A0A3Q0KM41_SCHMA Loading...

Sel-1-like protein, sel-1l

AlphaFold DB , UniProt , Accession A0A3Q0KM41, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 786 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	28.6	Very low	30.8	Very low	235 Å²	235	156.7 Å²	156.7	100%	1.158	82%	0.824	S	S	*	*				0	89.5	0	-80.9	-174.6	175.6	0	0	109.7
2	F	27.8	Very low	31.6	Very low	201 Å²	201	150.3 Å²	150.3	88%	0.882	82%	0.823	S	S	*	*			trans	-143.4	90.4	156.7	-92.1	-75.5	0	0	0	106.7	L4	F2-L4 PolarHBondContact O-N 3.23Å
3	S	27	Very low	32.5	Very low	125 Å²	125	144.2 Å²	144.2	87%	0.874	80%	0.798	S	S	*	*			trans	-71.3	97.7	166.1	172.1	0	0	0	0	107	G5	S3-G5 PolarHBondContact O-N 3.27Å
4	L	32.2	Very low	33.8	Very low	144 Å²	144	140.9 Å²	140.9	75%	0.754	79%	0.787	S	S	*	*			trans	-85.1	89.1	172.9	-83.7	152.2	0	0	0	108.4	F2	F2-L4 PolarHBondContact O-N 3.23Å
5	G	26.7	Very low	34.7	Very low	59 Å²	59	145 Å²	145	61%	0.608	79%	0.785	S	S	*	*			trans	-73.1	123.8	161.7	0	0	0	0	0	109.4	S3	S3-G5 PolarHBondContact O-N 3.27Å
6	F	30.1	Very low	35.9	Very low	189 Å²	189	143.6 Å²	143.6	83%	0.829	78%	0.776	S	S	*	*			trans	-142.9	98.5	157.3	-92.1	-78.8	0	0	0	108.3
7	S	29.6	Very low	37.2	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	77%	0.77	S	S	*	*			trans	-41.5	140.2	149.8	174.7	0	0	0	0	111.9	H9	S7-H9 PolarHBondContact O-N 2.57Å
8	D	30	Very low	38.7	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	76%	0.756	S	S	*	*	S	Bend	trans	27.4	87.9	148.7	-62.6	-23.1	0	0	0	117.9
9	H	30.1	Very low	39.6	Very low	183 Å²	183	142 Å²	142	85%	0.847	75%	0.75	S	S	*	*			trans	-170.6	118.3	135.9	-101.5	-61.3	0	0	0	109.1	S7 Y11	S7-H9 PolarHBondContact O-N 2.57Å; H9-Y11 VanDerWaalsContact C-N 3.26Å; H9-Y11 PolarHBondContact O-N 2.72Å
10	P	41.2	Very low	41.2	Very low	114 Å²	114	139.7 Å²	139.7	74%	0.74	74%	0.737	S	S	*	*	S	Bend	trans	-85.3	62.3	-173.1	35.3	-34.5	0	0	0	111.4
11	Y	35.9	Very low	42.7	Very low	231 Å²	231	135.7 Å²	135.7	91%	0.906	72%	0.718	S	S	*	*			trans	-151.8	58.8	161.3	-78	-70	0	0	0	110.4	H9 S13	H9-Y11 VanDerWaalsContact C-N 3.26Å; H9-Y11 PolarHBondContact O-N 2.72Å; Y11-S13 PolarHBondContact O-N 2.92Å
12	G	39.9	Very low	44.6	Very low	79 Å²	79	128.2 Å²	128.2	81%	0.814	69%	0.685	S	S	*	*			trans	-70.6	105.4	163.9	0	0	0	0	0	109.7
13	S	43.6	Very low	46.7	Very low	72 Å²	72	124.3 Å²	124.3	50%	0.503	67%	0.672	S	S	.	*			trans	-54	140.4	-169.7	70.9	0	0	0	0	114.2	Y11 R15 L16	Y11-S13 PolarHBondContact O-N 2.92Å; S13-R15 PolarHBondContact O-N 3.07Å; S13-L16 PolarHBondContact O-N 3.4Å
14	P	51.1	Low	48.8	Very low	98 Å²	98	123.7 Å²	123.7	64%	0.636	66%	0.659	S	S	*	*	H	α-helix	trans	-58.8	-13.5	178.9	20	-31.3	0	0	0	114.4	L16 I18	P14-L16 PolarHBondContact O-N 3.41Å; P14-I18 WeakPolarHBondContact O-CG1 3.36Å; P14-I18 PolarHBondContact O-N 3.46Å
15	R	46.2	Very low	50.2	Low	202 Å²	202	121.9 Å²	121.9	76%	0.762	65%	0.649	S	S	*	*	H	α-helix	trans	-67.2	-30	179.5	-71.4	-176.7	174.9	174.8	-1.1	113.8	S13 K19	S13-R15 PolarHBondContact O-N 3.07Å; R15-K19 PolarHBondContact O-N 3.23Å
16	L	54.7	Low	51.8	Low	123 Å²	123	123.2 Å²	123.2	64%	0.644	65%	0.645	S	S	*	*	H	α-helix	trans	-73.9	-41.4	179.1	-166.3	74.8	0	0	0	111.1	S13 P14 K19 I20	S13-L16 PolarHBondContact O-N 3.4Å; P14-L16 PolarHBondContact O-N 3.41Å; L16-K19 PolarHBondContact O-N 3.24Å; L16-I20 WeakPolarHBondContact O-CG1 3.29Å; L16-I20 PolarHBondContact O-N 3.32Å
17	F	58.1	Low	52.8	Low	153 Å²	153	117.1 Å²	117.1	67%	0.671	63%	0.626	S	S	*	*	H	α-helix	trans	-61	-45.9	176.5	-174.3	-99.6	0	0	0	111.6	K19 I20 V21	F17-K19 VanDerWaalsContact C-N 3.32Å; F17-K19 PolarHBondContact O-N 2.95Å; F17-I20 PolarHBondContact O-N 3.21Å; F17-V21 HydrophobicContact CD1-CG2 4.17Å; F17-V21 HydrophobicContact CE1-CG2 3.86Å; F17-V21 HydrophobicContact CZ-CG2 4.08Å; F17-V21 WeakPolarHBondContact O-CG2 3.45Å; F17-V21 PolarHBondContact O-N 2.96Å
