O-SG 3.41Å; D434-Y450 PolarHBondContact OD2-OH 3.36Å; D434-K497 WeakPolarHBondContact OD2-CE 3.31Å; D434-K497 IonicContact OD2-NZ 3.16Å; D434-K497 PolarHBondContact OD2-NZ 2.96Å
435	V	75.7	Confident	70.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-61.4	-31.8	179.6	177.2	0	0	0	0	110.7	F432 K433 S437 R472 L476 Y530 Q533	F432-V435 VanDerWaalsContact O-CB 3.22Å; F432-V435 WeakPolarHBondContact O-CB 3.22Å; F432-V435 VanDerWaalsContact O-CG2 3.3Å; F432-V435 WeakPolarHBondContact O-CG2 3.23Å; F432-V435 PolarHBondContact O-N 2.99Å; K433-V435 PolarHBondContact O-N 2.72Å; K433-V435 VanDerWaalsContact O-N 3.15Å; V435-S437 VanDerWaalsContact C-N 3.34Å; V435-R472 VanDerWaalsContact O-CZ 3.25Å; V435-R472 PolarHBondContact O-NH1 3.02Å; V435-R472 PolarHBondContact O-NH2 3.38Å; V435-L476 HydrophobicContact CG1-CD2 4.17Å; V435-Y530 HydrophobicContact CB-CD1 4.45Å; V435-Y530 HydrophobicContact CG2-CD1 4.28Å; V435-Q533 HydrophobicContact CB-CB 4.5Å; V435-Q533 HydrophobicContact CG1-CB 3.75Å; V435-Q533 HydrophobicContact CG1-CG 4.39Å; V435-Q533 HydrophobicContact CG2-CB 3.9Å
436	Y	75.4	Confident	68.3	Low	77 Å²	77	46.6 Å²	46.6	30%	0.302	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-79.9	-14	177.5	-69.3	-76.6	0	0	0	113.7	K433 D434 L476 E485 V488 Y530	K433-Y436 PolarHBondContact O-N 3.09Å; K433-Y436 VanDerWaalsContact O-N 3.13Å; D434-Y436 PolarHBondContact O-N 3.39Å; Y436-L476 HydrophobicContact CE1-CD2 4.2Å; Y436-E485 WeakPolarHBondContact OH-CG 3.27Å; Y436-V488 HydrophobicContact CD2-CG1 4.15Å; Y436-V488 HydrophobicContact CE2-CG1 3.78Å; Y436-Y530 AromaticContact CE2-CE1 3.95Å; Y436-Y530 HydrophobicContact CE2-CE1 3.95Å; Y436-Y530 PolarHBondContact OH-OH 3.07Å
437	S	69.6	Low	66	Low	34 Å²	34	48.5 Å²	48.5	24%	0.238	26%	0.261	C	S	.	.			trans	-62.6	131.5	178.4	74.8	0	0	0	0	110.3	D434 V435 T439 C440	D434-S437 WeakPolarHBondContact O-CB 3.45Å; D434-S437 PolarHBondContact O-N 3.4Å; D434-S437 PolarHBondContact O-OG 3.44Å; V435-S437 VanDerWaalsContact C-N 3.34Å; S437-T439 PolarHBondContact O-N 3.33Å; S437-C440 WeakPolarHBondContact O-CB 3.26Å; S437-C440 PolarHBondContact O-N 2.98Å; S437-C440 WeakPolarHBondContact OG-CA 3.39Å; S437-C440 WeakPolarHBondContact OG-CB 3.49Å; S437-C440 PolarHBondContact OG-N 2.95Å
438	P	60	Low	63.8	Low	129 Å²	129	57.2 Å²	57.2	84%	0.838	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.2	180	24.8	-33.2	0	0	0	112.1
439	T	59	Low	61.5	Low	35 Å²	35	61.5 Å²	61.5	22%	0.215	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	1.4	-177	49.8	0	0	0	0	114.5	S437 F441 S442 K445	S437-T439 PolarHBondContact O-N 3.33Å; T439-F441 PolarHBondContact O-N 3.42Å; T439-S442 PolarHBondContact O-N 3.29Å; T439-K445 HydrophobicContact CG2-CD 4.19Å; T439-K445 HydrophobicContact CG2-CG 4.36Å; T439-K445 VanDerWaalsContact OG1-CD 3.3Å; T439-K445 WeakPolarHBondContact OG1-CD 3.43Å; T439-K445 WeakPolarHBondContact OG1-CE 3.4Å; T439-K445 PolarHBondContact OG1-NZ 2.66Å
440	C	58.3	Low	59.3	Low	11 Å²	11	64.5 Å²	64.5	7%	0.074	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-36.2	-174.5	-165.3	0	0	0	0	112.9	D434 S437 L535	D434-C440 PolarHBondContact O-SG 3.24Å; D434-C440 VanDerWaalsContact O-SG 3.41Å; S437-C440 WeakPolarHBondContact O-CB 3.26Å; S437-C440 PolarHBondContact O-N 2.98Å; S437-C440 WeakPolarHBondContact OG-CA 3.39Å; S437-C440 WeakPolarHBondContact OG-CB 3.49Å; S437-C440 PolarHBondContact OG-N 2.95Å; C440-L535 WeakPolarHBondContact O-CD1 3.35Å; C440-L535 WeakPolarHBondContact SG-CD1 3.44Å
441	F	59.7	Low	57	Low	20 Å²	20	71.4 Å²	71.4	9%	0.088	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	22.6	176	-59.8	-72.9	0	0	0	113.2	T439 M465 L469 Q533 L535	T439-F441 PolarHBondContact O-N 3.42Å; F441-M465 HydrophobicContact CB-CG 4.47Å; F441-M465 WeakPolarHBondContact O-CE 3.36Å; F441-L469 HydrophobicContact CB-CD2 4.05Å; F441-L469 HydrophobicContact CB-CG 4.34Å; F441-Q533 WeakPolarHBondContact CZ-O 3.44Å; F441-L535 HydrophobicContact CD1-CD1 4.37Å; F441-L535 HydrophobicContact CD1-CD2 4.44Å; F441-L535 HydrophobicContact CE1-CD1 3.83Å; F441-L535 HydrophobicContact CE1-CD2 4.12Å; F441-L535 HydrophobicContact CE1-CG 4.01Å; F441-L535 HydrophobicContact CZ-CD1 4.03Å; F441-L535 HydrophobicContact CZ-CG 4.5Å
442	S	53.9	Low	54.7	Low	45 Å²	45	77.4 Å²	77.4	32%	0.315	41%	0.411	S	S	.	.			trans	-84.7	138.1	176.1	179.7	0	0	0	0	110.9	T439 K444	T439-S442 PolarHBondContact O-N 3.29Å; S442-K444 PolarHBondContact O-N 3.01Å
443	S	46.5	Very low	52.5	Low	98 Å²	98	84.1 Å²	84.1	69%	0.685	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.8	-178.8	67	0	0	0	0	113.6
444	K	44.4	Very low	50.5	Low	177 Å²	177	83.3 Å²	83.3	77%	0.77	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-27.6	-171.6	-67.2	-174.1	177.8	-177.4	0	115.4	S442	S442-K444 PolarHBondContact O-N 3.01Å
445	K	42.6	Very low	48.6	Very low	127 Å²	127	86.1 Å²	86.1	55%	0.552	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-17.2	-179.5	-84.2	-158.5	-170.9	164.6	0	115.1	T439 S447 F448	T439-K445 HydrophobicContact CG2-CD 4.19Å; T439-K445 HydrophobicContact CG2-CG 4.36Å; T439-K445 VanDerWaalsContact OG1-CD 3.3Å; T439-K445 WeakPolarHBondContact OG1-CD 3.43Å; T439-K445 WeakPolarHBondContact OG1-CE 3.4Å; T439-K445 PolarHBondContact OG1-NZ 2.66Å; K445-S447 PolarHBondContact O-N 2.75Å; K445-S447 VanDerWaalsContact O-N 3.1Å; K445-F448 PolarHBondContact O-N 3.12Å
446	F	41.7	Very low	46.7	Very low	77 Å²	77	95.1 Å²	95.1	34%	0.338	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.7	174.5	-114.4	-84.9	0	0	0	113.2	V454 L535	F446-V454 HydrophobicContact CD1-CG1 4.38Å; F446-V454 HydrophobicContact CE1-CG1 3.99Å; F446-V454 HydrophobicContact CE1-CG2 4.35Å; F446-L535 HydrophobicContact CE2-CD2 3.32Å; F446-L535 HydrophobicContact CZ-CD2 3.27Å
447	S	36.7	Very low	44.7	Very low	70 Å²	70	94 Å²	94	49%	0.49	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.6	-175.1	177.7	0	0	0	0	115.5	K445 K451	K445-S447 PolarHBondContact O-N 2.75Å; K445-S447 VanDerWaalsContact O-N 3.1Å; S447-K451 WeakPolarHBondContact O-CD 3.08Å; S447-K451 VanDerWaalsContact O-CE 3.28Å; S447-K451 WeakPolarHBondContact O-CE 3.46Å
448	F	38.6	Very low	43.3	Very low	182 Å²	182	99.3 Å²	99.3	80%	0.798	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-28.2	-163.6	-143.6	-96.3	0	0	0	115.9	K445	K445-F448 PolarHBondContact O-N 3.12Å
449	S	38.5	Very low	42.5	Very low	91 Å²	91	96 Å²	96	64%	0.636	52%	0.519	S	S	*	.	S	Bend	trans	-109.2	-25.2	-177.3	169.3	0	0	0	0	114.3
450	Y	41.1	Very low	41.6	Very low	66 Å²	66	98.4 Å²	98.4	26%	0.259	53%	0.53	S	S	.	.	S	Bend	trans	-106.3	20.9	-177.1	-68.5	-85.7	0	0	0	113.7	D434 C452 Y453 K497	D434-Y450 PolarHBondContact OD2-OH 3.36Å; Y450-C452 PolarHBondContact O-N 3.24Å; Y450-C452 VanDerWaalsContact O-N 3.1Å; Y450-Y453 PolarHBondContact O-N 2.8Å; Y450-K497 HydrophobicContact CE1-CD 4.33Å; Y450-K497 VanDerWaalsContact OH-CE 3.28Å; Y450-K497 WeakPolarHBondContact OH-CE 3.11Å; Y450-K497 PolarHBondContact OH-NZ 2.92Å
451	K	33.9	Very low	41.4	Very low	154 Å²	154	102 Å²	102	67%	0.67	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.6	-171.5	-119.9	176.7	-179.8	179.9	0	114	S447	S447-K451 WeakPolarHBondContact O-CD 3.08Å; S447-K451 VanDerWaalsContact O-CE 3.28Å; S447-K451 WeakPolarHBondContact O-CE 3.46Å
452	C	35.4	Very low	41.4	Very low	129 Å²	129	103.6 Å²	103.6	87%	0.872	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-18.4	-178.6	-109.1	0	0	0	0	116	Y450	Y450-C452 PolarHBondContact O-N 3.24Å; Y450-C452 VanDerWaalsContact O-N 3.1Å
453	Y	36.3	Very low	41.9	Very low	142 Å²	142	105.2 Å²	105.2	56%	0.557	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-8.6	-172.9	-89.5	-87.7	0	0	0	115	Y450 F500	Y450-Y453 PolarHBondContact O-N 2.8Å; Y453-F500 WeakPolarHBondContact OH-CD1 3.26Å
454	V	38	Very low	43	Very low	42 Å²	42	102.2 Å²	102.2	26%	0.255	53%	0.533	S	S	.	.			trans	-125.4	25.2	-155.9	-170.6	0	0	0	0	113.5	F446 K461	F446-V454 HydrophobicContact CD1-CG1 4.38Å; F446-V454 HydrophobicContact CE1-CG1 3.99Å; F446-V454 HydrophobicContact CE1-CG2 4.35Å; V454-K461 HydrophobicContact CG1-CD 4.28Å; V454-K461 VanDerWaalsContact O-CE 3.28Å; V454-K461 WeakPolarHBondContact O-CE 3.16Å; V454-K461 PolarHBondContact O-NZ 3.22Å
455	S	35.8	Very low	44.3	Very low	103 Å²	103	97.3 Å²	97.3	72%	0.72	51%	0.514	S	S	*	.	S	Bend	trans	-77.1	-28.7	-177.2	179.9	0	0	0	0	114.7
456	Q	36.1	Very low	45.6	Very low	188 Å²	188	98.9 Å²	98.9	88%	0.879	52%	0.516	S	S	*	.	S	Bend	trans	-92.8	-5.7	-161.9	-81.6	174.7	-14.7	0	0	118.6
457	C	32.8	Very low	47.1	Very low	53 Å²	53	95.3 Å²	95.3	36%	0.358	50%	0.5	S	S	.	.			trans	-139.8	71.9	-168.5	-66.9	0	0	0	0	114.9	G459 L460 K461	C457-G459 VanDerWaalsContact C-N 3.33Å; C457-G459 PolarHBondContact O-N 3.36Å; C457-L460 HydrophobicContact CB-CB 4.21Å; C457-L460 HydrophobicContact CB-CD1 4.14Å; C457-K461 WeakPolarHBondContact O-CE 3.45Å; C457-K461 VanDerWaalsContact O-CG 3.26Å; C457-K461 WeakPolarHBondContact O-CG 2.88Å; C457-K461 PolarHBondContact O-N 3.06Å
458	I	40.4	Very low	49	Very low	147 Å²	147	92 Å²	92	75%	0.754	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-30.9	-178.3	-61.5	171	0	0	0	112.6
459	G	42.3	Very low	50.8	Low	60 Å²	60	87.3 Å²	87.3	62%	0.619	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-37.5	178.7	0	0	0	0	0	115.2	C457 S462	C457-G459 VanDerWaalsContact C-N 3.33Å; C457-G459 PolarHBondContact O-N 3.36Å; G459-S462 PolarHBondContact O-OG 3.22Å
460	L	41.7	Very low	52.4	Low	85 Å²	85	88.3 Å²	88.3	45%	0.445	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-24	-178.3	-74.7	101.3	0	0	0	113.4	C457 S462 R463 L464	C457-L460 HydrophobicContact CB-CB 4.21Å; C457-L460 HydrophobicContact CB-CD1 4.14Å; L460-S462 PolarHBondContact O-N 2.87Å; L460-R463 WeakPolarHBondContact O-CB 2.99Å; L460-R463 PolarHBondContact O-N 2.92Å; L460-L464 PolarHBondContact O-N 3.43Å
461	K	53.3	Low	54.3	Low	87 Å²	87	85.3 Å²	85.3	38%	0.378	45%	0.447	S	S	.	.	H	α-helix	trans	-54.3	-36.6	175.7	-76.4	169.7	-163	-171.9	0	112.8	V454 C457 R463 M465	V454-K461 HydrophobicContact CG1-CD 4.28Å; V454-K461 VanDerWaalsContact O-CE 3.28Å; V454-K461 WeakPolarHBondContact O-CE 3.16Å; V454-K461 PolarHBondContact O-NZ 3.22Å; C457-K461 WeakPolarHBondContact O-CE 3.45Å; C457-K461 VanDerWaalsContact O-CG 3.26Å; C457-K461 WeakPolarHBondContact O-CG 2.88Å; C457-K461 PolarHBondContact O-N 3.06Å; K461-R463 VanDerWaalsContact C-N 3.31Å; K461-R463 PolarHBondContact O-N 3.5Å; K461-M465 VanDerWaalsContact O-CB 3.26Å; K461-M465 WeakPolarHBondContact O-CB 3.08Å; K461-M465 PolarHBondContact O-N 2.95Å
462	S	59.6	Low	56.6	Low	52 Å²	52	80.3 Å²	80.3	36%	0.364	42%	0.424	S	S	.	.	H	α-helix	trans	-71.1	-24.8	179.8	79.4	0	0	0	0	113.7	G459 L460 R466	G459-S462 PolarHBondContact O-OG 3.22Å; L460-S462 PolarHBondContact O-N 2.87Å; S462-R466 WeakPolarHBondContact O-CB 3.45Å; S462-R466 WeakPolarHBondContact O-CG 3.39Å; S462-R466 PolarHBondContact O-N 3.48Å; S462-R466 PolarHBondContact O-NE 3.32Å; S462-R466 VanDerWaalsContact O-NE 3.1Å; S462-R466 PolarHBondContact OG-NH2 2.82Å; S462-R466 VanDerWaalsContact OG-NH2 3.07Å
463	R	64.9	Low	58.7	Low	80 Å²	80	82.8 Å²	82.8	30%	0.302	42%	0.42	S	S	.	.	H	α-helix	trans	-78.4	-54.5	-176.1	-178.3	178.8	-179.2	-161.3	-2.3	110.7	L460 K461 M465 R466 R467 Y569 F573	L460-R463 WeakPolarHBondContact O-CB 2.99Å; L460-R463 PolarHBondContact O-N 2.92Å; K461-R463 VanDerWaalsContact C-N 3.31Å; K461-R463 PolarHBondContact O-N 3.5Å; R463-M465 VanDerWaalsContact C-N 3.31Å; R463-M465 PolarHBondContact O-N 3.02Å; R463-R466 PolarHBondContact O-N 3.21Å; R463-R467 WeakPolarHBondContact O-CB 3.35Å; R463-R467 PolarHBondContact O-N 3.15Å; R463-Y569 VanDerWaalsContact CG-OH 3.29Å; R463-Y569 WeakPolarHBondContact CG-OH 3.44Å; R463-Y569 PolarHBondContact O-OH 3.03Å; R463-F573 HydrophobicContact CG-CE1 3.78Å; R463-F573 HydrophobicContact CG-CZ 3.84Å; R463-F573 VanDerWaalsContact CZ-CD1 3.46Å; R463-F573 VanDerWaalsContact NE-CD1 3.26Å; R463-F573 VanDerWaalsContact NH2-CD1 3.34Å
464	L	70	Confident	60.9	Low	34 Å²	34	77.1 Å²	77.1	18%	0.178	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-43.8	176.9	171.9	63.2	0	0	0	110.8	L460 R467 S468 A538 I543	L460-L464 PolarHBondContact O-N 3.43Å; L464-R467 WeakPolarHBondContact O-CB 3.46Å; L464-R467 PolarHBondContact O-N 3.11Å; L464-S468 WeakPolarHBondContact O-CB 3.4Å; L464-S468 PolarHBondContact O-N 3.18Å; L464-S468 PolarHBondContact O-OG 2.86Å; L464-S468 VanDerWaalsContact O-OG 3.12Å; L464-A538 HydrophobicContact CD1-CB 4.23Å; L464-A538 VanDerWaalsContact CD2-O 3.26Å; L464-A538 WeakPolarHBondContact CD2-O 3.49Å; L464-I543 HydrophobicContact CB-CD1 4.03Å; L464-I543 HydrophobicContact CD1-CD1 3.28Å; L464-I543 HydrophobicContact CD1-CG1 3.83Å; L464-I543 HydrophobicContact CD2-CD1 4.12Å; L464-I543 HydrophobicContact CG-CD1 3.96Å
465	M	70.3	Confident	63.1	Low	75 Å²	75	75.1 Å²	75.1	37%	0.369	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-47.5	179.2	-175.5	174.6	169.8	0	0	112.4	F441 K461 R463 R467 S468 L469	F441-M465 HydrophobicContact CB-CG 4.47Å; F441-M465 WeakPolarHBondContact O-CE 3.36Å; K461-M465 VanDerWaalsContact O-CB 3.26Å; K461-M465 WeakPolarHBondContact O-CB 3.08Å; K461-M465 PolarHBondContact O-N 2.95Å; R463-M465 VanDerWaalsContact C-N 3.31Å; R463-M465 PolarHBondContact O-N 3.02Å; M465-R467 VanDerWaalsContact C-N 3.35Å; M465-R467 PolarHBondContact O-N 3.32Å; M465-S468 PolarHBondContact O-N 2.86Å; M465-L469 HydrophobicContact CE-CD1 4.11Å; M465-L469 HydrophobicContact CG-CD1 3.97Å; M465-L469 WeakPolarHBondContact O-CB 3.41Å; M465-L469 VanDerWaalsContact O-CG 3.26Å; M465-L469 WeakPolarHBondContact O-CG 3.24Å; M465-L469 PolarHBondContact O-N 3.39Å
466	R	70	Confident	65.4	Low	160 Å²	160	72.5 Å²	72.5	60%	0.604	37%	0.365	S	S	*	.	H	α-helix	trans	-61.9	-41.2	176.1	-82.4	-176.1	-80.9	-179.6	-9.1	112.2	S462 R463 N470	S462-R466 WeakPolarHBondContact O-CB 3.45Å; S462-R466 WeakPolarHBondContact O-CG 3.39Å; S462-R466 PolarHBondContact O-N 3.48Å; S462-R466 PolarHBondContact O-NE 3.32Å; S462-R466 VanDerWaalsContact O-NE 3.1Å; S462-R466 PolarHBondContact OG-NH2 2.82Å; S462-R466 VanDerWaalsContact OG-NH2 3.07Å; R463-R466 PolarHBondContact O-N 3.21Å; R466-N470 WeakPolarHBondContact O-CB 3.47Å; R466-N470 VanDerWaalsContact O-CG 3.24Å; R466-N470 PolarHBondContact O-N 3.13Å; R466-N470 VanDerWaalsContact O-N 3.15Å; R466-N470 PolarHBondContact O-ND2 3.3Å
467	R	74.5	Confident	67.7	Low	1 Å²	1	69.7 Å²	69.7	0%	0.004	35%	0.35	C	S	.	.	H	α-helix	trans	-55.4	-58.5	173.5	-177	-174.9	159.5	-114.8	1.3	111.5	R463 L464 M465 L469 N470 L471 S532 D547 Y569	R463-R467 WeakPolarHBondContact O-CB 3.35Å; R463-R467 PolarHBondContact O-N 3.15Å; L464-R467 WeakPolarHBondContact O-CB 3.46Å; L464-R467 PolarHBondContact O-N 3.11Å; M465-R467 VanDerWaalsContact C-N 3.35Å; M465-R467 PolarHBondContact O-N 3.32Å; R467-L469 VanDerWaalsContact C-N 3.31Å; R467-L469 PolarHBondContact O-N 3.25Å; R467-N470 PolarHBondContact O-N 3.48Å; R467-N470 VanDerWaalsContact O-N 3.12Å; R467-L471 HydrophobicContact CG-CD1 3.94Å; R467-L471 PolarHBondContact O-N 3.31Å; R467-S532 PolarHBondContact NH1-O 3.18Å; R467-D547 IonicContact CZ-OD1 3.43Å; R467-D547 IonicContact CZ-OD2 2.66Å; R467-D547 VanDerWaalsContact CZ-OD2 3.29Å; R467-D547 IonicContact NE-OD1 3.96Å; R467-D547 PolarHBondContact NE-OD1 3.21Å; R467-D547 IonicContact NE-OD2 3.08Å; R467-D547 PolarHBondContact NE-OD2 3.09Å; R467-D547 IonicContact NH2-OD1 3.78Å; R467-D547 PolarHBondContact NH2-OD1 3.07Å; R467-D547 IonicContact NH2-OD2 2.98Å; R467-D547 PolarHBondContact NH2-OD2 2.71Å; R467-Y569 VanDerWaalsContact CA-CE2 3.46Å; R467-Y569 HydrophobicContact CB-CD1 4.49Å; R467-Y569 HydrophobicContact CB-CD2 4.02Å; R467-Y569 HydrophobicContact CB-CE1 3.91Å; R467-Y569 HydrophobicContact CB-CE2 3.34Å; R467-Y569 WeakPolarHBondContact CB-OH 3.32Å; R467-Y569 VanDerWaalsContact CD-CE1 3.45Å; R467-Y569 HydrophobicContact CG-CD1 3.78Å; R467-Y569 HydrophobicContact CG-CD2 4.02Å; R467-Y569 HydrophobicContact CG-CE1 3.45Å; R467-Y569 VanDerWaalsContact CG-CE1 3.45Å; R467-Y569 HydrophobicContact CG-CE2 3.71Å; R467-Y569 HydrophobicContact CG-CG 4.06Å; R467-Y569 VanDerWaalsContact CG-CZ 3.41Å
468	S	75.9	Confident	70.1	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.007	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-39.7	-170.6	-61.3	0	0	0	0	110.6	L464 M465 N470 L471 R472 Q533	L464-S468 WeakPolarHBondContact O-CB 3.4Å; L464-S468 PolarHBondContact O-N 3.18Å; L464-S468 PolarHBondContact O-OG 2.86Å; L464-S468 VanDerWaalsContact O-OG 3.12Å; M465-S468 PolarHBondContact O-N 2.86Å; S468-N470 PolarHBondContact O-N 3.29Å; S468-L471 PolarHBondContact O-N 3.13Å; S468-R472 WeakPolarHBondContact O-CA 3.5Å; S468-R472 VanDerWaalsContact O-CB 3.24Å; S468-R472 WeakPolarHBondContact O-CB 3.5Å; S468-R472 PolarHBondContact O-N 3.34Å; S468-Q533 PolarHBondContact O-NE2 3.19Å; S468-Q533 PolarHBondContact O-OE1 3.49Å
469	L	75.2	Confident	72.3	Confident	83 Å²	83	61.6 Å²	61.6	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-59.3	-42.4	173	-73.8	169.2	0	0	0	112.9	F441 M465 R467	F441-L469 HydrophobicContact CB-CD2 4.05Å; F441-L469 HydrophobicContact CB-CG 4.34Å; M465-L469 HydrophobicContact CE-CD1 4.11Å; M465-L469 HydrophobicContact CG-CD1 3.97Å; M465-L469 WeakPolarHBondContact O-CB 3.41Å; M465-L469 VanDerWaalsContact O-CG 3.26Å; M465-L469 WeakPolarHBondContact O-CG 3.24Å; M465-L469 PolarHBondContact O-N 3.39Å; R467-L469 VanDerWaalsContact C-N 3.31Å; R467-L469 PolarHBondContact O-N 3.25Å
470	N	73.5	Confident	74.1	Confident	113 Å²	113	66.2 Å²	66.2	60%	0.604	31%	0.305	S	S	*	.	H	α-helix	trans	-67.3	-40.8	178.3	-75.1	-25.5	0	0	0	112.4	R466 R467 S468	R466-N470 WeakPolarHBondContact O-CB 3.47Å; R466-N470 VanDerWaalsContact O-CG 3.24Å; R466-N470 PolarHBondContact O-N 3.13Å; R466-N470 VanDerWaalsContact O-N 3.15Å; R466-N470 PolarHBondContact O-ND2 3.3Å; R467-N470 PolarHBondContact O-N 3.48Å; R467-N470 VanDerWaalsContact O-N 3.12Å; S468-N470 PolarHBondContact O-N 3.29Å
471	L	81.4	Confident	75.9	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-78.8	-25	-179.4	-70	175.8	0	0	0	113.1	R467 S468 K473 V474 V475 N565 I566	R467-L471 HydrophobicContact CG-CD1 3.94Å; R467-L471 PolarHBondContact O-N 3.31Å; S468-L471 PolarHBondContact O-N 3.13Å; L471-K473 PolarHBondContact O-N 2.93Å; L471-V474 PolarHBondContact O-N 3.45Å; L471-V474 VanDerWaalsContact O-N 3.08Å; L471-V475 HydrophobicContact CB-CG2 4.1Å; L471-V475 WeakPolarHBondContact O-CB 3.15Å; L471-V475 WeakPolarHBondContact O-CG2 3.44Å; L471-V475 PolarHBondContact O-N 3.09Å; L471-N565 HydrophobicContact CD2-CB 3.85Å; L471-I566 HydrophobicContact CD2-CG1 4.12Å
472	R	81.3	Confident	77.5	Confident	50 Å²	50	65.5 Å²	65.5	19%	0.189	30%	0.301	C	S	.	.	H	α-helix	trans	-51.1	-49.4	-169.5	-177.4	174.6	179.6	82.1	-0.4	113.7	V435 S468 V474 V475 L476	V435-R472 VanDerWaalsContact O-CZ 3.25Å; V435-R472 PolarHBondContact O-NH1 3.02Å; V435-R472 PolarHBondContact O-NH2 3.38Å; S468-R472 WeakPolarHBondContact O-CA 3.5Å; S468-R472 VanDerWaalsContact O-CB 3.24Å; S468-R472 WeakPolarHBondContact O-CB 3.5Å; S468-R472 PolarHBondContact O-N 3.34Å; R472-V474 VanDerWaalsContact C-N 3.31Å; R472-V474 PolarHBondContact O-N 3.1Å; R472-V475 PolarHBondContact O-N 2.68Å; R472-L476 HydrophobicContact CG-CD1 3.77Å; R472-L476 HydrophobicContact CG-CG 4.3Å; R472-L476 WeakPolarHBondContact O-CB 3.48Å; R472-L476 VanDerWaalsContact O-CG 3.28Å; R472-L476 WeakPolarHBondContact O-CG 3.4Å; R472-L476 PolarHBondContact O-N 3.26Å
473	K	80.4	Confident	78.6	Confident	181 Å²	181	72.8 Å²	72.8	79%	0.787	32%	0.321	S	S	*	.	H	α-helix	trans	-60.2	-43.1	-177.7	-70.8	-173.3	178.9	-177.2	0	111.9	L471 F477	L471-K473 PolarHBondContact O-N 2.93Å; K473-F477 WeakPolarHBondContact O-CB 3.45Å; K473-F477 PolarHBondContact O-N 2.9Å; K473-F477 VanDerWaalsContact O-N 3.1Å
474	V	81.7	Confident	79.5	Confident	23 Å²	23	70 Å²	70	14%	0.139	31%	0.312	C	S	.	.	H	α-helix	trans	-74.7	-43.1	-176	177.7	0	0	0	0	109.7	L471 R472 F477 T478 L562 N565	L471-V474 PolarHBondContact O-N 3.45Å; L471-V474 VanDerWaalsContact O-N 3.08Å; R472-V474 VanDerWaalsContact C-N 3.31Å; R472-V474 PolarHBondContact O-N 3.1Å; V474-F477 WeakPolarHBondContact O-CB 3.36Å; V474-F477 PolarHBondContact O-N 3.32Å; V474-T478 WeakPolarHBondContact O-CG2 3.44Å; V474-T478 PolarHBondContact O-N 3Å; V474-T478 PolarHBondContact O-OG1 3.28Å; V474-L562 HydrophobicContact CG1-CB 4.4Å; V474-L562 HydrophobicContact CG1-CD1 4.18Å; V474-N565 HydrophobicContact CG2-CB 4.42Å; V474-N565 WeakPolarHBondContact CG2-ND2 3.29Å
475	V	84.1	Confident	80.2	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-50	176.6	167.6	0	0	0	0	111.1	L471 R472 F477 T478 L479 C529 Q533 L562	L471-V475 HydrophobicContact CB-CG2 4.1Å; L471-V475 WeakPolarHBondContact O-CB 3.15Å; L471-V475 WeakPolarHBondContact O-CG2 3.44Å; L471-V475 PolarHBondContact O-N 3.09Å; R472-V475 PolarHBondContact O-N 2.68Å; V475-F477 VanDerWaalsContact C-N 3.27Å; V475-F477 PolarHBondContact O-N 3Å; V475-T478 WeakPolarHBondContact CA-OG1 3.35Å; V475-T478 PolarHBondContact O-N 3.23Å; V475-T478 VanDerWaalsContact O-N 3.15Å; V475-T478 PolarHBondContact O-OG1 3.47Å; V475-L479 HydrophobicContact CG1-CD1 3.75Å; V475-L479 HydrophobicContact CG1-CG 4.44Å; V475-L479 VanDerWaalsContact O-CG 3.22Å; V475-L479 WeakPolarHBondContact O-CG 3.35Å; V475-L479 PolarHBondContact O-N 3.31Å; V475-C529 HydrophobicContact CG1-CB 3.77Å; V475-C529 WeakPolarHBondContact CG1-O 3.44Å; V475-Q533 HydrophobicContact CB-CG 4.33Å; V475-Q533 HydrophobicContact CG1-CG 3.74Å; V475-L562 HydrophobicContact CG2-CD1 4.32Å
476	L	83.1	Confident	80.8	Confident	48 Å²	48	72.5 Å²	72.5	25%	0.251	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-34.9	178	-68.8	176.4	0	0	0	112.2	V435 Y436 R472 L479 R480	V435-L476 HydrophobicContact CG1-CD2 4.17Å; Y436-L476 HydrophobicContact CE1-CD2 4.2Å; R472-L476 HydrophobicContact CG-CD1 3.77Å; R472-L476 HydrophobicContact CG-CG 4.3Å; R472-L476 WeakPolarHBondContact O-CB 3.48Å; R472-L476 VanDerWaalsContact O-CG 3.28Å; R472-L476 WeakPolarHBondContact O-CG 3.4Å; R472-L476 PolarHBondContact O-N 3.26Å; L476-L479 PolarHBondContact O-N 2.65Å; L476-R480 PolarHBondContact O-N 2.85Å
477	F	84.7	Confident	81.3	Confident	128 Å²	128	67.7 Å²	67.7	56%	0.561	31%	0.306	S	S	*	.	H	α-helix	trans	-65.3	-42.9	173.5	-177	-96.7	0	0	0	112	K473 V474 V475 L479 R480	K473-F477 WeakPolarHBondContact O-CB 3.45Å; K473-F477 PolarHBondContact O-N 2.9Å; K473-F477 VanDerWaalsContact O-N 3.1Å; V474-F477 WeakPolarHBondContact O-CB 3.36Å; V474-F477 PolarHBondContact O-N 3.32Å; V475-F477 VanDerWaalsContact C-N 3.27Å; V475-F477 PolarHBondContact O-N 3Å; F477-L479 VanDerWaalsContact C-N 3.26Å; F477-L479 PolarHBondContact O-N 3.13Å; F477-R480 VanDerWaalsContact O-CB 3.31Å; F477-R480 WeakPolarHBondContact O-CB 3.49Å; F477-R480 PolarHBondContact O-N 2.86Å
478	T	84.6	Confident	81.7	Confident	31 Å²	31	67.7 Å²	67.7	19%	0.19	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-26.4	177.4	50.5	0	0	0	0	113.5	V474 V475 R480 L562	V474-T478 WeakPolarHBondContact O-CG2 3.44Å; V474-T478 PolarHBondContact O-N 3Å; V474-T478 PolarHBondContact O-OG1 3.28Å; V475-T478 WeakPolarHBondContact CA-OG1 3.35Å; V475-T478 PolarHBondContact O-N 3.23Å; V475-T478 VanDerWaalsContact O-N 3.15Å; V475-T478 PolarHBondContact O-OG1 3.47Å; T478-R480 VanDerWaalsContact C-N 3.33Å; T478-L562 HydrophobicContact CG2-CB 4.34Å; T478-L562 HydrophobicContact CG2-CD2 4.43Å
479	L	84.9	Confident	81.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-82.3	-14.2	179.2	-70.4	170.7	0	0	0	113.1	V475 L476 F477 H481 S482 E485 H526 C529 Y530	V475-L479 HydrophobicContact CG1-CD1 3.75Å; V475-L479 HydrophobicContact CG1-CG 4.44Å; V475-L479 VanDerWaalsContact O-CG 3.22Å; V475-L479 WeakPolarHBondContact O-CG 3.35Å; V475-L479 PolarHBondContact O-N 3.31Å; L476-L479 PolarHBondContact O-N 2.65Å; F477-L479 VanDerWaalsContact C-N 3.26Å; F477-L479 PolarHBondContact O-N 3.13Å; L479-H481 PolarHBondContact O-N 3.02Å; L479-S482 VanDerWaalsContact O-CB 3.22Å; L479-S482 WeakPolarHBondContact O-CB 3.48Å; L479-S482 PolarHBondContact O-N 3.47Å; L479-S482 PolarHBondContact O-OG 3.32Å; L479-E485 VanDerWaalsContact O-OE2 3.1Å; L479-H526 HydrophobicContact CD2-CB 3.83Å; L479-C529 HydrophobicContact CD1-CB 4.09Å; L479-C529 HydrophobicContact CD2-CB 3.74Å; L479-C529 HydrophobicContact CG-CB 3.98Å; L479-Y530 HydrophobicContact CB-CE2 4.32Å; L479-Y530 HydrophobicContact CD1-CD1 3.98Å; L479-Y530 HydrophobicContact CD1-CD2 3.7Å; L479-Y530 HydrophobicContact CD1-CE1 3.8Å; L479-Y530 HydrophobicContact CD1-CE2 3.55Å; L479-Y530 HydrophobicContact CD1-CG 3.95Å; L479-Y530 HydrophobicContact CD2-CD2 3.52Å; L479-Y530 HydrophobicContact CD2-CE2 3.34Å; L479-Y530 HydrophobicContact CG-CD2 4.21Å; L479-Y530 HydrophobicContact CG-CE2 3.9Å
480	R	81.3	Confident	81.9	Confident	157 Å²	157	74.1 Å²	74.1	59%	0.592	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	128.5	-174.6	-160.6	-173.8	171.8	157.9	2.2	110.9	L476 F477 T478 S482 E485	L476-R480 PolarHBondContact O-N 2.85Å; F477-R480 VanDerWaalsContact O-CB 3.31Å; F477-R480 WeakPolarHBondContact O-CB 3.49Å; F477-R480 PolarHBondContact O-N 2.86Å; T478-R480 VanDerWaalsContact C-N 3.33Å; R480-S482 PolarHBondContact O-N 3.46Å; R480-E485 WeakPolarHBondContact CA-OE2 3.35Å
481	H	79.6	Confident	81.9	Confident	150 Å²	150	69.6 Å²	69.6	69%	0.694	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	12.4	-175.9	-51.6	-71.2	0	0	0	115.6	L479 E485	L479-H481 PolarHBondContact O-N 3.02Å; H481-E485 PolarHBondContact N-OE2 2.9Å
482	S	85.6	Confident	81.2	Confident	7 Å²	7	71.9 Å²	71.9	5%	0.049	32%	0.323	C	S	.	.			trans	-71.7	152.4	175.2	66.1	0	0	0	0	111.9	L479 R480 L484 E485 K486	L479-S482 VanDerWaalsContact O-CB 3.22Å; L479-S482 WeakPolarHBondContact O-CB 3.48Å; L479-S482 PolarHBondContact O-N 3.47Å; L479-S482 PolarHBondContact O-OG 3.32Å; R480-S482 PolarHBondContact O-N 3.46Å; S482-L484 PolarHBondContact O-N 3.37Å; S482-E485 PolarHBondContact O-N 3.41Å; S482-E485 VanDerWaalsContact OG-CB 3.29Å; S482-E485 WeakPolarHBondContact OG-CB 3.26Å; S482-E485 PolarHBondContact OG-N 3.08Å; S482-K486 PolarHBondContact O-N 3.37Å
483	R	83.7	Confident	80.5	Confident	205 Å²	205	73.2 Å²	73.2	77%	0.774	34%	0.338	S	S	*	.	H	α-helix	trans	-56.3	-40.6	172.8	-67.6	-179.2	179.7	-179.8	-2.1	111.2	K486 L487	R483-K486 WeakPolarHBondContact O-CB 3.22Å; R483-K486 PolarHBondContact O-N 3.34Å; R483-L487 PolarHBondContact O-N 3.43Å
484	L	83.7	Confident	79.9	Confident	20 Å²	20	66.6 Å²	66.6	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-70.8	-31.2	-179.4	-159.4	139.2	0	0	0	112.5	F432 S482 L487 V488 L527 Y530	F432-L484 HydrophobicContact CD2-CD2 4.17Å; F432-L484 HydrophobicContact CE2-CD2 4.46Å; S482-L484 PolarHBondContact O-N 3.37Å; L484-L487 PolarHBondContact O-N 3.36Å; L484-V488 HydrophobicContact CD2-CG2 3.8Å; L484-V488 WeakPolarHBondContact O-CB 3.48Å; L484-V488 WeakPolarHBondContact O-CG2 3.33Å; L484-V488 PolarHBondContact O-N 3.07Å; L484-L527 HydrophobicContact CD1-CD1 4.44Å; L484-Y530 HydrophobicContact CD2-CD2 3.15Å; L484-Y530 HydrophobicContact CD2-CE2 3.18Å; L484-Y530 HydrophobicContact CD2-CG 4.06Å; L484-Y530 HydrophobicContact CG-CE2 4.45Å
485	E	84.4	Confident	78.8	Confident	21 Å²	21	76.7 Å²	76.7	10%	0.098	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-41.7	169.7	176.2	-176.3	-164.4	0	0	112.6	Y436 L479 R480 H481 S482 V488 K489 Y530	Y436-E485 WeakPolarHBondContact OH-CG 3.27Å; L479-E485 VanDerWaalsContact O-OE2 3.1Å; R480-E485 WeakPolarHBondContact CA-OE2 3.35Å; H481-E485 PolarHBondContact N-OE2 2.9Å; S482-E485 PolarHBondContact O-N 3.41Å; S482-E485 VanDerWaalsContact OG-CB 3.29Å; S482-E485 WeakPolarHBondContact OG-CB 3.26Å; S482-E485 PolarHBondContact OG-N 3.08Å; E485-V488 PolarHBondContact O-N 3.34Å; E485-K489 HydrophobicContact CG-CD 3.99Å; E485-K489 HydrophobicContact CG-CG 4.46Å; E485-K489 WeakPolarHBondContact O-CB 3.34Å; E485-K489 WeakPolarHBondContact O-CG 3.42Å; E485-K489 PolarHBondContact O-N 3.15Å; E485-K489 VanDerWaalsContact OE1-CE 3.23Å; E485-K489 WeakPolarHBondContact OE1-CE 3.18Å; E485-K489 IonicContact OE1-NZ 3.77Å; E485-K489 PolarHBondContact OE1-NZ 3.3Å; E485-Y530 VanDerWaalsContact CA-OH 3.3Å; E485-Y530 WeakPolarHBondContact CA-OH 3.47Å; E485-Y530 WeakPolarHBondContact CB-OH 3.18Å