18	I	63.4	Low	53.9	Low	102 Å²	102	119 Å²	119	52%	0.523	62%	0.622	S	S	.	*	H	α-helix	trans	-59.9	-40.9	177.6	-66.3	166.6	0	0	0	111.4	P14 I20 V21 V22	P14-I18 WeakPolarHBondContact O-CG1 3.36Å; P14-I18 PolarHBondContact O-N 3.46Å; I18-I20 PolarHBondContact O-N 3.37Å; I18-V21 PolarHBondContact O-N 3.16Å; I18-V22 HydrophobicContact CG2-CG2 4.37Å; I18-V22 VanDerWaalsContact O-CG2 3.3Å; I18-V22 WeakPolarHBondContact O-CG2 3.41Å; I18-V22 PolarHBondContact O-N 3.2Å
19	K	56	Low	54.9	Low	145 Å²	145	116.4 Å²	116.4	63%	0.63	61%	0.611	S	S	*	*	H	α-helix	trans	-64.2	-40	178.2	-78.4	-175.5	176.2	-173.3	0	112.6	R15 L16 F17 I23	R15-K19 PolarHBondContact O-N 3.23Å; L16-K19 PolarHBondContact O-N 3.24Å; F17-K19 VanDerWaalsContact C-N 3.32Å; F17-K19 PolarHBondContact O-N 2.95Å; K19-I23 WeakPolarHBondContact O-CD1 3.46Å; K19-I23 VanDerWaalsContact O-CG1 3.28Å; K19-I23 WeakPolarHBondContact O-CG1 3.44Å; K19-I23 PolarHBondContact O-N 3.41Å; K19-I23 VanDerWaalsContact O-N 3.13Å
20	I	71.2	Confident	55.8	Low	95 Å²	95	112.1 Å²	112.1	49%	0.487	60%	0.598	S	S	.	*	H	α-helix	trans	-65.9	-43.7	178.4	-66.1	169.3	0	0	0	110.5	L16 F17 I18 V22 I23 L24	L16-I20 WeakPolarHBondContact O-CG1 3.29Å; L16-I20 PolarHBondContact O-N 3.32Å; F17-I20 PolarHBondContact O-N 3.21Å; I18-I20 PolarHBondContact O-N 3.37Å; I20-V22 PolarHBondContact O-N 2.89Å; I20-I23 PolarHBondContact O-N 3.23Å; I20-L24 HydrophobicContact CG2-CD1 4.02Å; I20-L24 PolarHBondContact O-N 3.47Å
21	V	73.1	Confident	56	Low	57 Å²	57	111.2 Å²	111.2	35%	0.345	59%	0.59	S	S	.	*	H	α-helix	trans	-63.3	-41.9	178.4	174	0	0	0	0	111.7	F17 I18 L24 L25	F17-V21 HydrophobicContact CD1-CG2 4.17Å; F17-V21 HydrophobicContact CE1-CG2 3.86Å; F17-V21 HydrophobicContact CZ-CG2 4.08Å; F17-V21 WeakPolarHBondContact O-CG2 3.45Å; F17-V21 PolarHBondContact O-N 2.96Å; I18-V21 PolarHBondContact O-N 3.16Å; V21-L24 PolarHBondContact O-N 3.27Å; V21-L25 HydrophobicContact CG1-CD1 3.91Å; V21-L25 WeakPolarHBondContact O-CG 3.08Å; V21-L25 PolarHBondContact O-N 3.43Å
22	V	69.4	Low	56.2	Low	77 Å²	77	104.7 Å²	104.7	47%	0.467	57%	0.57	S	S	.	*	H	α-helix	trans	-65.2	-40.4	177.7	172.6	0	0	0	0	111.7	I18 I20 L24 L25 V26	I18-V22 HydrophobicContact CG2-CG2 4.37Å; I18-V22 VanDerWaalsContact O-CG2 3.3Å; I18-V22 WeakPolarHBondContact O-CG2 3.41Å; I18-V22 PolarHBondContact O-N 3.2Å; I20-V22 PolarHBondContact O-N 2.89Å; V22-L24 VanDerWaalsContact C-N 3.34Å; V22-L24 PolarHBondContact O-N 3.08Å; V22-L25 PolarHBondContact O-N 3.25Å; V22-V26 HydrophobicContact CG1-CG2 4.41Å; V22-V26 WeakPolarHBondContact O-CG2 3.16Å; V22-V26 PolarHBondContact O-N 2.95Å
23	I	71	Confident	56.4	Low	120 Å²	120	105.1 Å²	105.1	62%	0.615	56%	0.561	S	S	*	*	H	α-helix	trans	-65.9	-38.4	178	-67.8	166.9	0	0	0	111.1	K19 I20 S27	K19-I23 WeakPolarHBondContact O-CD1 3.46Å; K19-I23 VanDerWaalsContact O-CG1 3.28Å; K19-I23 WeakPolarHBondContact O-CG1 3.44Å; K19-I23 PolarHBondContact O-N 3.41Å; K19-I23 VanDerWaalsContact O-N 3.13Å; I20-I23 PolarHBondContact O-N 3.23Å; I23-S27 PolarHBondContact O-N 2.95Å; I23-S27 VanDerWaalsContact O-N 3.13Å; I23-S27 PolarHBondContact O-OG 3.07Å
24	L	71.2	Confident	56.2	Low	111 Å²	111	109.3 Å²	109.3	58%	0.581	57%	0.573	S	S	*	*	H	α-helix	trans	-66.2	-40.7	174.8	-76.8	165.8	0	0	0	112.4	I20 V21 V22 S27 F28	I20-L24 HydrophobicContact CG2-CD1 4.02Å; I20-L24 PolarHBondContact O-N 3.47Å; V21-L24 PolarHBondContact O-N 3.27Å; V22-L24 VanDerWaalsContact C-N 3.34Å; V22-L24 PolarHBondContact O-N 3.08Å; L24-S27 WeakPolarHBondContact CA-OG 3.27Å; L24-S27 PolarHBondContact O-N 3.45Å; L24-S27 PolarHBondContact O-OG 2.84Å; L24-F28 WeakPolarHBondContact O-CB 3.44Å; L24-F28 PolarHBondContact O-N 3.28Å
25	L	61.1	Low	55.6	Low	107 Å²	107	111.5 Å²	111.5	56%	0.56	58%	0.579	S	S	*	*	H	α-helix	trans	-68	-38.2	177.7	-79.1	164.3	0	0	0	113.1	V21 V22 F28 T29	V21-L25 HydrophobicContact CG1-CD1 3.91Å; V21-L25 WeakPolarHBondContact O-CG 3.08Å; V21-L25 PolarHBondContact O-N 3.43Å; V22-L25 PolarHBondContact O-N 3.25Å; L25-F28 PolarHBondContact O-N 2.95Å; L25-T29 WeakPolarHBondContact O-CG2 3.48Å; L25-T29 PolarHBondContact O-N 3.01Å; L25-T29 VanDerWaalsContact O-N 3.11Å; L25-T29 PolarHBondContact O-OG1 2.61Å
26	V	60.4	Low	54.9	Low	86 Å²	86	108.6 Å²	108.6	52%	0.521	58%	0.578	S	S	.	*	H	α-helix	trans	-69.6	-36.6	177.2	174.7	0	0	0	0	111.1	V22 T29 V30	V22-V26 HydrophobicContact CG1-CG2 4.41Å; V22-V26 WeakPolarHBondContact O-CG2 3.16Å; V22-V26 PolarHBondContact O-N 2.95Å; V26-T29 WeakPolarHBondContact CA-OG1 3.48Å; V26-T29 PolarHBondContact O-OG1 3.15Å; V26-V30 WeakPolarHBondContact O-CG2 3.24Å; V26-V30 PolarHBondContact O-N 2.97Å
27	S	51	Low	53.8	Low	61 Å²	61	111.5 Å²	111.5	43%	0.427	59%	0.585	S	S	.	*	H	α-helix	trans	-70.1	-37	175.9	40.8	0	0	0	0	112.3	I23 L24 V30 V31	I23-S27 PolarHBondContact O-N 2.95Å; I23-S27 VanDerWaalsContact O-N 3.13Å; I23-S27 PolarHBondContact O-OG 3.07Å; L24-S27 WeakPolarHBondContact CA-OG 3.27Å; L24-S27 PolarHBondContact O-N 3.45Å; L24-S27 PolarHBondContact O-OG 2.84Å; S27-V30 PolarHBondContact O-N 3.29Å; S27-V31 WeakPolarHBondContact O-CG2 3.46Å; S27-V31 PolarHBondContact O-N 2.83Å
28	F	54.4	Low	52.4	Low	141 Å²	141	109.8 Å²	109.8	62%	0.618	59%	0.589	S	S	*	*	H	α-helix	trans	-67.9	-36.5	177.1	-157.2	-100.3	0	0	0	113.2	L24 L25 V31 L32	L24-F28 WeakPolarHBondContact O-CB 3.44Å; L24-F28 PolarHBondContact O-N 3.28Å; L25-F28 PolarHBondContact O-N 2.95Å; F28-V31 PolarHBondContact O-N 3.49Å; F28-L32 HydrophobicContact CD1-CD1 3.82Å; F28-L32 HydrophobicContact CE1-CD1 3.74Å; F28-L32 PolarHBondContact O-N 2.92Å
29	T	50.1	Low	50.6	Low	87 Å²	87	114.7 Å²	114.7	53%	0.534	61%	0.607	S	S	.	*	H	α-helix	trans	-71.4	-30.8	177.7	46.9	0	0	0	0	113.5	L25 V26 S33	L25-T29 WeakPolarHBondContact O-CG2 3.48Å; L25-T29 PolarHBondContact O-N 3.01Å; L25-T29 VanDerWaalsContact O-N 3.11Å; L25-T29 PolarHBondContact O-OG1 2.61Å; V26-T29 WeakPolarHBondContact CA-OG1 3.48Å; V26-T29 PolarHBondContact O-OG1 3.15Å; T29-S33 PolarHBondContact O-N 3.37Å
30	V	49.1	Very low	49.1	Very low	93 Å²	93	119.4 Å²	119.4	56%	0.564	62%	0.621	S	S	*	*	H	α-helix	trans	-68.5	-38.5	174.3	173.4	0	0	0	0	111.3	V26 S27 S33	V26-V30 WeakPolarHBondContact O-CG2 3.24Å; V26-V30 PolarHBondContact O-N 2.97Å; S27-V30 PolarHBondContact O-N 3.29Å; V30-S33 PolarHBondContact O-N 2.97Å
31	V	45.3	Very low	46.9	Very low	95 Å²	95	124.9 Å²	124.9	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-65.9	-40.8	177.8	175.4	0	0	0	0	111.7	S27 F28 S33 E34	S27-V31 WeakPolarHBondContact O-CG2 3.46Å; S27-V31 PolarHBondContact O-N 2.83Å; F28-V31 PolarHBondContact O-N 3.49Å; V31-S33 VanDerWaalsContact C-N 3.26Å; V31-S33 PolarHBondContact O-N 3.25Å; V31-E34 PolarHBondContact O-N 3.36Å
32	L	41.4	Very low	44.6	Very low	95 Å²	95	127.4 Å²	127.4	50%	0.497	66%	0.661	S	S	.	*	H	α-helix	trans	-66.5	-22.8	178.2	-87	160.8	0	0	0	114.2	F28	F28-L32 HydrophobicContact CD1-CD1 3.82Å; F28-L32 HydrophobicContact CE1-CD1 3.74Å; F28-L32 PolarHBondContact O-N 2.92Å
33	S	42.5	Very low	42.5	Very low	88 Å²	88	127.2 Å²	127.2	62%	0.615	68%	0.675	S	S	*	*	H	α-helix	trans	-76.2	-29.8	178.5	-171.9	0	0	0	0	112.6	T29 V30 V31	T29-S33 PolarHBondContact O-N 3.37Å; V30-S33 PolarHBondContact O-N 2.97Å; V31-S33 VanDerWaalsContact C-N 3.26Å; V31-S33 PolarHBondContact O-N 3.25Å
34	E	39.5	Very low	40.3	Very low	160 Å²	160	127.8 Å²	127.8	75%	0.748	68%	0.679	S	S	*	*	H	α-helix	trans	-75.5	-31.3	-178.8	-103.2	177.1	163.7	0	0	113.3	V31 L36	V31-E34 PolarHBondContact O-N 3.36Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3.32Å
35	D	38.8	Very low	38.2	Very low	143 Å²	143	127 Å²	127	77%	0.765	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-11.7	179.8	-87.9	-20.2	0	0	0	114.2	K37	D35-K37 VanDerWaalsContact C-N 3.34Å; D35-K37 PolarHBondContact O-N 3.34Å