486	K	82.9	Confident	77.8	Confident	141 Å²	141	81.3 Å²	81.3	61%	0.613	37%	0.371	S	S	*	.	H	α-helix	trans	-59.7	-48.5	176.7	-65.2	-176.1	177.7	-174.1	0	110.7	S482 R483 V488 K489 Q490	S482-K486 PolarHBondContact O-N 3.37Å; R483-K486 WeakPolarHBondContact O-CB 3.22Å; R483-K486 PolarHBondContact O-N 3.34Å; K486-V488 PolarHBondContact O-N 3.43Å; K486-K489 PolarHBondContact O-N 3.42Å; K486-Q490 WeakPolarHBondContact O-CG 3.48Å; K486-Q490 PolarHBondContact O-N 3.08Å; K486-Q490 PolarHBondContact O-OE1 2.94Å
487	L	81	Confident	77	Confident	60 Å²	60	82 Å²	82	31%	0.314	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-45.5	177.1	-67.2	173.7	0	0	0	112.7	R483 L484 K489 Q490 S491	R483-L487 PolarHBondContact O-N 3.43Å; L484-L487 PolarHBondContact O-N 3.36Å; L487-K489 VanDerWaalsContact C-N 3.3Å; L487-K489 PolarHBondContact O-N 3.39Å; L487-Q490 PolarHBondContact O-N 3.14Å; L487-S491 PolarHBondContact O-N 3.21Å
488	V	81.8	Confident	76	Confident	0 Å²	0	82.4 Å²	82.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-65.9	-31.9	179	174.2	0	0	0	0	112.2	A429 F432 K433 Y436 L484 E485 K486 S491 Y530	A429-V488 HydrophobicContact CB-CG2 3.75Å; F432-V488 HydrophobicContact CB-CG1 4.02Å; F432-V488 HydrophobicContact CB-CG2 3.89Å; F432-V488 HydrophobicContact CD2-CG2 4.27Å; K433-V488 HydrophobicContact CB-CG1 4.43Å; Y436-V488 HydrophobicContact CD2-CG1 4.15Å; Y436-V488 HydrophobicContact CE2-CG1 3.78Å; L484-V488 HydrophobicContact CD2-CG2 3.8Å; L484-V488 WeakPolarHBondContact O-CB 3.48Å; L484-V488 WeakPolarHBondContact O-CG2 3.33Å; L484-V488 PolarHBondContact O-N 3.07Å; E485-V488 PolarHBondContact O-N 3.34Å; K486-V488 PolarHBondContact O-N 3.43Å; V488-S491 PolarHBondContact O-OG 3.43Å; V488-Y530 HydrophobicContact CG1-CE1 4.23Å; V488-Y530 HydrophobicContact CG2-CE1 4.31Å; V488-Y530 HydrophobicContact CG2-CE2 4.43Å
489	K	81.4	Confident	75.4	Confident	118 Å²	118	82 Å²	82	51%	0.513	37%	0.366	S	S	.	.	H	α-helix	trans	-71.7	-40.1	175.8	-77	175.7	170.3	174.1	0	111.5	K433 E485 K486 L487	K433-K489 PolarHBondContact NZ-O 2.95Å; E485-K489 HydrophobicContact CG-CD 3.99Å; E485-K489 HydrophobicContact CG-CG 4.46Å; E485-K489 WeakPolarHBondContact O-CB 3.34Å; E485-K489 WeakPolarHBondContact O-CG 3.42Å; E485-K489 PolarHBondContact O-N 3.15Å; E485-K489 VanDerWaalsContact OE1-CE 3.23Å; E485-K489 WeakPolarHBondContact OE1-CE 3.18Å; E485-K489 IonicContact OE1-NZ 3.77Å; E485-K489 PolarHBondContact OE1-NZ 3.3Å; K486-K489 PolarHBondContact O-N 3.42Å; L487-K489 VanDerWaalsContact C-N 3.3Å; L487-K489 PolarHBondContact O-N 3.39Å
490	Q	75.4	Confident	74.9	Confident	102 Å²	102	88.2 Å²	88.2	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-70.9	-29	177.9	-72.5	170.5	-33.9	0	0	113.1	K486 L487	K486-Q490 WeakPolarHBondContact O-CG 3.48Å; K486-Q490 PolarHBondContact O-N 3.08Å; K486-Q490 PolarHBondContact O-OE1 2.94Å; L487-Q490 PolarHBondContact O-N 3.14Å
491	S	71.9	Confident	74.6	Confident	17 Å²	17	82 Å²	82	12%	0.119	37%	0.374	C	S	.	.	S	Bend	trans	-61.4	149.2	-176.5	70	0	0	0	0	113.8	A429 K433 L487 V488	A429-S491 PolarHBondContact O-OG 2.92Å; A429-S491 VanDerWaalsContact O-OG 3.1Å; K433-S491 WeakPolarHBondContact CD-O 3.46Å; K433-S491 WeakPolarHBondContact CE-O 3.45Å; K433-S491 PolarHBondContact NZ-O 3.41Å; L487-S491 PolarHBondContact O-N 3.21Å; V488-S491 PolarHBondContact O-OG 3.43Å
492	V	68.4	Low	74.8	Confident	51 Å²	51	82.8 Å²	82.8	31%	0.309	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-77.5	134.1	179.7	-178.1	0	0	0	0	110.3	F398 L494	F398-V492 HydrophobicContact CE1-CG1 4.46Å; V492-L494 PolarHBondContact O-N 3.14Å
493	P	66.4	Low	74.6	Confident	78 Å²	78	85.8 Å²	85.8	51%	0.506	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-69.1	121.2	174.9	27.8	-31.7	0	0	0	110.8	K433 R495	K433-P493 HydrophobicContact CD-CB 4.2Å; P493-R495 PolarHBondContact O-N 2.93Å
494	L	66.5	Low	74.8	Confident	41 Å²	41	76.1 Å²	76.1	22%	0.215	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-70.7	120.3	175.3	-71.2	168	0	0	0	110.3	D401 M430 Y431 V492	D401-L494 HydrophobicContact CB-CD1 4.26Å; D401-L494 HydrophobicContact CB-CD2 4.48Å; M430-L494 HydrophobicContact CB-CD1 4.05Å; M430-L494 HydrophobicContact CB-CG 4.47Å; M430-L494 HydrophobicContact CE-CD1 4.08Å; M430-L494 HydrophobicContact CE-CD2 3.63Å; M430-L494 HydrophobicContact CE-CG 3.95Å; Y431-L494 HydrophobicContact CD2-CD1 4.13Å; Y431-L494 HydrophobicContact CE1-CD1 4.42Å; Y431-L494 HydrophobicContact CE2-CD1 3.71Å; V492-L494 PolarHBondContact O-N 3.14Å
495	R	60	Low	75	Confident	236 Å²	236	77.6 Å²	77.6	89%	0.891	36%	0.359	S	S	*	.	S	Bend	trans	-74.6	-41.7	174.3	-67.7	-175.3	-178	-177	1.9	111.4	P493	P493-R495 PolarHBondContact O-N 2.93Å
496	D	61.7	Low	75.3	Confident	97 Å²	97	81.1 Å²	81.1	52%	0.519	38%	0.375	S	S	.	.	S	Bend	trans	-116.2	119.5	177.5	-62.8	-23	0	0	0	109.7	R498	D496-R498 HydrophobicContact CB-CG 4.23Å; D496-R498 PolarHBondContact O-N 3.48Å; D496-R498 IonicContact OD2-NH2 3.24Å
497	K	67.2	Low	75.6	Confident	63 Å²	63	74.8 Å²	74.8	27%	0.274	35%	0.348	S	S	.	.			trans	-89.6	103.9	173.9	-66.7	-176.3	173.3	-161.2	0	109	Y431 D434 Y450	Y431-K497 HydrophobicContact CD1-CD 4.41Å; Y431-K497 HydrophobicContact CE1-CB 4.32Å; Y431-K497 HydrophobicContact CE1-CD 4.14Å; Y431-K497 HydrophobicContact CE1-CG 4.12Å; D434-K497 WeakPolarHBondContact OD2-CE 3.31Å; D434-K497 IonicContact OD2-NZ 3.16Å; D434-K497 PolarHBondContact OD2-NZ 2.96Å; Y450-K497 HydrophobicContact CE1-CD 4.33Å; Y450-K497 VanDerWaalsContact OH-CE 3.28Å; Y450-K497 WeakPolarHBondContact OH-CE 3.11Å; Y450-K497 PolarHBondContact OH-NZ 2.92Å
498	R	64.7	Low	76.2	Confident	135 Å²	135	72 Å²	72	51%	0.509	33%	0.333	S	S	.	.			trans	-97.3	-16.6	-170.8	-64.5	177.3	-178.5	-179.3	-0.5	113.6	D496	D496-R498 HydrophobicContact CB-CG 4.23Å; D496-R498 PolarHBondContact O-N 3.48Å; D496-R498 IonicContact OD2-NH2 3.24Å
499	I	71.7	Confident	76.7	Confident	23 Å²	23	73.7 Å²	73.7	12%	0.118	34%	0.342	C	S	.	.	S	Bend	trans	-84.2	142.6	-176	-58.6	164.8	0	0	0	111.7	D401 V405 L427 Y431 D503 L504	D401-I499 HydrophobicContact CB-CD1 3.51Å; D401-I499 HydrophobicContact CB-CG1 4.34Å; D401-I499 WeakPolarHBondContact OD2-CD1 3.41Å; D401-I499 WeakPolarHBondContact OD2-CG1 3.38Å; V405-I499 HydrophobicContact CG2-CD1 3.37Å; V405-I499 HydrophobicContact CG2-CG1 4.06Å; V405-I499 HydrophobicContact CG2-CG2 4.22Å; L427-I499 HydrophobicContact CD1-CD1 3.87Å; Y431-I499 HydrophobicContact CE2-CD1 3.95Å; Y431-I499 WeakPolarHBondContact OH-CD1 3.46Å; I499-D503 HydrophobicContact CG2-CB 4.1Å; I499-L504 HydrophobicContact CB-CD1 4.36Å; I499-L504 HydrophobicContact CB-CG 4.32Å; I499-L504 HydrophobicContact CD1-CD2 4.3Å; I499-L504 HydrophobicContact CG2-CD1 4.29Å; I499-L504 HydrophobicContact CG2-CD2 4.25Å; I499-L504 HydrophobicContact CG2-CG 3.79Å
500	F	72.9	Confident	77.2	Confident	130 Å²	130	70.9 Å²	70.9	57%	0.57	33%	0.33	S	S	*	.			trans	-66.5	139.1	172.1	-65.2	-84.2	0	0	0	111.4	Y453 K502 D503 L504	Y453-F500 WeakPolarHBondContact OH-CD1 3.26Å; F500-K502 PolarHBondContact O-N 2.96Å; F500-D503 PolarHBondContact O-N 3.28Å; F500-L504 PolarHBondContact O-N 3.02Å
501	S	76.4	Confident	78.1	Confident	28 Å²	28	66 Å²	66	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-22.5	179.5	62.5	0	0	0	0	113.9	W505	S501-W505 WeakPolarHBondContact O-CB 3.38Å; S501-W505 PolarHBondContact O-N 2.85Å; S501-W505 VanDerWaalsContact O-N 3.11Å
502	K	82.2	Confident	79.1	Confident	165 Å²	165	65.2 Å²	65.2	72%	0.717	30%	0.302	S	S	*	.	H	α-helix	trans	-69.6	-42.8	178.6	-68.6	-176.1	178.8	179.9	0	112.1	F500 W505 H506	F500-K502 PolarHBondContact O-N 2.96Å; K502-W505 PolarHBondContact O-N 3.43Å; K502-H506 PolarHBondContact O-N 3.37Å
503	D	83	Confident	80.2	Confident	71 Å²	71	66.2 Å²	66.2	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-70.7	-41.3	-177.7	-53.9	-31.6	0	0	0	110.4	I499 F500 W505 H506 I507	I499-D503 HydrophobicContact CG2-CB 4.1Å; F500-D503 PolarHBondContact O-N 3.28Å; D503-W505 VanDerWaalsContact C-N 3.31Å; D503-W505 PolarHBondContact O-N 2.92Å; D503-H506 PolarHBondContact O-N 3.29Å; D503-I507 WeakPolarHBondContact O-CG1 3.42Å; D503-I507 PolarHBondContact O-N 2.75Å
504	L	86.5	Confident	81.4	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-40.1	172.5	-70.1	171.8	0	0	0	112.2	L427 Y431 I499 F500 F508 A536	L427-L504 HydrophobicContact CD2-CD2 4.11Å; L427-L504 HydrophobicContact CG-CD2 4.22Å; Y431-L504 HydrophobicContact CD1-CD1 3.77Å; Y431-L504 HydrophobicContact CD2-CD1 4.41Å; Y431-L504 HydrophobicContact CD2-CD2 3.97Å; Y431-L504 HydrophobicContact CE1-CD1 3.49Å; Y431-L504 VanDerWaalsContact CE1-CD1 3.49Å; Y431-L504 HydrophobicContact CE2-CD1 4.22Å; Y431-L504 HydrophobicContact CE2-CD2 3.85Å; Y431-L504 HydrophobicContact CG-CD1 4.23Å; Y431-L504 HydrophobicContact CG-CD2 4.44Å; I499-L504 HydrophobicContact CB-CD1 4.36Å; I499-L504 HydrophobicContact CB-CG 4.32Å; I499-L504 HydrophobicContact CD1-CD2 4.3Å; I499-L504 HydrophobicContact CG2-CD1 4.29Å; I499-L504 HydrophobicContact CG2-CD2 4.25Å; I499-L504 HydrophobicContact CG2-CG 3.79Å; F500-L504 PolarHBondContact O-N 3.02Å; L504-F508 VanDerWaalsContact O-CB 3.25Å; L504-F508 WeakPolarHBondContact O-CB 3.19Å; L504-F508 PolarHBondContact O-N 3.11Å; L504-A536 HydrophobicContact CD1-CB 4.45Å
505	W	89	Confident	82.6	Confident	51 Å²	51	61.8 Å²	61.8	19%	0.193	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-44	175.1	171.9	-105	0	0	0	111.9	S501 K502 D503 F508 D509 I537 T542 R545 I546	S501-W505 WeakPolarHBondContact O-CB 3.38Å; S501-W505 PolarHBondContact O-N 2.85Å; S501-W505 VanDerWaalsContact O-N 3.11Å; K502-W505 PolarHBondContact O-N 3.43Å; D503-W505 VanDerWaalsContact C-N 3.31Å; D503-W505 PolarHBondContact O-N 2.92Å; W505-F508 AromaticContact CE3-CD1 3.92Å; W505-F508 HydrophobicContact CE3-CD1 3.92Å; W505-F508 HydrophobicContact CH2-CD1 4.39Å; W505-F508 HydrophobicContact CH2-CE1 4.49Å; W505-F508 AromaticContact CZ3-CD1 3.59Å; W505-F508 HydrophobicContact CZ3-CD1 3.59Å; W505-F508 AromaticContact CZ3-CE1 3.83Å; W505-F508 HydrophobicContact CZ3-CE1 3.83Å; W505-F508 PolarHBondContact O-N 3.35Å; W505-D509 HydrophobicContact CZ2-CB 4.16Å; W505-D509 PolarHBondContact O-N 3.27Å; W505-I537 HydrophobicContact CE3-CG2 3.68Å; W505-I537 HydrophobicContact CZ3-CG2 4.09Å; W505-T542 HydrophobicContact CD2-CG2 3.46Å; W505-T542 VanDerWaalsContact CD2-CG2 3.46Å; W505-T542 HydrophobicContact CE3-CG2 3.73Å; W505-T542 HydrophobicContact CG-CG2 3.93Å; W505-T542 HydrophobicContact CH2-CG2 4.22Å; W505-T542 HydrophobicContact CZ2-CG2 3.97Å; W505-T542 HydrophobicContact CZ3-CG2 4.12Å; W505-R545 HydrophobicContact CH2-CB 4Å; W505-R545 HydrophobicContact CH2-CG 3.8Å; W505-R545 HydrophobicContact CZ2-CB 4.14Å; W505-R545 HydrophobicContact CZ2-CG 3.84Å; W505-I546 HydrophobicContact CH2-CD1 4.45Å; W505-I546 HydrophobicContact CH2-CG1 3.81Å; W505-I546 HydrophobicContact CZ3-CD1 3.74Å; W505-I546 HydrophobicContact CZ3-CG1 3.5Å; W505-I546 VanDerWaalsContact CZ3-CG1 3.5Å
506	H	90.2	Very high	84	Confident	94 Å²	94	52.1 Å²	52.1	44%	0.435	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-50	178.5	-175.8	-91.2	0	0	0	111.4	E412 K502 D503 F508 D509 K510	E412-H506 IonicContact OE1-CE1 3.44Å; E412-H506 PolarHBondContact OE1-CE1 3.06Å; E412-H506 IonicContact OE2-CE1 2.64Å; E412-H506 PolarHBondContact OE2-CE1 3.47Å; E412-H506 VanDerWaalsContact OE2-CE1 3.23Å; E412-H506 IonicContact OE2-ND1 2.99Å; K502-H506 PolarHBondContact O-N 3.37Å; D503-H506 PolarHBondContact O-N 3.29Å; H506-F508 VanDerWaalsContact C-N 3.33Å; H506-F508 PolarHBondContact O-N 2.89Å; H506-D509 PolarHBondContact O-N 2.94Å; H506-K510 VanDerWaalsContact O-CB 3.28Å; H506-K510 WeakPolarHBondContact O-CB 3.43Å; H506-K510 PolarHBondContact O-N 3.25Å
507	I	90.4	Very high	85.4	Confident	8 Å²	8	53 Å²	53	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-60.7	-44	177.1	-64.6	169	0	0	0	110.6	V405 C408 L427 D503 I511	V405-I507 HydrophobicContact CG2-CD1 4.26Å; C408-I507 HydrophobicContact CB-CD1 4Å; C408-I507 HydrophobicContact CB-CG1 4.33Å; L427-I507 HydrophobicContact CD2-CD1 3.67Å; D503-I507 WeakPolarHBondContact O-CG1 3.42Å; D503-I507 PolarHBondContact O-N 2.75Å; I507-I511 HydrophobicContact CG2-CD1 3.75Å; I507-I511 HydrophobicContact CG2-CG1 4.44Å; I507-I511 VanDerWaalsContact O-CG1 3.23Å; I507-I511 WeakPolarHBondContact O-CG1 3.22Å; I507-I511 PolarHBondContact O-N 2.98Å
508	F	92.9	Very high	86.4	Confident	1 Å²	1	54 Å²	54	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-51.4	178.2	175.3	-88.9	0	0	0	113.1	L428 F432 L504 W505 H506 K510 I511 C512 L527 I537 I546	L428-F508 HydrophobicContact CD1-CB 4.29Å; L428-F508 HydrophobicContact CD1-CD2 4.1Å; L428-F508 HydrophobicContact CD2-CB 4.23Å; L428-F508 HydrophobicContact CD2-CD2 4.47Å; F432-F508 HydrophobicContact CZ-CD2 4.43Å; F432-F508 HydrophobicContact CZ-CE2 4.42Å; L504-F508 VanDerWaalsContact O-CB 3.25Å; L504-F508 WeakPolarHBondContact O-CB 3.19Å; L504-F508 PolarHBondContact O-N 3.11Å; W505-F508 AromaticContact CE3-CD1 3.92Å; W505-F508 HydrophobicContact CE3-CD1 3.92Å; W505-F508 HydrophobicContact CH2-CD1 4.39Å; W505-F508 HydrophobicContact CH2-CE1 4.49Å; W505-F508 AromaticContact CZ3-CD1 3.59Å; W505-F508 HydrophobicContact CZ3-CD1 3.59Å; W505-F508 AromaticContact CZ3-CE1 3.83Å; W505-F508 HydrophobicContact CZ3-CE1 3.83Å; W505-F508 PolarHBondContact O-N 3.35Å; H506-F508 VanDerWaalsContact C-N 3.33Å; H506-F508 PolarHBondContact O-N 2.89Å; F508-K510 VanDerWaalsContact C-N 3.31Å; F508-K510 PolarHBondContact O-N 3.05Å; F508-I511 PolarHBondContact O-N 3.32Å; F508-C512 PolarHBondContact O-N 3.36Å; F508-C512 PolarHBondContact O-SG 3.39Å; F508-C512 VanDerWaalsContact O-SG 3.41Å; F508-L527 HydrophobicContact CD2-CD1 4.35Å; F508-L527 HydrophobicContact CD2-CG 4.23Å; F508-L527 HydrophobicContact CE2-CD1 4.24Å; F508-L527 HydrophobicContact CE2-CD2 4.49Å; F508-L527 HydrophobicContact CE2-CG 3.83Å; F508-I537 HydrophobicContact CB-CD1 4.36Å; F508-I537 HydrophobicContact CB-CG2 4.37Å; F508-I537 HydrophobicContact CD1-CG2 4.09Å; F508-I537 HydrophobicContact CD2-CD1 3.86Å; F508-I537 HydrophobicContact CD2-CG2 4.37Å; F508-I537 HydrophobicContact CG-CD1 4.24Å; F508-I537 HydrophobicContact CG-CG2 4.01Å; F508-I546 HydrophobicContact CE1-CG1 3.94Å; F508-I546 HydrophobicContact CZ-CG1 4.43Å
509	D	92.6	Very high	87.5	Confident	36 Å²	36	49.3 Å²	49.3	19%	0.193	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-37.6	-178.2	-163.2	41.6	0	0	0	110.4	W505 H506 C512 D513 R545	W505-D509 HydrophobicContact CZ2-CB 4.16Å; W505-D509 PolarHBondContact O-N 3.27Å; H506-D509 PolarHBondContact O-N 2.94Å; D509-C512 WeakPolarHBondContact O-CB 3.47Å; D509-C512 PolarHBondContact O-N 3.05Å; D509-D513 PolarHBondContact O-N 3.45Å; D509-R545 IonicContact OD1-CZ 3.59Å; D509-R545 IonicContact OD1-NE 4Å; D509-R545 PolarHBondContact OD1-NE 2.85Å; D509-R545 IonicContact OD1-NH2 2.53Å
510	K	92.2	Very high	88.4	Confident	59 Å²	59	53 Å²	53	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-47.1	175.3	-166.6	71	173.3	-127.7	0	112.5	E412 Y420 H506 F508 C512 D513 L514	E412-K510 IonicContact OE1-NZ 3.46Å; E412-K510 PolarHBondContact OE1-NZ 3.24Å; Y420-K510 HydrophobicContact CE1-CB 4.09Å; Y420-K510 HydrophobicContact CE1-CG 3.83Å; H506-K510 VanDerWaalsContact O-CB 3.28Å; H506-K510 WeakPolarHBondContact O-CB 3.43Å; H506-K510 PolarHBondContact O-N 3.25Å; F508-K510 VanDerWaalsContact C-N 3.31Å; F508-K510 PolarHBondContact O-N 3.05Å; K510-C512 VanDerWaalsContact C-N 3.29Å; K510-C512 PolarHBondContact O-N 3.47Å; K510-D513 PolarHBondContact O-N 3.25Å; K510-L514 HydrophobicContact CG-CD1 4.33Å; K510-L514 VanDerWaalsContact O-CG 3.31Å; K510-L514 WeakPolarHBondContact O-CG 3.36Å; K510-L514 PolarHBondContact O-N 2.63Å
511	I	93	Very high	89.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-39.8	175.8	-65.2	167.6	0	0	0	110.4	Y420 T425 L428 I507 F508 D513 L514 L515 L527	Y420-I511 HydrophobicContact CD1-CG1 4.11Å; Y420-I511 HydrophobicContact CE1-CG1 3.73Å; T425-I511 HydrophobicContact CG2-CG2 4.43Å; L428-I511 HydrophobicContact CD1-CD1 3.81Å; I507-I511 HydrophobicContact CG2-CD1 3.75Å; I507-I511 HydrophobicContact CG2-CG1 4.44Å; I507-I511 VanDerWaalsContact O-CG1 3.23Å; I507-I511 WeakPolarHBondContact O-CG1 3.22Å; I507-I511 PolarHBondContact O-N 2.98Å; F508-I511 PolarHBondContact O-N 3.32Å; I511-D513 VanDerWaalsContact C-N 3.34Å; I511-D513 PolarHBondContact O-N 2.93Å; I511-L514 PolarHBondContact O-N 3.14Å; I511-L515 HydrophobicContact CG2-CD1 3.8Å; I511-L515 HydrophobicContact CG2-CG 4.11Å; I511-L515 WeakPolarHBondContact O-CB 3.49Å; I511-L515 VanDerWaalsContact O-CG 3.32Å; I511-L515 WeakPolarHBondContact O-CG 3.47Å; I511-L515 PolarHBondContact O-N 3.07Å; I511-L527 HydrophobicContact CB-CD2 4.09Å; I511-L527 HydrophobicContact CG2-CD2 3.47Å; I511-L527 VanDerWaalsContact CG2-CD2 3.47Å
512	C	92.8	Very high	89.9	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.007	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-45.1	175.4	-78.5	0	0	0	0	112.2	F508 D509 K510 A516 L524 C528	F508-C512 PolarHBondContact O-N 3.36Å; F508-C512 PolarHBondContact O-SG 3.39Å; F508-C512 VanDerWaalsContact O-SG 3.41Å; D509-C512 WeakPolarHBondContact O-CB 3.47Å; D509-C512 PolarHBondContact O-N 3.05Å; K510-C512 VanDerWaalsContact C-N 3.29Å; K510-C512 PolarHBondContact O-N 3.47Å; C512-A516 WeakPolarHBondContact O-CB 3.48Å; C512-A516 PolarHBondContact O-N 3.11Å; C512-L524 HydrophobicContact CB-CD1 3.78Å; C512-L524 WeakPolarHBondContact O-CD1 2.85Å; C512-C528 VanDerWaalsContact SG-SG 3.61Å
513	D	91.9	Very high	90.3	Very high	72 Å²	72	47 Å²	47	39%	0.385	25%	0.25	S	C	.	.	H	α-helix	trans	-66.2	-42.6	177.4	-77.4	-18.5	0	0	0	111.5	D509 K510 I511 A516 T517 R545	D509-D513 PolarHBondContact O-N 3.45Å; K510-D513 PolarHBondContact O-N 3.25Å; I511-D513 VanDerWaalsContact C-N 3.34Å; I511-D513 PolarHBondContact O-N 2.93Å; D513-A516 WeakPolarHBondContact O-CB 2.89Å; D513-A516 PolarHBondContact O-N 3.06Å; D513-T517 WeakPolarHBondContact O-CG2 3.36Å; D513-T517 PolarHBondContact O-N 3.42Å; D513-T517 PolarHBondContact O-OG1 3.3Å; D513-R545 IonicContact OD1-NH2 3.9Å; D513-R545 PolarHBondContact OD1-NH2 3.22Å; D513-R545 VanDerWaalsContact OD1-NH2 3.08Å; D513-R545 IonicContact OD2-NH2 2.82Å
514	L	91.9	Very high	90.7	Very high	19 Å²	19	43.8 Å²	43.8	10%	0.099	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-49.6	176.2	-70.1	170	0	0	0	112	W417 Y420 I421 K510 I511 A516 T517 E518	W417-L514 HydrophobicContact CB-CD1 4.29Å; W417-L514 HydrophobicContact CB-CD2 4.11Å; W417-L514 HydrophobicContact CD2-CD1 4.22Å; W417-L514 HydrophobicContact CD2-CD2 3.79Å; W417-L514 HydrophobicContact CE3-CD1 3.62Å; W417-L514 HydrophobicContact CE3-CD2 3.95Å; W417-L514 HydrophobicContact CE3-CG 4.39Å; W417-L514 HydrophobicContact CG-CD2 3.87Å; W417-L514 HydrophobicContact CZ3-CD1 4.36Å; Y420-L514 HydrophobicContact CD1-CD1 3.75Å; Y420-L514 HydrophobicContact CE1-CD1 4.13Å; I421-L514 HydrophobicContact CD1-CB 4.18Å; I421-L514 HydrophobicContact CG1-CB 4.42Å; I421-L514 HydrophobicContact CG1-CD1 4.19Å; K510-L514 HydrophobicContact CG-CD1 4.33Å; K510-L514 VanDerWaalsContact O-CG 3.31Å; K510-L514 WeakPolarHBondContact O-CG 3.36Å; K510-L514 PolarHBondContact O-N 2.63Å; I511-L514 PolarHBondContact O-N 3.14Å; L514-A516 PolarHBondContact O-N 2.98Å; L514-T517 WeakPolarHBondContact CA-OG1 3.28Å; L514-T517 PolarHBondContact O-N 3.34Å; L514-T517 VanDerWaalsContact O-N 3.07Å; L514-T517 PolarHBondContact O-OG1 3.47Å; L514-E518 PolarHBondContact O-N 3.49Å
515	L	91.6	Very high	91	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-33.6	177	-69.7	174	0	0	0	112.3	I421 I511 G519 K520 D523 L524 L527	I421-L515 HydrophobicContact CG2-CD2 4.37Å; I511-L515 HydrophobicContact CG2-CD1 3.8Å; I511-L515 HydrophobicContact CG2-CG 4.11Å; I511-L515 WeakPolarHBondContact O-CB 3.49Å; I511-L515 VanDerWaalsContact O-CG 3.32Å; I511-L515 WeakPolarHBondContact O-CG 3.47Å; I511-L515 PolarHBondContact O-N 3.07Å; L515-G519 PolarHBondContact O-N 3.32Å; L515-K520 HydrophobicContact CD2-CB 4.05Å; L515-K520 HydrophobicContact CD2-CD 4.17Å; L515-K520 PolarHBondContact O-N 2.74Å; L515-K520 VanDerWaalsContact O-N 3.08Å; L515-D523 HydrophobicContact CD1-CB 4.38Å; L515-D523 HydrophobicContact CD2-CB 4.35Å; L515-L524 HydrophobicContact CB-CB 4.08Å; L515-L524 HydrophobicContact CB-CD1 4.26Å; L515-L524 HydrophobicContact CD1-CB 4.42Å; L515-L527 HydrophobicContact CD1-CD2 3.91Å
516	A	89.7	Confident	91.2	Very high	33 Å²	33	43.1 Å²	43.1	27%	0.273	23%	0.232	S	C	.	.	H	α-helix	trans	-68.6	-37	174.4	0	0	0	0	0	112.3	C512 D513 L514 G519 L524	C512-A516 WeakPolarHBondContact O-CB 3.48Å; C512-A516 PolarHBondContact O-N 3.11Å; D513-A516 WeakPolarHBondContact O-CB 2.89Å; D513-A516 PolarHBondContact O-N 3.06Å; L514-A516 PolarHBondContact O-N 2.98Å; A516-G519 PolarHBondContact O-N 2.53Å; A516-L524 HydrophobicContact CB-CD2 4.04Å
517	T	90.2	Very high	91.3	Very high	114 Å²	114	38.7 Å²	38.7	70%	0.699	21%	0.211	S	C	*	.	H	α-helix	trans	-70.5	-38.6	174.8	57.4	0	0	0	0	113.1	D513 L514 G519	D513-T517 WeakPolarHBondContact O-CG2 3.36Å; D513-T517 PolarHBondContact O-N 3.42Å; D513-T517 PolarHBondContact O-OG1 3.3Å; L514-T517 WeakPolarHBondContact CA-OG1 3.28Å; L514-T517 PolarHBondContact O-N 3.34Å; L514-T517 VanDerWaalsContact O-N 3.07Å; L514-T517 PolarHBondContact O-OG1 3.47Å; T517-G519 PolarHBondContact O-N 3.5Å
518	E	89.1	Confident	91.3	Very high	86 Å²	86	38.3 Å²	38.3	40%	0.402	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.8	176.2	-68.6	-171.9	167.5	0	0	113.4	L514 K520	L514-E518 PolarHBondContact O-N 3.49Å; E518-K520 VanDerWaalsContact C-N 3.28Å; E518-K520 HydrophobicContact CB-CD 4.46Å; E518-K520 HydrophobicContact CB-CG 4.27Å; E518-K520 PolarHBondContact O-N 2.85Å; E518-K520 WeakPolarHBondContact OE2-CD 3.07Å; E518-K520 WeakPolarHBondContact OE2-CE 2.81Å; E518-K520 IonicContact OE2-NZ 2.68Å; E518-K520 PolarHBondContact OE2-NZ 2.9Å
519	G	87.8	Confident	91.2	Very high	35 Å²	35	38.2 Å²	38.2	36%	0.361	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	12.6	-178.5	0	0	0	0	0	114.7	L515 A516 T517 Y521	L515-G519 PolarHBondContact O-N 3.32Å; A516-G519 PolarHBondContact O-N 2.53Å; T517-G519 PolarHBondContact O-N 3.5Å; G519-Y521 WeakPolarHBondContact O-CD2 3.02Å; G519-Y521 PolarHBondContact O-N 3.35Å
520	K	90.4	Very high	91	Very high	100 Å²	100	36.5 Å²	36.5	44%	0.435	20%	0.2	S	C	.	.			trans	-79.4	65.2	177.5	-67.6	179.5	-176	156.5	0	111.4	L515 E518 V522 D523 L524	L515-K520 HydrophobicContact CD2-CB 4.05Å; L515-K520 HydrophobicContact CD2-CD 4.17Å; L515-K520 PolarHBondContact O-N 2.74Å; L515-K520 VanDerWaalsContact O-N 3.08Å; E518-K520 VanDerWaalsContact C-N 3.28Å; E518-K520 HydrophobicContact CB-CD 4.46Å; E518-K520 HydrophobicContact CB-CG 4.27Å; E518-K520 PolarHBondContact O-N 2.85Å; E518-K520 WeakPolarHBondContact OE2-CD 3.07Å; E518-K520 WeakPolarHBondContact OE2-CE 2.81Å; E518-K520 IonicContact OE2-NZ 2.68Å; E518-K520 PolarHBondContact OE2-NZ 2.9Å; K520-V522 VanDerWaalsContact C-N 3.31Å; K520-V522 PolarHBondContact O-N 2.86Å; K520-D523 PolarHBondContact O-N 3.29Å; K520-L524 PolarHBondContact O-N 3.49Å; K520-L524 VanDerWaalsContact O-N 3.11Å
521	Y	89.3	Confident	90.7	Very high	56 Å²	56	33.7 Å²	33.7	22%	0.22	19%	0.188	C	C	.	.	H	α-helix	trans	-67.5	-25.5	-172.1	-63.4	-66.7	0	0	0	114.8	G519 L524 M525 R556 C557	G519-Y521 WeakPolarHBondContact O-CD2 3.02Å; G519-Y521 PolarHBondContact O-N 3.35Å; Y521-L524 HydrophobicContact CD1-CD2 4.21Å; Y521-M525 VanDerWaalsContact O-CB 3.29Å; Y521-M525 WeakPolarHBondContact O-CB 3.06Å; Y521-M525 PolarHBondContact O-N 3.33Å; Y521-R556 HydrophobicContact CD1-CB 3.84Å; Y521-R556 HydrophobicContact CD1-CG 3.7Å; Y521-R556 HydrophobicContact CD2-CB 3.8Å; Y521-R556 HydrophobicContact CD2-CG 3.96Å; Y521-R556 HydrophobicContact CE1-CB 4.38Å; Y521-R556 HydrophobicContact CE1-CG 3.75Å; Y521-R556 HydrophobicContact CE2-CB 4.32Å; Y521-R556 HydrophobicContact CE2-CG 3.98Å; Y521-R556 HydrophobicContact CG-CB 3.52Å; Y521-R556 HydrophobicContact CG-CG 3.81Å; Y521-C557 PolarHBondContact O-SG 3.24Å; Y521-C557 VanDerWaalsContact O-SG 3.32Å
522	V	91.2	Very high	90.4	Very high	78 Å²	78	33.7 Å²	33.7	47%	0.473	19%	0.188	S	C	.	.	H	α-helix	trans	-68.8	-47.4	177.9	176.6	0	0	0	0	110.4	K520 M525 H526	K520-V522 VanDerWaalsContact C-N 3.31Å; K520-V522 PolarHBondContact O-N 2.86Å; V522-M525 WeakPolarHBondContact O-CB 2.94Å; V522-M525 PolarHBondContact O-N 3.31Å; V522-H526 WeakPolarHBondContact CG1-CE1 3.33Å; V522-H526 PolarHBondContact O-N 2.97Å; V522-H526 PolarHBondContact O-ND1 3.2Å
523	D	89.8	Confident	89.9	Confident	64 Å²	64	33.7 Å²	33.7	34%	0.342	19%	0.187	S	C	.	.	H	α-helix	trans	-66.7	-40.1	177.6	-62.1	-32.4	0	0	0	111	L515 K520 M525 H526 L527	L515-D523 HydrophobicContact CD1-CB 4.38Å; L515-D523 HydrophobicContact CD2-CB 4.35Å; K520-D523 PolarHBondContact O-N 3.29Å; D523-M525 VanDerWaalsContact C-N 3.33Å; D523-M525 PolarHBondContact O-N 2.92Å; D523-H526 PolarHBondContact O-N 3.1Å; D523-L527 WeakPolarHBondContact O-CB 3.02Å; D523-L527 PolarHBondContact O-N 3.31Å
524	L	92.7	Very high	89.5	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-57.4	-45.4	171.9	-179.6	62.6	0	0	0	111.7	C512 L515 A516 K520 Y521 H526 L527 C528 A553	C512-L524 HydrophobicContact CB-CD1 3.78Å; C512-L524 WeakPolarHBondContact O-CD1 2.85Å; L515-L524 HydrophobicContact CB-CB 4.08Å; L515-L524 HydrophobicContact CB-CD1 4.26Å; L515-L524 HydrophobicContact CD1-CB 4.42Å; A516-L524 HydrophobicContact CB-CD2 4.04Å; K520-L524 PolarHBondContact O-N 3.49Å; K520-L524 VanDerWaalsContact O-N 3.11Å; Y521-L524 HydrophobicContact CD1-CD2 4.21Å; L524-H526 PolarHBondContact O-N 2.92Å; L524-L527 PolarHBondContact O-N 3.5Å; L524-C528 WeakPolarHBondContact O-CB 3.32Å; L524-C528 PolarHBondContact O-N 3.39Å; L524-C528 PolarHBondContact O-SG 3.5Å; L524-A553 HydrophobicContact CB-CB 4.35Å; L524-A553 HydrophobicContact CD2-CB 3.92Å; L524-A553 HydrophobicContact CG-CB 3.91Å
525	M	92.8	Very high	88.7	Confident	17 Å²	17	31 Å²	31	8%	0.084	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-44.6	178.3	-177.7	-178.9	67.9	0	0	111.4	Y521 V522 D523 C529 L550 A553 C557 A559 L562	Y521-M525 VanDerWaalsContact O-CB 3.29Å; Y521-M525 WeakPolarHBondContact O-CB 3.06Å; Y521-M525 PolarHBondContact O-N 3.33Å; V522-M525 WeakPolarHBondContact O-CB 2.94Å; V522-M525 PolarHBondContact O-N 3.31Å; D523-M525 VanDerWaalsContact C-N 3.33Å; D523-M525 PolarHBondContact O-N 2.92Å; M525-C529 VanDerWaalsContact O-CB 3.26Å; M525-C529 WeakPolarHBondContact O-CB 3.48Å; M525-C529 PolarHBondContact O-N 3.17Å; M525-C529 PolarHBondContact O-SG 2.99Å; M525-L550 HydrophobicContact CG-CD1 4.44Å; M525-A553 HydrophobicContact CB-CB 3.95Å; M525-C557 HydrophobicContact CE-CB 4.33Å; M525-C557 HydrophobicContact SD-CB 3.92Å; M525-A559 HydrophobicContact SD-CB 4.07Å; M525-L562 HydrophobicContact CG-CD2 3.96Å; M525-L562 HydrophobicContact SD-CD2 4Å
526	H	92.5	Very high	87.9	Confident	21 Å²	21	31.3 Å²	31.3	10%	0.097	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-43.8	177.2	-62.4	146.5	0	0	0	111.9	L479 V522 D523 L524 C529 Y530	L479-H526 HydrophobicContact CD2-CB 3.83Å; V522-H526 WeakPolarHBondContact CG1-CE1 3.33Å; V522-H526 PolarHBondContact O-N 2.97Å; V522-H526 PolarHBondContact O-ND1 3.2Å; D523-H526 PolarHBondContact O-N 3.1Å; L524-H526 PolarHBondContact O-N 2.92Å; H526-C529 VanDerWaalsContact O-CB 3.3Å; H526-C529 WeakPolarHBondContact O-CB 3.47Å; H526-C529 PolarHBondContact O-N 3.17Å; H526-Y530 WeakPolarHBondContact O-CD2 3.35Å; H526-Y530 PolarHBondContact O-N 3.43Å