36	L	32.2	Very low	36.5	Very low	142 Å²	142	130.3 Å²	130.3	74%	0.743	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	15.8	-177	-74.4	170.4	0	0	0	114.9	E34 P38	E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3.32Å; L36-P38 VanDerWaalsContact O-CD 3.26Å; L36-P38 WeakPolarHBondContact O-CD 3.36Å
37	K	30.7	Very low	35.3	Very low	183 Å²	183	131.5 Å²	131.5	80%	0.796	70%	0.703	S	S	*	*			trans	-86.2	112.7	170.5	-82	-176.1	-178.7	172.5	0	111.7	D35 K39	D35-K37 VanDerWaalsContact C-N 3.34Å; D35-K37 PolarHBondContact O-N 3.34Å; K37-K39 PolarHBondContact O-N 3.47Å
38	P	28.1	Very low	34.5	Very low	118 Å²	118	131.8 Å²	131.8	77%	0.766	71%	0.705	S	S	*	*			trans	-68.8	123.1	-179.6	26.2	-32.7	0	0	0	111.6	L36 R40	L36-P38 VanDerWaalsContact O-CD 3.26Å; L36-P38 WeakPolarHBondContact O-CD 3.36Å; P38-R40 PolarHBondContact O-N 3.18Å; P38-R40 VanDerWaalsContact O-N 3.11Å
39	K	26.3	Very low	34	Very low	204 Å²	204	128.2 Å²	128.2	89%	0.887	69%	0.692	S	S	*	*			trans	-70.8	99	169.1	-75	179.8	178.6	172.4	0	109.5	K37 K41	K37-K39 PolarHBondContact O-N 3.47Å; K39-K41 PolarHBondContact O-N 3.28Å
40	R	24.5	Very low	33.9	Very low	245 Å²	245	128.4 Å²	128.4	93%	0.925	69%	0.693	S	S	*	*			trans	-61.9	112.8	168.1	-79.6	-177.8	174.5	179	-2.3	109.6	P38	P38-R40 PolarHBondContact O-N 3.18Å; P38-R40 VanDerWaalsContact O-N 3.11Å
41	K	26	Very low	34.1	Very low	209 Å²	209	130.5 Å²	130.5	91%	0.909	70%	0.696	S	S	*	*			trans	-87.8	102.9	160	-77.3	-176.1	176.6	179.3	0	107.7	K39	K39-K41 PolarHBondContact O-N 3.28Å
42	S	23.4	Very low	34.5	Very low	111 Å²	111	126.7 Å²	126.7	78%	0.776	67%	0.673	S	S	*	*			trans	-70.7	121.2	161.2	163.9	0	0	0	0	107.2
43	G	25	Very low	35.3	Very low	72 Å²	72	127.8 Å²	127.8	74%	0.742	67%	0.673	S	S	*	*			trans	-145.8	54.4	177.3	0	0	0	0	0	108.7	A45	G43-A45 PolarHBondContact O-N 3.35Å
44	D	25	Very low	36.3	Very low	133 Å²	133	130.8 Å²	130.8	71%	0.711	68%	0.675	S	S	*	*			trans	-69.8	116.1	170.4	-71.1	-32	0	0	0	107.9	H46	D44-H46 PolarHBondContact O-N 3.42Å
45	A	26.8	Very low	37.3	Very low	94 Å²	94	126.8 Å²	126.8	78%	0.777	66%	0.656	S	S	*	*			trans	-66.7	83.8	172.8	0	0	0	0	0	109.1	G43 I47	G43-A45 PolarHBondContact O-N 3.35Å; A45-I47 VanDerWaalsContact C-N 3.34Å; A45-I47 PolarHBondContact O-N 3.12Å
46	H	25.5	Very low	38.2	Very low	176 Å²	176	120.3 Å²	120.3	82%	0.815	62%	0.621	S	S	*	*			trans	-65.1	96	165.4	-86.4	-63.3	0	0	0	108.9	D44 S48	D44-H46 PolarHBondContact O-N 3.42Å; H46-S48 PolarHBondContact O-N 3.47Å
47	I	36.8	Very low	39.8	Very low	111 Å²	111	119.6 Å²	119.6	57%	0.569	61%	0.612	S	S	*	*			trans	-60.5	125.8	166.2	-62	170.8	0	0	0	107.3	A45 I49	A45-I47 VanDerWaalsContact C-N 3.34Å; A45-I47 PolarHBondContact O-N 3.12Å; I47-I49 PolarHBondContact O-N 3.22Å
48	S	33.4	Very low	41.4	Very low	67 Å²	67	113.5 Å²	113.5	47%	0.469	59%	0.592	S	S	.	*			trans	-66	100.9	-174.2	-178	0	0	0	0	112.3	H46 T50	H46-S48 PolarHBondContact O-N 3.47Å; S48-T50 PolarHBondContact O-N 3.35Å
49	I	43.5	Very low	42.9	Very low	67 Å²	67	108.9 Å²	108.9	34%	0.344	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-16.2	174.9	-63.2	166.9	0	0	0	111.7	I47 Q51 D52 K53	I47-I49 PolarHBondContact O-N 3.22Å; I49-Q51 VanDerWaalsContact C-N 3.27Å; I49-Q51 PolarHBondContact O-N 3.15Å; I49-D52 PolarHBondContact O-N 3.16Å; I49-D52 VanDerWaalsContact O-N 3.1Å; I49-K53 HydrophobicContact CG2-CG 4.45Å; I49-K53 PolarHBondContact O-N 2.86Å
50	T	48.3	Very low	44.3	Very low	90 Å²	90	100.3 Å²	100.3	55%	0.552	52%	0.523	S	S	*	.	H	α-helix	trans	-63.5	-31.3	-176.2	-32.6	0	0	0	0	112.9	S48 K54	S48-T50 PolarHBondContact O-N 3.35Å; T50-K54 PolarHBondContact O-N 3.34Å
51	Q	52.6	Low	46	Very low	138 Å²	138	93.9 Å²	93.9	65%	0.645	50%	0.503	S	S	*	.	H	α-helix	trans	-68.1	-38.2	175.1	-73	-174.5	-15.6	0	0	111.9	I49 K54 K55	I49-Q51 VanDerWaalsContact C-N 3.27Å; I49-Q51 PolarHBondContact O-N 3.15Å; Q51-K54 PolarHBondContact O-N 3.42Å; Q51-K55 PolarHBondContact O-N 3.3Å
52	D	54.9	Low	47.4	Very low	15 Å²	15	89 Å²	89	8%	0.08	48%	0.484	C	S	.	.	H	α-helix	trans	-69.3	-42.5	-179.3	-60.9	-24.8	0	0	0	110.9	I49 K54 K55 I56 K499	I49-D52 PolarHBondContact O-N 3.16Å; I49-D52 VanDerWaalsContact O-N 3.1Å; D52-K54 VanDerWaalsContact C-N 3.29Å; D52-K54 PolarHBondContact O-N 3.27Å; D52-K55 PolarHBondContact O-N 3.44Å; D52-I56 HydrophobicContact CB-CD1 4.45Å; D52-I56 VanDerWaalsContact O-CB 3.31Å; D52-I56 WeakPolarHBondContact O-CB 3.49Å; D52-I56 WeakPolarHBondContact O-CD1 3.06Å; D52-I56 WeakPolarHBondContact O-CG1 3.5Å; D52-I56 PolarHBondContact O-N 2.87Å; D52-K499 IonicContact OD2-NZ 3.53Å; D52-K499 PolarHBondContact OD2-NZ 3.03Å
53	K	56.8	Low	48.9	Very low	117 Å²	117	86.1 Å²	86.1	51%	0.509	46%	0.458	S	S	.	.	H	α-helix	trans	-58.6	-40.2	174.7	-72.1	-176.2	178.1	173.9	0	112.3	I49 K57 D470	I49-K53 HydrophobicContact CG2-CG 4.45Å; I49-K53 PolarHBondContact O-N 2.86Å; K53-K57 VanDerWaalsContact O-CB 3.28Å; K53-K57 WeakPolarHBondContact O-CB 3.2Å; K53-K57 PolarHBondContact O-N 2.7Å; K53-D470 VanDerWaalsContact CE-OD2 3.25Å; K53-D470 WeakPolarHBondContact CE-OD2 3.14Å; K53-D470 IonicContact NZ-OD2 3.23Å; K53-D470 PolarHBondContact NZ-OD2 2.82Å
54	K	64.1	Low	50.2	Low	151 Å²	151	88.7 Å²	88.7	66%	0.657	45%	0.454	S	S	*	.	H	α-helix	trans	-68.1	-45.6	176.1	-73.2	-177.4	179.8	-176.6	0	112.5	T50 Q51 D52 I56 K57 S58	T50-K54 PolarHBondContact O-N 3.34Å; Q51-K54 PolarHBondContact O-N 3.42Å; D52-K54 VanDerWaalsContact C-N 3.29Å; D52-K54 PolarHBondContact O-N 3.27Å; K54-I56 VanDerWaalsContact C-N 3.33Å; K54-I56 PolarHBondContact O-N 3.06Å; K54-K57 PolarHBondContact O-N 3.18Å; K54-S58 PolarHBondContact O-N 3.33Å
55	K	60	Low	51.9	Low	76 Å²	76	85.4 Å²	85.4	33%	0.33	44%	0.437	S	S	.	.	H	α-helix	trans	-60.1	-44.2	176.2	-81	-178.6	168.1	-165.7	0	111.6	Q51 D52 S58 Y59 D493	Q51-K55 PolarHBondContact O-N 3.3Å; D52-K55 PolarHBondContact O-N 3.44Å; K55-S58 PolarHBondContact O-N 3Å; K55-S58 VanDerWaalsContact O-N 3.15Å; K55-S58 PolarHBondContact O-OG 3.49Å; K55-Y59 HydrophobicContact CB-CE2 4.33Å; K55-Y59 WeakPolarHBondContact O-CD2 3.31Å; K55-Y59 PolarHBondContact O-N 3.23Å; K55-D493 IonicContact NZ-OD2 2.97Å
56	I	58.1	Low	53	Low	8 Å²	8	85.6 Å²	85.6	4%	0.041	43%	0.43	C	S	.	.	H	α-helix	trans	-68	-42.3	179.9	-66.6	167.7	0	0	0	110.5	D52 K54 S58 Y59 I60 M462 L466 F484	D52-I56 HydrophobicContact CB-CD1 4.45Å; D52-I56 VanDerWaalsContact O-CB 3.31Å; D52-I56 WeakPolarHBondContact O-CB 3.49Å; D52-I56 WeakPolarHBondContact O-CD1 3.06Å; D52-I56 WeakPolarHBondContact O-CG1 3.5Å; D52-I56 PolarHBondContact O-N 2.87Å; K54-I56 VanDerWaalsContact C-N 3.33Å; K54-I56 PolarHBondContact O-N 3.06Å; I56-S58 PolarHBondContact O-N 3.45Å; I56-Y59 WeakPolarHBondContact O-CA 3.29Å; I56-Y59 WeakPolarHBondContact O-CB 3.28Å; I56-Y59 PolarHBondContact O-N 3.18Å; I56-I60 HydrophobicContact CG2-CD1 3.88Å; I56-I60 HydrophobicContact CG2-CG1 4.26Å; I56-I60 VanDerWaalsContact O-CG1 3.29Å; I56-I60 WeakPolarHBondContact O-CG1 3.4Å; I56-I60 PolarHBondContact O-N 3.42Å; I56-M462 HydrophobicContact CG2-CE 3.54Å; I56-M462 HydrophobicContact CG2-SD 4.01Å; I56-L466 HydrophobicContact CB-CD1 4.34Å; I56-L466 HydrophobicContact CD1-CD1 3.38Å; I56-L466 HydrophobicContact CD1-CD2 3.38Å; I56-L466 HydrophobicContact CD1-CG 3.96Å; I56-L466 HydrophobicContact CG1-CD1 4.35Å; I56-L466 HydrophobicContact CG2-CD1 3.71Å; I56-F484 HydrophobicContact CD1-CZ 3.83Å; I56-F484 HydrophobicContact CG1-CE1 4.35Å; I56-F484 HydrophobicContact CG1-CZ 3.94Å
57	K	65.8	Low	54.7	Low	127 Å²	127	84.4 Å²	84.4	55%	0.552	43%	0.425	S	S	*	.	H	α-helix	trans	-54.8	-42.2	170.9	-164.6	-173.2	-178	-147.9	0	111.6	K53 K54 Y59 I60 E61	K53-K57 VanDerWaalsContact O-CB 3.28Å; K53-K57 WeakPolarHBondContact O-CB 3.2Å; K53-K57 PolarHBondContact O-N 2.7Å; K54-K57 PolarHBondContact O-N 3.18Å; K57-Y59 VanDerWaalsContact C-N 3.35Å; K57-Y59 PolarHBondContact O-N 3.23Å; K57-I60 PolarHBondContact O-N 3.26Å; K57-E61 WeakPolarHBondContact CE-OE1 3.4Å; K57-E61 IonicContact NZ-OE1 2.76Å; K57-E61 PolarHBondContact NZ-OE1 3.48Å; K57-E61 WeakPolarHBondContact O-CB 3.27Å; K57-E61 VanDerWaalsContact O-CG 3.27Å; K57-E61 WeakPolarHBondContact O-CG 3.39Å; K57-E61 PolarHBondContact O-N 2.82Å