527	L	92.1	Very high	87.5	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-49.4	177.6	-175.3	64.1	0	0	0	111.4	L428 F432 L484 F508 I511 L515 D523 L524 C529 Y530 G531	L428-L527 HydrophobicContact CD1-CD1 3.9Å; F432-L527 HydrophobicContact CE2-CD1 3.8Å; F432-L527 HydrophobicContact CZ-CD1 4.04Å; L484-L527 HydrophobicContact CD1-CD1 4.44Å; F508-L527 HydrophobicContact CD2-CD1 4.35Å; F508-L527 HydrophobicContact CD2-CG 4.23Å; F508-L527 HydrophobicContact CE2-CD1 4.24Å; F508-L527 HydrophobicContact CE2-CD2 4.49Å; F508-L527 HydrophobicContact CE2-CG 3.83Å; I511-L527 HydrophobicContact CB-CD2 4.09Å; I511-L527 HydrophobicContact CG2-CD2 3.47Å; I511-L527 VanDerWaalsContact CG2-CD2 3.47Å; L515-L527 HydrophobicContact CD1-CD2 3.91Å; D523-L527 WeakPolarHBondContact O-CB 3.02Å; D523-L527 PolarHBondContact O-N 3.31Å; L524-L527 PolarHBondContact O-N 3.5Å; L527-C529 VanDerWaalsContact C-N 3.3Å; L527-C529 PolarHBondContact O-N 2.91Å; L527-Y530 PolarHBondContact O-N 3.4Å; L527-G531 PolarHBondContact O-N 3.28Å
528	C	91.3	Very high	86.9	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.4	-33.1	177.5	-63.8	0	0	0	0	112.5	C512 L524 G531 S532 L550	C512-C528 VanDerWaalsContact SG-SG 3.61Å; L524-C528 WeakPolarHBondContact O-CB 3.32Å; L524-C528 PolarHBondContact O-N 3.39Å; L524-C528 PolarHBondContact O-SG 3.5Å; C528-G531 PolarHBondContact O-N 2.99Å; C528-S532 VanDerWaalsContact O-CB 3.31Å; C528-S532 WeakPolarHBondContact O-CB 3.31Å; C528-S532 PolarHBondContact O-N 3.06Å; C528-L550 HydrophobicContact CB-CB 3.83Å; C528-L550 HydrophobicContact CB-CD1 3.65Å; C528-L550 HydrophobicContact CB-CG 4.29Å
529	C	89.9	Confident	86.3	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.7	-50.4	172.8	-85.5	0	0	0	0	111.3	V475 L479 M525 H526 L527 S532	V475-C529 HydrophobicContact CG1-CB 3.77Å; V475-C529 WeakPolarHBondContact CG1-O 3.44Å; L479-C529 HydrophobicContact CD1-CB 4.09Å; L479-C529 HydrophobicContact CD2-CB 3.74Å; L479-C529 HydrophobicContact CG-CB 3.98Å; M525-C529 VanDerWaalsContact O-CB 3.26Å; M525-C529 WeakPolarHBondContact O-CB 3.48Å; M525-C529 PolarHBondContact O-N 3.17Å; M525-C529 PolarHBondContact O-SG 2.99Å; H526-C529 VanDerWaalsContact O-CB 3.3Å; H526-C529 WeakPolarHBondContact O-CB 3.47Å; H526-C529 PolarHBondContact O-N 3.17Å; L527-C529 VanDerWaalsContact C-N 3.3Å; L527-C529 PolarHBondContact O-N 2.91Å; C529-S532 PolarHBondContact O-N 3.34Å; C529-S532 PolarHBondContact O-OG 3.17Å
530	Y	89	Confident	85.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.7	-43.5	175.2	-81.3	-75	0	0	0	112.8	F432 V435 Y436 L479 L484 E485 V488 H526 L527 S532 Q533 S534	F432-Y530 HydrophobicContact CB-CD1 3.78Å; F432-Y530 HydrophobicContact CB-CE1 4.37Å; F432-Y530 HydrophobicContact CB-CG 4.22Å; F432-Y530 HydrophobicContact CD2-CD1 4.33Å; F432-Y530 HydrophobicContact CD2-CD2 4.45Å; F432-Y530 AromaticContact CD2-CG 3.9Å; F432-Y530 HydrophobicContact CD2-CG 3.9Å; F432-Y530 HydrophobicContact CE2-CG 4.37Å; F432-Y530 HydrophobicContact CG-CD1 4.03Å; F432-Y530 AromaticContact CG-CG 3.98Å; F432-Y530 HydrophobicContact CG-CG 3.98Å; V435-Y530 HydrophobicContact CB-CD1 4.45Å; V435-Y530 HydrophobicContact CG2-CD1 4.28Å; Y436-Y530 AromaticContact CE2-CE1 3.95Å; Y436-Y530 HydrophobicContact CE2-CE1 3.95Å; Y436-Y530 PolarHBondContact OH-OH 3.07Å; L479-Y530 HydrophobicContact CB-CE2 4.32Å; L479-Y530 HydrophobicContact CD1-CD1 3.98Å; L479-Y530 HydrophobicContact CD1-CD2 3.7Å; L479-Y530 HydrophobicContact CD1-CE1 3.8Å; L479-Y530 HydrophobicContact CD1-CE2 3.55Å; L479-Y530 HydrophobicContact CD1-CG 3.95Å; L479-Y530 HydrophobicContact CD2-CD2 3.52Å; L479-Y530 HydrophobicContact CD2-CE2 3.34Å; L479-Y530 HydrophobicContact CG-CD2 4.21Å; L479-Y530 HydrophobicContact CG-CE2 3.9Å; L484-Y530 HydrophobicContact CD2-CD2 3.15Å; L484-Y530 HydrophobicContact CD2-CE2 3.18Å; L484-Y530 HydrophobicContact CD2-CG 4.06Å; L484-Y530 HydrophobicContact CG-CE2 4.45Å; E485-Y530 VanDerWaalsContact CA-OH 3.3Å; E485-Y530 WeakPolarHBondContact CA-OH 3.47Å; E485-Y530 WeakPolarHBondContact CB-OH 3.18Å; V488-Y530 HydrophobicContact CG1-CE1 4.23Å; V488-Y530 HydrophobicContact CG2-CE1 4.31Å; V488-Y530 HydrophobicContact CG2-CE2 4.43Å; H526-Y530 WeakPolarHBondContact O-CD2 3.35Å; H526-Y530 PolarHBondContact O-N 3.43Å; L527-Y530 PolarHBondContact O-N 3.4Å; Y530-S532 PolarHBondContact O-N 2.86Å; Y530-Q533 PolarHBondContact O-N 3.43Å; Y530-S534 PolarHBondContact O-N 3.1Å
531	G	86.8	Confident	84.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.5	-36.7	175.5	0	0	0	0	0	112.8	L527 C528 Q533	L527-G531 PolarHBondContact O-N 3.28Å; C528-G531 PolarHBondContact O-N 2.99Å; G531-Q533 VanDerWaalsContact C-N 3.26Å; G531-Q533 PolarHBondContact O-N 2.7Å
532	S	85.3	Confident	84.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66	-26.7	177.2	79	0	0	0	0	114.1	R467 C528 C529 Y530	R467-S532 PolarHBondContact NH1-O 3.18Å; C528-S532 VanDerWaalsContact O-CB 3.31Å; C528-S532 WeakPolarHBondContact O-CB 3.31Å; C528-S532 PolarHBondContact O-N 3.06Å; C529-S532 PolarHBondContact O-N 3.34Å; C529-S532 PolarHBondContact O-OG 3.17Å; Y530-S532 PolarHBondContact O-N 2.86Å
533	Q	83.6	Confident	83.8	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-101.5	-19.6	-176.6	-64.2	-65.2	-41.8	0	0	113	V435 F441 S468 V475 Y530 G531	V435-Q533 HydrophobicContact CB-CB 4.5Å; V435-Q533 HydrophobicContact CG1-CB 3.75Å; V435-Q533 HydrophobicContact CG1-CG 4.39Å; V435-Q533 HydrophobicContact CG2-CB 3.9Å; F441-Q533 WeakPolarHBondContact CZ-O 3.44Å; S468-Q533 PolarHBondContact O-NE2 3.19Å; S468-Q533 PolarHBondContact O-OE1 3.49Å; V475-Q533 HydrophobicContact CB-CG 4.33Å; V475-Q533 HydrophobicContact CG1-CG 3.74Å; Y530-Q533 PolarHBondContact O-N 3.43Å; G531-Q533 VanDerWaalsContact C-N 3.26Å; G531-Q533 PolarHBondContact O-N 2.7Å
534	S	81.5	Confident	83.1	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.007	13%	0.127	C	C	.	.			trans	-77.6	121.2	180	-177	0	0	0	0	111.8	Y530 A536 I537 A538	Y530-S534 PolarHBondContact O-N 3.1Å; S534-A536 PolarHBondContact O-N 2.8Å; S534-A536 PolarHBondContact OG-N 3.25Å; S534-I537 PolarHBondContact O-N 3.24Å; S534-A538 VanDerWaalsContact O-CB 3.27Å; S534-A538 WeakPolarHBondContact O-CB 3.48Å; S534-A538 PolarHBondContact O-N 3.31Å
535	L	76.3	Confident	82.6	Confident	34 Å²	34	27.5 Å²	27.5	18%	0.178	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-13.5	176.6	-67.6	106.3	0	0	0	113.8	C440 F441 F446 I537	C440-L535 WeakPolarHBondContact O-CD1 3.35Å; C440-L535 WeakPolarHBondContact SG-CD1 3.44Å; F441-L535 HydrophobicContact CD1-CD1 4.37Å; F441-L535 HydrophobicContact CD1-CD2 4.44Å; F441-L535 HydrophobicContact CE1-CD1 3.83Å; F441-L535 HydrophobicContact CE1-CD2 4.12Å; F441-L535 HydrophobicContact CE1-CG 4.01Å; F441-L535 HydrophobicContact CZ-CD1 4.03Å; F441-L535 HydrophobicContact CZ-CG 4.5Å; F446-L535 HydrophobicContact CE2-CD2 3.32Å; F446-L535 HydrophobicContact CZ-CD2 3.27Å; L535-I537 VanDerWaalsContact C-N 3.33Å
536	A	75.2	Confident	82.2	Confident	12 Å²	12	26.7 Å²	26.7	10%	0.099	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-27.1	175	0	0	0	0	0	112.3	Y431 L504 S534	Y431-A536 HydrophobicContact CD1-CB 3.91Å; L504-A536 HydrophobicContact CD1-CB 4.45Å; S534-A536 PolarHBondContact O-N 2.8Å; S534-A536 PolarHBondContact OG-N 3.25Å
537	I	80.7	Confident	81.8	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-42	-173.9	-53	-175.2	0	0	0	111.1	L428 F432 W505 F508 S534 L535 N539 T542 I546	L428-I537 HydrophobicContact CD2-CD1 3.63Å; F432-I537 HydrophobicContact CE1-CD1 3.55Å; F432-I537 HydrophobicContact CZ-CD1 3.99Å; W505-I537 HydrophobicContact CE3-CG2 3.68Å; W505-I537 HydrophobicContact CZ3-CG2 4.09Å; F508-I537 HydrophobicContact CB-CD1 4.36Å; F508-I537 HydrophobicContact CB-CG2 4.37Å; F508-I537 HydrophobicContact CD1-CG2 4.09Å; F508-I537 HydrophobicContact CD2-CD1 3.86Å; F508-I537 HydrophobicContact CD2-CG2 4.37Å; F508-I537 HydrophobicContact CG-CD1 4.24Å; F508-I537 HydrophobicContact CG-CG2 4.01Å; S534-I537 PolarHBondContact O-N 3.24Å; L535-I537 VanDerWaalsContact C-N 3.33Å; I537-N539 PolarHBondContact O-N 3.45Å; I537-T542 PolarHBondContact O-OG1 3.03Å; I537-I546 HydrophobicContact CG2-CD1 4.21Å
538	A	77.6	Confident	81.1	Confident	3 Å²	3	26.3 Å²	26.3	3%	0.025	14%	0.136	C	C	.	.			trans	-79.8	91.3	-174.8	0	0	0	0	0	111.7	L464 S534 I543 I546	L464-A538 HydrophobicContact CD1-CB 4.23Å; L464-A538 VanDerWaalsContact CD2-O 3.26Å; L464-A538 WeakPolarHBondContact CD2-O 3.49Å; S534-A538 VanDerWaalsContact O-CB 3.27Å; S534-A538 WeakPolarHBondContact O-CB 3.48Å; S534-A538 PolarHBondContact O-N 3.31Å; A538-I543 HydrophobicContact CB-CG1 4.13Å; A538-I546 HydrophobicContact CB-CD1 4.38Å
539	N	75.7	Confident	80.9	Confident	64 Å²	64	27.1 Å²	27.1	34%	0.342	14%	0.141	S	C	.	.			trans	-102.8	164.4	172	-69.2	-14.3	0	0	0	110.4	I537 E541 T542 I543	I537-N539 PolarHBondContact O-N 3.45Å; N539-E541 PolarHBondContact O-N 3.24Å; N539-T542 PolarHBondContact N-OG1 2.97Å; N539-T542 PolarHBondContact O-N 2.95Å; N539-T542 VanDerWaalsContact O-N 3.08Å; N539-T542 PolarHBondContact O-OG1 3.09Å; N539-I543 WeakPolarHBondContact O-CD1 3.31Å; N539-I543 WeakPolarHBondContact O-CG1 3.36Å; N539-I543 PolarHBondContact O-N 3.48Å; N539-I543 VanDerWaalsContact O-N 3.08Å
540	S	69.9	Low	80.8	Confident	64 Å²	64	27.1 Å²	27.1	45%	0.448	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.6	-178.8	46.5	0	0	0	0	114.3
541	E	75.3	Confident	80.5	Confident	175 Å²	175	27.2 Å²	27.2	82%	0.818	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-34	-179.2	-63.2	174.8	-177.1	0	0	112.7	N539	N539-E541 PolarHBondContact O-N 3.24Å
542	T	80.8	Confident	80.3	Confident	15 Å²	15	30.1 Å²	30.1	9%	0.092	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-23.8	-172.1	60.3	0	0	0	0	113.1	W505 I537 N539 D544 R545 I546	W505-T542 HydrophobicContact CD2-CG2 3.46Å; W505-T542 VanDerWaalsContact CD2-CG2 3.46Å; W505-T542 HydrophobicContact CE3-CG2 3.73Å; W505-T542 HydrophobicContact CG-CG2 3.93Å; W505-T542 HydrophobicContact CH2-CG2 4.22Å; W505-T542 HydrophobicContact CZ2-CG2 3.97Å; W505-T542 HydrophobicContact CZ3-CG2 4.12Å; I537-T542 PolarHBondContact O-OG1 3.03Å; N539-T542 PolarHBondContact N-OG1 2.97Å; N539-T542 PolarHBondContact O-N 2.95Å; N539-T542 VanDerWaalsContact O-N 3.08Å; N539-T542 PolarHBondContact O-OG1 3.09Å; T542-D544 VanDerWaalsContact C-N 3.34Å; T542-D544 PolarHBondContact O-N 3.13Å; T542-R545 WeakPolarHBondContact O-CB 3.36Å; T542-R545 PolarHBondContact O-N 2.73Å; T542-R545 VanDerWaalsContact O-N 3.14Å; T542-I546 WeakPolarHBondContact O-CG1 3.3Å; T542-I546 PolarHBondContact O-N 3.34Å
543	I	79.9	Confident	80.3	Confident	14 Å²	14	30.1 Å²	30.1	7%	0.072	16%	0.155	C	C	.	.	H	α-helix	trans	-54.5	-45.3	-177.5	-74.3	154.2	0	0	0	112.9	L464 A538 N539 R545 I546 D547	L464-I543 HydrophobicContact CB-CD1 4.03Å; L464-I543 HydrophobicContact CD1-CD1 3.28Å; L464-I543 HydrophobicContact CD1-CG1 3.83Å; L464-I543 HydrophobicContact CD2-CD1 4.12Å; L464-I543 HydrophobicContact CG-CD1 3.96Å; A538-I543 HydrophobicContact CB-CG1 4.13Å; N539-I543 WeakPolarHBondContact O-CD1 3.31Å; N539-I543 WeakPolarHBondContact O-CG1 3.36Å; N539-I543 PolarHBondContact O-N 3.48Å; N539-I543 VanDerWaalsContact O-N 3.08Å; I543-R545 VanDerWaalsContact C-N 3.25Å; I543-R545 PolarHBondContact O-N 3.43Å; I543-I546 PolarHBondContact O-N 3.02Å; I543-D547 WeakPolarHBondContact O-CB 3.26Å; I543-D547 PolarHBondContact O-N 3.25Å
544	D	75.9	Confident	80.5	Confident	68 Å²	68	30.1 Å²	30.1	36%	0.364	16%	0.155	S	C	.	.	H	α-helix	trans	-64.1	-36	-176.4	-74	-12.2	0	0	0	111	T542 S548	T542-D544 VanDerWaalsContact C-N 3.34Å; T542-D544 PolarHBondContact O-N 3.13Å; D544-S548 WeakPolarHBondContact O-CB 3.36Å; D544-S548 PolarHBondContact O-N 3.47Å
545	R	82.4	Confident	80.5	Confident	86 Å²	86	30.6 Å²	30.6	33%	0.325	16%	0.158	S	C	.	.	H	α-helix	trans	-67.3	-47.2	173.4	178	63	173.7	170.2	0.4	110.9	W505 D509 D513 T542 I543 D547 S548 T549	W505-R545 HydrophobicContact CH2-CB 4Å; W505-R545 HydrophobicContact CH2-CG 3.8Å; W505-R545 HydrophobicContact CZ2-CB 4.14Å; W505-R545 HydrophobicContact CZ2-CG 3.84Å; D509-R545 IonicContact OD1-CZ 3.59Å; D509-R545 IonicContact OD1-NE 4Å; D509-R545 PolarHBondContact OD1-NE 2.85Å; D509-R545 IonicContact OD1-NH2 2.53Å; D513-R545 IonicContact OD1-NH2 3.9Å; D513-R545 PolarHBondContact OD1-NH2 3.22Å; D513-R545 VanDerWaalsContact OD1-NH2 3.08Å; D513-R545 IonicContact OD2-NH2 2.82Å; T542-R545 WeakPolarHBondContact O-CB 3.36Å; T542-R545 PolarHBondContact O-N 2.73Å; T542-R545 VanDerWaalsContact O-N 3.14Å; I543-R545 VanDerWaalsContact C-N 3.25Å; I543-R545 PolarHBondContact O-N 3.43Å; R545-D547 VanDerWaalsContact C-N 3.35Å; R545-D547 PolarHBondContact O-N 3.49Å; R545-S548 WeakPolarHBondContact O-CB 3.49Å; R545-S548 PolarHBondContact O-N 3.13Å; R545-S548 PolarHBondContact O-OG 3.38Å; R545-T549 PolarHBondContact O-N 3.02Å; R545-T549 PolarHBondContact O-OG1 2.65Å
546	I	85.2	Confident	80.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.1	-45.2	177	-61.1	167.4	0	0	0	111.1	W505 F508 I537 A538 T542 I543 S548 T549 L550	W505-I546 HydrophobicContact CH2-CD1 4.45Å; W505-I546 HydrophobicContact CH2-CG1 3.81Å; W505-I546 HydrophobicContact CZ3-CD1 3.74Å; W505-I546 HydrophobicContact CZ3-CG1 3.5Å; W505-I546 VanDerWaalsContact CZ3-CG1 3.5Å; F508-I546 HydrophobicContact CE1-CG1 3.94Å; F508-I546 HydrophobicContact CZ-CG1 4.43Å; I537-I546 HydrophobicContact CG2-CD1 4.21Å; A538-I546 HydrophobicContact CB-CD1 4.38Å; T542-I546 WeakPolarHBondContact O-CG1 3.3Å; T542-I546 PolarHBondContact O-N 3.34Å; I543-I546 PolarHBondContact O-N 3.02Å; I546-S548 VanDerWaalsContact C-N 3.29Å; I546-S548 PolarHBondContact O-N 2.9Å; I546-T549 PolarHBondContact O-N 3.46Å; I546-T549 PolarHBondContact O-OG1 3.2Å; I546-L550 WeakPolarHBondContact O-CB 3.49Å; I546-L550 PolarHBondContact O-N 2.96Å
547	D	82.3	Confident	81.3	Confident	11 Å²	11	36.1 Å²	36.1	6%	0.059	18%	0.179	C	C	.	.	H	α-helix	trans	-65	-35.9	178.9	-84.9	-27.1	0	0	0	111.7	R467 I543 R545 L551	R467-D547 IonicContact CZ-OD1 3.43Å; R467-D547 IonicContact CZ-OD2 2.66Å; R467-D547 VanDerWaalsContact CZ-OD2 3.29Å; R467-D547 IonicContact NE-OD1 3.96Å; R467-D547 PolarHBondContact NE-OD1 3.21Å; R467-D547 IonicContact NE-OD2 3.08Å; R467-D547 PolarHBondContact NE-OD2 3.09Å; R467-D547 IonicContact NH2-OD1 3.78Å; R467-D547 PolarHBondContact NH2-OD1 3.07Å; R467-D547 IonicContact NH2-OD2 2.98Å; R467-D547 PolarHBondContact NH2-OD2 2.71Å; I543-D547 WeakPolarHBondContact O-CB 3.26Å; I543-D547 PolarHBondContact O-N 3.25Å; R545-D547 VanDerWaalsContact C-N 3.35Å; R545-D547 PolarHBondContact O-N 3.49Å; D547-L551 VanDerWaalsContact O-CB 3.22Å; D547-L551 WeakPolarHBondContact O-CB 3.35Å; D547-L551 PolarHBondContact O-N 2.88Å
548	S	79.2	Confident	81.3	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-44.6	176.5	78.5	0	0	0	0	112.8	D544 R545 I546 H552 L582	D544-S548 WeakPolarHBondContact O-CB 3.36Å; D544-S548 PolarHBondContact O-N 3.47Å; R545-S548 WeakPolarHBondContact O-CB 3.49Å; R545-S548 PolarHBondContact O-N 3.13Å; R545-S548 PolarHBondContact O-OG 3.38Å; I546-S548 VanDerWaalsContact C-N 3.29Å; I546-S548 PolarHBondContact O-N 2.9Å; S548-H552 WeakPolarHBondContact O-CB 3.18Å; S548-H552 PolarHBondContact O-N 3.3Å; S548-L582 VanDerWaalsContact CB-CD1 3.48Å
549	T	85.3	Confident	81.5	Confident	17 Å²	17	45.3 Å²	45.3	10%	0.104	22%	0.217	C	C	.	.	H	α-helix	trans	-72.9	-40.1	179.7	53.9	0	0	0	0	110.8	R545 I546 L551 H552 A553	R545-T549 PolarHBondContact O-N 3.02Å; R545-T549 PolarHBondContact O-OG1 2.65Å; I546-T549 PolarHBondContact O-N 3.46Å; I546-T549 PolarHBondContact O-OG1 3.2Å; T549-L551 PolarHBondContact O-N 3.3Å; T549-H552 WeakPolarHBondContact O-CB 3.49Å; T549-H552 PolarHBondContact O-N 3.25Å; T549-A553 WeakPolarHBondContact O-CB 3.36Å; T549-A553 PolarHBondContact O-N 2.72Å
550	L	87.8	Confident	81.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-47.1	173.6	-177.4	60.2	0	0	0	111.7	M525 C528 I546 H552 A553 A554 L562 I566	M525-L550 HydrophobicContact CG-CD1 4.44Å; C528-L550 HydrophobicContact CB-CB 3.83Å; C528-L550 HydrophobicContact CB-CD1 3.65Å; C528-L550 HydrophobicContact CB-CG 4.29Å; I546-L550 WeakPolarHBondContact O-CB 3.49Å; I546-L550 PolarHBondContact O-N 2.96Å; L550-H552 VanDerWaalsContact C-N 3.32Å; L550-H552 PolarHBondContact O-N 2.95Å; L550-A553 PolarHBondContact O-N 3.07Å; L550-A554 VanDerWaalsContact O-CB 3.28Å; L550-A554 WeakPolarHBondContact O-CB 3.4Å; L550-A554 PolarHBondContact O-N 3.08Å; L550-L562 HydrophobicContact CD1-CD2 4.09Å; L550-I566 HydrophobicContact CB-CD1 4.4Å; L550-I566 HydrophobicContact CD2-CD1 3.55Å; L550-I566 HydrophobicContact CD2-CG1 4.24Å; L550-I566 HydrophobicContact CG-CD1 3.6Å
551	L	83.5	Confident	81.9	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-44.8	176.3	-179.8	64.4	0	0	0	110.4	D547 T549 A553 A554 I555 I563 V567 F579 I583	D547-L551 VanDerWaalsContact O-CB 3.22Å; D547-L551 WeakPolarHBondContact O-CB 3.35Å; D547-L551 PolarHBondContact O-N 2.88Å; T549-L551 PolarHBondContact O-N 3.3Å; L551-A553 PolarHBondContact O-N 2.83Å; L551-A554 PolarHBondContact O-N 3.35Å; L551-I555 HydrophobicContact CD1-CD1 4.09Å; L551-I555 HydrophobicContact CD1-CG1 4.36Å; L551-I555 HydrophobicContact CG-CD1 3.79Å; L551-I555 WeakPolarHBondContact O-CD1 3.39Å; L551-I555 WeakPolarHBondContact O-CG1 3.42Å; L551-I555 PolarHBondContact O-N 3.48Å; L551-I563 HydrophobicContact CD1-CB 4.48Å; L551-I563 HydrophobicContact CD1-CG1 4.41Å; L551-I563 HydrophobicContact CD1-CG2 3.99Å; L551-V567 HydrophobicContact CD1-CG2 4.31Å; L551-F579 HydrophobicContact CD2-CD2 4.38Å; L551-F579 HydrophobicContact CD2-CE2 3.66Å; L551-F579 HydrophobicContact CD2-CZ 3.77Å; L551-I583 HydrophobicContact CD2-CG1 4.25Å
552	H	81.9	Confident	82.3	Confident	62 Å²	62	39 Å²	39	29%	0.287	18%	0.183	S	C	.	.	H	α-helix	trans	-57.9	-47.2	177.9	-174.2	80.3	0	0	0	112.6	S548 T549 L550 R556	S548-H552 WeakPolarHBondContact O-CB 3.18Å; S548-H552 PolarHBondContact O-N 3.3Å; T549-H552 WeakPolarHBondContact O-CB 3.49Å; T549-H552 PolarHBondContact O-N 3.25Å; L550-H552 VanDerWaalsContact C-N 3.32Å; L550-H552 PolarHBondContact O-N 2.95Å; H552-R556 WeakPolarHBondContact O-CG 3.5Å; H552-R556 PolarHBondContact O-N 3.17Å
553	A	86.6	Confident	82.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-46.2	177.5	0	0	0	0	0	111.4	L524 M525 T549 L550 L551 I555 R556 C557	L524-A553 HydrophobicContact CB-CB 4.35Å; L524-A553 HydrophobicContact CD2-CB 3.92Å; L524-A553 HydrophobicContact CG-CB 3.91Å; M525-A553 HydrophobicContact CB-CB 3.95Å; T549-A553 WeakPolarHBondContact O-CB 3.36Å; T549-A553 PolarHBondContact O-N 2.72Å; L550-A553 PolarHBondContact O-N 3.07Å; L551-A553 PolarHBondContact O-N 2.83Å; A553-I555 VanDerWaalsContact C-N 3.3Å; A553-I555 PolarHBondContact O-N 2.91Å; A553-R556 WeakPolarHBondContact O-CB 3.33Å; A553-R556 PolarHBondContact O-N 3.01Å; A553-R556 VanDerWaalsContact O-N 3.07Å; A553-C557 PolarHBondContact O-N 2.89Å; A553-C557 PolarHBondContact O-SG 3.44Å; A553-C557 VanDerWaalsContact O-SG 3.38Å
554	A	86.5	Confident	82.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-37.5	179.4	0	0	0	0	0	112.7	L550 L551 C557 R558 A559 L562 I563	L550-A554 VanDerWaalsContact O-CB 3.28Å; L550-A554 WeakPolarHBondContact O-CB 3.4Å; L550-A554 PolarHBondContact O-N 3.08Å; L551-A554 PolarHBondContact O-N 3.35Å; A554-C557 PolarHBondContact O-N 3.25Å; A554-R558 PolarHBondContact O-N 3.25Å; A554-A559 HydrophobicContact CB-CB 4.49Å; A554-A559 PolarHBondContact O-N 3.4Å; A554-L562 HydrophobicContact CB-CD2 3.86Å; A554-L562 HydrophobicContact CB-CG 4.24Å; A554-I563 HydrophobicContact CB-CD1 4.49Å; A554-I563 HydrophobicContact CB-CG1 3.73Å
555	I	81.7	Confident	82.2	Confident	12 Å²	12	37.8 Å²	37.8	6%	0.062	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-44.4	174.2	-67.2	153.6	0	0	0	111	L551 A553 C557 R558 I563 R588 L591 F594	L551-I555 HydrophobicContact CD1-CD1 4.09Å; L551-I555 HydrophobicContact CD1-CG1 4.36Å; L551-I555 HydrophobicContact CG-CD1 3.79Å; L551-I555 WeakPolarHBondContact O-CD1 3.39Å; L551-I555 WeakPolarHBondContact O-CG1 3.42Å; L551-I555 PolarHBondContact O-N 3.48Å; A553-I555 VanDerWaalsContact C-N 3.3Å; A553-I555 PolarHBondContact O-N 2.91Å; I555-C557 VanDerWaalsContact C-N 3.33Å; I555-R558 PolarHBondContact O-N 3.47Å; I555-I563 HydrophobicContact CG1-CD1 4.11Å; I555-I563 HydrophobicContact CG1-CG1 4.4Å; I555-R588 VanDerWaalsContact CG2-NH1 3.28Å; I555-L591 HydrophobicContact CB-CD1 4.43Å; I555-L591 HydrophobicContact CD1-CD1 3.52Å; I555-L591 HydrophobicContact CD1-CD2 3.45Å; I555-L591 VanDerWaalsContact CD1-CD2 3.45Å; I555-L591 HydrophobicContact CD1-CG 4.03Å; I555-L591 HydrophobicContact CG1-CD1 3.98Å; I555-L591 HydrophobicContact CG1-CD2 4.29Å; I555-L591 HydrophobicContact CG2-CD1 3.62Å; I555-F594 HydrophobicContact CG2-CD1 4.24Å; I555-F594 HydrophobicContact CG2-CE1 3.97Å
556	R	83.8	Confident	82	Confident	122 Å²	122	33.8 Å²	33.8	46%	0.46	16%	0.158	S	C	.	.	H	α-helix	trans	-63.1	-41.1	178.1	-75.9	-81.2	-176.2	-156.1	2.5	111.2	Y521 H552 A553 R558 R588	Y521-R556 HydrophobicContact CD1-CB 3.84Å; Y521-R556 HydrophobicContact CD1-CG 3.7Å; Y521-R556 HydrophobicContact CD2-CB 3.8Å; Y521-R556 HydrophobicContact CD2-CG 3.96Å; Y521-R556 HydrophobicContact CE1-CB 4.38Å; Y521-R556 HydrophobicContact CE1-CG 3.75Å; Y521-R556 HydrophobicContact CE2-CB 4.32Å; Y521-R556 HydrophobicContact CE2-CG 3.98Å; Y521-R556 HydrophobicContact CG-CB 3.52Å; Y521-R556 HydrophobicContact CG-CG 3.81Å; H552-R556 WeakPolarHBondContact O-CG 3.5Å; H552-R556 PolarHBondContact O-N 3.17Å; A553-R556 WeakPolarHBondContact O-CB 3.33Å; A553-R556 PolarHBondContact O-N 3.01Å; A553-R556 VanDerWaalsContact O-N 3.07Å; R556-R558 VanDerWaalsContact C-N 3.29Å; R556-R558 PolarHBondContact O-N 3.46Å; R556-R588 VanDerWaalsContact CG-NH2 3.34Å; R556-R588 VanDerWaalsContact NH1-NH2 3.19Å
557	C	84.3	Confident	81.5	Confident	39 Å²	39	33.9 Å²	33.9	26%	0.264	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.8	178.5	-62.7	0	0	0	0	114.3	Y521 M525 A553 A554 I555 A559	Y521-C557 PolarHBondContact O-SG 3.24Å; Y521-C557 VanDerWaalsContact O-SG 3.32Å; M525-C557 HydrophobicContact CE-CB 4.33Å; M525-C557 HydrophobicContact SD-CB 3.92Å; A553-C557 PolarHBondContact O-N 2.89Å; A553-C557 PolarHBondContact O-SG 3.44Å; A553-C557 VanDerWaalsContact O-SG 3.38Å; A554-C557 PolarHBondContact O-N 3.25Å; I555-C557 VanDerWaalsContact C-N 3.33Å; C557-A559 PolarHBondContact O-N 3.36Å
558	R	81.6	Confident	81	Confident	177 Å²	177	38.7 Å²	38.7	67%	0.668	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	49.5	-176.7	-60	-175	174.4	158.3	-1.7	113.1	A554 I555 R556 P560 F594 M598	A554-R558 PolarHBondContact O-N 3.25Å; I555-R558 PolarHBondContact O-N 3.47Å; R556-R558 VanDerWaalsContact C-N 3.29Å; R556-R558 PolarHBondContact O-N 3.46Å; R558-P560 WeakPolarHBondContact O-CD 3.5Å; R558-F594 HydrophobicContact CG-CZ 4.31Å; R558-M598 HydrophobicContact CB-CE 3.76Å; R558-M598 HydrophobicContact CG-CE 4.11Å
559	A	82.1	Confident	80.6	Confident	20 Å²	20	39.7 Å²	39.7	17%	0.165	18%	0.179	C	C	.	.			trans	-98.9	85.5	178.8	0	0	0	0	0	112.4	M525 A554 C557 Q561 L562 I563	M525-A559 HydrophobicContact SD-CB 4.07Å; A554-A559 HydrophobicContact CB-CB 4.49Å; A554-A559 PolarHBondContact O-N 3.4Å; C557-A559 PolarHBondContact O-N 3.36Å; A559-Q561 PolarHBondContact O-N 2.97Å; A559-L562 HydrophobicContact CB-CB 4.26Å; A559-L562 PolarHBondContact O-N 3.19Å; A559-I563 WeakPolarHBondContact O-CD1 3.47Å; A559-I563 VanDerWaalsContact O-CG1 3.24Å; A559-I563 WeakPolarHBondContact O-CG1 3.36Å; A559-I563 PolarHBondContact O-N 3.19Å; A559-I563 VanDerWaalsContact O-N 3.16Å
560	P	74.8	Confident	79.8	Confident	47 Å²	47	39.1 Å²	39.1	31%	0.305	18%	0.177	S	C	.	.	H	α-helix	trans	-63	-41.2	-169.2	23.5	-34.8	0	0	0	113.8	R558 L562 I563 W564 I599	R558-P560 WeakPolarHBondContact O-CD 3.5Å; P560-L562 PolarHBondContact O-N 3.38Å; P560-I563 PolarHBondContact O-N 3.33Å; P560-W564 WeakPolarHBondContact O-CB 3.49Å; P560-W564 PolarHBondContact O-N 3.05Å; P560-I599 HydrophobicContact CB-CD1 3.83Å; P560-I599 HydrophobicContact CB-CG1 3.64Å; P560-I599 WeakPolarHBondContact O-CD1 3.31Å
561	Q	80	Confident	78.7	Confident	123 Å²	123	39.4 Å²	39.4	58%	0.575	18%	0.179	S	C	*	.	H	α-helix	trans	-64.7	-40.2	-177.5	-65.3	-177.5	-1.1	0	0	112.1	A559 N565	A559-Q561 PolarHBondContact O-N 2.97Å; Q561-N565 PolarHBondContact O-N 2.98Å; Q561-N565 VanDerWaalsContact O-N 3.16Å; Q561-N565 PolarHBondContact O-ND2 3.13Å
562	L	82.7	Confident	77.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-47.9	177.7	-178.6	61.7	0	0	0	110.7	V474 V475 T478 M525 L550 A554 A559 P560 W564 N565 I566	V474-L562 HydrophobicContact CG1-CB 4.4Å; V474-L562 HydrophobicContact CG1-CD1 4.18Å; V475-L562 HydrophobicContact CG2-CD1 4.32Å; T478-L562 HydrophobicContact CG2-CB 4.34Å; T478-L562 HydrophobicContact CG2-CD2 4.43Å; M525-L562 HydrophobicContact CG-CD2 3.96Å; M525-L562 HydrophobicContact SD-CD2 4Å; L550-L562 HydrophobicContact CD1-CD2 4.09Å; A554-L562 HydrophobicContact CB-CD2 3.86Å; A554-L562 HydrophobicContact CB-CG 4.24Å; A559-L562 HydrophobicContact CB-CB 4.26Å; A559-L562 PolarHBondContact O-N 3.19Å; P560-L562 PolarHBondContact O-N 3.38Å; L562-W564 VanDerWaalsContact C-N 3.29Å; L562-W564 PolarHBondContact O-N 3.24Å; L562-N565 PolarHBondContact O-N 3.34Å; L562-I566 HydrophobicContact CD1-CD1 3.96Å; L562-I566 HydrophobicContact CD1-CG1 4.35Å; L562-I566 HydrophobicContact CG-CD1 3.84Å; L562-I566 VanDerWaalsContact O-CG1 3.29Å; L562-I566 WeakPolarHBondContact O-CG1 3.37Å; L562-I566 PolarHBondContact O-N 3Å; L562-I566 VanDerWaalsContact O-N 3.08Å
563	I	79.8	Confident	76.7	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-53.6	-49.3	175.8	-65.9	165.1	0	0	0	110.1	L551 A554 I555 A559 P560 N565 I566 V567 I595	L551-I563 HydrophobicContact CD1-CB 4.48Å; L551-I563 HydrophobicContact CD1-CG1 4.41Å; L551-I563 HydrophobicContact CD1-CG2 3.99Å; A554-I563 HydrophobicContact CB-CD1 4.49Å; A554-I563 HydrophobicContact CB-CG1 3.73Å; I555-I563 HydrophobicContact CG1-CD1 4.11Å; I555-I563 HydrophobicContact CG1-CG1 4.4Å; A559-I563 WeakPolarHBondContact O-CD1 3.47Å; A559-I563 VanDerWaalsContact O-CG1 3.24Å; A559-I563 WeakPolarHBondContact O-CG1 3.36Å; A559-I563 PolarHBondContact O-N 3.19Å; A559-I563 VanDerWaalsContact O-N 3.16Å; P560-I563 PolarHBondContact O-N 3.33Å; I563-N565 PolarHBondContact O-N 3.04Å; I563-I566 PolarHBondContact O-N 3.07Å; I563-V567 HydrophobicContact CG2-CG2 4.21Å; I563-V567 WeakPolarHBondContact O-CB 3.33Å; I563-V567 WeakPolarHBondContact O-CG2 3.43Å; I563-V567 PolarHBondContact O-N 3.07Å; I563-I595 HydrophobicContact CG2-CG1 4.08Å
564	W	75.9	Confident	75	Confident	36 Å²	36	50.3 Å²	50.3	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-47.6	-179.2	171.6	-122.1	0	0	0	112.5	P560 L562 I566 V567 R568 M571 I599 I604 F607	P560-W564 WeakPolarHBondContact O-CB 3.49Å; P560-W564 PolarHBondContact O-N 3.05Å; L562-W564 VanDerWaalsContact C-N 3.29Å; L562-W564 PolarHBondContact O-N 3.24Å; W564-I566 VanDerWaalsContact C-N 3.34Å; W564-I566 PolarHBondContact O-N 3.24Å; W564-V567 PolarHBondContact O-N 3.45Å; W564-R568 HydrophobicContact CD2-CB 4.45Å; W564-R568 HydrophobicContact CH2-CB 4.45Å; W564-R568 HydrophobicContact CZ2-CB 4.27Å; W564-R568 HydrophobicContact CZ2-CG 4.17Å; W564-R568 WeakPolarHBondContact O-CB 3.45Å; W564-R568 PolarHBondContact O-N 3.35Å; W564-M571 HydrophobicContact CZ3-CE 4.28Å; W564-M571 HydrophobicContact CZ3-SD 4.47Å; W564-I599 HydrophobicContact CB-CD1 3.79Å; W564-I604 HydrophobicContact CD2-CD1 3.71Å; W564-I604 HydrophobicContact CD2-CG1 3.61Å; W564-I604 HydrophobicContact CE3-CB 4.2Å; W564-I604 HydrophobicContact CE3-CD1 3.58Å; W564-I604 HydrophobicContact CE3-CG1 3.56Å; W564-I604 HydrophobicContact CE3-CG2 3.87Å; W564-I604 HydrophobicContact CG-CD1 4.14Å; W564-I604 HydrophobicContact CG-CG1 4.36Å; W564-I604 HydrophobicContact CH2-CB 3.79Å; W564-I604 HydrophobicContact CH2-CG1 3.73Å; W564-I604 HydrophobicContact CH2-CG2 3.65Å; W564-I604 HydrophobicContact CZ2-CB 4.23Å; W564-I604 HydrophobicContact CZ2-CG1 3.76Å; W564-I604 HydrophobicContact CZ3-CB 3.8Å; W564-I604 HydrophobicContact CZ3-CD1 4.09Å; W564-I604 HydrophobicContact CZ3-CG1 3.66Å; W564-I604 HydrophobicContact CZ3-CG2 3.27Å; W564-F607 HydrophobicContact CH2-CB 4.01Å; W564-F607 AromaticContact CH2-CD1 3.68Å; W564-F607 HydrophobicContact CH2-CD1 3.68Å; W564-F607 HydrophobicContact CH2-CG 4.09Å; W564-F607 HydrophobicContact CZ2-CB 4.06Å; W564-F607 HydrophobicContact CZ2-CD1 4.06Å; W564-F607 HydrophobicContact CZ2-CG 4.11Å