58	S	63.6	Low	55.7	Low	54 Å²	54	82.6 Å²	82.6	38%	0.378	42%	0.419	S	S	.	.	H	α-helix	trans	-67.1	-31.3	175.5	72.2	0	0	0	0	114.1	K54 K55 I56 Q62	K54-S58 PolarHBondContact O-N 3.33Å; K55-S58 PolarHBondContact O-N 3Å; K55-S58 VanDerWaalsContact O-N 3.15Å; K55-S58 PolarHBondContact O-OG 3.49Å; I56-S58 PolarHBondContact O-N 3.45Å; S58-Q62 PolarHBondContact O-N 3.05Å
59	Y	60.3	Low	56.6	Low	22 Å²	22	81.8 Å²	81.8	9%	0.086	41%	0.411	C	S	.	.	H	α-helix	trans	-70.1	-41.7	172.1	-66.7	-51.1	0	0	0	111.1	K55 I56 K57 Q62 F63 F484 K491 D493	K55-Y59 HydrophobicContact CB-CE2 4.33Å; K55-Y59 WeakPolarHBondContact O-CD2 3.31Å; K55-Y59 PolarHBondContact O-N 3.23Å; I56-Y59 WeakPolarHBondContact O-CA 3.29Å; I56-Y59 WeakPolarHBondContact O-CB 3.28Å; I56-Y59 PolarHBondContact O-N 3.18Å; K57-Y59 VanDerWaalsContact C-N 3.35Å; K57-Y59 PolarHBondContact O-N 3.23Å; Y59-Q62 WeakPolarHBondContact O-CB 3.25Å; Y59-Q62 PolarHBondContact O-N 3.39Å; Y59-F63 WeakPolarHBondContact O-CD2 3.5Å; Y59-F484 HydrophobicContact CD2-CE1 4.4Å; Y59-F484 HydrophobicContact CE2-CE1 4.21Å; Y59-K491 HydrophobicContact CD1-CB 3.92Å; Y59-K491 HydrophobicContact CD1-CD 4.46Å; Y59-K491 HydrophobicContact CE1-CB 3.77Å; Y59-K491 HydrophobicContact CE1-CD 3.87Å; Y59-K491 HydrophobicContact CE1-CG 3.96Å; Y59-D493 PolarHBondContact OH-OD2 3.1Å
60	I	56.2	Low	57.1	Low	23 Å²	23	83.6 Å²	83.6	12%	0.118	42%	0.418	C	S	.	.	H	α-helix	trans	-61.8	-45.9	176.3	-65.6	172.9	0	0	0	110.6	I56 K57 Q62 F63 D64 V459 M462 E463	I56-I60 HydrophobicContact CG2-CD1 3.88Å; I56-I60 HydrophobicContact CG2-CG1 4.26Å; I56-I60 VanDerWaalsContact O-CG1 3.29Å; I56-I60 WeakPolarHBondContact O-CG1 3.4Å; I56-I60 PolarHBondContact O-N 3.42Å; K57-I60 PolarHBondContact O-N 3.26Å; I60-Q62 PolarHBondContact O-N 3.14Å; I60-Q62 VanDerWaalsContact O-N 3.16Å; I60-F63 PolarHBondContact O-N 3.26Å; I60-D64 PolarHBondContact O-N 3Å; I60-V459 HydrophobicContact CB-CG1 4.34Å; I60-V459 HydrophobicContact CD1-CG1 4.05Å; I60-V459 HydrophobicContact CG1-CG1 3.81Å; I60-V459 HydrophobicContact CG2-CG1 3.76Å; I60-M462 HydrophobicContact CD1-CE 4.12Å; I60-M462 HydrophobicContact CG1-CE 3.72Å; I60-E463 HydrophobicContact CD1-CG 4.04Å
61	E	60.2	Low	57.7	Low	110 Å²	110	86.2 Å²	86.2	51%	0.514	42%	0.422	S	S	.	.	H	α-helix	trans	-60.9	-23	177.5	-73.4	169.2	-175.8	0	0	112.7	K57	K57-E61 WeakPolarHBondContact CE-OE1 3.4Å; K57-E61 IonicContact NZ-OE1 2.76Å; K57-E61 PolarHBondContact NZ-OE1 3.48Å; K57-E61 WeakPolarHBondContact O-CB 3.27Å; K57-E61 VanDerWaalsContact O-CG 3.27Å; K57-E61 WeakPolarHBondContact O-CG 3.39Å; K57-E61 PolarHBondContact O-N 2.82Å
62	Q	55.8	Low	57.6	Low	106 Å²	106	83.9 Å²	83.9	50%	0.495	41%	0.41	S	S	.	.	H	α-helix	trans	-78	-21.8	172.8	-81.2	-176.2	-31.1	0	0	114.1	S58 Y59 I60	S58-Q62 PolarHBondContact O-N 3.05Å; Y59-Q62 WeakPolarHBondContact O-CB 3.25Å; Y59-Q62 PolarHBondContact O-N 3.39Å; I60-Q62 PolarHBondContact O-N 3.14Å; I60-Q62 VanDerWaalsContact O-N 3.16Å
63	F	54.1	Low	57.1	Low	52 Å²	52	87.3 Å²	87.3	23%	0.228	43%	0.428	C	S	.	.	H	α-helix	trans	-89.9	-12.8	177.4	-72.1	-76.5	0	0	0	113.8	Y59 I60 D65 V69 V459 G489	Y59-F63 WeakPolarHBondContact O-CD2 3.5Å; I60-F63 PolarHBondContact O-N 3.26Å; F63-D65 PolarHBondContact O-N 3.13Å; F63-V69 HydrophobicContact CD1-CG2 4.17Å; F63-V69 WeakPolarHBondContact O-CG2 3.34Å; F63-V459 HydrophobicContact CB-CG2 4.21Å; F63-V459 HydrophobicContact CD2-CG2 4.2Å; F63-V459 HydrophobicContact CG-CG2 4.32Å; F63-G489 WeakPolarHBondContact CZ-O 3.45Å