565	N	78.9	Confident	73.3	Confident	33 Å²	33	57.2 Å²	57.2	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-69.4	-33	-176.2	-71.9	-61.8	0	0	0	112.8	L471 V474 Q561 L562 I563 Y569	L471-N565 HydrophobicContact CD2-CB 3.85Å; V474-N565 HydrophobicContact CG2-CB 4.42Å; V474-N565 WeakPolarHBondContact CG2-ND2 3.29Å; Q561-N565 PolarHBondContact O-N 2.98Å; Q561-N565 VanDerWaalsContact O-N 3.16Å; Q561-N565 PolarHBondContact O-ND2 3.13Å; L562-N565 PolarHBondContact O-N 3.34Å; I563-N565 PolarHBondContact O-N 3.04Å; N565-Y569 PolarHBondContact O-N 3.15Å
566	I	78.4	Confident	71.8	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-49.5	172.4	-62.7	165	0	0	0	110	L471 L550 L562 I563 W564 R568 Y569 G570 F579	L471-I566 HydrophobicContact CD2-CG1 4.12Å; L550-I566 HydrophobicContact CB-CD1 4.4Å; L550-I566 HydrophobicContact CD2-CD1 3.55Å; L550-I566 HydrophobicContact CD2-CG1 4.24Å; L550-I566 HydrophobicContact CG-CD1 3.6Å; L562-I566 HydrophobicContact CD1-CD1 3.96Å; L562-I566 HydrophobicContact CD1-CG1 4.35Å; L562-I566 HydrophobicContact CG-CD1 3.84Å; L562-I566 VanDerWaalsContact O-CG1 3.29Å; L562-I566 WeakPolarHBondContact O-CG1 3.37Å; L562-I566 PolarHBondContact O-N 3Å; L562-I566 VanDerWaalsContact O-N 3.08Å; I563-I566 PolarHBondContact O-N 3.07Å; W564-I566 VanDerWaalsContact C-N 3.34Å; W564-I566 PolarHBondContact O-N 3.24Å; I566-R568 PolarHBondContact O-N 3.44Å; I566-Y569 PolarHBondContact O-N 3.46Å; I566-G570 PolarHBondContact O-N 3.33Å; I566-F579 HydrophobicContact CG2-CE2 3.7Å; I566-F579 HydrophobicContact CG2-CZ 3.94Å
567	V	73.6	Confident	70.3	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-44.8	179	171.3	0	0	0	0	111.3	L551 I563 W564 Y569 G570 M571 F579 I595	L551-V567 HydrophobicContact CD1-CG2 4.31Å; I563-V567 HydrophobicContact CG2-CG2 4.21Å; I563-V567 WeakPolarHBondContact O-CB 3.33Å; I563-V567 WeakPolarHBondContact O-CG2 3.43Å; I563-V567 PolarHBondContact O-N 3.07Å; W564-V567 PolarHBondContact O-N 3.45Å; V567-Y569 VanDerWaalsContact C-N 3.26Å; V567-Y569 PolarHBondContact O-N 3.47Å; V567-G570 PolarHBondContact O-N 3.24Å; V567-G570 VanDerWaalsContact O-N 3.13Å; V567-M571 HydrophobicContact CG1-CE 3.45Å; V567-M571 VanDerWaalsContact CG1-CE 3.45Å; V567-M571 HydrophobicContact CG1-CG 4.27Å; V567-M571 HydrophobicContact CG1-SD 4.12Å; V567-M571 VanDerWaalsContact O-CG 3.23Å; V567-M571 WeakPolarHBondContact O-CG 3.37Å; V567-M571 PolarHBondContact O-N 3.34Å; V567-F579 HydrophobicContact CB-CE1 4.33Å; V567-F579 HydrophobicContact CB-CZ 4.29Å; V567-F579 HydrophobicContact CG1-CE1 4.49Å; V567-F579 HydrophobicContact CG2-CE1 4.02Å; V567-F579 HydrophobicContact CG2-CZ 3.79Å; V567-I595 HydrophobicContact CG2-CD1 4.27Å
568	R	73.6	Confident	68.8	Low	111 Å²	111	58.7 Å²	58.7	42%	0.419	28%	0.277	S	S	.	.	H	α-helix	trans	-55.2	-41.9	176.7	-172.7	-170.6	176.9	-176.2	-3.8	111.9	W564 I566 H572 F607	W564-R568 HydrophobicContact CD2-CB 4.45Å; W564-R568 HydrophobicContact CH2-CB 4.45Å; W564-R568 HydrophobicContact CZ2-CB 4.27Å; W564-R568 HydrophobicContact CZ2-CG 4.17Å; W564-R568 WeakPolarHBondContact O-CB 3.45Å; W564-R568 PolarHBondContact O-N 3.35Å; I566-R568 PolarHBondContact O-N 3.44Å; R568-H572 PolarHBondContact O-CD2 3.12Å; R568-H572 VanDerWaalsContact O-CD2 3.28Å; R568-F607 HydrophobicContact CB-CE1 4.26Å; R568-F607 HydrophobicContact CG-CD1 3.98Å; R568-F607 HydrophobicContact CG-CE1 3.35Å; R568-F607 HydrophobicContact CG-CE2 3.97Å; R568-F607 HydrophobicContact CG-CZ 3.33Å
569	Y	70.9	Confident	67.5	Low	24 Å²	24	51.1 Å²	51.1	9%	0.094	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-45.4	175.6	175.8	-96.9	0	0	0	111.7	R463 R467 N565 I566 V567 M571 H572 F573	R463-Y569 VanDerWaalsContact CG-OH 3.29Å; R463-Y569 WeakPolarHBondContact CG-OH 3.44Å; R463-Y569 PolarHBondContact O-OH 3.03Å; R467-Y569 VanDerWaalsContact CA-CE2 3.46Å; R467-Y569 HydrophobicContact CB-CD1 4.49Å; R467-Y569 HydrophobicContact CB-CD2 4.02Å; R467-Y569 HydrophobicContact CB-CE1 3.91Å; R467-Y569 HydrophobicContact CB-CE2 3.34Å; R467-Y569 WeakPolarHBondContact CB-OH 3.32Å; R467-Y569 VanDerWaalsContact CD-CE1 3.45Å; R467-Y569 HydrophobicContact CG-CD1 3.78Å; R467-Y569 HydrophobicContact CG-CD2 4.02Å; R467-Y569 HydrophobicContact CG-CE1 3.45Å; R467-Y569 VanDerWaalsContact CG-CE1 3.45Å; R467-Y569 HydrophobicContact CG-CE2 3.71Å; R467-Y569 HydrophobicContact CG-CG 4.06Å; R467-Y569 VanDerWaalsContact CG-CZ 3.41Å; N565-Y569 PolarHBondContact O-N 3.15Å; I566-Y569 PolarHBondContact O-N 3.46Å; V567-Y569 VanDerWaalsContact C-N 3.26Å; V567-Y569 PolarHBondContact O-N 3.47Å; Y569-M571 VanDerWaalsContact C-N 3.25Å; Y569-M571 PolarHBondContact O-N 3.09Å; Y569-H572 PolarHBondContact O-N 3.02Å; Y569-F573 AromaticContact CD1-CE2 3.9Å; Y569-F573 HydrophobicContact CD1-CE2 3.9Å; Y569-F573 AromaticContact CD2-CE2 3.95Å; Y569-F573 HydrophobicContact CD2-CE2 3.95Å; Y569-F573 HydrophobicContact CD2-CZ 4.42Å; Y569-F573 HydrophobicContact CE1-CD2 4.15Å; Y569-F573 AromaticContact CE1-CE2 3.38Å; Y569-F573 HydrophobicContact CE1-CE2 3.38Å; Y569-F573 HydrophobicContact CE1-CZ 4.09Å; Y569-F573 AromaticContact CE2-CE2 3.44Å; Y569-F573 HydrophobicContact CE2-CE2 3.44Å; Y569-F573 VanDerWaalsContact CE2-CE2 3.44Å; Y569-F573 AromaticContact CE2-CZ 3.57Å; Y569-F573 HydrophobicContact CE2-CZ 3.57Å; Y569-F573 HydrophobicContact CG-CE2 4.16Å; Y569-F573 AromaticContact CZ-CE2 3.11Å; Y569-F573 AromaticContact CZ-CZ 3.36Å; Y569-F573 WeakPolarHBondContact O-CD2 3.45Å; Y569-F573 VanDerWaalsContact O-CE2 3.28Å; Y569-F573 WeakPolarHBondContact O-CE2 3.29Å; Y569-F573 WeakPolarHBondContact OH-CE2 3.49Å; Y569-F573 WeakPolarHBondContact OH-CZ 3.36Å
570	G	67.2	Low	66.3	Low	6 Å²	6	51.9 Å²	51.9	6%	0.062	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-33.7	178.4	0	0	0	0	0	113.8	I566 V567 H572 F573	I566-G570 PolarHBondContact O-N 3.33Å; V567-G570 PolarHBondContact O-N 3.24Å; V567-G570 VanDerWaalsContact O-N 3.13Å; G570-H572 PolarHBondContact O-N 3.25Å; G570-F573 PolarHBondContact O-N 3.43Å
571	M	64.9	Low	65.3	Low	5 Å²	5	54 Å²	54	3%	0.025	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-24	178.2	-78	170.8	172.1	0	0	114.5	W564 V567 Y569 W580 F607 A608 L621 I624	W564-M571 HydrophobicContact CZ3-CE 4.28Å; W564-M571 HydrophobicContact CZ3-SD 4.47Å; V567-M571 HydrophobicContact CG1-CE 3.45Å; V567-M571 VanDerWaalsContact CG1-CE 3.45Å; V567-M571 HydrophobicContact CG1-CG 4.27Å; V567-M571 HydrophobicContact CG1-SD 4.12Å; V567-M571 VanDerWaalsContact O-CG 3.23Å; V567-M571 WeakPolarHBondContact O-CG 3.37Å; V567-M571 PolarHBondContact O-N 3.34Å; Y569-M571 VanDerWaalsContact C-N 3.25Å; Y569-M571 PolarHBondContact O-N 3.09Å; M571-W580 HydrophobicContact CG-CH2 3.99Å; M571-F607 HydrophobicContact SD-CD1 4.16Å; M571-F607 HydrophobicContact SD-CE1 4.07Å; M571-A608 HydrophobicContact CE-CB 4.37Å; M571-L621 HydrophobicContact CB-CD2 3.93Å; M571-L621 HydrophobicContact CG-CD2 3.65Å; M571-L621 HydrophobicContact SD-CD2 4.28Å; M571-I624 HydrophobicContact CE-CD1 3.48Å; M571-I624 VanDerWaalsContact CE-CD1 3.48Å; M571-I624 HydrophobicContact CE-CG2 4.19Å
572	H	63.7	Low	63.8	Low	71 Å²	71	50.1 Å²	50.1	33%	0.329	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-12.4	-176.7	-78.2	-70.9	0	0	0	114.6	R568 Y569 G570 F607 Y615	R568-H572 PolarHBondContact O-CD2 3.12Å; R568-H572 VanDerWaalsContact O-CD2 3.28Å; Y569-H572 PolarHBondContact O-N 3.02Å; G570-H572 PolarHBondContact O-N 3.25Å; H572-F607 AromaticContact NE2-CZ 3.43Å; H572-F607 WeakPolarHBondContact NE2-CZ 3.34Å; H572-Y615 PolarHBondContact O-OH 3.09Å
573	F	59.7	Low	62.2	Low	50 Å²	50	51 Å²	51	22%	0.219	24%	0.243	C	C	.	.			trans	-103.4	122.9	-170.3	-62	-73.3	0	0	0	112.6	R463 Y569 G570 N575	R463-F573 HydrophobicContact CG-CE1 3.78Å; R463-F573 HydrophobicContact CG-CZ 3.84Å; R463-F573 VanDerWaalsContact CZ-CD1 3.46Å; R463-F573 VanDerWaalsContact NE-CD1 3.26Å; R463-F573 VanDerWaalsContact NH2-CD1 3.34Å; Y569-F573 AromaticContact CD1-CE2 3.9Å; Y569-F573 HydrophobicContact CD1-CE2 3.9Å; Y569-F573 AromaticContact CD2-CE2 3.95Å; Y569-F573 HydrophobicContact CD2-CE2 3.95Å; Y569-F573 HydrophobicContact CD2-CZ 4.42Å; Y569-F573 HydrophobicContact CE1-CD2 4.15Å; Y569-F573 AromaticContact CE1-CE2 3.38Å; Y569-F573 HydrophobicContact CE1-CE2 3.38Å; Y569-F573 HydrophobicContact CE1-CZ 4.09Å; Y569-F573 AromaticContact CE2-CE2 3.44Å; Y569-F573 HydrophobicContact CE2-CE2 3.44Å; Y569-F573 VanDerWaalsContact CE2-CE2 3.44Å; Y569-F573 AromaticContact CE2-CZ 3.57Å; Y569-F573 HydrophobicContact CE2-CZ 3.57Å; Y569-F573 HydrophobicContact CG-CE2 4.16Å; Y569-F573 AromaticContact CZ-CE2 3.11Å; Y569-F573 AromaticContact CZ-CZ 3.36Å; Y569-F573 WeakPolarHBondContact O-CD2 3.45Å; Y569-F573 VanDerWaalsContact O-CE2 3.28Å; Y569-F573 WeakPolarHBondContact O-CE2 3.29Å; Y569-F573 WeakPolarHBondContact OH-CE2 3.49Å; Y569-F573 WeakPolarHBondContact OH-CZ 3.36Å; G570-F573 PolarHBondContact O-N 3.43Å; F573-N575 PolarHBondContact O-N 3.29Å; F573-N575 VanDerWaalsContact O-N 3.07Å
574	K	51.8	Low	60.2	Low	172 Å²	172	53.5 Å²	53.5	75%	0.748	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.5	-172.4	-80.9	-176	171.5	-176	0	115.5	Y615	K574-Y615 HydrophobicContact CG-CD1 4.12Å; K574-Y615 HydrophobicContact CG-CE1 4.24Å
575	N	49.2	Very low	58.3	Low	146 Å²	146	59.2 Å²	59.2	78%	0.781	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	14.3	-165.1	-76.3	-10.8	0	0	0	116.1	F573 N577	F573-N575 PolarHBondContact O-N 3.29Å; F573-N575 VanDerWaalsContact O-N 3.07Å; N575-N577 PolarHBondContact O-N 2.93Å
576	C	50.8	Low	56.4	Low	18 Å²	18	66 Å²	66	12%	0.122	32%	0.32	C	S	.	.			trans	-81	60.1	-177.7	-66.3	0	0	0	0	112.5	H578 F579 W580	C576-H578 PolarHBondContact O-N 3.16Å; C576-F579 HydrophobicContact CB-CB 4.16Å; C576-F579 PolarHBondContact O-N 3.04Å; C576-W580 PolarHBondContact O-N 3.31Å
577	N	52.6	Low	54.3	Low	114 Å²	114	71.9 Å²	71.9	61%	0.61	35%	0.345	S	S	*	.	H	α-helix	trans	-50.4	-29.6	170.1	-81.8	-11.2	0	0	0	111.6	N575 W580 N581	N575-N577 PolarHBondContact O-N 2.93Å; N577-W580 PolarHBondContact O-N 3.01Å; N577-N581 WeakPolarHBondContact O-CA 3.49Å; N577-N581 WeakPolarHBondContact O-CB 3.34Å; N577-N581 PolarHBondContact O-N 3.43Å; N577-N581 PolarHBondContact O-ND2 2.94Å
578	H	51.9	Low	52.3	Low	72 Å²	72	74.7 Å²	74.7	33%	0.333	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.4	-167.6	72.5	0	0	0	113.3	C576 N581 L582	C576-H578 PolarHBondContact O-N 3.16Å; H578-N581 PolarHBondContact O-N 3.21Å; H578-L582 WeakPolarHBondContact NE2-CD1 3.36Å; H578-L582 WeakPolarHBondContact O-CD1 3.17Å; H578-L582 PolarHBondContact O-N 3.4Å
579	F	54.1	Low	50.5	Low	18 Å²	18	76.9 Å²	76.9	8%	0.079	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-43.5	178.7	-167.7	-100.9	0	0	0	110.7	L551 I566 V567 C576 N581 L582 I583	L551-F579 HydrophobicContact CD2-CD2 4.38Å; L551-F579 HydrophobicContact CD2-CE2 3.66Å; L551-F579 HydrophobicContact CD2-CZ 3.77Å; I566-F579 HydrophobicContact CG2-CE2 3.7Å; I566-F579 HydrophobicContact CG2-CZ 3.94Å; V567-F579 HydrophobicContact CB-CE1 4.33Å; V567-F579 HydrophobicContact CB-CZ 4.29Å; V567-F579 HydrophobicContact CG1-CE1 4.49Å; V567-F579 HydrophobicContact CG2-CE1 4.02Å; V567-F579 HydrophobicContact CG2-CZ 3.79Å; C576-F579 HydrophobicContact CB-CB 4.16Å; C576-F579 PolarHBondContact O-N 3.04Å; F579-N581 VanDerWaalsContact C-N 3.35Å; F579-N581 PolarHBondContact O-N 3.1Å; F579-L582 PolarHBondContact O-N 3.48Å; F579-I583 HydrophobicContact CD1-CD1 3.67Å; F579-I583 HydrophobicContact CE1-CD1 3.56Å; F579-I583 HydrophobicContact CZ-CD1 4.39Å; F579-I583 WeakPolarHBondContact O-CG1 3.45Å; F579-I583 PolarHBondContact O-N 2.75Å
580	W	56.9	Low	49.1	Very low	35 Å²	35	82.2 Å²	82.2	13%	0.133	39%	0.388	C	S	.	.	H	α-helix	trans	-64.5	-37.6	175.3	-58.5	122	0	0	0	112.6	M571 C576 N577 I583 G584 L621 I624	M571-W580 HydrophobicContact CG-CH2 3.99Å; C576-W580 PolarHBondContact O-N 3.31Å; N577-W580 PolarHBondContact O-N 3.01Å; W580-I583 HydrophobicContact CE3-CD1 3.95Å; W580-I583 HydrophobicContact CZ3-CD1 4.07Å; W580-I583 CarbonylContact O-C 3.59Å; W580-I583 WeakPolarHBondContact O-CB 3.37Å; W580-I583 PolarHBondContact O-N 3.26Å; W580-G584 PolarHBondContact O-N 2.93Å; W580-L621 HydrophobicContact CH2-CD2 4.13Å; W580-L621 HydrophobicContact CZ2-CD2 4.43Å; W580-L621 HydrophobicContact CZ2-CG 4.47Å; W580-I624 HydrophobicContact CE3-CD1 4.45Å; W580-I624 HydrophobicContact CH2-CD1 3.54Å; W580-I624 HydrophobicContact CZ3-CD1 3.25Å; W580-I624 HydrophobicContact CZ3-CG1 4.23Å
581	N	53.7	Low	48	Very low	93 Å²	93	82.3 Å²	82.3	50%	0.497	39%	0.387	S	S	.	.	H	α-helix	trans	-75.4	-25.9	176.8	-73.8	-20.7	0	0	0	112.6	N577 H578 F579 G584 R585	N577-N581 WeakPolarHBondContact O-CA 3.49Å; N577-N581 WeakPolarHBondContact O-CB 3.34Å; N577-N581 PolarHBondContact O-N 3.43Å; N577-N581 PolarHBondContact O-ND2 2.94Å; H578-N581 PolarHBondContact O-N 3.21Å; F579-N581 VanDerWaalsContact C-N 3.35Å; F579-N581 PolarHBondContact O-N 3.1Å; N581-G584 CarbonylContact O-C 3.39Å; N581-G584 PolarHBondContact O-N 2.96Å; N581-R585 WeakPolarHBondContact O-CA 3.49Å; N581-R585 WeakPolarHBondContact O-CB 3.32Å; N581-R585 WeakPolarHBondContact O-CG 3.33Å; N581-R585 PolarHBondContact O-N 3.42Å
582	L	49	Very low	47.1	Very low	40 Å²	40	83.4 Å²	83.4	21%	0.209	40%	0.395	C	S	.	.	H	α-helix	trans	-74	-34.4	169	-97.9	111.5	0	0	0	112.1	S548 H578 F579 G584	S548-L582 VanDerWaalsContact CB-CD1 3.48Å; H578-L582 WeakPolarHBondContact NE2-CD1 3.36Å; H578-L582 WeakPolarHBondContact O-CD1 3.17Å; H578-L582 PolarHBondContact O-N 3.4Å; F579-L582 PolarHBondContact O-N 3.48Å; L582-G584 VanDerWaalsContact C-N 3.25Å
583	I	49.3	Very low	46.3	Very low	20 Å²	20	86.8 Å²	86.8	10%	0.103	41%	0.405	C	S	.	.	H	α-helix	trans	-65.4	-33.3	169.1	-65.6	165.2	0	0	0	110.4	L551 F579 W580 L591	L551-I583 HydrophobicContact CD2-CG1 4.25Å; F579-I583 HydrophobicContact CD1-CD1 3.67Å; F579-I583 HydrophobicContact CE1-CD1 3.56Å; F579-I583 HydrophobicContact CZ-CD1 4.39Å; F579-I583 WeakPolarHBondContact O-CG1 3.45Å; F579-I583 PolarHBondContact O-N 2.75Å; W580-I583 HydrophobicContact CE3-CD1 3.95Å; W580-I583 HydrophobicContact CZ3-CD1 4.07Å; W580-I583 CarbonylContact O-C 3.59Å; W580-I583 WeakPolarHBondContact O-CB 3.37Å; W580-I583 PolarHBondContact O-N 3.26Å; I583-L591 HydrophobicContact CB-CD2 4.38Å; I583-L591 HydrophobicContact CG1-CD2 4.13Å; I583-L591 HydrophobicContact CG2-CB 4.43Å; I583-L591 HydrophobicContact CG2-CD2 4.33Å
584	G	38.8	Very low	45.9	Very low	56 Å²	56	86.7 Å²	86.7	58%	0.577	40%	0.404	S	S	*	.	H	α-helix	trans	-98.9	-2.1	-179.9	0	0	0	0	0	116.8	W580 N581 L582 K586	W580-G584 PolarHBondContact O-N 2.93Å; N581-G584 CarbonylContact O-C 3.39Å; N581-G584 PolarHBondContact O-N 2.96Å; L582-G584 VanDerWaalsContact C-N 3.25Å; G584-K586 PolarHBondContact O-N 3.35Å
585	R	36	Very low	46	Very low	156 Å²	156	79.4 Å²	79.4	59%	0.589	37%	0.373	S	S	*	.			trans	-69.1	133.3	-169.9	-112.9	173.9	-179.7	172	-1	109.8	N581 K587 R588	N581-R585 WeakPolarHBondContact O-CA 3.49Å; N581-R585 WeakPolarHBondContact O-CB 3.32Å; N581-R585 WeakPolarHBondContact O-CG 3.33Å; N581-R585 PolarHBondContact O-N 3.42Å; R585-K587 PolarHBondContact O-N 3.32Å; R585-R588 PolarHBondContact O-N 3.15Å; R585-R588 VanDerWaalsContact O-N 3.13Å
586	K	37.6	Very low	46.3	Very low	176 Å²	176	73.4 Å²	73.4	77%	0.765	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-12	-161.8	-71.1	179.1	173.2	179.9	0	118.1	G584 F737	G584-K586 PolarHBondContact O-N 3.35Å; K586-F737 WeakPolarHBondContact O-CE1 3.49Å
587	K	34.6	Very low	46.6	Very low	124 Å²	124	77.6 Å²	77.6	54%	0.539	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.6	177.3	-87.2	-175.9	172.7	-178.6	0	115.1	R585 H733 F737	R585-K587 PolarHBondContact O-N 3.32Å; K587-H733 PolarHBondContact NZ-CD2 2.86Å; K587-H733 PolarHBondContact NZ-NE2 3.48Å; K587-F737 HydrophobicContact CG-CZ 4.13Å
588	R	32.7	Very low	46.8	Very low	62 Å²	62	75.1 Å²	75.1	23%	0.234	35%	0.348	C	S	.	.			trans	-145.5	69.4	176.1	-80.7	176	172.3	180	-19.1	112.5	I555 R556 R585 F590 L591	I555-R588 VanDerWaalsContact CG2-NH1 3.28Å; R556-R588 VanDerWaalsContact CG-NH2 3.34Å; R556-R588 VanDerWaalsContact NH1-NH2 3.19Å; R585-R588 PolarHBondContact O-N 3.15Å; R585-R588 VanDerWaalsContact O-N 3.13Å; R588-F590 PolarHBondContact O-N 3.24Å; R588-L591 HydrophobicContact CB-CD1 4.44Å; R588-L591 PolarHBondContact O-N 2.93Å
589	R	35.3	Very low	47.2	Very low	156 Å²	156	72.7 Å²	72.7	59%	0.589	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-0.9	170.3	-80.4	179.4	178	165.3	-9.9	114.9	E697	R589-E697 IonicContact CZ-OE1 3.77Å; R589-E697 IonicContact CZ-OE2 2.65Å; R589-E697 IonicContact NH1-OE1 3.72Å; R589-E697 PolarHBondContact NH1-OE1 3.34Å; R589-E697 VanDerWaalsContact NH1-OE1 3.08Å; R589-E697 IonicContact NH1-OE2 2.84Å; R589-E697 IonicContact NH2-OE1 2.91Å; R589-E697 PolarHBondContact NH2-OE1 3.38Å; R589-E697 IonicContact NH2-OE2 3.16Å; R589-E697 PolarHBondContact NH2-OE2 3.48Å
590	F	41.1	Very low	47.5	Very low	137 Å²	137	77.2 Å²	77.2	60%	0.601	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.8	177.1	-91.2	-93	0	0	0	114.1	R588 S592 R593 F594	R588-F590 PolarHBondContact O-N 3.24Å; F590-S592 PolarHBondContact O-N 3.41Å; F590-R593 CarbonylContact O-C 3.41Å; F590-R593 WeakPolarHBondContact O-CA 3.42Å; F590-R593 PolarHBondContact O-N 3.16Å; F590-F594 WeakPolarHBondContact O-CA 3.5Å; F590-F594 WeakPolarHBondContact O-CB 3.49Å; F590-F594 PolarHBondContact O-N 3.43Å
591	L	43.5	Very low	47.9	Very low	8 Å²	8	77.7 Å²	77.7	4%	0.042	37%	0.374	C	S	.	.	H	α-helix	trans	-70.4	-39	-163	-142.3	92.2	0	0	0	116.1	I555 I583 R588 R593 F594 I595	I555-L591 HydrophobicContact CB-CD1 4.43Å; I555-L591 HydrophobicContact CD1-CD1 3.52Å; I555-L591 HydrophobicContact CD1-CD2 3.45Å; I555-L591 VanDerWaalsContact CD1-CD2 3.45Å; I555-L591 HydrophobicContact CD1-CG 4.03Å; I555-L591 HydrophobicContact CG1-CD1 3.98Å; I555-L591 HydrophobicContact CG1-CD2 4.29Å; I555-L591 HydrophobicContact CG2-CD1 3.62Å; I583-L591 HydrophobicContact CB-CD2 4.38Å; I583-L591 HydrophobicContact CG1-CD2 4.13Å; I583-L591 HydrophobicContact CG2-CB 4.43Å; I583-L591 HydrophobicContact CG2-CD2 4.33Å; R588-L591 HydrophobicContact CB-CD1 4.44Å; R588-L591 PolarHBondContact O-N 2.93Å; L591-R593 VanDerWaalsContact C-N 3.28Å; L591-R593 PolarHBondContact O-N 3.27Å; L591-F594 PolarHBondContact O-N 3.48Å; L591-I595 HydrophobicContact CD2-CD1 3.83Å; L591-I595 HydrophobicContact CD2-CG1 4.38Å; L591-I595 HydrophobicContact CG-CD1 4.31Å; L591-I595 HydrophobicContact CG-CG1 4.46Å; L591-I595 WeakPolarHBondContact O-CB 3.41Å; L591-I595 VanDerWaalsContact O-CG1 3.27Å; L591-I595 WeakPolarHBondContact O-CG1 3.46Å; L591-I595 PolarHBondContact O-N 3.13Å
592	S	47.6	Very low	48.8	Very low	27 Å²	27	77.1 Å²	77.1	19%	0.189	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-39.6	173.9	74	0	0	0	0	110.5	F590 C596 N627	F590-S592 PolarHBondContact O-N 3.41Å; S592-C596 WeakPolarHBondContact O-CB 3.48Å; S592-C596 PolarHBondContact O-N 3.1Å; S592-C596 PolarHBondContact O-SG 2.86Å; S592-N627 WeakPolarHBondContact CB-ND2 3.02Å; S592-N627 PolarHBondContact OG-ND2 3.01Å
593	R	45.9	Very low	49.9	Very low	143 Å²	143	84 Å²	84	54%	0.54	40%	0.397	S	S	.	.	H	α-helix	trans	-67.4	-32.7	172.7	-173.4	165.2	-177.7	156.1	0.5	112.4	F590 L591 C596 L597	F590-R593 CarbonylContact O-C 3.41Å; F590-R593 WeakPolarHBondContact O-CA 3.42Å; F590-R593 PolarHBondContact O-N 3.16Å; L591-R593 VanDerWaalsContact C-N 3.28Å; L591-R593 PolarHBondContact O-N 3.27Å; R593-C596 CarbonylContact O-C 3.58Å; R593-C596 PolarHBondContact O-N 3.33Å; R593-L597 HydrophobicContact CG-CD1 3.6Å; R593-L597 HydrophobicContact CG-CG 4.06Å; R593-L597 WeakPolarHBondContact O-CA 3.48Å; R593-L597 WeakPolarHBondContact O-CB 3.34Å; R593-L597 WeakPolarHBondContact O-CD1 3.4Å; R593-L597 WeakPolarHBondContact O-CG 3.29Å; R593-L597 PolarHBondContact O-N 3.22Å
594	F	50.8	Low	50.8	Low	48 Å²	48	83.5 Å²	83.5	21%	0.211	39%	0.394	C	S	.	.	H	α-helix	trans	-78.9	-38.9	-178.6	-172.4	-101	0	0	0	110.6	I555 R558 F590 L591 C596 L597 M598	I555-F594 HydrophobicContact CG2-CD1 4.24Å; I555-F594 HydrophobicContact CG2-CE1 3.97Å; R558-F594 HydrophobicContact CG-CZ 4.31Å; F590-F594 WeakPolarHBondContact O-CA 3.5Å; F590-F594 WeakPolarHBondContact O-CB 3.49Å; F590-F594 PolarHBondContact O-N 3.43Å; L591-F594 PolarHBondContact O-N 3.48Å; F594-C596 VanDerWaalsContact C-N 3.3Å; F594-L597 PolarHBondContact O-N 2.93Å; F594-M598 HydrophobicContact CD1-CG 3.72Å; F594-M598 HydrophobicContact CD2-CG 3.87Å; F594-M598 HydrophobicContact CD2-SD 4.37Å; F594-M598 HydrophobicContact CE1-CG 3.52Å; F594-M598 HydrophobicContact CE1-SD 4.25Å; F594-M598 HydrophobicContact CE2-CG 3.66Å; F594-M598 HydrophobicContact CE2-SD 3.69Å; F594-M598 HydrophobicContact CG-CG 3.9Å; F594-M598 HydrophobicContact CZ-CE 4.13Å; F594-M598 HydrophobicContact CZ-CG 3.49Å; F594-M598 VanDerWaalsContact CZ-CG 3.49Å; F594-M598 HydrophobicContact CZ-SD 3.62Å; F594-M598 WeakPolarHBondContact O-CB 3.47Å; F594-M598 WeakPolarHBondContact O-CG 3.43Å; F594-M598 PolarHBondContact O-N 2.89Å
595	I	55.2	Low	52.3	Low	18 Å²	18	82.2 Å²	82.2	9%	0.092	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-41.8	170.4	-66.1	165.3	0	0	0	109.4	I563 V567 L591 I599	I563-I595 HydrophobicContact CG2-CG1 4.08Å; V567-I595 HydrophobicContact CG2-CD1 4.27Å; L591-I595 HydrophobicContact CD2-CD1 3.83Å; L591-I595 HydrophobicContact CD2-CG1 4.38Å; L591-I595 HydrophobicContact CG-CD1 4.31Å; L591-I595 HydrophobicContact CG-CG1 4.46Å; L591-I595 WeakPolarHBondContact O-CB 3.41Å; L591-I595 VanDerWaalsContact O-CG1 3.27Å; L591-I595 WeakPolarHBondContact O-CG1 3.46Å; L591-I595 PolarHBondContact O-N 3.13Å; I595-I599 PolarHBondContact O-N 3.48Å
596	C	55.7	Low	54.2	Low	20 Å²	20	81.9 Å²	81.9	14%	0.135	37%	0.372	C	S	.	.	H	α-helix	trans	-72.4	-30.7	176.5	-63.4	0	0	0	0	113.9	S592 R593 F594	S592-C596 WeakPolarHBondContact O-CB 3.48Å; S592-C596 PolarHBondContact O-N 3.1Å; S592-C596 PolarHBondContact O-SG 2.86Å; R593-C596 CarbonylContact O-C 3.58Å; R593-C596 PolarHBondContact O-N 3.33Å; F594-C596 VanDerWaalsContact C-N 3.3Å
597	L	55.9	Low	56	Low	107 Å²	107	74.7 Å²	74.7	56%	0.56	34%	0.341	S	S	*	.	H	α-helix	trans	-83.7	-35.1	178.5	-77.2	171.2	0	0	0	112.7	R593 F594 I599	R593-L597 HydrophobicContact CG-CD1 3.6Å; R593-L597 HydrophobicContact CG-CG 4.06Å; R593-L597 WeakPolarHBondContact O-CA 3.48Å; R593-L597 WeakPolarHBondContact O-CB 3.34Å; R593-L597 WeakPolarHBondContact O-CD1 3.4Å; R593-L597 WeakPolarHBondContact O-CG 3.29Å; R593-L597 PolarHBondContact O-N 3.22Å; F594-L597 PolarHBondContact O-N 2.93Å; L597-I599 VanDerWaalsContact C-N 3.31Å
598	M	58	Low	57.7	Low	61 Å²	61	68.8 Å²	68.8	30%	0.3	32%	0.315	S	S	.	.	H	α-helix	trans	-77.9	-20.7	179.5	-67.8	-66.1	-66	0	0	112.1	R558 F594	R558-M598 HydrophobicContact CB-CE 3.76Å; R558-M598 HydrophobicContact CG-CE 4.11Å; F594-M598 HydrophobicContact CD1-CG 3.72Å; F594-M598 HydrophobicContact CD2-CG 3.87Å; F594-M598 HydrophobicContact CD2-SD 4.37Å; F594-M598 HydrophobicContact CE1-CG 3.52Å; F594-M598 HydrophobicContact CE1-SD 4.25Å; F594-M598 HydrophobicContact CE2-CG 3.66Å; F594-M598 HydrophobicContact CE2-SD 3.69Å; F594-M598 HydrophobicContact CG-CG 3.9Å; F594-M598 HydrophobicContact CZ-CE 4.13Å; F594-M598 HydrophobicContact CZ-CG 3.49Å; F594-M598 VanDerWaalsContact CZ-CG 3.49Å; F594-M598 HydrophobicContact CZ-SD 3.62Å; F594-M598 WeakPolarHBondContact O-CB 3.47Å; F594-M598 WeakPolarHBondContact O-CG 3.43Å; F594-M598 PolarHBondContact O-N 2.89Å
599	I	59.8	Low	59.8	Low	22 Å²	22	69.4 Å²	69.4	11%	0.113	32%	0.323	C	S	.	.			trans	-135.8	83.5	179.3	-34.6	177.9	0	0	0	109.1	P560 W564 I595 L597 D601 I604	P560-I599 HydrophobicContact CB-CD1 3.83Å; P560-I599 HydrophobicContact CB-CG1 3.64Å; P560-I599 WeakPolarHBondContact O-CD1 3.31Å; W564-I599 HydrophobicContact CB-CD1 3.79Å; I595-I599 PolarHBondContact O-N 3.48Å; L597-I599 VanDerWaalsContact C-N 3.31Å; I599-D601 HydrophobicContact CG2-CB 3.76Å; I599-D601 PolarHBondContact O-N 3.07Å; I599-I604 HydrophobicContact CB-CD1 3.56Å; I599-I604 HydrophobicContact CD1-CD1 3.93Å; I599-I604 HydrophobicContact CG1-CD1 4.33Å; I599-I604 HydrophobicContact CG2-CD1 3.31Å; I599-I604 HydrophobicContact CG2-CG1 4.47Å
600	P	60.4	Low	61.9	Low	113 Å²	113	69.8 Å²	69.8	73%	0.734	32%	0.324	S	S	*	.			trans	-72	29.5	178.3	31	-36	0	0	0	112.9	V602	P600-V602 PolarHBondContact O-N 3.27Å
601	D	66	Low	63.6	Low	44 Å²	44	63.4 Å²	63.4	24%	0.235	30%	0.297	C	S	.	.			trans	-90.6	115	-167.9	-165	-20	0	0	0	111.3	I599 R603 I604	I599-D601 HydrophobicContact CG2-CB 3.76Å; I599-D601 PolarHBondContact O-N 3.07Å; D601-R603 VanDerWaalsContact CG-NE 3.29Å; D601-R603 PolarHBondContact O-N 3.27Å; D601-R603 VanDerWaalsContact OD1-CB 3.29Å; D601-R603 WeakPolarHBondContact OD1-CB 3.5Å; D601-R603 VanDerWaalsContact OD1-CG 3.22Å; D601-R603 WeakPolarHBondContact OD1-CG 3.25Å; D601-R603 IonicContact OD1-CZ 3.99Å; D601-R603 PolarHBondContact OD1-N 3.3Å; D601-R603 IonicContact OD1-NE 3.06Å; D601-R603 PolarHBondContact OD1-NE 3.03Å; D601-R603 IonicContact OD2-CZ 3.08Å; D601-R603 IonicContact OD2-NE 2.77Å; D601-R603 PolarHBondContact OD2-NE 3.43Å; D601-R603 IonicContact OD2-NH2 2.63Å; D601-R603 PolarHBondContact OD2-NH2 3.14Å; D601-I604 HydrophobicContact CB-CD1 4.37Å; D601-I604 HydrophobicContact CB-CG1 4.32Å; D601-I604 WeakPolarHBondContact O-CB 3.46Å; D601-I604 PolarHBondContact O-N 2.92Å
602	V	71.4	Confident	65.1	Low	81 Å²	81	64 Å²	64	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-53.2	-27	177.6	-176.3	0	0	0	0	112	P600 I604 H605 R606	P600-V602 PolarHBondContact O-N 3.27Å; V602-I604 PolarHBondContact O-N 3.12Å; V602-H605 PolarHBondContact O-N 3.46Å; V602-R606 HydrophobicContact CG1-CG 4.31Å; V602-R606 WeakPolarHBondContact O-CG 3.29Å; V602-R606 PolarHBondContact O-N 3.43Å
603	R	72.2	Confident	66.7	Low	184 Å²	184	66.6 Å²	66.6	69%	0.694	33%	0.326	S	S	*	.	H	α-helix	trans	-59.2	-35.6	176.4	-64.8	-178.9	-69.5	-173.7	-0.4	112.4	D601 F607	D601-R603 VanDerWaalsContact CG-NE 3.29Å; D601-R603 PolarHBondContact O-N 3.27Å; D601-R603 VanDerWaalsContact OD1-CB 3.29Å; D601-R603 WeakPolarHBondContact OD1-CB 3.5Å; D601-R603 VanDerWaalsContact OD1-CG 3.22Å; D601-R603 WeakPolarHBondContact OD1-CG 3.25Å; D601-R603 IonicContact OD1-CZ 3.99Å; D601-R603 PolarHBondContact OD1-N 3.3Å; D601-R603 IonicContact OD1-NE 3.06Å; D601-R603 PolarHBondContact OD1-NE 3.03Å; D601-R603 IonicContact OD2-CZ 3.08Å; D601-R603 IonicContact OD2-NE 2.77Å; D601-R603 PolarHBondContact OD2-NE 3.43Å; D601-R603 IonicContact OD2-NH2 2.63Å; D601-R603 PolarHBondContact OD2-NH2 3.14Å; R603-F607 WeakPolarHBondContact O-CB 3.5Å; R603-F607 PolarHBondContact O-N 3.35Å