64	D	52	Low	57	Low	125 Å²	125	89.6 Å²	89.6	67%	0.668	43%	0.433	S	S	*	.	S	Bend	trans	-74.3	-6.7	178.4	-78.8	-21.5	0	0	0	113.1	I60 P66	I60-D64 PolarHBondContact O-N 3Å; D64-P66 WeakPolarHBondContact O-CD 3.16Å
65	D	60.6	Low	56.4	Low	64 Å²	64	86.8 Å²	86.8	34%	0.342	43%	0.425	S	S	.	.			trans	-90.6	109.1	170.5	178.4	26	0	0	0	111.4	F63 E67 T68 V69	F63-D65 PolarHBondContact O-N 3.13Å; D65-E67 PolarHBondContact O-N 3.11Å; D65-E67 PolarHBondContact OD1-N 3.36Å; D65-T68 PolarHBondContact O-N 3.33Å; D65-T68 WeakPolarHBondContact OD2-CB 3.49Å; D65-T68 PolarHBondContact OD2-N 2.9Å; D65-T68 PolarHBondContact OD2-OG1 3.49Å; D65-V69 PolarHBondContact O-N 2.99Å
66	P	50.8	Low	55.6	Low	98 Å²	98	88.9 Å²	88.9	64%	0.636	44%	0.439	S	S	*	.	H	α-helix	trans	-59.2	-32.5	-179.1	-19.6	31.4	0	0	0	113.3	D64 V69 E70	D64-P66 WeakPolarHBondContact O-CD 3.16Å; P66-V69 PolarHBondContact O-N 3.17Å; P66-E70 WeakPolarHBondContact O-CB 3.47Å; P66-E70 PolarHBondContact O-N 3.46Å
67	E	61.7	Low	54.9	Low	151 Å²	151	95.1 Å²	95.1	71%	0.706	47%	0.472	S	S	*	.	H	α-helix	trans	-71.2	-39.5	-179.2	-67.4	-173.2	178.9	0	0	111.6	D65 V69 E70 K71	D65-E67 PolarHBondContact O-N 3.11Å; D65-E67 PolarHBondContact OD1-N 3.36Å; E67-V69 VanDerWaalsContact C-N 3.34Å; E67-E70 PolarHBondContact O-N 2.9Å; E67-K71 VanDerWaalsContact O-CB 3.29Å; E67-K71 WeakPolarHBondContact O-CB 3.25Å; E67-K71 PolarHBondContact O-N 3.11Å
68	T	57.4	Low	53.5	Low	74 Å²	74	93.2 Å²	93.2	45%	0.454	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-40.7	174.7	-62.7	0	0	0	0	111.2	D65 F72	D65-T68 PolarHBondContact O-N 3.33Å; D65-T68 WeakPolarHBondContact OD2-CB 3.49Å; D65-T68 PolarHBondContact OD2-N 2.9Å; D65-T68 PolarHBondContact OD2-OG1 3.49Å; T68-F72 WeakPolarHBondContact O-CB 3.31Å; T68-F72 PolarHBondContact O-N 3.16Å
69	V	51.3	Low	52.3	Low	50 Å²	50	95.5 Å²	95.5	30%	0.303	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-45.6	175.7	177.7	0	0	0	0	111.3	F63 D65 P66 E67 F72 L73	F63-V69 HydrophobicContact CD1-CG2 4.17Å; F63-V69 WeakPolarHBondContact O-CG2 3.34Å; D65-V69 PolarHBondContact O-N 2.99Å; P66-V69 PolarHBondContact O-N 3.17Å; E67-V69 VanDerWaalsContact C-N 3.34Å; V69-F72 PolarHBondContact O-N 3.21Å; V69-L73 HydrophobicContact CG1-CD1 3.98Å; V69-L73 HydrophobicContact CG1-CG 4.42Å; V69-L73 WeakPolarHBondContact O-CB 3.42Å; V69-L73 VanDerWaalsContact O-CG 3.24Å; V69-L73 WeakPolarHBondContact O-CG 3.43Å; V69-L73 PolarHBondContact O-N 2.96Å
70	E	54.1	Low	51.3	Low	104 Å²	104	101.3 Å²	101.3	49%	0.486	51%	0.514	S	S	.	.	H	α-helix	trans	-66.7	-43.6	-179	-167.1	-174.8	160.3	0	0	112.4	P66 E67 L73 R74	P66-E70 WeakPolarHBondContact O-CB 3.47Å; P66-E70 PolarHBondContact O-N 3.46Å; E67-E70 PolarHBondContact O-N 2.9Å; E70-L73 PolarHBondContact O-N 3.48Å; E70-R74 PolarHBondContact O-N 2.91Å; E70-R74 IonicContact OE1-CZ 3.59Å; E70-R74 IonicContact OE1-NE 3.83Å; E70-R74 IonicContact OE1-NH2 2.72Å; E70-R74 PolarHBondContact OE1-NH2 2.9Å
71	K	60.5	Low	50.4	Low	145 Å²	145	106.9 Å²	106.9	63%	0.63	54%	0.544	S	S	*	.	H	α-helix	trans	-62.2	-44	176.3	-176.4	179.7	176.6	-177.9	0	111.3	E67 R74 D75	E67-K71 VanDerWaalsContact O-CB 3.29Å; E67-K71 WeakPolarHBondContact O-CB 3.25Å; E67-K71 PolarHBondContact O-N 3.11Å; K71-R74 WeakPolarHBondContact O-CB 3.28Å; K71-R74 PolarHBondContact O-N 3.34Å; K71-D75 PolarHBondContact O-N 3.36Å; K71-D75 VanDerWaalsContact O-N 3.08Å
72	F	51.9	Low	49	Very low	89 Å²	89	108.7 Å²	108.7	39%	0.39	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-41.2	178.3	178.6	-96	0	0	0	112.4	T68 V69 R74 D75 L76 G489	T68-F72 WeakPolarHBondContact O-CB 3.31Å; T68-F72 PolarHBondContact O-N 3.16Å; V69-F72 PolarHBondContact O-N 3.21Å; F72-R74 VanDerWaalsContact C-N 3.3Å; F72-R74 PolarHBondContact O-N 3.17Å; F72-D75 PolarHBondContact O-N 3.47Å; F72-L76 HydrophobicContact CE1-CD2 4.22Å; F72-L76 WeakPolarHBondContact O-CB 3.5Å; F72-L76 PolarHBondContact O-N 3.26Å; F72-G489 VanDerWaalsContact CE1-CA 3.48Å