604	I	68.4	Low	68.3	Low	10 Å²	10	65.1 Å²	65.1	5%	0.051	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-48.8	-179.8	-69	-176.5	0	0	0	110.6	W564 I599 D601 V602 F607 A608	W564-I604 HydrophobicContact CD2-CD1 3.71Å; W564-I604 HydrophobicContact CD2-CG1 3.61Å; W564-I604 HydrophobicContact CE3-CB 4.2Å; W564-I604 HydrophobicContact CE3-CD1 3.58Å; W564-I604 HydrophobicContact CE3-CG1 3.56Å; W564-I604 HydrophobicContact CE3-CG2 3.87Å; W564-I604 HydrophobicContact CG-CD1 4.14Å; W564-I604 HydrophobicContact CG-CG1 4.36Å; W564-I604 HydrophobicContact CH2-CB 3.79Å; W564-I604 HydrophobicContact CH2-CG1 3.73Å; W564-I604 HydrophobicContact CH2-CG2 3.65Å; W564-I604 HydrophobicContact CZ2-CB 4.23Å; W564-I604 HydrophobicContact CZ2-CG1 3.76Å; W564-I604 HydrophobicContact CZ3-CB 3.8Å; W564-I604 HydrophobicContact CZ3-CD1 4.09Å; W564-I604 HydrophobicContact CZ3-CG1 3.66Å; W564-I604 HydrophobicContact CZ3-CG2 3.27Å; I599-I604 HydrophobicContact CB-CD1 3.56Å; I599-I604 HydrophobicContact CD1-CD1 3.93Å; I599-I604 HydrophobicContact CG1-CD1 4.33Å; I599-I604 HydrophobicContact CG2-CD1 3.31Å; I599-I604 HydrophobicContact CG2-CG1 4.47Å; D601-I604 HydrophobicContact CB-CD1 4.37Å; D601-I604 HydrophobicContact CB-CG1 4.32Å; D601-I604 WeakPolarHBondContact O-CB 3.46Å; D601-I604 PolarHBondContact O-N 2.92Å; V602-I604 PolarHBondContact O-N 3.12Å; I604-F607 WeakPolarHBondContact O-CB 3.16Å; I604-F607 PolarHBondContact O-N 2.96Å; I604-A608 WeakPolarHBondContact O-CB 3.28Å; I604-A608 PolarHBondContact O-N 2.84Å
605	H	69.8	Low	69.4	Low	29 Å²	29	66 Å²	66	13%	0.134	33%	0.331	C	S	.	.	H	α-helix	trans	-65.7	-43.4	179.5	-174.5	56	0	0	0	112.4	V602 F607 A608 L609 H628	V602-H605 PolarHBondContact O-N 3.46Å; H605-F607 PolarHBondContact O-N 3.43Å; H605-A608 PolarHBondContact O-N 3.02Å; H605-L609 WeakPolarHBondContact O-CB 3.29Å; H605-L609 WeakPolarHBondContact O-CG 3.06Å; H605-L609 PolarHBondContact O-N 3.05Å; H605-H628 WeakPolarHBondContact CB-CE1 3.21Å; H605-H628 WeakPolarHBondContact CB-ND1 3.33Å; H605-H628 AromaticContact CD2-CE1 3.88Å; H605-H628 AromaticContact CD2-ND1 3.61Å; H605-H628 AromaticContact CE1-ND1 3.73Å; H605-H628 AromaticContact CG-CE1 3.48Å; H605-H628 VanDerWaalsContact CG-CE1 3.48Å; H605-H628 AromaticContact CG-CG 3.73Å; H605-H628 AromaticContact CG-ND1 3.15Å; H605-H628 AromaticContact ND1-CG 3.54Å; H605-H628 AromaticContact ND1-ND1 3.24Å; H605-H628 PolarHBondContact ND1-ND1 3.4Å; H605-H628 AromaticContact NE2-ND1 3.94Å
606	R	76.3	Confident	70.3	Confident	149 Å²	149	68.9 Å²	68.9	56%	0.562	35%	0.351	S	S	*	.	H	α-helix	trans	-58.4	-39.4	174.2	-71.7	179.4	-177.2	177.1	2.8	111.5	V602 R610	V602-R606 HydrophobicContact CG1-CG 4.31Å; V602-R606 WeakPolarHBondContact O-CG 3.29Å; V602-R606 PolarHBondContact O-N 3.43Å; R606-R610 WeakPolarHBondContact O-CG 3.3Å; R606-R610 PolarHBondContact O-N 3.47Å; R606-R610 VanDerWaalsContact O-N 3.11Å
607	F	75.7	Confident	71.1	Confident	25 Å²	25	73.3 Å²	73.3	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-66.7	-47.7	175.1	-178.9	-90.4	0	0	0	111.7	W564 R568 M571 H572 R603 I604 H605 L609 R610 T611	W564-F607 HydrophobicContact CH2-CB 4.01Å; W564-F607 AromaticContact CH2-CD1 3.68Å; W564-F607 HydrophobicContact CH2-CD1 3.68Å; W564-F607 HydrophobicContact CH2-CG 4.09Å; W564-F607 HydrophobicContact CZ2-CB 4.06Å; W564-F607 HydrophobicContact CZ2-CD1 4.06Å; W564-F607 HydrophobicContact CZ2-CG 4.11Å; R568-F607 HydrophobicContact CB-CE1 4.26Å; R568-F607 HydrophobicContact CG-CD1 3.98Å; R568-F607 HydrophobicContact CG-CE1 3.35Å; R568-F607 HydrophobicContact CG-CE2 3.97Å; R568-F607 HydrophobicContact CG-CZ 3.33Å; M571-F607 HydrophobicContact SD-CD1 4.16Å; M571-F607 HydrophobicContact SD-CE1 4.07Å; H572-F607 AromaticContact NE2-CZ 3.43Å; H572-F607 WeakPolarHBondContact NE2-CZ 3.34Å; R603-F607 WeakPolarHBondContact O-CB 3.5Å; R603-F607 PolarHBondContact O-N 3.35Å; I604-F607 WeakPolarHBondContact O-CB 3.16Å; I604-F607 PolarHBondContact O-N 2.96Å; H605-F607 PolarHBondContact O-N 3.43Å; F607-L609 VanDerWaalsContact C-N 3.32Å; F607-L609 PolarHBondContact O-N 3.46Å; F607-R610 PolarHBondContact O-N 3.3Å; F607-R610 VanDerWaalsContact O-N 3.14Å; F607-T611 HydrophobicContact CD1-CG2 4.02Å; F607-T611 HydrophobicContact CE1-CG2 3.47Å; F607-T611 VanDerWaalsContact CE1-CG2 3.47Å; F607-T611 HydrophobicContact CE2-CG2 4.26Å; F607-T611 HydrophobicContact CZ-CG2 3.62Å; F607-T611 PolarHBondContact O-N 2.83Å; F607-T611 PolarHBondContact O-OG1 3.24Å
608	A	70.6	Confident	71.9	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.008	36%	0.355	C	S	.	.	H	α-helix	trans	-60	-40.2	179.3	0	0	0	0	0	112.4	M571 I604 H605 T611 A612 N625	M571-A608 HydrophobicContact CE-CB 4.37Å; I604-A608 WeakPolarHBondContact O-CB 3.28Å; I604-A608 PolarHBondContact O-N 2.84Å; H605-A608 PolarHBondContact O-N 3.02Å; A608-T611 VanDerWaalsContact CA-OG1 3.26Å; A608-T611 WeakPolarHBondContact CA-OG1 3.46Å; A608-T611 PolarHBondContact O-N 2.98Å; A608-T611 PolarHBondContact O-OG1 3.11Å; A608-A612 WeakPolarHBondContact O-CB 3.19Å; A608-A612 PolarHBondContact O-N 3.02Å; A608-N625 WeakPolarHBondContact CB-OD1 3.48Å
609	L	75.9	Confident	72.6	Confident	75 Å²	75	69.2 Å²	69.2	39%	0.393	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-45.5	172.6	-73	173.4	0	0	0	112.2	H605 F607 T611 A612 A613	H605-L609 WeakPolarHBondContact O-CB 3.29Å; H605-L609 WeakPolarHBondContact O-CG 3.06Å; H605-L609 PolarHBondContact O-N 3.05Å; F607-L609 VanDerWaalsContact C-N 3.32Å; F607-L609 PolarHBondContact O-N 3.46Å; L609-T611 VanDerWaalsContact C-N 3.32Å; L609-T611 PolarHBondContact O-N 3.44Å; L609-A612 PolarHBondContact O-N 3.32Å; L609-A613 PolarHBondContact O-N 3.13Å
610	R	80.8	Confident	73.1	Confident	163 Å²	163	68.8 Å²	68.8	62%	0.615	36%	0.356	S	S	*	.	H	α-helix	trans	-62.8	-39	175.5	-70.9	170.9	-160.9	163	1.1	112	R606 F607 A613 N614	R606-R610 WeakPolarHBondContact O-CG 3.3Å; R606-R610 PolarHBondContact O-N 3.47Å; R606-R610 VanDerWaalsContact O-N 3.11Å; F607-R610 PolarHBondContact O-N 3.3Å; F607-R610 VanDerWaalsContact O-N 3.14Å; R610-A613 PolarHBondContact O-N 2.93Å; R610-N614 PolarHBondContact O-N 3.42Å
611	T	75.5	Confident	73.6	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.018	32%	0.321	C	S	.	.	H	α-helix	trans	-69.9	-35.8	175.8	49.1	0	0	0	0	112.1	F607 A608 L609 A613 N614 Y615	F607-T611 HydrophobicContact CD1-CG2 4.02Å; F607-T611 HydrophobicContact CE1-CG2 3.47Å; F607-T611 VanDerWaalsContact CE1-CG2 3.47Å; F607-T611 HydrophobicContact CE2-CG2 4.26Å; F607-T611 HydrophobicContact CZ-CG2 3.62Å; F607-T611 PolarHBondContact O-N 2.83Å; F607-T611 PolarHBondContact O-OG1 3.24Å; A608-T611 VanDerWaalsContact CA-OG1 3.26Å; A608-T611 WeakPolarHBondContact CA-OG1 3.46Å; A608-T611 PolarHBondContact O-N 2.98Å; A608-T611 PolarHBondContact O-OG1 3.11Å; L609-T611 VanDerWaalsContact C-N 3.32Å; L609-T611 PolarHBondContact O-N 3.44Å; T611-A613 VanDerWaalsContact C-N 3.3Å; T611-A613 PolarHBondContact O-N 3.19Å; T611-N614 PolarHBondContact O-N 2.93Å; T611-N614 VanDerWaalsContact O-N 3.16Å; T611-Y615 VanDerWaalsContact O-CD2 3.32Å; T611-Y615 WeakPolarHBondContact O-CD2 3.47Å; T611-Y615 PolarHBondContact O-N 2.92Å
612	A	75.8	Confident	74	Confident	22 Å²	22	61.6 Å²	61.6	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-34.6	175	0	0	0	0	0	111.8	A608 L609 N614 Y615 P616 N625	A608-A612 WeakPolarHBondContact O-CB 3.19Å; A608-A612 PolarHBondContact O-N 3.02Å; L609-A612 PolarHBondContact O-N 3.32Å; A612-N614 VanDerWaalsContact C-N 3.26Å; A612-N614 PolarHBondContact O-N 3.45Å; A612-Y615 CarbonylContact O-C 3.51Å; A612-Y615 PolarHBondContact O-N 2.91Å; A612-Y615 VanDerWaalsContact O-N 3.17Å; A612-P616 WeakPolarHBondContact O-CA 3.43Å; A612-P616 VanDerWaalsContact O-N 3.09Å; A612-N625 WeakPolarHBondContact CB-ND2 3.3Å
613	A	80.8	Confident	74.2	Confident	80 Å²	80	59.7 Å²	59.7	66%	0.661	30%	0.297	S	S	*	.	H	α-helix	trans	-61	-34.7	172.4	0	0	0	0	0	112.8	L609 R610 T611	L609-A613 PolarHBondContact O-N 3.13Å; R610-A613 PolarHBondContact O-N 2.93Å; T611-A613 VanDerWaalsContact C-N 3.3Å; T611-A613 PolarHBondContact O-N 3.19Å
614	N	79.6	Confident	74.1	Confident	113 Å²	113	52 Å²	52	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-79.7	-25	176	-66.1	-20.3	0	0	0	113.2	R610 T611 A612	R610-N614 PolarHBondContact O-N 3.42Å; T611-N614 PolarHBondContact O-N 2.93Å; T611-N614 VanDerWaalsContact O-N 3.16Å; A612-N614 VanDerWaalsContact C-N 3.26Å; A612-N614 PolarHBondContact O-N 3.45Å
615	Y	73.6	Confident	74.4	Confident	67 Å²	67	51.6 Å²	51.6	26%	0.263	27%	0.267	S	S	.	.			trans	-135.6	69.2	-175.5	-53.6	-69.4	0	0	0	110.7	H572 K574 T611 A612 D617 S618	H572-Y615 PolarHBondContact O-OH 3.09Å; K574-Y615 HydrophobicContact CG-CD1 4.12Å; K574-Y615 HydrophobicContact CG-CE1 4.24Å; T611-Y615 VanDerWaalsContact O-CD2 3.32Å; T611-Y615 WeakPolarHBondContact O-CD2 3.47Å; T611-Y615 PolarHBondContact O-N 2.92Å; A612-Y615 CarbonylContact O-C 3.51Å; A612-Y615 PolarHBondContact O-N 2.91Å; A612-Y615 VanDerWaalsContact O-N 3.17Å; Y615-D617 PolarHBondContact O-N 3.08Å; Y615-S618 PolarHBondContact O-N 3.49Å
616	P	74.1	Confident	74.6	Confident	77 Å²	77	50.2 Å²	50.2	50%	0.5	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-31.1	-173.2	23.4	-33.5	0	0	0	112.4	A612 S618 F643	A612-P616 WeakPolarHBondContact O-CA 3.43Å; A612-P616 VanDerWaalsContact O-N 3.09Å; P616-S618 VanDerWaalsContact C-N 3.27Å; P616-S618 PolarHBondContact O-N 3.3Å; P616-F643 WeakPolarHBondContact O-CZ 3.36Å
617	D	73.3	Confident	74.5	Confident	113 Å²	113	44 Å²	44	60%	0.604	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-1.9	-175.8	-62.6	-45.6	0	0	0	115.3	Y615 I619 R647	Y615-D617 PolarHBondContact O-N 3.08Å; D617-I619 PolarHBondContact O-N 3.09Å; D617-R647 IonicContact OD1-CZ 3.78Å; D617-R647 IonicContact OD1-NE 3.99Å; D617-R647 IonicContact OD1-NH2 2.78Å; D617-R647 PolarHBondContact OD1-NH2 3.37Å
618	S	71.2	Confident	74.2	Confident	26 Å²	26	43.9 Å²	43.9	18%	0.182	24%	0.238	C	C	.	.			trans	-77.5	107.9	-176.3	-174.1	0	0	0	0	112.4	Y615 P616 G620 L621 A622	Y615-S618 PolarHBondContact O-N 3.49Å; P616-S618 VanDerWaalsContact C-N 3.27Å; P616-S618 PolarHBondContact O-N 3.3Å; S618-G620 VanDerWaalsContact C-N 3.31Å; S618-G620 PolarHBondContact O-N 3.14Å; S618-L621 PolarHBondContact O-N 3.48Å; S618-A622 PolarHBondContact O-N 2.84Å; S618-A622 VanDerWaalsContact O-N 3.17Å
619	I	73	Confident	74.2	Confident	57 Å²	57	44 Å²	44	29%	0.292	24%	0.239	S	C	.	.	H	α-helix	trans	-61.5	-38.6	178.3	-56.5	175.1	0	0	0	111.5	D617 L621 A622 F623 I644	D617-I619 PolarHBondContact O-N 3.09Å; I619-L621 PolarHBondContact O-N 3.01Å; I619-A622 PolarHBondContact O-N 3.49Å; I619-F623 HydrophobicContact CG2-CD2 3.89Å; I619-F623 HydrophobicContact CG2-CE2 3.71Å; I619-F623 WeakPolarHBondContact O-CD2 3.38Å; I619-F623 PolarHBondContact O-N 3.48Å; I619-I644 HydrophobicContact CG2-CG2 3.96Å
620	G	69.9	Low	73.7	Confident	13 Å²	13	43.1 Å²	43.1	13%	0.134	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-39.6	179.5	0	0	0	0	0	113.1	S618 F623 I624	S618-G620 VanDerWaalsContact C-N 3.31Å; S618-G620 PolarHBondContact O-N 3.14Å; G620-F623 PolarHBondContact O-N 3.16Å; G620-I624 PolarHBondContact O-N 3.46Å
621	L	71.1	Confident	72.9	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-66.3	-42.6	174.6	-71.6	177.2	0	0	0	111.4	M571 W580 S618 I619 F623 I624 N625	M571-L621 HydrophobicContact CB-CD2 3.93Å; M571-L621 HydrophobicContact CG-CD2 3.65Å; M571-L621 HydrophobicContact SD-CD2 4.28Å; W580-L621 HydrophobicContact CH2-CD2 4.13Å; W580-L621 HydrophobicContact CZ2-CD2 4.43Å; W580-L621 HydrophobicContact CZ2-CG 4.47Å; S618-L621 PolarHBondContact O-N 3.48Å; I619-L621 PolarHBondContact O-N 3.01Å; L621-F623 VanDerWaalsContact C-N 3.31Å; L621-F623 PolarHBondContact O-N 3.27Å; L621-I624 PolarHBondContact O-N 3.35Å; L621-I624 VanDerWaalsContact O-N 3.12Å; L621-N625 WeakPolarHBondContact O-CB 3.43Å; L621-N625 PolarHBondContact O-N 3.47Å
622	A	75.5	Confident	72.5	Confident	4 Å²	4	43.7 Å²	43.7	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-41.4	175.3	0	0	0	0	0	111.6	S618 I619 I624 N625 G626 F643 I644	S618-A622 PolarHBondContact O-N 2.84Å; S618-A622 VanDerWaalsContact O-N 3.17Å; I619-A622 PolarHBondContact O-N 3.49Å; A622-I624 VanDerWaalsContact C-N 3.34Å; A622-I624 PolarHBondContact O-N 3.08Å; A622-N625 PolarHBondContact O-N 3.09Å; A622-G626 PolarHBondContact O-N 2.85Å; A622-F643 HydrophobicContact CB-CD1 4.08Å; A622-F643 HydrophobicContact CB-CE1 4.29Å; A622-I644 HydrophobicContact CB-CD1 3.86Å; A622-I644 HydrophobicContact CB-CG1 3.63Å
623	F	74.3	Confident	72.3	Confident	42 Å²	42	46.1 Å²	46.1	18%	0.184	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-38.4	174.4	-89	-66.5	0	0	0	113.1	I619 G620 L621 N627 I644 I654 L657	I619-F623 HydrophobicContact CG2-CD2 3.89Å; I619-F623 HydrophobicContact CG2-CE2 3.71Å; I619-F623 WeakPolarHBondContact O-CD2 3.38Å; I619-F623 PolarHBondContact O-N 3.48Å; G620-F623 PolarHBondContact O-N 3.16Å; L621-F623 VanDerWaalsContact C-N 3.31Å; L621-F623 PolarHBondContact O-N 3.27Å; F623-N627 VanDerWaalsContact O-CB 3.27Å; F623-N627 WeakPolarHBondContact O-CB 3.49Å; F623-N627 VanDerWaalsContact O-CG 3.26Å; F623-N627 PolarHBondContact O-N 3.4Å; F623-N627 PolarHBondContact O-ND2 3.11Å; F623-I644 HydrophobicContact CB-CD1 4.4Å; F623-I644 HydrophobicContact CD1-CD1 3.79Å; F623-I644 HydrophobicContact CD2-CD1 3.98Å; F623-I644 HydrophobicContact CD2-CG2 4.43Å; F623-I644 HydrophobicContact CE1-CD1 3.99Å; F623-I644 HydrophobicContact CE1-CG2 4.36Å; F623-I644 HydrophobicContact CE2-CD1 4.17Å; F623-I644 HydrophobicContact CE2-CG2 3.69Å; F623-I644 HydrophobicContact CG-CD1 3.78Å; F623-I644 HydrophobicContact CZ-CD1 4.17Å; F623-I644 HydrophobicContact CZ-CG2 3.65Å; F623-I654 HydrophobicContact CE1-CG1 4.34Å; F623-I654 HydrophobicContact CZ-CD1 4.35Å; F623-I654 HydrophobicContact CZ-CG1 3.88Å; F623-L657 HydrophobicContact CD1-CD1 4.5Å; F623-L657 HydrophobicContact CE1-CD1 4.03Å
624	I	71.6	Confident	72	Confident	23 Å²	23	42.4 Å²	42.4	12%	0.118	24%	0.24	C	C	.	.	H	α-helix	trans	-72	-46.4	177.9	-66.8	159.4	0	0	0	111	M571 W580 G620 L621 A622 G626 N627 H628	M571-I624 HydrophobicContact CE-CD1 3.48Å; M571-I624 VanDerWaalsContact CE-CD1 3.48Å; M571-I624 HydrophobicContact CE-CG2 4.19Å; W580-I624 HydrophobicContact CE3-CD1 4.45Å; W580-I624 HydrophobicContact CH2-CD1 3.54Å; W580-I624 HydrophobicContact CZ3-CD1 3.25Å; W580-I624 HydrophobicContact CZ3-CG1 4.23Å; G620-I624 PolarHBondContact O-N 3.46Å; L621-I624 PolarHBondContact O-N 3.35Å; L621-I624 VanDerWaalsContact O-N 3.12Å; A622-I624 VanDerWaalsContact C-N 3.34Å; A622-I624 PolarHBondContact O-N 3.08Å; I624-G626 VanDerWaalsContact C-N 3.29Å; I624-G626 PolarHBondContact O-N 3.47Å; I624-N627 PolarHBondContact O-N 3.3Å; I624-H628 WeakPolarHBondContact O-CB 3.4Å; I624-H628 PolarHBondContact O-N 3.12Å
625	N	74.5	Confident	71.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-43.7	178.8	-74.6	-12.2	0	0	0	110.8	A608 A612 L621 A622 S629 E640	A608-N625 WeakPolarHBondContact CB-OD1 3.48Å; A612-N625 WeakPolarHBondContact CB-ND2 3.3Å; L621-N625 WeakPolarHBondContact O-CB 3.43Å; L621-N625 PolarHBondContact O-N 3.47Å; A622-N625 PolarHBondContact O-N 3.09Å; N625-S629 WeakPolarHBondContact O-CB 3.46Å; N625-S629 PolarHBondContact O-N 3.25Å; N625-S629 PolarHBondContact O-OG 2.86Å; N625-E640 HydrophobicContact CB-CG 4.44Å
626	G	73.1	Confident	72	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-53.5	-68.9	168	0	0	0	0	0	110	A622 I624 H628 S629 L630 L637	A622-G626 PolarHBondContact O-N 2.85Å; I624-G626 VanDerWaalsContact C-N 3.29Å; I624-G626 PolarHBondContact O-N 3.47Å; G626-H628 VanDerWaalsContact C-N 3.26Å; G626-H628 PolarHBondContact O-N 3.21Å; G626-H628 VanDerWaalsContact O-N 3.08Å; G626-S629 WeakPolarHBondContact O-CA 3.13Å; G626-S629 VanDerWaalsContact O-CB 3.29Å; G626-S629 WeakPolarHBondContact O-CB 3.46Å; G626-S629 PolarHBondContact O-N 3.34Å; G626-L630 PolarHBondContact O-N 3.04Å; G626-L637 WeakPolarHBondContact O-CD1 3.44Å
627	N	74.4	Confident	72.3	Confident	18 Å²	18	39.3 Å²	39.3	10%	0.096	23%	0.225	C	C	.	.	H	α-helix	trans	-55.2	-35.1	-174.5	-76.9	-54.9	0	0	0	114.7	S592 F623 I624 S629 L630 Y641	S592-N627 WeakPolarHBondContact CB-ND2 3.02Å; S592-N627 PolarHBondContact OG-ND2 3.01Å; F623-N627 VanDerWaalsContact O-CB 3.27Å; F623-N627 WeakPolarHBondContact O-CB 3.49Å; F623-N627 VanDerWaalsContact O-CG 3.26Å; F623-N627 PolarHBondContact O-N 3.4Å; F623-N627 PolarHBondContact O-ND2 3.11Å; I624-N627 PolarHBondContact O-N 3.3Å; N627-S629 VanDerWaalsContact C-N 3.3Å; N627-S629 PolarHBondContact O-N 3.05Å; N627-L630 VanDerWaalsContact O-CB 3.27Å; N627-L630 WeakPolarHBondContact O-CB 3.41Å; N627-L630 WeakPolarHBondContact O-CD1 3.47Å; N627-L630 PolarHBondContact O-N 3.12Å; N627-Y641 PolarHBondContact OD1-OH 3.48Å
628	H	69.7	Low	72.8	Confident	23 Å²	23	34.7 Å²	34.7	11%	0.106	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-37.7	174.2	-176.6	-78.1	0	0	0	111.6	H605 I624 G626 L630 V631	H605-H628 WeakPolarHBondContact CB-CE1 3.21Å; H605-H628 WeakPolarHBondContact CB-ND1 3.33Å; H605-H628 AromaticContact CD2-CE1 3.88Å; H605-H628 AromaticContact CD2-ND1 3.61Å; H605-H628 AromaticContact CE1-ND1 3.73Å; H605-H628 AromaticContact CG-CE1 3.48Å; H605-H628 VanDerWaalsContact CG-CE1 3.48Å; H605-H628 AromaticContact CG-CG 3.73Å; H605-H628 AromaticContact CG-ND1 3.15Å; H605-H628 AromaticContact ND1-CG 3.54Å; H605-H628 AromaticContact ND1-ND1 3.24Å; H605-H628 PolarHBondContact ND1-ND1 3.4Å; H605-H628 AromaticContact NE2-ND1 3.94Å; I624-H628 WeakPolarHBondContact O-CB 3.4Å; I624-H628 PolarHBondContact O-N 3.12Å; G626-H628 VanDerWaalsContact C-N 3.26Å; G626-H628 PolarHBondContact O-N 3.21Å; G626-H628 VanDerWaalsContact O-N 3.08Å; H628-L630 PolarHBondContact O-N 2.89Å; H628-L630 VanDerWaalsContact O-N 3.16Å; H628-V631 PolarHBondContact O-N 2.77Å
629	S	69.9	Low	73.5	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-68.5	-8.4	178.7	-55.3	0	0	0	0	114	N625 G626 N627 V631 S632 V633	N625-S629 WeakPolarHBondContact O-CB 3.46Å; N625-S629 PolarHBondContact O-N 3.25Å; N625-S629 PolarHBondContact O-OG 2.86Å; G626-S629 WeakPolarHBondContact O-CA 3.13Å; G626-S629 VanDerWaalsContact O-CB 3.29Å; G626-S629 WeakPolarHBondContact O-CB 3.46Å; G626-S629 PolarHBondContact O-N 3.34Å; N627-S629 VanDerWaalsContact C-N 3.3Å; N627-S629 PolarHBondContact O-N 3.05Å; S629-V631 PolarHBondContact O-N 3.09Å; S629-S632 WeakPolarHBondContact CA-OG 3.18Å; S629-S632 PolarHBondContact O-N 3.25Å; S629-S632 PolarHBondContact O-OG 3.06Å; S629-V633 CarbonylContact O-C 3.39Å; S629-V633 PolarHBondContact O-N 3.25Å
630	L	66.8	Low	74	Confident	58 Å²	58	37.6 Å²	37.6	30%	0.304	22%	0.217	S	C	.	.	H	α-helix	trans	-56.9	-31.3	167.8	-78.1	163.2	0	0	0	112.1	G626 N627 H628 L634 L637 T661	G626-L630 PolarHBondContact O-N 3.04Å; N627-L630 VanDerWaalsContact O-CB 3.27Å; N627-L630 WeakPolarHBondContact O-CB 3.41Å; N627-L630 WeakPolarHBondContact O-CD1 3.47Å; N627-L630 PolarHBondContact O-N 3.12Å; H628-L630 PolarHBondContact O-N 2.89Å; H628-L630 VanDerWaalsContact O-N 3.16Å; L630-L634 HydrophobicContact CD2-CD2 4.14Å; L630-L637 HydrophobicContact CD2-CD1 4.47Å; L630-L637 HydrophobicContact CD2-CD2 3.4Å; L630-L637 VanDerWaalsContact CD2-CD2 3.4Å; L630-L637 HydrophobicContact CG-CD1 4.09Å; L630-L637 HydrophobicContact CG-CD2 3.82Å; L630-T661 HydrophobicContact CD2-CG2 4.31Å
631	V	63.8	Low	74.7	Confident	116 Å²	116	37 Å²	37	70%	0.703	21%	0.211	S	C	*	.	H	α-helix	trans	-83.2	-33.3	-179.6	-178.3	0	0	0	0	111.8	H628 S629	H628-V631 PolarHBondContact O-N 2.77Å; S629-V631 PolarHBondContact O-N 3.09Å
632	S	65.7	Low	75.6	Confident	62 Å²	62	40.7 Å²	40.7	43%	0.434	23%	0.227	S	C	.	.	H	α-helix	trans	-89.4	-80.7	-175.2	58	0	0	0	0	112.3	S629	S629-S632 WeakPolarHBondContact CA-OG 3.18Å; S629-S632 PolarHBondContact O-N 3.25Å; S629-S632 PolarHBondContact O-OG 3.06Å
633	V	71.7	Confident	76	Confident	72 Å²	72	43.6 Å²	43.6	44%	0.436	24%	0.239	S	C	.	.			trans	-140.4	109.4	-167.7	-176.6	0	0	0	0	109	S629 L635 V636 L637	S629-V633 CarbonylContact O-C 3.39Å; S629-V633 PolarHBondContact O-N 3.25Å; V633-L635 HydrophobicContact CG1-CB 4.21Å; V633-L635 PolarHBondContact O-N 3.03Å; V633-L635 VanDerWaalsContact O-N 3.12Å; V633-V636 HydrophobicContact CB-CG2 4.17Å; V633-V636 HydrophobicContact CG1-CG2 4.2Å; V633-V636 PolarHBondContact O-N 3.49Å; V633-V636 VanDerWaalsContact O-N 3.11Å; V633-L637 PolarHBondContact O-N 2.94Å
634	L	75.1	Confident	76.4	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-20.5	-176.8	-63.6	178.4	0	0	0	113.9	L630 L637 L638 N664 I665 R668	L630-L634 HydrophobicContact CD2-CD2 4.14Å; L634-L637 HydrophobicContact CD2-CD2 3.72Å; L634-L637 WeakPolarHBondContact O-CB 3.33Å; L634-L638 PolarHBondContact O-N 3.43Å; L634-N664 HydrophobicContact CD1-CB 4.35Å; L634-I665 HydrophobicContact CB-CD1 3.84Å; L634-I665 HydrophobicContact CB-CG1 3.6Å; L634-I665 HydrophobicContact CD1-CG1 3.59Å; L634-I665 HydrophobicContact CG-CG1 4.25Å; L634-R668 VanDerWaalsContact CD1-NE 3.32Å; L634-R668 VanDerWaalsContact CD1-NH2 3.3Å
635	L	76.6	Confident	77.2	Confident	119 Å²	119	41.8 Å²	41.8	62%	0.623	23%	0.231	S	C	*	.	H	α-helix	trans	-70.5	-39.1	175.7	-66	173.3	0	0	0	112	V633 L637 L638 V639	V633-L635 HydrophobicContact CG1-CB 4.21Å; V633-L635 PolarHBondContact O-N 3.03Å; V633-L635 VanDerWaalsContact O-N 3.12Å; L635-L637 VanDerWaalsContact C-N 3.31Å; L635-L637 PolarHBondContact O-N 3.42Å; L635-L638 PolarHBondContact O-N 3.24Å; L635-V639 PolarHBondContact O-N 2.97Å
636	V	77.4	Confident	77.8	Confident	73 Å²	73	52.4 Å²	52.4	44%	0.442	27%	0.271	S	S	.	.	H	α-helix	trans	-66.8	-38.4	177.5	179.4	0	0	0	0	110.5	V633 L638 V639 E640	V633-V636 HydrophobicContact CB-CG2 4.17Å; V633-V636 HydrophobicContact CG1-CG2 4.2Å; V633-V636 PolarHBondContact O-N 3.49Å; V633-V636 VanDerWaalsContact O-N 3.11Å; V636-L638 VanDerWaalsContact C-N 3.33Å; V636-L638 PolarHBondContact O-N 3.25Å; V636-V639 PolarHBondContact O-N 2.87Å; V636-E640 PolarHBondContact O-N 3.35Å
637	L	79.9	Confident	78.4	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-55.8	-44.2	172.9	170.5	75	0	0	0	112.8	G626 L630 V633 L634 L635 V639 E640 Y641 T661	G626-L637 WeakPolarHBondContact O-CD1 3.44Å; L630-L637 HydrophobicContact CD2-CD1 4.47Å; L630-L637 HydrophobicContact CD2-CD2 3.4Å; L630-L637 VanDerWaalsContact CD2-CD2 3.4Å; L630-L637 HydrophobicContact CG-CD1 4.09Å; L630-L637 HydrophobicContact CG-CD2 3.82Å; V633-L637 PolarHBondContact O-N 2.94Å; L634-L637 HydrophobicContact CD2-CD2 3.72Å; L634-L637 WeakPolarHBondContact O-CB 3.33Å; L635-L637 VanDerWaalsContact C-N 3.31Å; L635-L637 PolarHBondContact O-N 3.42Å; L637-V639 VanDerWaalsContact C-N 3.34Å; L637-V639 PolarHBondContact O-N 3.47Å; L637-E640 PolarHBondContact O-N 3.45Å; L637-Y641 HydrophobicContact CD1-CD1 4.43Å; L637-Y641 HydrophobicContact CD1-CD2 4.06Å; L637-Y641 HydrophobicContact CD1-CE1 3.86Å; L637-Y641 HydrophobicContact CD1-CE2 3.41Å; L637-Y641 VanDerWaalsContact CD1-CE2 3.41Å; L637-Y641 WeakPolarHBondContact CD1-OH 3.37Å; L637-Y641 HydrophobicContact CD2-CE2 4.23Å; L637-Y641 HydrophobicContact CG-CD2 4.02Å; L637-Y641 HydrophobicContact CG-CE2 3.7Å; L637-Y641 PolarHBondContact O-N 3.17Å; L637-T661 HydrophobicContact CD2-CG2 3.23Å; L637-T661 HydrophobicContact CG-CG2 4.01Å
638	L	84.3	Confident	78.7	Confident	16 Å²	16	57.8 Å²	57.8	8%	0.084	30%	0.295	C	S	.	.	H	α-helix	trans	-62.2	-41.3	178.5	-78.3	172.5	0	0	0	111.9	L634 L635 V636 E640 Y641 F642 I658 T661 L662 I665	L634-L638 PolarHBondContact O-N 3.43Å; L635-L638 PolarHBondContact O-N 3.24Å; V636-L638 VanDerWaalsContact C-N 3.33Å; V636-L638 PolarHBondContact O-N 3.25Å; L638-E640 VanDerWaalsContact C-N 3.32Å; L638-E640 PolarHBondContact O-N 2.97Å; L638-Y641 PolarHBondContact O-N 3.25Å; L638-F642 HydrophobicContact CB-CD2 4.28Å; L638-F642 HydrophobicContact CB-CE2 4.19Å; L638-F642 HydrophobicContact CD2-CE2 4.2Å; L638-F642 WeakPolarHBondContact O-CB 3.34Å; L638-F642 WeakPolarHBondContact O-CD2 3.48Å; L638-F642 PolarHBondContact O-N 2.92Å; L638-I658 HydrophobicContact CD2-CG2 4.24Å; L638-T661 VanDerWaalsContact CD2-OG1 3.25Å; L638-T661 WeakPolarHBondContact CD2-OG1 3.23Å; L638-L662 HydrophobicContact CD1-CD2 3.81Å; L638-L662 HydrophobicContact CD2-CD2 4.07Å; L638-L662 HydrophobicContact CD2-CG 4.1Å; L638-I665 HydrophobicContact CD1-CD1 3.42Å; L638-I665 VanDerWaalsContact CD1-CD1 3.42Å; L638-I665 HydrophobicContact CG-CD1 4.16Å
639	V	85.3	Confident	79.4	Confident	102 Å²	102	60.3 Å²	60.3	62%	0.618	31%	0.313	S	S	*	.	H	α-helix	trans	-58.2	-46.7	178.5	177.2	0	0	0	0	110.8	L635 V636 L637 F642 F643	L635-V639 PolarHBondContact O-N 2.97Å; V636-V639 PolarHBondContact O-N 2.87Å; L637-V639 VanDerWaalsContact C-N 3.34Å; L637-V639 PolarHBondContact O-N 3.47Å; V639-F642 PolarHBondContact O-N 2.8Å; V639-F643 WeakPolarHBondContact O-CB 3.14Å; V639-F643 PolarHBondContact O-N 3.35Å
640	E	82.8	Confident	80.1	Confident	42 Å²	42	64.8 Å²	64.8	20%	0.196	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-41.9	177	-67.6	-70.8	-176.8	0	0	111.6	N625 V636 L637 L638 F643 I644	N625-E640 HydrophobicContact CB-CG 4.44Å; V636-E640 PolarHBondContact O-N 3.35Å; L637-E640 PolarHBondContact O-N 3.45Å; L638-E640 VanDerWaalsContact C-N 3.32Å; L638-E640 PolarHBondContact O-N 2.97Å; E640-F643 WeakPolarHBondContact O-CB 3.46Å; E640-F643 PolarHBondContact O-N 3.36Å; E640-I644 VanDerWaalsContact O-CG1 3.26Å; E640-I644 WeakPolarHBondContact O-CG1 2.97Å; E640-I644 PolarHBondContact O-N 3.47Å
641	Y	86.2	Confident	80.9	Confident	1 Å²	1	64.6 Å²	64.6	0%	0.004	34%	0.344	C	S	.	.	H	α-helix	trans	-67.6	-37.5	177.7	-70.6	-12.8	0	0	0	113.5	N627 L637 L638 F643 I644 L645 L657 I658 T661	N627-Y641 PolarHBondContact OD1-OH 3.48Å; L637-Y641 HydrophobicContact CD1-CD1 4.43Å; L637-Y641 HydrophobicContact CD1-CD2 4.06Å; L637-Y641 HydrophobicContact CD1-CE1 3.86Å; L637-Y641 HydrophobicContact CD1-CE2 3.41Å; L637-Y641 VanDerWaalsContact CD1-CE2 3.41Å; L637-Y641 WeakPolarHBondContact CD1-OH 3.37Å; L637-Y641 HydrophobicContact CD2-CE2 4.23Å; L637-Y641 HydrophobicContact CG-CD2 4.02Å; L637-Y641 HydrophobicContact CG-CE2 3.7Å; L637-Y641 PolarHBondContact O-N 3.17Å; L638-Y641 PolarHBondContact O-N 3.25Å; Y641-F643 VanDerWaalsContact C-N 3.31Å; Y641-I644 HydrophobicContact CD1-CD1 4.11Å; Y641-I644 PolarHBondContact O-N 2.89Å; Y641-L645 WeakPolarHBondContact O-CB 3.28Å; Y641-L645 PolarHBondContact O-N 3Å; Y641-L657 HydrophobicContact CD2-CB 4.09Å; Y641-L657 HydrophobicContact CE1-CD1 4.33Å; Y641-L657 HydrophobicContact CE2-CB 3.67Å; Y641-L657 HydrophobicContact CE2-CD1 4.49Å; Y641-L657 HydrophobicContact CE2-CG 4.49Å; Y641-I658 HydrophobicContact CD2-CG1 4.26Å; Y641-I658 HydrophobicContact CG-CG1 4.38Å; Y641-T661 HydrophobicContact CD2-CG2 4.29Å; Y641-T661 HydrophobicContact CE2-CG2 3.84Å
642	F	88.4	Confident	81.9	Confident	78 Å²	78	60.5 Å²	60.5	34%	0.342	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-36	172.3	-78.2	-59.7	0	0	0	112.1	L638 V639 I644 L645 R646 I658 F684	L638-F642 HydrophobicContact CB-CD2 4.28Å; L638-F642 HydrophobicContact CB-CE2 4.19Å; L638-F642 HydrophobicContact CD2-CE2 4.2Å; L638-F642 WeakPolarHBondContact O-CB 3.34Å; L638-F642 WeakPolarHBondContact O-CD2 3.48Å; L638-F642 PolarHBondContact O-N 2.92Å; V639-F642 PolarHBondContact O-N 2.8Å; F642-I644 VanDerWaalsContact C-N 3.33Å; F642-I644 PolarHBondContact O-N 3.07Å; F642-L645 HydrophobicContact CD1-CD2 4.14Å; F642-L645 HydrophobicContact CE1-CD2 4.42Å; F642-L645 PolarHBondContact O-N 3.31Å; F642-R646 WeakPolarHBondContact O-CG 3.45Å; F642-R646 PolarHBondContact O-N 2.93Å; F642-I658 HydrophobicContact CD1-CD1 4.24Å; F642-I658 HydrophobicContact CE1-CD1 4.25Å; F642-I658 HydrophobicContact CE1-CG2 4.39Å; F642-I658 HydrophobicContact CZ-CG2 4.16Å; F642-F684 HydrophobicContact CE1-CE1 4.27Å; F642-F684 HydrophobicContact CE1-CE2 4.37Å; F642-F684 AromaticContact CE1-CZ 3.69Å; F642-F684 HydrophobicContact CE1-CZ 3.69Å; F642-F684 HydrophobicContact CZ-CE2 4.32Å; F642-F684 HydrophobicContact CZ-CZ 4.08Å
643	F	85.6	Confident	82.9	Confident	65 Å²	65	61.1 Å²	61.1	29%	0.285	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-41.2	172.6	177.6	-93.7	0	0	0	112.2	P616 A622 V639 E640 Y641 R647	P616-F643 WeakPolarHBondContact O-CZ 3.36Å; A622-F643 HydrophobicContact CB-CD1 4.08Å; A622-F643 HydrophobicContact CB-CE1 4.29Å; V639-F643 WeakPolarHBondContact O-CB 3.14Å; V639-F643 PolarHBondContact O-N 3.35Å; E640-F643 WeakPolarHBondContact O-CB 3.46Å; E640-F643 PolarHBondContact O-N 3.36Å; Y641-F643 VanDerWaalsContact C-N 3.31Å; F643-R647 VanDerWaalsContact CD2-NH1 3.32Å
644	I	82.2	Confident	83.6	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-69.4	-43.8	174.9	-59.3	167.1	0	0	0	110.5	I619 A622 F623 E640 Y641 F642 R646 R647 C648 I654	I619-I644 HydrophobicContact CG2-CG2 3.96Å; A622-I644 HydrophobicContact CB-CD1 3.86Å; A622-I644 HydrophobicContact CB-CG1 3.63Å; F623-I644 HydrophobicContact CB-CD1 4.4Å; F623-I644 HydrophobicContact CD1-CD1 3.79Å; F623-I644 HydrophobicContact CD2-CD1 3.98Å; F623-I644 HydrophobicContact CD2-CG2 4.43Å; F623-I644 HydrophobicContact CE1-CD1 3.99Å; F623-I644 HydrophobicContact CE1-CG2 4.36Å; F623-I644 HydrophobicContact CE2-CD1 4.17Å; F623-I644 HydrophobicContact CE2-CG2 3.69Å; F623-I644 HydrophobicContact CG-CD1 3.78Å; F623-I644 HydrophobicContact CZ-CD1 4.17Å; F623-I644 HydrophobicContact CZ-CG2 3.65Å; E640-I644 VanDerWaalsContact O-CG1 3.26Å; E640-I644 WeakPolarHBondContact O-CG1 2.97Å; E640-I644 PolarHBondContact O-N 3.47Å; Y641-I644 HydrophobicContact CD1-CD1 4.11Å; Y641-I644 PolarHBondContact O-N 2.89Å; F642-I644 VanDerWaalsContact C-N 3.33Å; F642-I644 PolarHBondContact O-N 3.07Å; I644-R646 VanDerWaalsContact C-N 3.31Å; I644-R646 PolarHBondContact O-N 2.9Å; I644-R647 PolarHBondContact O-N 3.38Å; I644-C648 PolarHBondContact O-N 2.94Å; I644-I654 HydrophobicContact CB-CD1 4.25Å; I644-I654 HydrophobicContact CG2-CD1 3.25Å; I644-I654 HydrophobicContact CG2-CG1 3.86Å
645	L	87.7	Confident	84.4	Confident	26 Å²	26	58.8 Å²	58.8	14%	0.136	30%	0.301	C	S	.	.	H	α-helix	trans	-57.1	-43.3	179.7	-177.1	66.2	0	0	0	111.9	Y641 F642 R647 C648 I654 Y655 I658 F684	Y641-L645 WeakPolarHBondContact O-CB 3.28Å; Y641-L645 PolarHBondContact O-N 3Å; F642-L645 HydrophobicContact CD1-CD2 4.14Å; F642-L645 HydrophobicContact CE1-CD2 4.42Å; F642-L645 PolarHBondContact O-N 3.31Å; L645-R647 PolarHBondContact O-N 2.97Å; L645-C648 CarbonylContact O-C 3.58Å; L645-C648 PolarHBondContact O-N 3.29Å; L645-I654 HydrophobicContact CB-CG2 3.86Å; L645-I654 HydrophobicContact CD1-CG2 3.98Å; L645-Y655 HydrophobicContact CD1-CD1 4.3Å; L645-Y655 HydrophobicContact CD1-CD2 4.28Å; L645-Y655 HydrophobicContact CD1-CE1 3.76Å; L645-Y655 HydrophobicContact CD1-CE2 3.76Å; L645-Y655 VanDerWaalsContact CD1-CZ 3.48Å; L645-I658 HydrophobicContact CB-CD1 4.15Å; L645-I658 HydrophobicContact CD2-CD1 3.88Å; L645-I658 HydrophobicContact CG-CD1 4.45Å; L645-F684 HydrophobicContact CD2-CE1 4.06Å
646	R	88	Confident	85.1	Confident	223 Å²	223	54 Å²	54	84%	0.842	28%	0.276	S	S	*	.	H	α-helix	trans	-60.2	-30.6	177.2	-76.1	-179.5	179.3	-172.3	0.3	113.2	F642 I644	F642-R646 WeakPolarHBondContact O-CG 3.45Å; F642-R646 PolarHBondContact O-N 2.93Å; I644-R646 VanDerWaalsContact C-N 3.31Å; I644-R646 PolarHBondContact O-N 2.9Å
647	R	84	Confident	85.6	Confident	97 Å²	97	52.4 Å²	52.4	37%	0.366	27%	0.265	S	S	.	.	H	α-helix	trans	-90.2	-29.8	178.2	-74.7	-175.1	173.6	76.3	-9	113.3	D617 F643 I644 L645	D617-R647 IonicContact OD1-CZ 3.78Å; D617-R647 IonicContact OD1-NE 3.99Å; D617-R647 IonicContact OD1-NH2 2.78Å; D617-R647 PolarHBondContact OD1-NH2 3.37Å; F643-R647 VanDerWaalsContact CD2-NH1 3.32Å; I644-R647 PolarHBondContact O-N 3.38Å; L645-R647 PolarHBondContact O-N 2.97Å
648	C	80.8	Confident	86.1	Confident	34 Å²	34	52.4 Å²	52.4	23%	0.23	27%	0.265	C	S	.	.			trans	-131.5	68.6	-175.9	-68.8	0	0	0	0	111.5	I644 L645 S650 N651 I654	I644-C648 PolarHBondContact O-N 2.94Å; L645-C648 CarbonylContact O-C 3.58Å; L645-C648 PolarHBondContact O-N 3.29Å; C648-S650 PolarHBondContact O-N 3.47Å; C648-N651 HydrophobicContact CB-CB 4.27Å; C648-N651 PolarHBondContact O-N 2.98Å; C648-I654 HydrophobicContact CB-CD1 3.9Å; C648-I654 WeakPolarHBondContact O-CD1 3.47Å
649	P	85.7	Confident	86.4	Confident	77 Å²	77	51.7 Å²	51.7	50%	0.5	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.5	-177.4	29.1	-36.2	0	0	0	113.3	Y655	P649-Y655 WeakPolarHBondContact O-CE2 3.32Å; P649-Y655 PolarHBondContact O-OH 3.03Å
650	S	83.9	Confident	86.6	Confident	95 Å²	95	50.1 Å²	50.1	66%	0.664	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-11	179	56.8	0	0	0	0	113.9	C648 P652	C648-S650 PolarHBondContact O-N 3.47Å; S650-P652 WeakPolarHBondContact O-CD 3.34Å
651	N	83.4	Confident	86.8	Confident	55 Å²	55	48.3 Å²	48.3	29%	0.294	24%	0.243	S	C	.	.			trans	-84.4	110.3	-173.8	-174.9	-10.2	0	0	0	111	C648 L653 I654 Y655	C648-N651 HydrophobicContact CB-CB 4.27Å; C648-N651 PolarHBondContact O-N 2.98Å; N651-L653 PolarHBondContact O-N 3.49Å; N651-L653 WeakPolarHBondContact OD1-CB 3.43Å; N651-L653 PolarHBondContact OD1-N 3.36Å; N651-L653 VanDerWaalsContact OD1-N 3.13Å; N651-I654 HydrophobicContact CB-CD1 3.81Å; N651-I654 HydrophobicContact CB-CG1 4.2Å; N651-I654 PolarHBondContact O-N 2.92Å; N651-Y655 WeakPolarHBondContact O-CD2 3.37Å
652	P	86.2	Confident	87	Confident	30 Å²	30	48.6 Å²	48.6	20%	0.195	25%	0.245	C	C	.	.	H	α-helix	trans	-64.2	-28.3	-175.1	24.2	-33.2	0	0	0	113.2	S650 I654 Y655 L656 H688 I691 R692	S650-P652 WeakPolarHBondContact O-CD 3.34Å; P652-I654 PolarHBondContact O-N 2.86Å; P652-Y655 PolarHBondContact O-N 3.48Å; P652-L656 PolarHBondContact O-N 2.89Å; P652-H688 PolarHBondContact O-CE1 3.49Å; P652-H688 PolarHBondContact O-ND1 3.17Å; P652-I691 HydrophobicContact CB-CB 4.44Å; P652-I691 HydrophobicContact CB-CG2 3.98Å; P652-I691 HydrophobicContact CG-CG2 4.39Å; P652-R692 HydrophobicContact CB-CG 3.51Å; P652-R692 VanDerWaalsContact CG-CD 3.46Å; P652-R692 HydrophobicContact CG-CG 4.04Å
653	L	86.1	Confident	87.1	Confident	74 Å²	74	45 Å²	45	39%	0.387	23%	0.229	S	C	.	.	H	α-helix	trans	-62.1	-33.5	-178.5	-178.1	64.5	0	0	0	112.1	N651 L656 L657	N651-L653 PolarHBondContact O-N 3.49Å; N651-L653 WeakPolarHBondContact OD1-CB 3.43Å; N651-L653 PolarHBondContact OD1-N 3.36Å; N651-L653 VanDerWaalsContact OD1-N 3.13Å; L653-L656 HydrophobicContact CD1-CD2 4.45Å; L653-L656 PolarHBondContact O-N 3.49Å; L653-L657 HydrophobicContact CD1-CG 4.43Å; L653-L657 HydrophobicContact CG-CD1 4.07Å; L653-L657 HydrophobicContact CG-CG 4.36Å; L653-L657 VanDerWaalsContact O-CG 3.29Å; L653-L657 WeakPolarHBondContact O-CG 3.4Å; L653-L657 PolarHBondContact O-N 3.29Å
654	I	86.2	Confident	87.1	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-43.8	-178.4	-59.3	168.6	0	0	0	110.2	F623 I644 L645 C648 N651 P652 L656 L657 I658	F623-I654 HydrophobicContact CE1-CG1 4.34Å; F623-I654 HydrophobicContact CZ-CD1 4.35Å; F623-I654 HydrophobicContact CZ-CG1 3.88Å; I644-I654 HydrophobicContact CB-CD1 4.25Å; I644-I654 HydrophobicContact CG2-CD1 3.25Å; I644-I654 HydrophobicContact CG2-CG1 3.86Å; L645-I654 HydrophobicContact CB-CG2 3.86Å; L645-I654 HydrophobicContact CD1-CG2 3.98Å; C648-I654 HydrophobicContact CB-CD1 3.9Å; C648-I654 WeakPolarHBondContact O-CD1 3.47Å; N651-I654 HydrophobicContact CB-CD1 3.81Å; N651-I654 HydrophobicContact CB-CG1 4.2Å; N651-I654 PolarHBondContact O-N 2.92Å; P652-I654 PolarHBondContact O-N 2.86Å; I654-L656 VanDerWaalsContact C-N 3.33Å; I654-L656 PolarHBondContact O-N 3.11Å; I654-L657 PolarHBondContact O-N 2.86Å; I654-I658 HydrophobicContact CG2-CD1 3.74Å; I654-I658 HydrophobicContact CG2-CG1 4.29Å; I654-I658 WeakPolarHBondContact O-CG1 3.36Å; I654-I658 PolarHBondContact O-N 3.42Å
655	Y	91.7	Very high	87.3	Confident	26 Å²	26	45.6 Å²	45.6	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-60	-43.5	176.3	-66.3	-88.9	0	0	0	111.8	L645 P649 N651 P652 I658 G659 F684 K687 I691	L645-Y655 HydrophobicContact CD1-CD1 4.3Å; L645-Y655 HydrophobicContact CD1-CD2 4.28Å; L645-Y655 HydrophobicContact CD1-CE1 3.76Å; L645-Y655 HydrophobicContact CD1-CE2 3.76Å; L645-Y655 VanDerWaalsContact CD1-CZ 3.48Å; P649-Y655 WeakPolarHBondContact O-CE2 3.32Å; P649-Y655 PolarHBondContact O-OH 3.03Å; N651-Y655 WeakPolarHBondContact O-CD2 3.37Å; P652-Y655 PolarHBondContact O-N 3.48Å; Y655-I658 PolarHBondContact O-N 2.82Å; Y655-G659 PolarHBondContact O-N 3.28Å; Y655-F684 AromaticContact CD1-CD1 3.94Å; Y655-F684 HydrophobicContact CD1-CD1 3.94Å; Y655-K687 HydrophobicContact CD1-CB 3.86Å; Y655-K687 HydrophobicContact CD1-CG 3.71Å; Y655-K687 HydrophobicContact CE1-CB 4.17Å; Y655-K687 HydrophobicContact CE1-CG 3.51Å; Y655-I691 HydrophobicContact CD2-CD1 3.71Å; Y655-I691 HydrophobicContact CE1-CD1 4.48Å; Y655-I691 HydrophobicContact CE2-CD1 3.32Å; Y655-I691 HydrophobicContact CG-CD1 4.41Å
656	L	90.8	Very high	87.3	Confident	17 Å²	17	44.5 Å²	44.5	9%	0.089	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-47.6	174.6	178.5	65.5	0	0	0	111.5	P652 L653 I654 G659 V660 L685 N701	P652-L656 PolarHBondContact O-N 2.89Å; L653-L656 HydrophobicContact CD1-CD2 4.45Å; L653-L656 PolarHBondContact O-N 3.49Å; I654-L656 VanDerWaalsContact C-N 3.33Å; I654-L656 PolarHBondContact O-N 3.11Å; L656-G659 PolarHBondContact O-N 3.49Å; L656-V660 HydrophobicContact CD1-CG2 4.04Å; L656-V660 HydrophobicContact CG-CG2 4.42Å; L656-V660 WeakPolarHBondContact O-CB 3.44Å; L656-V660 VanDerWaalsContact O-CG2 3.24Å; L656-V660 WeakPolarHBondContact O-CG2 3.44Å; L656-V660 PolarHBondContact O-N 3.49Å; L656-L685 HydrophobicContact CD1-CD2 3.71Å; L656-N701 HydrophobicContact CD1-CB 4.04Å
657	L	87.9	Confident	87.1	Confident	41 Å²	41	36.4 Å²	36.4	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-45.8	-179.8	-72.2	173.5	0	0	0	111.7	F623 Y641 L653 I654 T661	F623-L657 HydrophobicContact CD1-CD1 4.5Å; F623-L657 HydrophobicContact CE1-CD1 4.03Å; Y641-L657 HydrophobicContact CD2-CB 4.09Å; Y641-L657 HydrophobicContact CE1-CD1 4.33Å; Y641-L657 HydrophobicContact CE2-CB 3.67Å; Y641-L657 HydrophobicContact CE2-CD1 4.49Å; Y641-L657 HydrophobicContact CE2-CG 4.49Å; L653-L657 HydrophobicContact CD1-CG 4.43Å; L653-L657 HydrophobicContact CG-CD1 4.07Å; L653-L657 HydrophobicContact CG-CG 4.36Å; L653-L657 VanDerWaalsContact O-CG 3.29Å; L653-L657 WeakPolarHBondContact O-CG 3.4Å; L653-L657 PolarHBondContact O-N 3.29Å; I654-L657 PolarHBondContact O-N 2.86Å; L657-T661 WeakPolarHBondContact O-CB 3.41Å; L657-T661 WeakPolarHBondContact O-CG2 2.97Å; L657-T661 PolarHBondContact O-N 3.36Å; L657-T661 PolarHBondContact O-OG1 3.19Å; L657-T661 VanDerWaalsContact O-OG1 3.09Å
658	I	90.1	Very high	87.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-50	176.3	-66.8	171.2	0	0	0	110.2	L638 Y641 F642 L645 I654 Y655 V660 T661 L662 F684	L638-I658 HydrophobicContact CD2-CG2 4.24Å; Y641-I658 HydrophobicContact CD2-CG1 4.26Å; Y641-I658 HydrophobicContact CG-CG1 4.38Å; F642-I658 HydrophobicContact CD1-CD1 4.24Å; F642-I658 HydrophobicContact CE1-CD1 4.25Å; F642-I658 HydrophobicContact CE1-CG2 4.39Å; F642-I658 HydrophobicContact CZ-CG2 4.16Å; L645-I658 HydrophobicContact CB-CD1 4.15Å; L645-I658 HydrophobicContact CD2-CD1 3.88Å; L645-I658 HydrophobicContact CG-CD1 4.45Å; I654-I658 HydrophobicContact CG2-CD1 3.74Å; I654-I658 HydrophobicContact CG2-CG1 4.29Å; I654-I658 WeakPolarHBondContact O-CG1 3.36Å; I654-I658 PolarHBondContact O-N 3.42Å; Y655-I658 PolarHBondContact O-N 2.82Å; I658-V660 PolarHBondContact O-N 3.24Å; I658-T661 WeakPolarHBondContact CA-OG1 3.5Å; I658-T661 PolarHBondContact O-N 2.98Å; I658-T661 VanDerWaalsContact O-N 3.15Å; I658-T661 PolarHBondContact O-OG1 2.77Å; I658-L662 HydrophobicContact CG2-CD1 3.89Å; I658-L662 HydrophobicContact CG2-CG 4.45Å; I658-L662 WeakPolarHBondContact O-CG 3.37Å; I658-L662 PolarHBondContact O-N 3.38Å; I658-F684 HydrophobicContact CB-CD1 4.42Å; I658-F684 HydrophobicContact CB-CG 4.38Å; I658-F684 HydrophobicContact CG2-CB 4.42Å; I658-F684 HydrophobicContact CG2-CD1 3.96Å; I658-F684 HydrophobicContact CG2-CD2 3.67Å; I658-F684 HydrophobicContact CG2-CE1 4.16Å; I658-F684 HydrophobicContact CG2-CE2 3.88Å; I658-F684 HydrophobicContact CG2-CG 3.75Å; I658-F684 HydrophobicContact CG2-CZ 4.14Å
659	G	91.1	Very high	86.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-48.5	179.5	0	0	0	0	0	112.8	Y655 L656 T661 L662 I663 G681	Y655-G659 PolarHBondContact O-N 3.28Å; L656-G659 PolarHBondContact O-N 3.49Å; G659-T661 VanDerWaalsContact C-N 3.33Å; G659-T661 PolarHBondContact O-N 3.11Å; G659-L662 PolarHBondContact O-N 3.49Å; G659-I663 VanDerWaalsContact O-CG1 3.31Å; G659-I663 WeakPolarHBondContact O-CG1 3.4Å; G659-I663 PolarHBondContact O-N 3.21Å; G659-G681 WeakPolarHBondContact CA-O 3.29Å
660	V	89.3	Confident	86.1	Confident	69 Å²	69	47.1 Å²	47.1	42%	0.418	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-39.1	177	172	0	0	0	0	111.6	L656 I658 I663 N664	L656-V660 HydrophobicContact CD1-CG2 4.04Å; L656-V660 HydrophobicContact CG-CG2 4.42Å; L656-V660 WeakPolarHBondContact O-CB 3.44Å; L656-V660 VanDerWaalsContact O-CG2 3.24Å; L656-V660 WeakPolarHBondContact O-CG2 3.44Å; L656-V660 PolarHBondContact O-N 3.49Å; I658-V660 PolarHBondContact O-N 3.24Å; V660-I663 PolarHBondContact O-N 3.3Å; V660-N664 VanDerWaalsContact O-CB 3.3Å; V660-N664 WeakPolarHBondContact O-CB 3.32Å; V660-N664 PolarHBondContact O-N 3.06Å
661	T	87.9	Confident	85.7	Confident	4 Å²	4	45.2 Å²	45.2	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-40.3	178.1	54.5	0	0	0	0	112.9	L630 L637 L638 Y641 L657 I658 G659 N664 I665	L630-T661 HydrophobicContact CD2-CG2 4.31Å; L637-T661 HydrophobicContact CD2-CG2 3.23Å; L637-T661 HydrophobicContact CG-CG2 4.01Å; L638-T661 VanDerWaalsContact CD2-OG1 3.25Å; L638-T661 WeakPolarHBondContact CD2-OG1 3.23Å; Y641-T661 HydrophobicContact CD2-CG2 4.29Å; Y641-T661 HydrophobicContact CE2-CG2 3.84Å; L657-T661 WeakPolarHBondContact O-CB 3.41Å; L657-T661 WeakPolarHBondContact O-CG2 2.97Å; L657-T661 PolarHBondContact O-N 3.36Å; L657-T661 PolarHBondContact O-OG1 3.19Å; L657-T661 VanDerWaalsContact O-OG1 3.09Å; I658-T661 WeakPolarHBondContact CA-OG1 3.5Å; I658-T661 PolarHBondContact O-N 2.98Å; I658-T661 VanDerWaalsContact O-N 3.15Å; I658-T661 PolarHBondContact O-OG1 2.77Å; G659-T661 VanDerWaalsContact C-N 3.33Å; G659-T661 PolarHBondContact O-N 3.11Å; T661-N664 PolarHBondContact O-N 3.46Å; T661-I665 VanDerWaalsContact O-CG1 3.23Å; T661-I665 WeakPolarHBondContact O-CG1 3.36Å; T661-I665 PolarHBondContact O-N 3.26Å
662	L	90.3	Very high	84.9	Confident	8 Å²	8	51.3 Å²	51.3	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-43.8	175.4	-70.4	169.3	0	0	0	111.4	L638 I658 G659 N664 I665 A666 C677 Q680 F684	L638-L662 HydrophobicContact CD1-CD2 3.81Å; L638-L662 HydrophobicContact CD2-CD2 4.07Å; L638-L662 HydrophobicContact CD2-CG 4.1Å; I658-L662 HydrophobicContact CG2-CD1 3.89Å; I658-L662 HydrophobicContact CG2-CG 4.45Å; I658-L662 WeakPolarHBondContact O-CG 3.37Å; I658-L662 PolarHBondContact O-N 3.38Å; G659-L662 PolarHBondContact O-N 3.49Å; L662-N664 VanDerWaalsContact C-N 3.32Å; L662-N664 PolarHBondContact O-N 3.29Å; L662-I665 WeakPolarHBondContact O-CB 3.48Å; L662-I665 PolarHBondContact O-N 3.32Å; L662-A666 WeakPolarHBondContact O-CB 3.3Å; L662-A666 PolarHBondContact O-N 2.89Å; L662-C677 PolarHBondContact O-SG 3.46Å; L662-Q680 HydrophobicContact CD1-CB 4.11Å; L662-F684 HydrophobicContact CD1-CD2 3.61Å; L662-F684 HydrophobicContact CD1-CE2 3.91Å
663	I	89.5	Confident	84.7	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-41.2	175.5	-68.7	166.4	0	0	0	111.1	G659 V660 A666 S667 F682 L685 A705 Q708 M709	G659-I663 VanDerWaalsContact O-CG1 3.31Å; G659-I663 WeakPolarHBondContact O-CG1 3.4Å; G659-I663 PolarHBondContact O-N 3.21Å; V660-I663 PolarHBondContact O-N 3.3Å; I663-A666 PolarHBondContact O-N 2.66Å; I663-S667 WeakPolarHBondContact O-CB 3.33Å; I663-S667 PolarHBondContact O-N 3.32Å; I663-S667 PolarHBondContact O-OG 3.4Å; I663-F682 HydrophobicContact CD1-CE1 4.49Å; I663-L685 HydrophobicContact CD1-CD1 3.46Å; I663-L685 VanDerWaalsContact CD1-CD1 3.46Å; I663-L685 HydrophobicContact CD1-CG 4.37Å; I663-A705 HydrophobicContact CD1-CB 3.66Å; I663-Q708 HydrophobicContact CG2-CB 4.46Å; I663-Q708 HydrophobicContact CG2-CG 4.16Å; I663-M709 HydrophobicContact CG2-CG 4.2Å; I663-M709 HydrophobicContact CG2-SD 3.89Å
664	N	87.3	Confident	84.6	Confident	60 Å²	60	57 Å²	57	32%	0.321	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-38.2	175.8	-169.4	25.9	0	0	0	112.3	L634 V660 T661 L662 S667	L634-N664 HydrophobicContact CD1-CB 4.35Å; V660-N664 VanDerWaalsContact O-CB 3.3Å; V660-N664 WeakPolarHBondContact O-CB 3.32Å; V660-N664 PolarHBondContact O-N 3.06Å; T661-N664 PolarHBondContact O-N 3.46Å; L662-N664 VanDerWaalsContact C-N 3.32Å; L662-N664 PolarHBondContact O-N 3.29Å; N664-S667 PolarHBondContact O-N 3.13Å
665	I	86.4	Confident	84.6	Confident	18 Å²	18	61.6 Å²	61.6	9%	0.092	32%	0.322	C	S	.	.	H	α-helix	trans	-59.7	-54.4	171.2	-70.9	163.4	0	0	0	108.7	L634 L638 T661 L662 S667 R668 I671	L634-I665 HydrophobicContact CB-CD1 3.84Å; L634-I665 HydrophobicContact CB-CG1 3.6Å; L634-I665 HydrophobicContact CD1-CG1 3.59Å; L634-I665 HydrophobicContact CG-CG1 4.25Å; L638-I665 HydrophobicContact CD1-CD1 3.42Å; L638-I665 VanDerWaalsContact CD1-CD1 3.42Å; L638-I665 HydrophobicContact CG-CD1 4.16Å; T661-I665 VanDerWaalsContact O-CG1 3.23Å; T661-I665 WeakPolarHBondContact O-CG1 3.36Å; T661-I665 PolarHBondContact O-N 3.26Å; L662-I665 WeakPolarHBondContact O-CB 3.48Å; L662-I665 PolarHBondContact O-N 3.32Å; I665-S667 PolarHBondContact O-N 3.34Å; I665-S667 VanDerWaalsContact O-N 3.09Å; I665-R668 WeakPolarHBondContact O-CB 3.26Å; I665-R668 PolarHBondContact O-N 3.4Å; I665-I671 HydrophobicContact CG2-CD1 3.54Å; I665-I671 WeakPolarHBondContact O-CD1 3.36Å
666	A	87	Confident	84.5	Confident	4 Å²	4	64.3 Å²	64.3	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-56.2	-29.8	179.7	0	0	0	0	0	113.9	L662 I663 R668 C677 C678	L662-A666 WeakPolarHBondContact O-CB 3.3Å; L662-A666 PolarHBondContact O-N 2.89Å; I663-A666 PolarHBondContact O-N 2.66Å; A666-R668 VanDerWaalsContact C-N 3.3Å; A666-R668 PolarHBondContact O-N 3.29Å; A666-C677 HydrophobicContact CB-CB 4.24Å; A666-C678 HydrophobicContact CB-CB 4.35Å
667	S	84.4	Confident	84.3	Confident	53 Å²	53	64.3 Å²	64.3	37%	0.371	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-16.2	176.7	-56.6	0	0	0	0	113.9	I663 N664 I665 Q708	I663-S667 WeakPolarHBondContact O-CB 3.33Å; I663-S667 PolarHBondContact O-N 3.32Å; I663-S667 PolarHBondContact O-OG 3.4Å; N664-S667 PolarHBondContact O-N 3.13Å; I665-S667 PolarHBondContact O-N 3.34Å; I665-S667 VanDerWaalsContact O-N 3.09Å; S667-Q708 PolarHBondContact OG-NE2 2.68Å
668	R	82.7	Confident	84.5	Confident	109 Å²	109	63.2 Å²	63.2	41%	0.411	34%	0.335	S	S	.	.	S	Bend	trans	-75.1	149.3	179.9	-68.9	179	174.4	-164.3	-5.6	111.9	L634 I665 A666 I671 K674	L634-R668 VanDerWaalsContact CD1-NE 3.32Å; L634-R668 VanDerWaalsContact CD1-NH2 3.3Å; I665-R668 WeakPolarHBondContact O-CB 3.26Å; I665-R668 PolarHBondContact O-N 3.4Å; A666-R668 VanDerWaalsContact C-N 3.3Å; A666-R668 PolarHBondContact O-N 3.29Å; R668-I671 HydrophobicContact CB-CD1 4.18Å; R668-K674 WeakPolarHBondContact O-CE 3.01Å
669	R	72.5	Confident	84.5	Confident	247 Å²	247	69.6 Å²	69.6	93%	0.932	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	137.7	172	-63.7	-177.4	178	174.4	-1.2	109.3
670	G	73.6	Confident	84.6	Confident	77 Å²	77	74.6 Å²	74.6	79%	0.794	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	4.1	170.5	0	0	0	0	0	118.4
671	I	74.5	Confident	84.8	Confident	55 Å²	55	71.3 Å²	71.3	28%	0.282	37%	0.37	S	S	.	.			trans	-89.3	130.6	175.5	-66.1	152.2	0	0	0	110.2	I665 R668 K674	I665-I671 HydrophobicContact CG2-CD1 3.54Å; I665-I671 WeakPolarHBondContact O-CD1 3.36Å; R668-I671 HydrophobicContact CB-CD1 4.18Å; I671-K674 HydrophobicContact CB-CG 4.08Å; I671-K674 HydrophobicContact CG2-CG 4.21Å; I671-K674 WeakPolarHBondContact O-CG 3.01Å
672	L	67.8	Low	85.1	Confident	182 Å²	182	72.8 Å²	72.8	95%	0.953	38%	0.376	S	S	*	.	S	Bend	trans	-74.9	-34.8	-179.9	-71.4	163	0	0	0	112.7
673	Q	80.9	Confident	85.3	Confident	132 Å²	132	76.1 Å²	76.1	62%	0.617	40%	0.4	S	S	*	.			trans	-108.4	54.2	-176.2	-69.5	177.1	-12	0	0	112.6	C675 D676 C677	Q673-C675 VanDerWaalsContact C-N 3.35Å; Q673-C675 PolarHBondContact O-N 3.43Å; Q673-D676 HydrophobicContact CB-CB 4.36Å; Q673-C677 PolarHBondContact O-N 3.19Å
674	K	84.4	Confident	85.5	Confident	91 Å²	91	78 Å²	78	40%	0.396	41%	0.408	S	S	.	.	H	α-helix	trans	-61.7	-41.5	-178	-72.5	-179.3	178.8	-178.2	0	113	R668 I671 C677 C678	R668-K674 WeakPolarHBondContact O-CE 3.01Å; I671-K674 HydrophobicContact CB-CG 4.08Å; I671-K674 HydrophobicContact CG2-CG 4.21Å; I671-K674 WeakPolarHBondContact O-CG 3.01Å; K674-C677 PolarHBondContact O-N 3.32Å; K674-C678 VanDerWaalsContact O-CB 3.25Å; K674-C678 WeakPolarHBondContact O-CB 3.4Å; K674-C678 PolarHBondContact O-N 2.65Å
675	C	86.8	Confident	85.9	Confident	98 Å²	98	75.4 Å²	75.4	66%	0.662	39%	0.394	S	S	*	.	H	α-helix	trans	-63.9	-45.4	-177.8	-61.7	0	0	0	0	111.3	Q673 C677 C678 M679	Q673-C675 VanDerWaalsContact C-N 3.35Å; Q673-C675 PolarHBondContact O-N 3.43Å; C675-C677 PolarHBondContact O-N 3.31Å; C675-C678 WeakPolarHBondContact O-CB 3.5Å; C675-C678 PolarHBondContact O-N 3.02Å; C675-M679 WeakPolarHBondContact O-CB 3.45Å; C675-M679 VanDerWaalsContact O-CG 3.3Å; C675-M679 WeakPolarHBondContact O-CG 3.16Å; C675-M679 PolarHBondContact O-N 3.25Å
676	D	88.5	Confident	86.2	Confident	84 Å²	84	76.9 Å²	76.9	45%	0.449	41%	0.409	S	S	.	.	H	α-helix	trans	-63.1	-44.7	179.5	-56.8	-35.9	0	0	0	111.5	Q673 C678 M679 Q680	Q673-D676 HydrophobicContact CB-CB 4.36Å; D676-C678 VanDerWaalsContact C-N 3.32Å; D676-C678 PolarHBondContact O-N 3.44Å; D676-M679 PolarHBondContact O-N 3.33Å; D676-Q680 WeakPolarHBondContact O-CB 3.46Å; D676-Q680 VanDerWaalsContact O-CG 3.24Å; D676-Q680 WeakPolarHBondContact O-CG 3.37Å; D676-Q680 PolarHBondContact O-N 3.38Å
677	C	88.3	Confident	86.5	Confident	16 Å²	16	80.3 Å²	80.3	11%	0.108	42%	0.423	C	S	.	.	H	α-helix	trans	-63.1	-39.8	177.4	-170.2	0	0	0	0	111.9	L662 A666 Q673 K674 C675 G681	L662-C677 PolarHBondContact O-SG 3.46Å; A666-C677 HydrophobicContact CB-CB 4.24Å; Q673-C677 PolarHBondContact O-N 3.19Å; K674-C677 PolarHBondContact O-N 3.32Å; C675-C677 PolarHBondContact O-N 3.31Å; C677-G681 PolarHBondContact O-N 3.16Å
678	C	90.4	Very high	86.9	Confident	18 Å²	18	78 Å²	78	12%	0.122	41%	0.407	C	S	.	.	H	α-helix	trans	-63.5	-48.6	175	-175.7	0	0	0	0	111.8	A666 K674 C675 D676 Q680 G681 F682 M709	A666-C678 HydrophobicContact CB-CB 4.35Å; K674-C678 VanDerWaalsContact O-CB 3.25Å; K674-C678 WeakPolarHBondContact O-CB 3.4Å; K674-C678 PolarHBondContact O-N 2.65Å; C675-C678 WeakPolarHBondContact O-CB 3.5Å; C675-C678 PolarHBondContact O-N 3.02Å; D676-C678 VanDerWaalsContact C-N 3.32Å; D676-C678 PolarHBondContact O-N 3.44Å; C678-Q680 PolarHBondContact O-N 3.37Å; C678-G681 WeakPolarHBondContact O-CA 3.47Å; C678-G681 PolarHBondContact O-N 2.71Å; C678-G681 VanDerWaalsContact O-N 3.11Å; C678-F682 VanDerWaalsContact O-CD2 3.31Å; C678-F682 WeakPolarHBondContact O-CD2 3.43Å; C678-F682 PolarHBondContact O-N 3.38Å; C678-F682 WeakPolarHBondContact SG-CE2 3.48Å; C678-M709 HydrophobicContact CB-CE 4.2Å; C678-M709 VanDerWaalsContact SG-CE 3.59Å
679	M	92.1	Very high	87.4	Confident	135 Å²	135	75.9 Å²	75.9	67%	0.665	40%	0.402	S	S	*	.	H	α-helix	trans	-60.5	-43.7	178	-73.1	-60.5	-65.2	0	0	111.8	C675 D676 F682 S683	C675-M679 WeakPolarHBondContact O-CB 3.45Å; C675-M679 VanDerWaalsContact O-CG 3.3Å; C675-M679 WeakPolarHBondContact O-CG 3.16Å; C675-M679 PolarHBondContact O-N 3.25Å; D676-M679 PolarHBondContact O-N 3.33Å; M679-F682 PolarHBondContact O-N 3.19Å; M679-S683 WeakPolarHBondContact O-CB 3.3Å; M679-S683 PolarHBondContact O-N 3.14Å
680	Q	92.6	Very high	88.4	Confident	105 Å²	105	70.6 Å²	70.6	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-61.2	-44.9	173	-70.9	172.4	6.6	0	0	111.1	L662 D676 C678 F682 S683 F684	L662-Q680 HydrophobicContact CD1-CB 4.11Å; D676-Q680 WeakPolarHBondContact O-CB 3.46Å; D676-Q680 VanDerWaalsContact O-CG 3.24Å; D676-Q680 WeakPolarHBondContact O-CG 3.37Å; D676-Q680 PolarHBondContact O-N 3.38Å; C678-Q680 PolarHBondContact O-N 3.37Å; Q680-F682 VanDerWaalsContact C-N 3.35Å; Q680-F682 PolarHBondContact O-N 2.97Å; Q680-S683 WeakPolarHBondContact O-CB 3.27Å; Q680-S683 PolarHBondContact O-N 3.31Å; Q680-S683 VanDerWaalsContact O-N 3.15Å; Q680-F684 WeakPolarHBondContact O-CD2 3.3Å; Q680-F684 PolarHBondContact O-N 3.48Å
681	G	92.8	Very high	89.2	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-55.8	-47.1	176.5	0	0	0	0	0	112.8	G659 C677 C678 F684 L685	G659-G681 WeakPolarHBondContact CA-O 3.29Å; C677-G681 PolarHBondContact O-N 3.16Å; C678-G681 WeakPolarHBondContact O-CA 3.47Å; C678-G681 PolarHBondContact O-N 2.71Å; C678-G681 VanDerWaalsContact O-N 3.11Å; G681-F684 PolarHBondContact O-N 3.1Å; G681-L685 WeakPolarHBondContact O-CG 3.25Å; G681-L685 PolarHBondContact O-N 3.4Å; G681-L685 VanDerWaalsContact O-N 3.12Å
682	F	94.4	Very high	89.8	Confident	35 Å²	35	72.3 Å²	72.3	15%	0.154	37%	0.371	C	S	.	.	H	α-helix	trans	-68.2	-33.8	175.5	-78.9	-66.5	0	0	0	113.4	I663 C678 M679 Q680 F684 L685 A686 M702 A705 M706 M709	I663-F682 HydrophobicContact CD1-CE1 4.49Å; C678-F682 VanDerWaalsContact O-CD2 3.31Å; C678-F682 WeakPolarHBondContact O-CD2 3.43Å; C678-F682 PolarHBondContact O-N 3.38Å; C678-F682 WeakPolarHBondContact SG-CE2 3.48Å; M679-F682 PolarHBondContact O-N 3.19Å; Q680-F682 VanDerWaalsContact C-N 3.35Å; Q680-F682 PolarHBondContact O-N 2.97Å; F682-F684 VanDerWaalsContact C-N 3.34Å; F682-F684 PolarHBondContact O-N 3.39Å; F682-L685 HydrophobicContact CD1-CD1 4.13Å; F682-L685 HydrophobicContact CE1-CD1 4.33Å; F682-L685 PolarHBondContact O-N 3.1Å; F682-A686 WeakPolarHBondContact O-CB 3.48Å; F682-A686 PolarHBondContact O-N 3.01Å; F682-M702 HydrophobicContact CD1-SD 3.87Å; F682-M702 HydrophobicContact CE1-SD 3.94Å; F682-A705 HydrophobicContact CE1-CB 3.79Å; F682-A705 HydrophobicContact CZ-CB 4.2Å; F682-M706 HydrophobicContact CD1-CE 3.9Å; F682-M706 HydrophobicContact CE1-CE 3.38Å; F682-M706 HydrophobicContact CE1-CG 4.21Å; F682-M706 HydrophobicContact CE1-SD 3.68Å; F682-M706 HydrophobicContact CE2-SD 4.35Å; F682-M706 HydrophobicContact CZ-CE 3.74Å; F682-M706 HydrophobicContact CZ-CG 4.32Å; F682-M706 HydrophobicContact CZ-SD 3.48Å; F682-M706 WeakPolarHBondContact CZ-SD 3.46Å; F682-M709 HydrophobicContact CE2-CG 4.06Å; F682-M709 HydrophobicContact CZ-CG 4.19Å
683	S	94.5	Very high	90.8	Very high	78 Å²	78	65.1 Å²	65.1	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-43.5	172.9	179.2	0	0	0	0	111.8	M679 Q680 A686 K687	M679-S683 WeakPolarHBondContact O-CB 3.3Å; M679-S683 PolarHBondContact O-N 3.14Å; Q680-S683 WeakPolarHBondContact O-CB 3.27Å; Q680-S683 PolarHBondContact O-N 3.31Å; Q680-S683 VanDerWaalsContact O-N 3.15Å; S683-A686 PolarHBondContact O-N 3.24Å; S683-K687 PolarHBondContact O-N 2.94Å
684	F	94.5	Very high	91.1	Very high	41 Å²	41	63.6 Å²	63.6	18%	0.18	34%	0.344	C	S	.	.	H	α-helix	trans	-66.9	-36.8	174.5	-76.7	-74.7	0	0	0	112.7	F642 L645 Y655 I658 L662 Q680 G681 F682 K687 H688	F642-F684 HydrophobicContact CE1-CE1 4.27Å; F642-F684 HydrophobicContact CE1-CE2 4.37Å; F642-F684 AromaticContact CE1-CZ 3.69Å; F642-F684 HydrophobicContact CE1-CZ 3.69Å; F642-F684 HydrophobicContact CZ-CE2 4.32Å; F642-F684 HydrophobicContact CZ-CZ 4.08Å; L645-F684 HydrophobicContact CD2-CE1 4.06Å; Y655-F684 AromaticContact CD1-CD1 3.94Å; Y655-F684 HydrophobicContact CD1-CD1 3.94Å; I658-F684 HydrophobicContact CB-CD1 4.42Å; I658-F684 HydrophobicContact CB-CG 4.38Å; I658-F684 HydrophobicContact CG2-CB 4.42Å; I658-F684 HydrophobicContact CG2-CD1 3.96Å; I658-F684 HydrophobicContact CG2-CD2 3.67Å; I658-F684 HydrophobicContact CG2-CE1 4.16Å; I658-F684 HydrophobicContact CG2-CE2 3.88Å; I658-F684 HydrophobicContact CG2-CG 3.75Å; I658-F684 HydrophobicContact CG2-CZ 4.14Å; L662-F684 HydrophobicContact CD1-CD2 3.61Å; L662-F684 HydrophobicContact CD1-CE2 3.91Å; Q680-F684 WeakPolarHBondContact O-CD2 3.3Å; Q680-F684 PolarHBondContact O-N 3.48Å; G681-F684 PolarHBondContact O-N 3.1Å; F682-F684 VanDerWaalsContact C-N 3.34Å; F682-F684 PolarHBondContact O-N 3.39Å; F684-K687 PolarHBondContact O-N 3.29Å; F684-H688 PolarHBondContact O-N 2.99Å
685	L	94.2	Very high	91.2	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.026	33%	0.328	C	S	.	.	H	α-helix	trans	-67.5	-37.5	174.3	-68.8	-178.6	0	0	0	112.8	L656 I663 G681 F682 K687 H688 E689 M702 A705	L656-L685 HydrophobicContact CD1-CD2 3.71Å; I663-L685 HydrophobicContact CD1-CD1 3.46Å; I663-L685 VanDerWaalsContact CD1-CD1 3.46Å; I663-L685 HydrophobicContact CD1-CG 4.37Å; G681-L685 WeakPolarHBondContact O-CG 3.25Å; G681-L685 PolarHBondContact O-N 3.4Å; G681-L685 VanDerWaalsContact O-N 3.12Å; F682-L685 HydrophobicContact CD1-CD1 4.13Å; F682-L685 HydrophobicContact CE1-CD1 4.33Å; F682-L685 PolarHBondContact O-N 3.1Å; L685-K687 VanDerWaalsContact C-N 3.33Å; L685-H688 VanDerWaalsContact O-CB 3.31Å; L685-H688 WeakPolarHBondContact O-CB 2.97Å; L685-H688 PolarHBondContact O-N 2.86Å; L685-E689 PolarHBondContact O-N 3.46Å; L685-M702 HydrophobicContact CB-CE 3.84Å; L685-M702 HydrophobicContact CB-SD 4.41Å; L685-M702 HydrophobicContact CD1-SD 4.31Å; L685-A705 HydrophobicContact CD1-CB 3.56Å
686	A	93.7	Very high	91.4	Very high	49 Å²	49	55.1 Å²	55.1	41%	0.405	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-39.8	173.7	0	0	0	0	0	111	F682 S683 H688 E689 E690	F682-A686 WeakPolarHBondContact O-CB 3.48Å; F682-A686 PolarHBondContact O-N 3.01Å; S683-A686 PolarHBondContact O-N 3.24Å; A686-H688 VanDerWaalsContact C-N 3.31Å; A686-H688 PolarHBondContact O-N 3.09Å; A686-E689 WeakPolarHBondContact O-CB 3.23Å; A686-E689 PolarHBondContact O-N 3.36Å; A686-E690 PolarHBondContact O-N 3.28Å
687	K	93	Very high	91.4	Very high	76 Å²	76	51.9 Å²	51.9	33%	0.33	28%	0.28	S	S	.	.	H	α-helix	trans	-65.8	-34.5	173.2	-164.5	69.7	-167.1	172.2	0	112.5	Y655 S683 F684 L685 E690 I691	Y655-K687 HydrophobicContact CD1-CB 3.86Å; Y655-K687 HydrophobicContact CD1-CG 3.71Å; Y655-K687 HydrophobicContact CE1-CB 4.17Å; Y655-K687 HydrophobicContact CE1-CG 3.51Å; S683-K687 PolarHBondContact O-N 2.94Å; F684-K687 PolarHBondContact O-N 3.29Å; L685-K687 VanDerWaalsContact C-N 3.33Å; K687-E690 VanDerWaalsContact CD-OE2 3.29Å; K687-E690 WeakPolarHBondContact CD-OE2 3.32Å; K687-E690 WeakPolarHBondContact CE-OE2 3.36Å; K687-E690 IonicContact NZ-OE1 3.72Å; K687-E690 PolarHBondContact NZ-OE1 2.79Å; K687-E690 IonicContact NZ-OE2 2.77Å; K687-E690 PolarHBondContact NZ-OE2 3.4Å; K687-E690 PolarHBondContact O-N 2.81Å; K687-I691 HydrophobicContact CG-CD1 4.24Å; K687-I691 WeakPolarHBondContact O-CG1 3.36Å; K687-I691 PolarHBondContact O-N 3.13Å
688	H	93.3	Very high	91.6	Very high	5 Å²	5	51.3 Å²	51.3	2%	0.023	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-43.4	172.2	174.8	70.6	0	0	0	112	P652 F684 L685 A686 I691 R692	P652-H688 PolarHBondContact O-CE1 3.49Å; P652-H688 PolarHBondContact O-ND1 3.17Å; F684-H688 PolarHBondContact O-N 2.99Å; L685-H688 VanDerWaalsContact O-CB 3.31Å; L685-H688 WeakPolarHBondContact O-CB 2.97Å; L685-H688 PolarHBondContact O-N 2.86Å; A686-H688 VanDerWaalsContact C-N 3.31Å; A686-H688 PolarHBondContact O-N 3.09Å; H688-I691 PolarHBondContact O-N 3.32Å; H688-R692 WeakPolarHBondContact O-CB 3.42Å; H688-R692 PolarHBondContact O-N 3.31Å
689	E	93.6	Very high	91.7	Very high	65 Å²	65	51 Å²	51	30%	0.304	27%	0.273	S	S	.	.	H	α-helix	trans	-60.8	-45.7	174.1	173.6	165.9	-156.7	0	0	112	L685 A686 I691 R692 G693 V698	L685-E689 PolarHBondContact O-N 3.46Å; A686-E689 WeakPolarHBondContact O-CB 3.23Å; A686-E689 PolarHBondContact O-N 3.36Å; E689-I691 VanDerWaalsContact C-N 3.32Å; E689-I691 PolarHBondContact O-N 2.94Å; E689-R692 PolarHBondContact O-N 3Å; E689-G693 WeakPolarHBondContact O-CA 3.32Å; E689-G693 PolarHBondContact O-N 3.38Å; E689-V698 HydrophobicContact CB-CG1 3.53Å; E689-V698 HydrophobicContact CG-CG1 3.66Å
690	E	92.7	Very high	91.9	Very high	136 Å²	136	46 Å²	46	64%	0.636	25%	0.247	S	C	*	.	H	α-helix	trans	-58.1	-42	177.8	-168.9	-168.4	142.4	0	0	112.4	A686 K687	A686-E690 PolarHBondContact O-N 3.28Å; K687-E690 VanDerWaalsContact CD-OE2 3.29Å; K687-E690 WeakPolarHBondContact CD-OE2 3.32Å; K687-E690 WeakPolarHBondContact CE-OE2 3.36Å; K687-E690 IonicContact NZ-OE1 3.72Å; K687-E690 PolarHBondContact NZ-OE1 2.79Å; K687-E690 IonicContact NZ-OE2 2.77Å; K687-E690 PolarHBondContact NZ-OE2 3.4Å; K687-E690 PolarHBondContact O-N 2.81Å
691	I	90.7	Very high	91.9	Very high	65 Å²	65	42.7 Å²	42.7	33%	0.333	23%	0.233	S	C	.	.	H	α-helix	trans	-77.5	-36.2	-177.3	-63.2	167.4	0	0	0	112	P652 Y655 K687 H688 E689	P652-I691 HydrophobicContact CB-CB 4.44Å; P652-I691 HydrophobicContact CB-CG2 3.98Å; P652-I691 HydrophobicContact CG-CG2 4.39Å; Y655-I691 HydrophobicContact CD2-CD1 3.71Å; Y655-I691 HydrophobicContact CE1-CD1 4.48Å; Y655-I691 HydrophobicContact CE2-CD1 3.32Å; Y655-I691 HydrophobicContact CG-CD1 4.41Å; K687-I691 HydrophobicContact CG-CD1 4.24Å; K687-I691 WeakPolarHBondContact O-CG1 3.36Å; K687-I691 PolarHBondContact O-N 3.13Å; H688-I691 PolarHBondContact O-N 3.32Å; E689-I691 VanDerWaalsContact C-N 3.32Å; E689-I691 PolarHBondContact O-N 2.94Å
692	R	87.3	Confident	91.9	Very high	102 Å²	102	43.3 Å²	43.3	39%	0.385	24%	0.236	S	C	.	.	H	α-helix	trans	-84.2	-28.9	-178.8	-73.2	-71.6	-84.6	138.5	-5.8	113.3	P652 H688 E689 E697 V698	P652-R692 HydrophobicContact CB-CG 3.51Å; P652-R692 VanDerWaalsContact CG-CD 3.46Å; P652-R692 HydrophobicContact CG-CG 4.04Å; H688-R692 WeakPolarHBondContact O-CB 3.42Å; H688-R692 PolarHBondContact O-N 3.31Å; E689-R692 PolarHBondContact O-N 3Å; R692-E697 IonicContact CZ-OE2 2.79Å; R692-E697 IonicContact NE-OE2 2.74Å; R692-E697 IonicContact NH2-OE2 2.78Å; R692-E697 PolarHBondContact NH2-OE2 3.23Å; R692-V698 HydrophobicContact CB-CG2 3.86Å; R692-V698 HydrophobicContact CG-CG2 4.38Å
693	G	88.6	Confident	91.9	Very high	31 Å²	31	41.7 Å²	41.7	32%	0.32	23%	0.229	S	C	.	.			trans	82.3	171.6	-163.8	0	0	0	0	0	112.9	E689 C695	E689-G693 WeakPolarHBondContact O-CA 3.32Å; E689-G693 PolarHBondContact O-N 3.38Å; G693-C695 VanDerWaalsContact C-N 3.34Å; G693-C695 PolarHBondContact O-N 3.44Å; G693-C695 PolarHBondContact O-SG 2.86Å
694	S	85.7	Confident	91.9	Very high	100 Å²	100	42.3 Å²	42.3	70%	0.699	22%	0.22	S	C	*	.	S	Bend	trans	-69	87.8	176.5	46.1	0	0	0	0	110.6	M725	S694-M725 WeakPolarHBondContact O-CE 3.25Å
695	C	88.1	Confident	91.8	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.061	21%	0.214	C	C	.	.			trans	-121.2	161.9	-175.8	67.6	0	0	0	0	111.1	G693 E697 V698 C699 D728	G693-C695 VanDerWaalsContact C-N 3.34Å; G693-C695 PolarHBondContact O-N 3.44Å; G693-C695 PolarHBondContact O-SG 2.86Å; C695-E697 PolarHBondContact O-N 3.08Å; C695-V698 PolarHBondContact O-N 3.47Å; C695-V698 VanDerWaalsContact O-N 3.15Å; C695-V698 WeakPolarHBondContact SG-CG2 3.45Å; C695-C699 PolarHBondContact O-N 3.35Å; C695-D728 WeakPolarHBondContact CB-OD1 3.37Å; C695-D728 VanDerWaalsContact CB-OD2 3.28Å; C695-D728 WeakPolarHBondContact CB-OD2 3.34Å
696	Q	90.1	Very high	91.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-38.6	-175.9	-167.5	-171.1	39.1	0	0	111.5	Y700 T722 M725 D728 D738 L739	Q696-Y700 WeakPolarHBondContact O-CB 3.37Å; Q696-Y700 PolarHBondContact O-N 3.21Å; Q696-Y700 VanDerWaalsContact O-N 3.11Å; Q696-T722 HydrophobicContact CG-CG2 3.74Å; Q696-M725 HydrophobicContact CB-CB 4.47Å; Q696-D728 PolarHBondContact N-OD1 3.35Å; Q696-D728 PolarHBondContact N-OD2 2.99Å; Q696-D738 PolarHBondContact NE2-OD1 3.49Å; Q696-L739 HydrophobicContact CG-CB 4.21Å
697	E	88.9	Confident	91.8	Very high	16 Å²	16	41.6 Å²	41.6	8%	0.075	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-45.3	177.1	176.4	175.1	-161.9	0	0	113.1	R589 R692 C695 N701 L739	R589-E697 IonicContact CZ-OE1 3.77Å; R589-E697 IonicContact CZ-OE2 2.65Å; R589-E697 IonicContact NH1-OE1 3.72Å; R589-E697 PolarHBondContact NH1-OE1 3.34Å; R589-E697 VanDerWaalsContact NH1-OE1 3.08Å; R589-E697 IonicContact NH1-OE2 2.84Å; R589-E697 IonicContact NH2-OE1 2.91Å; R589-E697 PolarHBondContact NH2-OE1 3.38Å; R589-E697 IonicContact NH2-OE2 3.16Å; R589-E697 PolarHBondContact NH2-OE2 3.48Å; R692-E697 IonicContact CZ-OE2 2.79Å; R692-E697 IonicContact NE-OE2 2.74Å; R692-E697 IonicContact NH2-OE2 2.78Å; R692-E697 PolarHBondContact NH2-OE2 3.23Å; C695-E697 PolarHBondContact O-N 3.08Å; E697-N701 WeakPolarHBondContact CG-ND2 3.1Å; E697-N701 WeakPolarHBondContact O-CB 3.36Å; E697-N701 PolarHBondContact O-N 3.28Å; E697-N701 PolarHBondContact O-ND2 3.22Å; E697-N701 VanDerWaalsContact O-ND2 3.12Å; E697-L739 HydrophobicContact CB-CD1 4.2Å
698	V	92.5	Very high	91.7	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.024	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-47.6	-177.4	166.7	0	0	0	0	110.7	E689 R692 C695 Y700 N701 M702	E689-V698 HydrophobicContact CB-CG1 3.53Å; E689-V698 HydrophobicContact CG-CG1 3.66Å; R692-V698 HydrophobicContact CB-CG2 3.86Å; R692-V698 HydrophobicContact CG-CG2 4.38Å; C695-V698 PolarHBondContact O-N 3.47Å; C695-V698 VanDerWaalsContact O-N 3.15Å; C695-V698 WeakPolarHBondContact SG-CG2 3.45Å; V698-Y700 VanDerWaalsContact C-N 3.33Å; V698-Y700 PolarHBondContact O-N 3.06Å; V698-N701 PolarHBondContact O-N 3.25Å; V698-M702 WeakPolarHBondContact O-CB 3.45Å; V698-M702 PolarHBondContact O-N 3.02Å
699	C	93.3	Very high	91.5	Very high	11 Å²	11	44.8 Å²	44.8	7%	0.074	23%	0.226	C	C	.	.	H	α-helix	trans	-58.5	-45.4	177.8	-73.3	0	0	0	0	111.8	C695 M702 G703 M725	C695-C699 PolarHBondContact O-N 3.35Å; C699-M702 PolarHBondContact O-N 3.3Å; C699-G703 PolarHBondContact O-N 3.19Å; C699-M725 HydrophobicContact CB-SD 4.11Å
700	Y	94.3	Very high	91.2	Very high	30 Å²	30	44.2 Å²	44.2	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-48.3	176.8	177.7	-96.5	0	0	0	112	Q696 V698 M702 G703 R704 Y719 T722 L739 L742 A743 N746	Q696-Y700 WeakPolarHBondContact O-CB 3.37Å; Q696-Y700 PolarHBondContact O-N 3.21Å; Q696-Y700 VanDerWaalsContact O-N 3.11Å; V698-Y700 VanDerWaalsContact C-N 3.33Å; V698-Y700 PolarHBondContact O-N 3.06Å; Y700-M702 VanDerWaalsContact C-N 3.33Å; Y700-M702 PolarHBondContact O-N 2.93Å; Y700-G703 PolarHBondContact O-N 3.21Å; Y700-R704 HydrophobicContact CD1-CG 3.99Å; Y700-R704 HydrophobicContact CE1-CG 3.5Å; Y700-R704 VanDerWaalsContact CE1-CG 3.5Å; Y700-R704 HydrophobicContact CE2-CG 4.31Å; Y700-R704 WeakPolarHBondContact O-CG 3.46Å; Y700-R704 PolarHBondContact O-N 3.37Å; Y700-Y719 HydrophobicContact CD2-CD1 4.28Å; Y700-Y719 HydrophobicContact CD2-CE1 4.16Å; Y700-Y719 HydrophobicContact CE2-CE1 4.15Å; Y700-T722 HydrophobicContact CD2-CG2 4.42Å; Y700-T722 PolarHBondContact N-OG1 3.4Å; Y700-L739 HydrophobicContact CD1-CD1 4.29Å; Y700-L739 HydrophobicContact CD2-CB 4.42Å; Y700-L739 HydrophobicContact CG-CB 4.37Å; Y700-L739 HydrophobicContact CG-CD1 4.14Å; Y700-L742 HydrophobicContact CE2-CB 3.76Å; Y700-A743 HydrophobicContact CD2-CB 4.14Å; Y700-A743 HydrophobicContact CE2-CB 4.38Å; Y700-N746 PolarHBondContact OH-ND2 2.97Å
701	N	93.2	Very high	91.2	Very high	36 Å²	36	40.8 Å²	40.8	19%	0.193	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-37.1	-178.1	-73.2	-26.7	0	0	0	112	L656 E697 V698 R704 A705	L656-N701 HydrophobicContact CD1-CB 4.04Å; E697-N701 WeakPolarHBondContact CG-ND2 3.1Å; E697-N701 WeakPolarHBondContact O-CB 3.36Å; E697-N701 PolarHBondContact O-N 3.28Å; E697-N701 PolarHBondContact O-ND2 3.22Å; E697-N701 VanDerWaalsContact O-ND2 3.12Å; V698-N701 PolarHBondContact O-N 3.25Å; N701-R704 PolarHBondContact O-N 2.99Å; N701-A705 WeakPolarHBondContact O-CB 3.49Å; N701-A705 PolarHBondContact O-N 2.93Å
702	M	94	Very high	91.2	Very high	14 Å²	14	40.5 Å²	40.5	7%	0.069	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-43.9	173.7	-166.2	63.3	73.2	0	0	111.3	F682 L685 V698 C699 Y700 R704 A705 M706 Y718	F682-M702 HydrophobicContact CD1-SD 3.87Å; F682-M702 HydrophobicContact CE1-SD 3.94Å; L685-M702 HydrophobicContact CB-CE 3.84Å; L685-M702 HydrophobicContact CB-SD 4.41Å; L685-M702 HydrophobicContact CD1-SD 4.31Å; V698-M702 WeakPolarHBondContact O-CB 3.45Å; V698-M702 PolarHBondContact O-N 3.02Å; C699-M702 PolarHBondContact O-N 3.3Å; Y700-M702 VanDerWaalsContact C-N 3.33Å; Y700-M702 PolarHBondContact O-N 2.93Å; M702-R704 VanDerWaalsContact C-N 3.33Å; M702-R704 PolarHBondContact O-N 3.06Å; M702-A705 WeakPolarHBondContact O-CB 3.34Å; M702-A705 PolarHBondContact O-N 2.84Å; M702-M706 WeakPolarHBondContact O-CG 3.18Å; M702-M706 PolarHBondContact O-N 3.1Å; M702-M706 HydrophobicContact SD-CE 4.35Å; M702-Y718 HydrophobicContact CB-CD1 3.93Å; M702-Y718 HydrophobicContact CB-CE1 3.88Å; M702-Y718 HydrophobicContact CB-CE2 4.5Å; M702-Y718 HydrophobicContact CB-CG 4.27Å; M702-Y718 HydrophobicContact CG-CD1 4.04Å; M702-Y718 HydrophobicContact CG-CD2 4.09Å; M702-Y718 HydrophobicContact CG-CE1 3.58Å; M702-Y718 HydrophobicContact CG-CE2 3.65Å; M702-Y718 HydrophobicContact CG-CG 4.28Å
703	G	93.7	Very high	91.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-40.6	173.3	0	0	0	0	0	112.9	C699 Y700 H707 A715 Y718 Y719	C699-G703 PolarHBondContact O-N 3.19Å; Y700-G703 PolarHBondContact O-N 3.21Å; G703-H707 VanDerWaalsContact O-CB 3.23Å; G703-H707 WeakPolarHBondContact O-CB 3.35Å; G703-H707 PolarHBondContact O-N 3.12Å; G703-A715 WeakPolarHBondContact O-CB 3.32Å; G703-Y718 VanDerWaalsContact CA-CB 3.5Å; G703-Y719 PolarHBondContact O-OH 3.16Å
704	R	93.6	Very high	91.7	Very high	92 Å²	92	43.8 Å²	43.8	35%	0.347	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-43	173.6	-73.4	-60.2	-50.3	174	-2.5	112.3	Y700 N701 M702 H707 Q708 Y719 N746	Y700-R704 HydrophobicContact CD1-CG 3.99Å; Y700-R704 HydrophobicContact CE1-CG 3.5Å; Y700-R704 VanDerWaalsContact CE1-CG 3.5Å; Y700-R704 HydrophobicContact CE2-CG 4.31Å; Y700-R704 WeakPolarHBondContact O-CG 3.46Å; Y700-R704 PolarHBondContact O-N 3.37Å; N701-R704 PolarHBondContact O-N 2.99Å; M702-R704 VanDerWaalsContact C-N 3.33Å; M702-R704 PolarHBondContact O-N 3.06Å; R704-H707 PolarHBondContact O-N 3.13Å; R704-Q708 WeakPolarHBondContact O-CB 3.38Å; R704-Q708 PolarHBondContact O-N 3.04Å; R704-Y719 WeakPolarHBondContact CA-OH 3.47Å; R704-Y719 WeakPolarHBondContact CD-OH 3.44Å; R704-Y719 HydrophobicContact CG-CE1 4.43Å; R704-Y719 PolarHBondContact N-OH 3.49Å; R704-N746 VanDerWaalsContact CD-ND2 3.25Å; R704-N746 WeakPolarHBondContact CD-ND2 3.31Å; R704-N746 PolarHBondContact NH1-ND2 3.21Å; R704-N746 PolarHBondContact NH1-OD1 2.71Å
705	A	93.5	Very high	92.1	Very high	7 Å²	7	39 Å²	39	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-48.4	177.1	0	0	0	0	0	111.8	I663 F682 L685 N701 M702 H707 Q708 M709	I663-A705 HydrophobicContact CD1-CB 3.66Å; F682-A705 HydrophobicContact CE1-CB 3.79Å; F682-A705 HydrophobicContact CZ-CB 4.2Å; L685-A705 HydrophobicContact CD1-CB 3.56Å; N701-A705 WeakPolarHBondContact O-CB 3.49Å; N701-A705 PolarHBondContact O-N 2.93Å; M702-A705 WeakPolarHBondContact O-CB 3.34Å; M702-A705 PolarHBondContact O-N 2.84Å; A705-H707 VanDerWaalsContact C-N 3.34Å; A705-H707 PolarHBondContact O-N 3.27Å; A705-Q708 PolarHBondContact O-N 3.37Å; A705-M709 PolarHBondContact O-N 2.74Å; A705-M709 VanDerWaalsContact O-N 3.11Å
706	M	93.5	Very high	92.4	Very high	34 Å²	34	39.7 Å²	39.7	17%	0.167	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-41.2	176.8	-67.6	-64.2	179	0	0	112	F682 M702 M709 G710 V711 V714 A715 Y718	F682-M706 HydrophobicContact CD1-CE 3.9Å; F682-M706 HydrophobicContact CE1-CE 3.38Å; F682-M706 HydrophobicContact CE1-CG 4.21Å; F682-M706 HydrophobicContact CE1-SD 3.68Å; F682-M706 HydrophobicContact CE2-SD 4.35Å; F682-M706 HydrophobicContact CZ-CE 3.74Å; F682-M706 HydrophobicContact CZ-CG 4.32Å; F682-M706 HydrophobicContact CZ-SD 3.48Å; F682-M706 WeakPolarHBondContact CZ-SD 3.46Å; M702-M706 WeakPolarHBondContact O-CG 3.18Å; M702-M706 PolarHBondContact O-N 3.1Å; M702-M706 HydrophobicContact SD-CE 4.35Å; M706-M709 PolarHBondContact O-N 3.45Å; M706-G710 PolarHBondContact O-N 3.07Å; M706-V711 PolarHBondContact O-N 3.08Å; M706-V714 HydrophobicContact CE-CG1 4.42Å; M706-V714 HydrophobicContact CG-CG1 3.96Å; M706-V714 HydrophobicContact SD-CG1 4.22Å; M706-A715 HydrophobicContact CB-CB 4.01Å; M706-Y718 HydrophobicContact CG-CD2 4.39Å; M706-Y718 HydrophobicContact CG-CE2 4.4Å
707	H	93.4	Very high	92.6	Very high	38 Å²	38	43.7 Å²	43.7	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-44.4	175.7	-172.5	-177.3	0	0	0	111.2	G703 R704 A705 M709 G710 A715 Y719	G703-H707 VanDerWaalsContact O-CB 3.23Å; G703-H707 WeakPolarHBondContact O-CB 3.35Å; G703-H707 PolarHBondContact O-N 3.12Å; R704-H707 PolarHBondContact O-N 3.13Å; A705-H707 VanDerWaalsContact C-N 3.34Å; A705-H707 PolarHBondContact O-N 3.27Å; H707-M709 VanDerWaalsContact C-N 3.28Å; H707-M709 PolarHBondContact O-N 3.26Å; H707-G710 PolarHBondContact O-N 3.24Å; H707-A715 HydrophobicContact CB-CB 3.82Å; H707-Y719 HydrophobicContact CB-CE2 4.47Å; H707-Y719 WeakPolarHBondContact CB-OH 3.28Å; H707-Y719 PolarHBondContact ND1-OH 3.11Å
708	Q	91.2	Very high	92.9	Very high	87 Å²	87	45 Å²	45	41%	0.407	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-34.3	177.9	-179.5	171.1	-17.6	0	0	112.8	I663 S667 R704 A705 G710	I663-Q708 HydrophobicContact CG2-CB 4.46Å; I663-Q708 HydrophobicContact CG2-CG 4.16Å; S667-Q708 PolarHBondContact OG-NE2 2.68Å; R704-Q708 WeakPolarHBondContact O-CB 3.38Å; R704-Q708 PolarHBondContact O-N 3.04Å; A705-Q708 PolarHBondContact O-N 3.37Å; Q708-G710 VanDerWaalsContact C-N 3.25Å; Q708-G710 PolarHBondContact O-N 2.76Å
709	M	89.1	Confident	93	Very high	61 Å²	61	44.8 Å²	44.8	30%	0.3	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-3.8	176.1	-66.4	-54.1	-53.4	0	0	113.9	I663 C678 F682 A705 M706 H707	I663-M709 HydrophobicContact CG2-CG 4.2Å; I663-M709 HydrophobicContact CG2-SD 3.89Å; C678-M709 HydrophobicContact CB-CE 4.2Å; C678-M709 VanDerWaalsContact SG-CE 3.59Å; F682-M709 HydrophobicContact CE2-CG 4.06Å; F682-M709 HydrophobicContact CZ-CG 4.19Å; A705-M709 PolarHBondContact O-N 2.74Å; A705-M709 VanDerWaalsContact O-N 3.11Å; M706-M709 PolarHBondContact O-N 3.45Å; H707-M709 VanDerWaalsContact C-N 3.28Å; H707-M709 PolarHBondContact O-N 3.26Å
710	G	88.7	Confident	93	Very high	53 Å²	53	49 Å²	49	55%	0.546	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	7.1	-179.7	0	0	0	0	0	114.8	M706 H707 Q708 V712	M706-G710 PolarHBondContact O-N 3.07Å; H707-G710 PolarHBondContact O-N 3.24Å; Q708-G710 VanDerWaalsContact C-N 3.25Å; Q708-G710 PolarHBondContact O-N 2.76Å; G710-V712 PolarHBondContact O-N 2.75Å
711	V	91.7	Very high	93	Very high	64 Å²	64	53.3 Å²	53.3	39%	0.388	27%	0.273	S	S	.	.			trans	-85.7	70	176.9	-167.1	0	0	0	0	109.5	M706 N713 V714 A715	M706-V711 PolarHBondContact O-N 3.08Å; V711-N713 PolarHBondContact O-N 3.45Å; V711-V714 HydrophobicContact CG1-CB 3.81Å; V711-V714 HydrophobicContact CG1-CG2 3.57Å; V711-V714 PolarHBondContact O-N 3.24Å; V711-A715 PolarHBondContact O-N 3.44Å; V711-A715 VanDerWaalsContact O-N 3.1Å
712	V	91.4	Very high	93	Very high	59 Å²	59	51.6 Å²	51.6	36%	0.358	26%	0.264	S	S	.	.	H	α-helix	trans	-57.8	-46	-171	177.1	0	0	0	0	112	G710 V714 A715 V716 M750	G710-V712 PolarHBondContact O-N 2.75Å; V712-V714 PolarHBondContact O-N 3.14Å; V712-A715 WeakPolarHBondContact O-CB 3.17Å; V712-A715 PolarHBondContact O-N 2.8Å; V712-A715 VanDerWaalsContact O-N 3.12Å; V712-V716 WeakPolarHBondContact O-CG2 3.3Å; V712-V716 PolarHBondContact O-N 3.28Å; V712-M750 HydrophobicContact CB-CE 4.1Å; V712-M750 HydrophobicContact CG1-CE 3.31Å; V712-M750 VanDerWaalsContact O-CE 3.29Å; V712-M750 WeakPolarHBondContact O-CE 3.25Å
713	N	91.6	Very high	92.8	Very high	143 Å²	143	52 Å²	52	77%	0.765	27%	0.266	S	S	*	.	H	α-helix	trans	-60.7	-43.8	-175.6	-64.7	-13.6	0	0	0	112.6	V711 V716 E717	V711-N713 PolarHBondContact O-N 3.45Å; N713-V716 PolarHBondContact O-N 2.96Å; N713-E717 PolarHBondContact O-N 2.95Å
714	V	94.1	Very high	92.7	Very high	60 Å²	60	56.3 Å²	56.3	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-69.5	-37.7	177.4	-179.8	0	0	0	0	110.4	M706 V711 V712 V716 E717 Y718	M706-V714 HydrophobicContact CE-CG1 4.42Å; M706-V714 HydrophobicContact CG-CG1 3.96Å; M706-V714 HydrophobicContact SD-CG1 4.22Å; V711-V714 HydrophobicContact CG1-CB 3.81Å; V711-V714 HydrophobicContact CG1-CG2 3.57Å; V711-V714 PolarHBondContact O-N 3.24Å; V712-V714 PolarHBondContact O-N 3.14Å; V714-V716 VanDerWaalsContact C-N 3.33Å; V714-V716 PolarHBondContact O-N 3.22Å; V714-E717 WeakPolarHBondContact O-CB 3.47Å; V714-E717 PolarHBondContact O-N 3.28Å; V714-Y718 HydrophobicContact CG1-CD2 3.84Å; V714-Y718 HydrophobicContact CG1-CE2 3.64Å; V714-Y718 WeakPolarHBondContact O-CD2 3.36Å; V714-Y718 PolarHBondContact O-N 3.4Å; V714-Y718 VanDerWaalsContact O-N 3.15Å
715	A	95.1	Very high	92.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-41.4	175.2	0	0	0	0	0	112.5	G703 M706 H707 V711 V712 E717 Y718 Y719 M750	G703-A715 WeakPolarHBondContact O-CB 3.32Å; M706-A715 HydrophobicContact CB-CB 4.01Å; H707-A715 HydrophobicContact CB-CB 3.82Å; V711-A715 PolarHBondContact O-N 3.44Å; V711-A715 VanDerWaalsContact O-N 3.1Å; V712-A715 WeakPolarHBondContact O-CB 3.17Å; V712-A715 PolarHBondContact O-N 2.8Å; V712-A715 VanDerWaalsContact O-N 3.12Å; A715-E717 VanDerWaalsContact C-N 3.31Å; A715-E717 PolarHBondContact O-N 2.95Å; A715-Y718 PolarHBondContact O-N 3.35Å; A715-Y719 HydrophobicContact CB-CE2 4.04Å; A715-Y719 WeakPolarHBondContact O-CD2 3.34Å; A715-Y719 PolarHBondContact O-N 3.09Å; A715-M750 HydrophobicContact CB-CE 3.9Å
716	V	93.5	Very high	91.9	Very high	22 Å²	22	61 Å²	61	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-57.6	-44.7	175.5	173	0	0	0	0	111.1	V712 N713 V714 Y719 K720 L747 M750	V712-V716 WeakPolarHBondContact O-CG2 3.3Å; V712-V716 PolarHBondContact O-N 3.28Å; N713-V716 PolarHBondContact O-N 2.96Å; V714-V716 VanDerWaalsContact C-N 3.33Å; V714-V716 PolarHBondContact O-N 3.22Å; V716-Y719 PolarHBondContact O-N 2.81Å; V716-K720 HydrophobicContact CG1-CD 4.08Å; V716-K720 HydrophobicContact CG1-CG 4.36Å; V716-K720 WeakPolarHBondContact O-CG 3.31Å; V716-K720 PolarHBondContact O-N 3.31Å; V716-L747 HydrophobicContact CB-CD2 4.23Å; V716-L747 HydrophobicContact CG1-CD2 3.93Å; V716-L747 HydrophobicContact CG2-CD2 4.14Å; V716-M750 HydrophobicContact CG2-CE 3.43Å; V716-M750 VanDerWaalsContact CG2-CE 3.43Å; V716-M750 HydrophobicContact CG2-SD 4.45Å
717	E	94.3	Very high	91.2	Very high	87 Å²	87	60.8 Å²	60.8	41%	0.407	33%	0.328	S	S	.	.	H	α-helix	trans	-61	-45.7	179.1	179.2	57.3	-160.4	0	0	111.8	N713 V714 A715 Y719 K720 R721	N713-E717 PolarHBondContact O-N 2.95Å; V714-E717 WeakPolarHBondContact O-CB 3.47Å; V714-E717 PolarHBondContact O-N 3.28Å; A715-E717 VanDerWaalsContact C-N 3.31Å; A715-E717 PolarHBondContact O-N 2.95Å; E717-Y719 PolarHBondContact O-N 3.4Å; E717-K720 PolarHBondContact O-N 2.71Å; E717-R721 WeakPolarHBondContact O-CG 3.37Å; E717-R721 PolarHBondContact O-N 2.89Å; E717-R721 IonicContact OE1-CZ 3.5Å; E717-R721 IonicContact OE1-NE 2.94Å; E717-R721 PolarHBondContact OE1-NE 3.35Å; E717-R721 IonicContact OE1-NH2 3.16Å; E717-R721 PolarHBondContact OE1-NH2 3.26Å; E717-R721 VanDerWaalsContact OE1-NH2 3.16Å
718	Y	95.2	Very high	90.1	Very high	42 Å²	42	62.6 Å²	62.6	17%	0.165	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-39	175.5	-82.5	-71.4	0	0	0	113.4	M702 G703 M706 V714 A715 R721 T722	M702-Y718 HydrophobicContact CB-CD1 3.93Å; M702-Y718 HydrophobicContact CB-CE1 3.88Å; M702-Y718 HydrophobicContact CB-CE2 4.5Å; M702-Y718 HydrophobicContact CB-CG 4.27Å; M702-Y718 HydrophobicContact CG-CD1 4.04Å; M702-Y718 HydrophobicContact CG-CD2 4.09Å; M702-Y718 HydrophobicContact CG-CE1 3.58Å; M702-Y718 HydrophobicContact CG-CE2 3.65Å; M702-Y718 HydrophobicContact CG-CG 4.28Å; G703-Y718 VanDerWaalsContact CA-CB 3.5Å; M706-Y718 HydrophobicContact CG-CD2 4.39Å; M706-Y718 HydrophobicContact CG-CE2 4.4Å; V714-Y718 HydrophobicContact CG1-CD2 3.84Å; V714-Y718 HydrophobicContact CG1-CE2 3.64Å; V714-Y718 WeakPolarHBondContact O-CD2 3.36Å; V714-Y718 PolarHBondContact O-N 3.4Å; V714-Y718 VanDerWaalsContact O-N 3.15Å; A715-Y718 PolarHBondContact O-N 3.35Å; Y718-R721 PolarHBondContact O-N 3.02Å; Y718-T722 PolarHBondContact O-N 3.09Å; Y718-T722 PolarHBondContact O-OG1 3.45Å
719	Y	95.2	Very high	89.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-41.4	174.7	-65.8	-50.2	0	0	0	111.6	Y700 G703 R704 H707 A715 V716 E717 R721 T722 L723 A743 N746 L747 M750	Y700-Y719 HydrophobicContact CD2-CD1 4.28Å; Y700-Y719 HydrophobicContact CD2-CE1 4.16Å; Y700-Y719 HydrophobicContact CE2-CE1 4.15Å; G703-Y719 PolarHBondContact O-OH 3.16Å; R704-Y719 WeakPolarHBondContact CA-OH 3.47Å; R704-Y719 WeakPolarHBondContact CD-OH 3.44Å; R704-Y719 HydrophobicContact CG-CE1 4.43Å; R704-Y719 PolarHBondContact N-OH 3.49Å; H707-Y719 HydrophobicContact CB-CE2 4.47Å; H707-Y719 WeakPolarHBondContact CB-OH 3.28Å; H707-Y719 PolarHBondContact ND1-OH 3.11Å; A715-Y719 HydrophobicContact CB-CE2 4.04Å; A715-Y719 WeakPolarHBondContact O-CD2 3.34Å; A715-Y719 PolarHBondContact O-N 3.09Å; V716-Y719 PolarHBondContact O-N 2.81Å; E717-Y719 PolarHBondContact O-N 3.4Å; Y719-R721 VanDerWaalsContact C-N 3.33Å; Y719-R721 PolarHBondContact O-N 3.44Å; Y719-T722 WeakPolarHBondContact O-CA 3.38Å; Y719-T722 VanDerWaalsContact O-CB 3.26Å; Y719-T722 WeakPolarHBondContact O-CB 3.42Å; Y719-T722 PolarHBondContact O-N 3.07Å; Y719-T722 VanDerWaalsContact O-N 3.09Å; Y719-L723 WeakPolarHBondContact O-CG 3.33Å; Y719-L723 PolarHBondContact O-N 3.37Å; Y719-A743 HydrophobicContact CD1-CB 4.04Å; Y719-N746 HydrophobicContact CE1-CB 4.18Å; Y719-N746 HydrophobicContact CE2-CB 4.07Å; Y719-L747 HydrophobicContact CD2-CD2 3.94Å; Y719-L747 HydrophobicContact CD2-CG 4.08Å; Y719-L747 HydrophobicContact CG-CD2 4.32Å; Y719-L747 HydrophobicContact CG-CG 4.13Å; Y719-M750 HydrophobicContact CD2-SD 3.92Å; Y719-M750 HydrophobicContact CE2-CE 4.45Å; Y719-M750 HydrophobicContact CE2-SD 3.55Å; Y719-M750 VanDerWaalsContact CE2-SD 3.55Å
720	K	93.2	Very high	88.1	Confident	101 Å²	101	69.6 Å²	69.6	44%	0.439	37%	0.365	S	S	.	.	H	α-helix	trans	-59.8	-42.5	174.2	-75.4	178.5	177.9	179.4	0	111.9	V716 E717 T722 L723 A724	V716-K720 HydrophobicContact CG1-CD 4.08Å; V716-K720 HydrophobicContact CG1-CG 4.36Å; V716-K720 WeakPolarHBondContact O-CG 3.31Å; V716-K720 PolarHBondContact O-N 3.31Å; E717-K720 PolarHBondContact O-N 2.71Å; K720-T722 VanDerWaalsContact C-N 3.32Å; K720-T722 PolarHBondContact O-N 3.01Å; K720-L723 WeakPolarHBondContact O-CB 3.49Å; K720-L723 PolarHBondContact O-N 3.38Å; K720-L723 VanDerWaalsContact O-N 3.13Å; K720-A724 PolarHBondContact O-N 2.91Å; K720-A724 VanDerWaalsContact O-N 3.13Å
721	R	93.8	Very high	87	Confident	119 Å²	119	68.9 Å²	68.9	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-43.2	171.7	-70.1	174.8	-170.3	-167.9	1.4	111.8	E717 Y718 Y719 L723 A724 M725	E717-R721 WeakPolarHBondContact O-CG 3.37Å; E717-R721 PolarHBondContact O-N 2.89Å; E717-R721 IonicContact OE1-CZ 3.5Å; E717-R721 IonicContact OE1-NE 2.94Å; E717-R721 PolarHBondContact OE1-NE 3.35Å; E717-R721 IonicContact OE1-NH2 3.16Å; E717-R721 PolarHBondContact OE1-NH2 3.26Å; E717-R721 VanDerWaalsContact OE1-NH2 3.16Å; Y718-R721 PolarHBondContact O-N 3.02Å; Y719-R721 VanDerWaalsContact C-N 3.33Å; Y719-R721 PolarHBondContact O-N 3.44Å; R721-L723 PolarHBondContact O-N 3.21Å; R721-A724 PolarHBondContact O-N 3.32Å; R721-M725 VanDerWaalsContact O-CG 3.29Å; R721-M725 WeakPolarHBondContact O-CG 3.3Å; R721-M725 PolarHBondContact O-N 3.09Å
722	T	92.9	Very high	85.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-59	-35.3	175.6	-51.2	0	0	0	0	112.1	Q696 Y700 Y718 Y719 K720 L739 A743	Q696-T722 HydrophobicContact CG-CG2 3.74Å; Y700-T722 HydrophobicContact CD2-CG2 4.42Å; Y700-T722 PolarHBondContact N-OG1 3.4Å; Y718-T722 PolarHBondContact O-N 3.09Å; Y718-T722 PolarHBondContact O-OG1 3.45Å; Y719-T722 WeakPolarHBondContact O-CA 3.38Å; Y719-T722 VanDerWaalsContact O-CB 3.26Å; Y719-T722 WeakPolarHBondContact O-CB 3.42Å; Y719-T722 PolarHBondContact O-N 3.07Å; Y719-T722 VanDerWaalsContact O-N 3.09Å; K720-T722 VanDerWaalsContact C-N 3.32Å; K720-T722 PolarHBondContact O-N 3.01Å; T722-L739 HydrophobicContact CG2-CB 4.32Å; T722-A743 HydrophobicContact CG2-CB 4.06Å
723	L	90.4	Very high	84.3	Confident	23 Å²	23	72.7 Å²	72.7	12%	0.12	37%	0.372	C	S	.	.	H	α-helix	trans	-71.7	-30	175.8	-61.7	-179.9	0	0	0	113.7	Y719 K720 R721 M725 R740 A743 V744 L747 Y767	Y719-L723 WeakPolarHBondContact O-CG 3.33Å; Y719-L723 PolarHBondContact O-N 3.37Å; K720-L723 WeakPolarHBondContact O-CB 3.49Å; K720-L723 PolarHBondContact O-N 3.38Å; K720-L723 VanDerWaalsContact O-N 3.13Å; R721-L723 PolarHBondContact O-N 3.21Å; L723-M725 VanDerWaalsContact C-N 3.34Å; L723-R740 HydrophobicContact CD2-CB 4.02Å; L723-R740 HydrophobicContact CD2-CG 4.18Å; L723-A743 HydrophobicContact CD2-CB 4.1Å; L723-V744 HydrophobicContact CD1-CG2 4.28Å; L723-V744 HydrophobicContact CD2-CG2 3.46Å; L723-V744 VanDerWaalsContact CD2-CG2 3.46Å; L723-L747 HydrophobicContact CD1-CD1 3.75Å; L723-Y767 HydrophobicContact CD1-CE2 4.24Å
724	A	91	Very high	83.1	Confident	91 Å²	91	67.3 Å²	67.3	75%	0.752	35%	0.345	S	S	*	.	H	α-helix	trans	-80.3	-15.9	178.5	0	0	0	0	0	113.3	K720 R721	K720-A724 PolarHBondContact O-N 2.91Å; K720-A724 VanDerWaalsContact O-N 3.13Å; R721-A724 PolarHBondContact O-N 3.32Å
725	M	88.2	Confident	82	Confident	47 Å²	47	71.7 Å²	71.7	23%	0.232	36%	0.359	C	S	.	.	S	Bend	trans	-89.8	143.8	-178.4	-67.5	175.3	83.5	0	0	112.3	S694 Q696 C699 R721 L723	S694-M725 WeakPolarHBondContact O-CE 3.25Å; Q696-M725 HydrophobicContact CB-CB 4.47Å; C699-M725 HydrophobicContact CB-SD 4.11Å; R721-M725 VanDerWaalsContact O-CG 3.29Å; R721-M725 WeakPolarHBondContact O-CG 3.3Å; R721-M725 PolarHBondContact O-N 3.09Å; L723-M725 VanDerWaalsContact C-N 3.34Å
726	E	82	Confident	80.9	Confident	150 Å²	150	75.4 Å²	75.4	70%	0.701	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-75.8	151.9	169.4	-67.8	-170.3	164.4	0	0	111.3	D728	E726-D728 PolarHBondContact O-N 3.04Å
727	P	78.1	Confident	80	Confident	29 Å²	29	76.7 Å²	76.7	19%	0.188	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-64.7	130.5	176.8	25.8	-33.8	0	0	0	111.5	V729 S734 D738	P727-V729 PolarHBondContact O-N 3.42Å; P727-V729 VanDerWaalsContact O-N 3.07Å; P727-S734 VanDerWaalsContact CG-OG 3.32Å; P727-S734 WeakPolarHBondContact CG-OG 3.41Å; P727-D738 HydrophobicContact CB-CB 4.44Å
728	D	72.3	Confident	79.5	Confident	76 Å²	76	73.9 Å²	73.9	41%	0.406	37%	0.374	S	S	.	.	S	Bend	trans	-63.3	-20	-172.4	-58.7	-40.5	0	0	0	114.3	C695 Q696 E726	C695-D728 WeakPolarHBondContact CB-OD1 3.37Å; C695-D728 VanDerWaalsContact CB-OD2 3.28Å; C695-D728 WeakPolarHBondContact CB-OD2 3.34Å; Q696-D728 PolarHBondContact N-OD1 3.35Å; Q696-D728 PolarHBondContact N-OD2 2.99Å; E726-D728 PolarHBondContact O-N 3.04Å
729	V	70	Confident	79.1	Confident	57 Å²	57	73.4 Å²	73.4	35%	0.345	37%	0.374	S	S	.	.			trans	-106.3	96.3	-171.6	-173.8	0	0	0	0	110.9	P727 S731 S734 F737	P727-V729 PolarHBondContact O-N 3.42Å; P727-V729 VanDerWaalsContact O-N 3.07Å; V729-S731 VanDerWaalsContact C-N 3.29Å; V729-S731 PolarHBondContact O-N 3.49Å; V729-S734 VanDerWaalsContact O-CB 3.25Å; V729-S734 WeakPolarHBondContact O-CB 3.27Å; V729-S734 PolarHBondContact O-OG 2.94Å; V729-S734 VanDerWaalsContact O-OG 3.13Å; V729-F737 HydrophobicContact CB-CB 4.29Å; V729-F737 HydrophobicContact CB-CD2 3.85Å; V729-F737 HydrophobicContact CB-CE2 4.48Å; V729-F737 HydrophobicContact CB-CG 4.16Å; V729-F737 HydrophobicContact CG1-CD2 3.91Å; V729-F737 HydrophobicContact CG1-CE2 4.06Å; V729-F737 HydrophobicContact CG2-CB 4.19Å; V729-F737 HydrophobicContact CG2-CD1 4.48Å; V729-F737 HydrophobicContact CG2-CD2 4.13Å; V729-F737 HydrophobicContact CG2-CG 4Å
730	R	67.5	Low	78.8	Confident	238 Å²	238	77.5 Å²	77.5	90%	0.898	39%	0.389	S	S	*	.			trans	-70.2	83.4	169.4	-62.8	-178.6	-175.2	173.9	0.6	110.3
731	S	65.2	Low	78.5	Confident	39 Å²	39	75.8 Å²	75.8	27%	0.273	39%	0.388	S	S	.	.	S	Bend	trans	-140	159.1	174.3	72	0	0	0	0	109.4	V729 H733 S734	V729-S731 VanDerWaalsContact C-N 3.29Å; V729-S731 PolarHBondContact O-N 3.49Å; S731-H733 PolarHBondContact O-N 2.96Å; S731-H733 PolarHBondContact OG-N 2.92Å; S731-S734 VanDerWaalsContact O-CB 3.26Å; S731-S734 WeakPolarHBondContact O-CB 3.38Å; S731-S734 PolarHBondContact O-N 3.46Å; S731-S734 PolarHBondContact OG-N 2.78Å
732	P	62.7	Low	78.3	Confident	122 Å²	122	74.2 Å²	74.2	79%	0.792	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-13.7	174	20.7	-32.1	0	0	0	113.3
733	H	63	Low	78.3	Confident	81 Å²	81	74.2 Å²	74.2	38%	0.375	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	26	174.3	-53.9	-69.7	0	0	0	113.3	K587 S731 F735 V736	K587-H733 PolarHBondContact NZ-CD2 2.86Å; K587-H733 PolarHBondContact NZ-NE2 3.48Å; S731-H733 PolarHBondContact O-N 2.96Å; S731-H733 PolarHBondContact OG-N 2.92Å; H733-F735 HydrophobicContact CB-CE1 4.3Å; H733-F735 PolarHBondContact O-N 3.36Å; H733-F735 VanDerWaalsContact O-N 3.17Å; H733-V736 HydrophobicContact CB-CG2 4.29Å; H733-V736 WeakPolarHBondContact O-CB 3.19Å; H733-V736 PolarHBondContact O-N 2.8Å
734	S	67.2	Low	78.4	Confident	30 Å²	30	73.1 Å²	73.1	21%	0.21	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-52.3	-36.3	180	-177.8	0	0	0	0	112.2	P727 V729 S731 V736 F737 D738	P727-S734 VanDerWaalsContact CG-OG 3.32Å; P727-S734 WeakPolarHBondContact CG-OG 3.41Å; V729-S734 VanDerWaalsContact O-CB 3.25Å; V729-S734 WeakPolarHBondContact O-CB 3.27Å; V729-S734 PolarHBondContact O-OG 2.94Å; V729-S734 VanDerWaalsContact O-OG 3.13Å; S731-S734 VanDerWaalsContact O-CB 3.26Å; S731-S734 WeakPolarHBondContact O-CB 3.38Å; S731-S734 PolarHBondContact O-N 3.46Å; S731-S734 PolarHBondContact OG-N 2.78Å; S734-V736 PolarHBondContact O-N 3.48Å; S734-F737 PolarHBondContact O-N 2.84Å; S734-D738 PolarHBondContact O-N 3.31Å
735	F	71.8	Confident	78.4	Confident	151 Å²	151	73.9 Å²	73.9	66%	0.662	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-54.6	-29.2	177.4	72.6	-92	0	0	0	114.3	H733 F737	H733-F735 HydrophobicContact CB-CE1 4.3Å; H733-F735 PolarHBondContact O-N 3.36Å; H733-F735 VanDerWaalsContact O-N 3.17Å; F735-F737 VanDerWaalsContact C-N 3.28Å; F735-F737 PolarHBondContact O-N 3.23Å
736	V	71.2	Confident	78.7	Confident	78 Å²	78	72.3 Å²	72.3	47%	0.473	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-73.2	-25.5	179.8	-176.5	0	0	0	0	111.7	H733 S734	H733-V736 HydrophobicContact CB-CG2 4.29Å; H733-V736 WeakPolarHBondContact O-CB 3.19Å; H733-V736 PolarHBondContact O-N 2.8Å; S734-V736 PolarHBondContact O-N 3.48Å
737	F	73.8	Confident	79.2	Confident	50 Å²	50	65.2 Å²	65.2	22%	0.219	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-2.8	-177.7	-60.2	-71.7	0	0	0	112.8	K586 K587 V729 S734 F735 L739	K586-F737 WeakPolarHBondContact O-CE1 3.49Å; K587-F737 HydrophobicContact CG-CZ 4.13Å; V729-F737 HydrophobicContact CB-CB 4.29Å; V729-F737 HydrophobicContact CB-CD2 3.85Å; V729-F737 HydrophobicContact CB-CE2 4.48Å; V729-F737 HydrophobicContact CB-CG 4.16Å; V729-F737 HydrophobicContact CG1-CD2 3.91Å; V729-F737 HydrophobicContact CG1-CE2 4.06Å; V729-F737 HydrophobicContact CG2-CB 4.19Å; V729-F737 HydrophobicContact CG2-CD1 4.48Å; V729-F737 HydrophobicContact CG2-CD2 4.13Å; V729-F737 HydrophobicContact CG2-CG 4Å; S734-F737 PolarHBondContact O-N 2.84Å; F735-F737 VanDerWaalsContact C-N 3.28Å; F735-F737 PolarHBondContact O-N 3.23Å; F737-L739 PolarHBondContact O-N 3.09Å
738	D	84.4	Confident	79.8	Confident	28 Å²	28	64.7 Å²	64.7	15%	0.15	33%	0.325	C	S	.	.			trans	-74.4	119.1	-179.8	-171.5	6.6	0	0	0	111.1	Q696 P727 S734 R740	Q696-D738 PolarHBondContact NE2-OD1 3.49Å; P727-D738 HydrophobicContact CB-CB 4.44Å; S734-D738 PolarHBondContact O-N 3.31Å; D738-R740 VanDerWaalsContact CG-NE 3.29Å; D738-R740 WeakPolarHBondContact OD1-CB 3.27Å; D738-R740 VanDerWaalsContact OD1-CG 3.23Å; D738-R740 WeakPolarHBondContact OD1-CG 3.37Å; D738-R740 IonicContact OD1-CZ 2.96Å; D738-R740 PolarHBondContact OD1-N 2.88Å; D738-R740 IonicContact OD1-NE 3Å; D738-R740 PolarHBondContact OD1-NE 3.31Å; D738-R740 IonicContact OD2-CZ 3.43Å; D738-R740 IonicContact OD2-NE 3.23Å; D738-R740 PolarHBondContact OD2-NE 3.17Å; D738-R740 IonicContact OD2-NH2 3.55Å; D738-R740 PolarHBondContact OD2-NH2 2.95Å
739	L	87.5	Confident	80.7	Confident	31 Å²	31	63.2 Å²	63.2	16%	0.162	32%	0.32	C	S	.	.			trans	-91.9	-2.9	-179.4	-60.7	175.1	0	0	0	113.2	Q696 E697 Y700 T722 F737 L742 A743	Q696-L739 HydrophobicContact CG-CB 4.21Å; E697-L739 HydrophobicContact CB-CD1 4.2Å; Y700-L739 HydrophobicContact CD1-CD1 4.29Å; Y700-L739 HydrophobicContact CD2-CB 4.42Å; Y700-L739 HydrophobicContact CG-CB 4.37Å; Y700-L739 HydrophobicContact CG-CD1 4.14Å; T722-L739 HydrophobicContact CG2-CB 4.32Å; F737-L739 PolarHBondContact O-N 3.09Å; L739-L742 HydrophobicContact CD2-CD1 3.89Å; L739-L742 PolarHBondContact O-N 3.37Å; L739-A743 PolarHBondContact O-N 3.29Å
740	R	88.8	Confident	81.8	Confident	87 Å²	87	60.7 Å²	60.7	33%	0.328	31%	0.305	S	S	.	.	H	α-helix	trans	-55.2	-48.3	178.3	-67.7	175.5	-64.4	-179.8	4.6	112.6	L723 D738 L742 A743 V744	L723-R740 HydrophobicContact CD2-CB 4.02Å; L723-R740 HydrophobicContact CD2-CG 4.18Å; D738-R740 VanDerWaalsContact CG-NE 3.29Å; D738-R740 WeakPolarHBondContact OD1-CB 3.27Å; D738-R740 VanDerWaalsContact OD1-CG 3.23Å; D738-R740 WeakPolarHBondContact OD1-CG 3.37Å; D738-R740 IonicContact OD1-CZ 2.96Å; D738-R740 PolarHBondContact OD1-N 2.88Å; D738-R740 IonicContact OD1-NE 3Å; D738-R740 PolarHBondContact OD1-NE 3.31Å; D738-R740 IonicContact OD2-CZ 3.43Å; D738-R740 IonicContact OD2-NE 3.23Å; D738-R740 PolarHBondContact OD2-NE 3.17Å; D738-R740 IonicContact OD2-NH2 3.55Å; D738-R740 PolarHBondContact OD2-NH2 2.95Å; R740-L742 VanDerWaalsContact C-N 3.25Å; R740-L742 PolarHBondContact O-N 3.3Å; R740-A743 PolarHBondContact O-N 3.45Å; R740-A743 VanDerWaalsContact O-N 3.1Å; R740-V744 WeakPolarHBondContact O-CG2 3.26Å; R740-V744 PolarHBondContact O-N 3.05Å
741	P	87.6	Confident	82.9	Confident	64 Å²	64	51.1 Å²	51.1	42%	0.416	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-37	-179.7	-23.7	35	0	0	0	112.9	H745	P741-H745 WeakPolarHBondContact O-CB 3.36Å; P741-H745 PolarHBondContact O-N 3.34Å
742	L	88.8	Confident	84.1	Confident	87 Å²	87	53.1 Å²	53.1	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-71.6	-37.8	177.6	-63	175.5	0	0	0	112.2	Y700 L739 R740 N746	Y700-L742 HydrophobicContact CE2-CB 3.76Å; L739-L742 HydrophobicContact CD2-CD1 3.89Å; L739-L742 PolarHBondContact O-N 3.37Å; R740-L742 VanDerWaalsContact C-N 3.25Å; R740-L742 PolarHBondContact O-N 3.3Å; L742-N746 VanDerWaalsContact O-CG 3.26Å; L742-N746 PolarHBondContact O-N 3.19Å; L742-N746 PolarHBondContact O-ND2 3.32Å
743	A	92.5	Very high	85.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.4	-44.3	175.2	0	0	0	0	0	111.2	Y700 Y719 T722 L723 L739 R740 N746 L747	Y700-A743 HydrophobicContact CD2-CB 4.14Å; Y700-A743 HydrophobicContact CE2-CB 4.38Å; Y719-A743 HydrophobicContact CD1-CB 4.04Å; T722-A743 HydrophobicContact CG2-CB 4.06Å; L723-A743 HydrophobicContact CD2-CB 4.1Å; L739-A743 PolarHBondContact O-N 3.29Å; R740-A743 PolarHBondContact O-N 3.45Å; R740-A743 VanDerWaalsContact O-N 3.1Å; A743-N746 PolarHBondContact O-N 2.81Å; A743-L747 WeakPolarHBondContact O-CG 3.31Å; A743-L747 PolarHBondContact O-N 3.1Å
744	V	92.6	Very high	86.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.2	-48.5	175	172.7	0	0	0	0	110.9	L723 R740 N746 L747 I748 L763 Y767 L768	L723-V744 HydrophobicContact CD1-CG2 4.28Å; L723-V744 HydrophobicContact CD2-CG2 3.46Å; L723-V744 VanDerWaalsContact CD2-CG2 3.46Å; R740-V744 WeakPolarHBondContact O-CG2 3.26Å; R740-V744 PolarHBondContact O-N 3.05Å; V744-N746 VanDerWaalsContact C-N 3.29Å; V744-N746 PolarHBondContact O-N 2.83Å; V744-L747 PolarHBondContact O-N 3.37Å; V744-L747 VanDerWaalsContact O-N 3.17Å; V744-I748 HydrophobicContact CG1-CD1 3.61Å; V744-I748 HydrophobicContact CG1-CG1 4.23Å; V744-I748 WeakPolarHBondContact O-CG1 3.36Å; V744-I748 PolarHBondContact O-N 2.97Å; V744-L763 HydrophobicContact CG1-CB 4.44Å; V744-Y767 HydrophobicContact CG2-CD1 4.28Å; V744-Y767 HydrophobicContact CG2-CD2 3.71Å; V744-Y767 HydrophobicContact CG2-CE2 4.41Å; V744-Y767 HydrophobicContact CG2-CG 3.65Å; V744-L768 HydrophobicContact CG1-CD1 4.12Å; V744-L768 HydrophobicContact CG1-CG 4.11Å
745	H	91.9	Very high	87.9	Confident	106 Å²	106	58.9 Å²	58.9	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-56.5	-44.1	178.2	178.4	74	0	0	0	112.1	P741 I748 C749	P741-H745 WeakPolarHBondContact O-CB 3.36Å; P741-H745 PolarHBondContact O-N 3.34Å; H745-I748 PolarHBondContact O-N 3Å; H745-C749 PolarHBondContact O-N 2.8Å; H745-C749 PolarHBondContact O-SG 3.41Å
746	N	93.1	Very high	88.8	Confident	15 Å²	15	54.8 Å²	54.8	8%	0.08	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-42.2	177.2	-69.2	-28.3	0	0	0	112.4	Y700 R704 Y719 L742 A743 V744 C749 M750	Y700-N746 PolarHBondContact OH-ND2 2.97Å; R704-N746 VanDerWaalsContact CD-ND2 3.25Å; R704-N746 WeakPolarHBondContact CD-ND2 3.31Å; R704-N746 PolarHBondContact NH1-ND2 3.21Å; R704-N746 PolarHBondContact NH1-OD1 2.71Å; Y719-N746 HydrophobicContact CE1-CB 4.18Å; Y719-N746 HydrophobicContact CE2-CB 4.07Å; L742-N746 VanDerWaalsContact O-CG 3.26Å; L742-N746 PolarHBondContact O-N 3.19Å; L742-N746 PolarHBondContact O-ND2 3.32Å; A743-N746 PolarHBondContact O-N 2.81Å; V744-N746 VanDerWaalsContact C-N 3.29Å; V744-N746 PolarHBondContact O-N 2.83Å; N746-C749 WeakPolarHBondContact O-CB 3.26Å; N746-C749 PolarHBondContact O-N 2.98Å; N746-M750 VanDerWaalsContact O-CG 3.27Å; N746-M750 WeakPolarHBondContact O-CG 3.35Å; N746-M750 PolarHBondContact O-N 2.93Å
747	L	92.8	Very high	89.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-43.2	176.2	-78.8	170.6	0	0	0	111.9	V716 Y719 L723 A743 V744 C749 M750 Y751 L763	V716-L747 HydrophobicContact CB-CD2 4.23Å; V716-L747 HydrophobicContact CG1-CD2 3.93Å; V716-L747 HydrophobicContact CG2-CD2 4.14Å; Y719-L747 HydrophobicContact CD2-CD2 3.94Å; Y719-L747 HydrophobicContact CD2-CG 4.08Å; Y719-L747 HydrophobicContact CG-CD2 4.32Å; Y719-L747 HydrophobicContact CG-CG 4.13Å; L723-L747 HydrophobicContact CD1-CD1 3.75Å; A743-L747 WeakPolarHBondContact O-CG 3.31Å; A743-L747 PolarHBondContact O-N 3.1Å; V744-L747 PolarHBondContact O-N 3.37Å; V744-L747 VanDerWaalsContact O-N 3.17Å; L747-C749 VanDerWaalsContact C-N 3.32Å; L747-C749 PolarHBondContact O-N 2.93Å; L747-M750 PolarHBondContact O-N 2.99Å; L747-Y751 PolarHBondContact O-N 3.3Å; L747-L763 HydrophobicContact CB-CD1 3.8Å; L747-L763 HydrophobicContact CD1-CD1 4.22Å
748	I	92	Very high	90.6	Very high	18 Å²	18	56.9 Å²	56.9	9%	0.092	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-45.1	175.4	-71	168.4	0	0	0	110.4	V744 H745 M750 Y751 N752 A760 L763 M764 L768	V744-I748 HydrophobicContact CG1-CD1 3.61Å; V744-I748 HydrophobicContact CG1-CG1 4.23Å; V744-I748 WeakPolarHBondContact O-CG1 3.36Å; V744-I748 PolarHBondContact O-N 2.97Å; H745-I748 PolarHBondContact O-N 3Å; I748-M750 VanDerWaalsContact C-N 3.31Å; I748-M750 PolarHBondContact O-N 3.48Å; I748-Y751 PolarHBondContact O-N 3.17Å; I748-N752 WeakPolarHBondContact O-CB 3.44Å; I748-N752 VanDerWaalsContact O-CG 3.25Å; I748-N752 PolarHBondContact O-N 3.34Å; I748-N752 PolarHBondContact O-ND2 3.01Å; I748-A760 HydrophobicContact CG2-CB 4.35Å; I748-L763 HydrophobicContact CG1-CB 4.19Å; I748-M764 HydrophobicContact CD1-CB 4.03Å; I748-L768 HydrophobicContact CD1-CD1 3.42Å; I748-L768 VanDerWaalsContact CD1-CD1 3.42Å
749	C	91.1	Very high	90.8	Very high	44 Å²	44	56.6 Å²	56.6	30%	0.297	31%	0.305	S	S	.	.	H	α-helix	trans	-59.5	-43.1	176.3	-67.1	0	0	0	0	111.7	H745 N746 L747 N752 Q753	H745-C749 PolarHBondContact O-N 2.8Å; H745-C749 PolarHBondContact O-SG 3.41Å; N746-C749 WeakPolarHBondContact O-CB 3.26Å; N746-C749 PolarHBondContact O-N 2.98Å; L747-C749 VanDerWaalsContact C-N 3.32Å; L747-C749 PolarHBondContact O-N 2.93Å; C749-N752 PolarHBondContact O-N 3.05Å; C749-Q753 WeakPolarHBondContact O-CG 3.36Å; C749-Q753 PolarHBondContact O-N 2.94Å
750	M	91.5	Very high	90.9	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-42.7	178.6	-67.7	165.5	74.7	0	0	112.1	V712 A715 V716 Y719 N746 L747 I748 N752 Q753 S754	V712-M750 HydrophobicContact CB-CE 4.1Å; V712-M750 HydrophobicContact CG1-CE 3.31Å; V712-M750 VanDerWaalsContact O-CE 3.29Å; V712-M750 WeakPolarHBondContact O-CE 3.25Å; A715-M750 HydrophobicContact CB-CE 3.9Å; V716-M750 HydrophobicContact CG2-CE 3.43Å; V716-M750 VanDerWaalsContact CG2-CE 3.43Å; V716-M750 HydrophobicContact CG2-SD 4.45Å; Y719-M750 HydrophobicContact CD2-SD 3.92Å; Y719-M750 HydrophobicContact CE2-CE 4.45Å; Y719-M750 HydrophobicContact CE2-SD 3.55Å; Y719-M750 VanDerWaalsContact CE2-SD 3.55Å; N746-M750 VanDerWaalsContact O-CG 3.27Å; N746-M750 WeakPolarHBondContact O-CG 3.35Å; N746-M750 PolarHBondContact O-N 2.93Å; L747-M750 PolarHBondContact O-N 2.99Å; I748-M750 VanDerWaalsContact C-N 3.31Å; I748-M750 PolarHBondContact O-N 3.48Å; M750-N752 VanDerWaalsContact C-N 3.34Å; M750-Q753 WeakPolarHBondContact O-CB 3.38Å; M750-Q753 PolarHBondContact O-N 3.24Å; M750-S754 PolarHBondContact O-N 3.24Å; M750-S754 PolarHBondContact O-OG 2.96Å
751	Y	91.6	Very high	90.9	Very high	37 Å²	37	57.3 Å²	57.3	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-66.5	-36	176.7	-69.9	-21.8	0	0	0	112.6	L747 I748 S754 N755 N756 A759 L763	L747-Y751 PolarHBondContact O-N 3.3Å; I748-Y751 PolarHBondContact O-N 3.17Å; Y751-S754 WeakPolarHBondContact CA-OG 3.26Å; Y751-S754 CarbonylContact O-C 3.6Å; Y751-S754 PolarHBondContact O-N 3.29Å; Y751-S754 PolarHBondContact O-OG 3.46Å; Y751-N755 PolarHBondContact O-N 2.77Å; Y751-N755 VanDerWaalsContact O-N 3.16Å; Y751-N756 PolarHBondContact O-N 3.46Å; Y751-A759 HydrophobicContact CD2-CB 3.8Å; Y751-A759 HydrophobicContact CE2-CB 3.86Å; Y751-A759 HydrophobicContact CG-CB 4.34Å; Y751-L763 HydrophobicContact CD2-CD1 3.85Å; Y751-L763 HydrophobicContact CE2-CD1 3.39Å; Y751-L763 HydrophobicContact CE2-CG 4.25Å
752	N	90.9	Very high	90.9	Very high	80 Å²	80	59 Å²	59	43%	0.428	32%	0.315	S	S	.	.	H	α-helix	trans	-65.1	-41.5	172	-73.5	-22.4	0	0	0	111.5	I748 C749 M750 S754 N755 A760	I748-N752 WeakPolarHBondContact O-CB 3.44Å; I748-N752 VanDerWaalsContact O-CG 3.25Å; I748-N752 PolarHBondContact O-N 3.34Å; I748-N752 PolarHBondContact O-ND2 3.01Å; C749-N752 PolarHBondContact O-N 3.05Å; M750-N752 VanDerWaalsContact C-N 3.34Å; N752-S754 VanDerWaalsContact C-N 3.26Å; N752-S754 PolarHBondContact O-N 3.11Å; N752-N755 PolarHBondContact O-N 3.24Å; N752-N755 VanDerWaalsContact O-N 3.13Å; N752-A760 WeakPolarHBondContact OD1-CB 3.37Å
753	Q	90.9	Very high	90.9	Very high	144 Å²	144	56.1 Å²	56.1	67%	0.673	30%	0.3	S	S	*	.	H	α-helix	trans	-63.7	-31.6	174.7	-74.5	173.3	-4.3	0	0	112.6	C749 M750 N755	C749-Q753 WeakPolarHBondContact O-CG 3.36Å; C749-Q753 PolarHBondContact O-N 2.94Å; M750-Q753 WeakPolarHBondContact O-CB 3.38Å; M750-Q753 PolarHBondContact O-N 3.24Å; Q753-N755 VanDerWaalsContact C-N 3.32Å
754	S	90.2	Very high	90.6	Very high	75 Å²	75	60.9 Å²	60.9	52%	0.524	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	8.3	175.6	76.4	0	0	0	0	114	M750 Y751 N752 N756	M750-S754 PolarHBondContact O-N 3.24Å; M750-S754 PolarHBondContact O-OG 2.96Å; Y751-S754 WeakPolarHBondContact CA-OG 3.26Å; Y751-S754 CarbonylContact O-C 3.6Å; Y751-S754 PolarHBondContact O-N 3.29Å; Y751-S754 PolarHBondContact O-OG 3.46Å; N752-S754 VanDerWaalsContact C-N 3.26Å; N752-S754 PolarHBondContact O-N 3.11Å; S754-N756 PolarHBondContact O-N 3.2Å
755	N	90.2	Very high	90.2	Very high	135 Å²	135	67.1 Å²	67.1	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	21.9	-174.2	-67.3	-36.7	0	0	0	115.8	Y751 N752 Q753 I757	Y751-N755 PolarHBondContact O-N 2.77Å; Y751-N755 VanDerWaalsContact O-N 3.16Å; N752-N755 PolarHBondContact O-N 3.24Å; N752-N755 VanDerWaalsContact O-N 3.13Å; Q753-N755 VanDerWaalsContact C-N 3.32Å; N755-I757 PolarHBondContact O-N 3.37Å
756	N	91.7	Very high	89.9	Confident	66 Å²	66	69.3 Å²	69.3	35%	0.353	36%	0.361	S	S	.	.			trans	-91.4	71.7	175.4	-168.6	-11.1	0	0	0	110.9	Y751 S754 S758 A759 A760	Y751-N756 PolarHBondContact O-N 3.46Å; S754-N756 PolarHBondContact O-N 3.2Å; N756-S758 VanDerWaalsContact C-N 3.33Å; N756-S758 PolarHBondContact O-N 3.43Å; N756-S758 PolarHBondContact OD1-OG 3.47Å; N756-S758 VanDerWaalsContact OD1-OG 3.1Å; N756-A759 WeakPolarHBondContact OD1-CB 3.39Å; N756-A759 PolarHBondContact OD1-N 3.4Å; N756-A760 PolarHBondContact O-N 3.1Å
757	I	90.4	Very high	89.2	Confident	94 Å²	94	71.7 Å²	71.7	48%	0.482	37%	0.369	S	S	.	.	H	α-helix	trans	-68.6	-32.6	-172.9	-56.8	169.5	0	0	0	111.7	N755 A760 K761	N755-I757 PolarHBondContact O-N 3.37Å; I757-A760 PolarHBondContact O-N 3.17Å; I757-K761 HydrophobicContact CG2-CD 4.32Å; I757-K761 HydrophobicContact CG2-CG 4.46Å; I757-K761 WeakPolarHBondContact O-CG 3.38Å; I757-K761 PolarHBondContact O-N 3.35Å
758	S	91.5	Very high	88.2	Confident	78 Å²	78	75 Å²	75	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-52	178.2	48.6	0	0	0	0	111.1	N756 A760 K761 D762	N756-S758 VanDerWaalsContact C-N 3.33Å; N756-S758 PolarHBondContact O-N 3.43Å; N756-S758 PolarHBondContact OD1-OG 3.47Å; N756-S758 VanDerWaalsContact OD1-OG 3.1Å; S758-A760 VanDerWaalsContact C-N 3.25Å; S758-A760 PolarHBondContact O-N 3.11Å; S758-K761 WeakPolarHBondContact O-CB 3.41Å; S758-K761 PolarHBondContact O-N 3.12Å; S758-K761 VanDerWaalsContact O-N 3.1Å; S758-D762 VanDerWaalsContact O-CG 3.3Å; S758-D762 PolarHBondContact O-N 2.76Å
759	A	89.3	Confident	86.9	Confident	21 Å²	21	80.4 Å²	80.4	17%	0.174	42%	0.415	C	S	.	.	H	α-helix	trans	-62.4	-33.5	178.4	0	0	0	0	0	112.8	Y751 N756 L763	Y751-A759 HydrophobicContact CD2-CB 3.8Å; Y751-A759 HydrophobicContact CE2-CB 3.86Å; Y751-A759 HydrophobicContact CG-CB 4.34Å; N756-A759 WeakPolarHBondContact OD1-CB 3.39Å; N756-A759 PolarHBondContact OD1-N 3.4Å; A759-L763 WeakPolarHBondContact O-CG 3.49Å; A759-L763 PolarHBondContact O-N 2.91Å; A759-L763 VanDerWaalsContact O-N 3.15Å
760	A	89.7	Confident	85.1	Confident	4 Å²	4	89 Å²	89	3%	0.033	46%	0.457	C	S	.	.	H	α-helix	trans	-64.9	-44	174.1	0	0	0	0	0	112	I748 N752 N756 I757 S758 M764	I748-A760 HydrophobicContact CG2-CB 4.35Å; N752-A760 WeakPolarHBondContact OD1-CB 3.37Å; N756-A760 PolarHBondContact O-N 3.1Å; I757-A760 PolarHBondContact O-N 3.17Å; S758-A760 VanDerWaalsContact C-N 3.25Å; S758-A760 PolarHBondContact O-N 3.11Å; A760-M764 WeakPolarHBondContact O-CB 3.47Å; A760-M764 PolarHBondContact O-N 3.41Å
761	K	88.5	Confident	84.8	Confident	129 Å²	129	93.3 Å²	93.3	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-63.6	-44.1	176.4	-76.3	178.2	177.5	-179.2	0	112	I757 S758 L763 M764 Q765	I757-K761 HydrophobicContact CG2-CD 4.32Å; I757-K761 HydrophobicContact CG2-CG 4.46Å; I757-K761 WeakPolarHBondContact O-CG 3.38Å; I757-K761 PolarHBondContact O-N 3.35Å; S758-K761 WeakPolarHBondContact O-CB 3.41Å; S758-K761 PolarHBondContact O-N 3.12Å; S758-K761 VanDerWaalsContact O-N 3.1Å; K761-L763 VanDerWaalsContact C-N 3.35Å; K761-L763 PolarHBondContact O-N 3.25Å; K761-M764 WeakPolarHBondContact O-CB 3.46Å; K761-M764 PolarHBondContact O-N 3.47Å; K761-Q765 WeakPolarHBondContact O-CG 3.44Å; K761-Q765 PolarHBondContact O-N 3.46Å
762	D	88.9	Confident	84.4	Confident	100 Å²	100	96.2 Å²	96.2	54%	0.535	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-43.3	179.6	-64.1	-15.2	0	0	0	111.5	S758 Q765 K766	S758-D762 VanDerWaalsContact O-CG 3.3Å; S758-D762 PolarHBondContact O-N 2.76Å; D762-Q765 PolarHBondContact O-N 3.13Å; D762-K766 WeakPolarHBondContact O-CB 3.44Å; D762-K766 PolarHBondContact O-N 3.38Å
763	L	87.5	Confident	84.1	Confident	27 Å²	27	97.1 Å²	97.1	14%	0.141	50%	0.5	C	S	.	.	H	α-helix	trans	-65.3	-40.4	175.1	-78.9	-175.2	0	0	0	112.6	V744 L747 I748 Y751 A759 K761 K766 Y767	V744-L763 HydrophobicContact CG1-CB 4.44Å; L747-L763 HydrophobicContact CB-CD1 3.8Å; L747-L763 HydrophobicContact CD1-CD1 4.22Å; I748-L763 HydrophobicContact CG1-CB 4.19Å; Y751-L763 HydrophobicContact CD2-CD1 3.85Å; Y751-L763 HydrophobicContact CE2-CD1 3.39Å; Y751-L763 HydrophobicContact CE2-CG 4.25Å; A759-L763 WeakPolarHBondContact O-CG 3.49Å; A759-L763 PolarHBondContact O-N 2.91Å; A759-L763 VanDerWaalsContact O-N 3.15Å; K761-L763 VanDerWaalsContact C-N 3.35Å; K761-L763 PolarHBondContact O-N 3.25Å; L763-K766 PolarHBondContact O-N 2.92Å; L763-Y767 HydrophobicContact CD2-CD2 4.18Å; L763-Y767 HydrophobicContact CD2-CE2 4Å; L763-Y767 PolarHBondContact O-N 3.47Å; L763-Y767 VanDerWaalsContact O-N 3.15Å
764	M	86.2	Confident	83.7	Confident	100 Å²	100	94.4 Å²	94.4	49%	0.493	49%	0.49	S	S	.	.	H	α-helix	trans	-62.6	-44.7	178	-172.7	170.5	-174.9	0	0	110.9	I748 A760 K761 K766 L768	I748-M764 HydrophobicContact CD1-CB 4.03Å; A760-M764 WeakPolarHBondContact O-CB 3.47Å; A760-M764 PolarHBondContact O-N 3.41Å; K761-M764 WeakPolarHBondContact O-CB 3.46Å; K761-M764 PolarHBondContact O-N 3.47Å; M764-K766 VanDerWaalsContact C-N 3.35Å; M764-K766 PolarHBondContact O-N 3.44Å; M764-L768 HydrophobicContact CB-CD1 4.43Å; M764-L768 HydrophobicContact CG-CB 4.2Å; M764-L768 HydrophobicContact CG-CD1 3.98Å; M764-L768 WeakPolarHBondContact O-CB 3.49Å; M764-L768 PolarHBondContact O-N 3.47Å
765	Q	85.1	Confident	83.3	Confident	131 Å²	131	95.6 Å²	95.6	61%	0.612	49%	0.488	S	S	*	.	H	α-helix	trans	-63.8	-39.7	176.6	-72.8	179.9	-5.4	0	0	112.5	K761 D762 L769	K761-Q765 WeakPolarHBondContact O-CG 3.44Å; K761-Q765 PolarHBondContact O-N 3.46Å; D762-Q765 PolarHBondContact O-N 3.13Å; Q765-L769 HydrophobicContact CB-CD1 4.31Å; Q765-L769 HydrophobicContact CG-CD1 4.09Å
766	K	84.8	Confident	82.8	Confident	151 Å²	151	92.9 Å²	92.9	66%	0.657	47%	0.472	S	S	*	.	H	α-helix	trans	-72.3	-31	-175.9	-172.3	171.2	178.7	-179.6	0	114.3	D762 L763 M764	D762-K766 WeakPolarHBondContact O-CB 3.44Å; D762-K766 PolarHBondContact O-N 3.38Å; L763-K766 PolarHBondContact O-N 2.92Å; M764-K766 VanDerWaalsContact C-N 3.35Å; M764-K766 PolarHBondContact O-N 3.44Å
767	Y	79.3	Confident	82.2	Confident	65 Å²	65	94.9 Å²	94.9	26%	0.255	48%	0.481	S	S	.	.	H	α-helix	trans	-130	-19.6	-167.9	-66.4	-79	0	0	0	116	L723 V744 L763	L723-Y767 HydrophobicContact CD1-CE2 4.24Å; V744-Y767 HydrophobicContact CG2-CD1 4.28Å; V744-Y767 HydrophobicContact CG2-CD2 3.71Å; V744-Y767 HydrophobicContact CG2-CE2 4.41Å; V744-Y767 HydrophobicContact CG2-CG 3.65Å; L763-Y767 HydrophobicContact CD2-CD2 4.18Å; L763-Y767 HydrophobicContact CD2-CE2 4Å; L763-Y767 PolarHBondContact O-N 3.47Å; L763-Y767 VanDerWaalsContact O-N 3.15Å
768	L	71.4	Confident	81.5	Confident	71 Å²	71	94.9 Å²	94.9	37%	0.372	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-11.1	-175.5	-68	171.3	0	0	0	114	V744 I748 M764 L770	V744-L768 HydrophobicContact CG1-CD1 4.12Å; V744-L768 HydrophobicContact CG1-CG 4.11Å; I748-L768 HydrophobicContact CD1-CD1 3.42Å; I748-L768 VanDerWaalsContact CD1-CD1 3.42Å; M764-L768 HydrophobicContact CB-CD1 4.43Å; M764-L768 HydrophobicContact CG-CB 4.2Å; M764-L768 HydrophobicContact CG-CD1 3.98Å; M764-L768 WeakPolarHBondContact O-CB 3.49Å; M764-L768 PolarHBondContact O-N 3.47Å; L768-L770 VanDerWaalsContact C-N 3.31Å; L768-L770 PolarHBondContact O-N 3.28Å
769	L	63.5	Low	80.7	Confident	131 Å²	131	96.3 Å²	96.3	69%	0.686	48%	0.475	S	S	*	.			trans	-91.6	54.9	176.7	-67.9	176.4	0	0	0	112.2	Q765	Q765-L769 HydrophobicContact CB-CD1 4.31Å; Q765-L769 HydrophobicContact CG-CD1 4.09Å
770	L	54.2	Low	79.9	Confident	226 Å²	226	103.2 Å²	103.2	100%	1.183	50%	0.502	S	S	*	.			trans	-109.7	0	170.4	-83	166.7	0	0	0	111.3	L768	L768-L770 VanDerWaalsContact C-N 3.31Å; L768-L770 PolarHBondContact O-N 3.28Å

Retrieved 770 of 770 residues in 610.5 ms (Link to these results)

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