73	L	44.3	Very low	47.9	Very low	87 Å²	87	110.8 Å²	110.8	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-62.3	-36.5	174.3	-72.6	172.3	0	0	0	112.1	V69 E70 L77	V69-L73 HydrophobicContact CG1-CD1 3.98Å; V69-L73 HydrophobicContact CG1-CG 4.42Å; V69-L73 WeakPolarHBondContact O-CB 3.42Å; V69-L73 VanDerWaalsContact O-CG 3.24Å; V69-L73 WeakPolarHBondContact O-CG 3.43Å; V69-L73 PolarHBondContact O-N 2.96Å; E70-L73 PolarHBondContact O-N 3.48Å; L73-L77 WeakPolarHBondContact O-CB 3.26Å; L73-L77 WeakPolarHBondContact O-CD1 3.41Å; L73-L77 VanDerWaalsContact O-CG 3.27Å; L73-L77 WeakPolarHBondContact O-CG 3.12Å; L73-L77 PolarHBondContact O-N 2.81Å; L73-L77 VanDerWaalsContact O-N 3.12Å
74	R	53.5	Low	46.8	Very low	166 Å²	166	114.4 Å²	114.4	63%	0.626	59%	0.59	S	S	*	*	H	α-helix	trans	-64.9	-42.6	173.8	-76.4	-175.6	-166.3	168.7	7.5	112.6	E70 K71 F72	E70-R74 PolarHBondContact O-N 2.91Å; E70-R74 IonicContact OE1-CZ 3.59Å; E70-R74 IonicContact OE1-NE 3.83Å; E70-R74 IonicContact OE1-NH2 2.72Å; E70-R74 PolarHBondContact OE1-NH2 2.9Å; K71-R74 WeakPolarHBondContact O-CB 3.28Å; K71-R74 PolarHBondContact O-N 3.34Å; F72-R74 VanDerWaalsContact C-N 3.3Å; F72-R74 PolarHBondContact O-N 3.17Å
75	D	52.9	Low	45.7	Very low	92 Å²	92	116.4 Å²	116.4	49%	0.492	60%	0.596	S	S	.	*	H	α-helix	trans	-69.7	-36.6	179.9	-68.4	-19.4	0	0	0	111.6	K71 F72 N78	K71-D75 PolarHBondContact O-N 3.36Å; K71-D75 VanDerWaalsContact O-N 3.08Å; F72-D75 PolarHBondContact O-N 3.47Å; D75-N78 WeakPolarHBondContact O-CB 3.31Å; D75-N78 PolarHBondContact O-N 3.31Å
76	L	42	Very low	44.1	Very low	119 Å²	119	120.6 Å²	120.6	62%	0.623	62%	0.617	S	S	*	*	H	α-helix	trans	-71.3	-32.6	179	-170	71.7	0	0	0	113.3	F72 N78	F72-L76 HydrophobicContact CE1-CD2 4.22Å; F72-L76 WeakPolarHBondContact O-CB 3.5Å; F72-L76 PolarHBondContact O-N 3.26Å; L76-N78 PolarHBondContact O-N 3.25Å
77	L	43.4	Very low	43.1	Very low	139 Å²	139	121.7 Å²	121.7	73%	0.728	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-1	177	-72.9	167.2	0	0	0	112.9	L73 P79	L73-L77 WeakPolarHBondContact O-CB 3.26Å; L73-L77 WeakPolarHBondContact O-CD1 3.41Å; L73-L77 VanDerWaalsContact O-CG 3.27Å; L73-L77 WeakPolarHBondContact O-CG 3.12Å; L73-L77 PolarHBondContact O-N 2.81Å; L73-L77 VanDerWaalsContact O-N 3.12Å; L77-P79 VanDerWaalsContact O-CD 3.31Å; L77-P79 WeakPolarHBondContact O-CD 3.04Å
78	N	38	Very low	41.5	Very low	87 Å²	87	123.5 Å²	123.5	47%	0.465	63%	0.629	S	S	.	*			trans	-90.6	107.6	-179.8	-143.8	0.6	0	0	0	110.2	D75 L76 D80	D75-N78 WeakPolarHBondContact O-CB 3.31Å; D75-N78 PolarHBondContact O-N 3.31Å; L76-N78 PolarHBondContact O-N 3.25Å; N78-D80 VanDerWaalsContact C-N 3.26Å; N78-D80 PolarHBondContact O-N 3.03Å
79	P	37.8	Very low	40	Very low	103 Å²	103	127.5 Å²	127.5	67%	0.669	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-68.2	-18.9	-167.4	-18.9	32.2	0	0	0	115.1	L77 L81	L77-P79 VanDerWaalsContact O-CD 3.31Å; L77-P79 WeakPolarHBondContact O-CD 3.04Å; P79-L81 VanDerWaalsContact C-N 3.29Å; P79-L81 PolarHBondContact O-N 3.45Å
80	D	39	Very low	38.9	Very low	143 Å²	143	135.1 Å²	135.1	77%	0.765	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-77.7	-6.4	-168.6	-70.4	-20.8	0	0	0	114.8	N78	N78-D80 VanDerWaalsContact C-N 3.26Å; N78-D80 PolarHBondContact O-N 3.03Å
81	L	37	Very low	37.6	Very low	141 Å²	141	138.3 Å²	138.3	74%	0.738	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-99.4	-10.1	-176.3	-90.3	146.9	0	0	0	115	P79	P79-L81 VanDerWaalsContact C-N 3.29Å; P79-L81 PolarHBondContact O-N 3.45Å
82	M	31.2	Very low	35.8	Very low	147 Å²	147	139 Å²	139	72%	0.724	70%	0.702	S	S	*	*	S	Bend	trans	-81.2	-14.7	-177.6	-79.4	-74.6	-86.4	0	0	113.7
83	F	33.1	Very low	34.7	Very low	150 Å²	150	141.5 Å²	141.5	66%	0.658	72%	0.724	S	S	*	*	S	Bend	trans	-151	113.4	178.4	-58.4	-77.4	0	0	0	111.6	Q85	F83-Q85 PolarHBondContact O-N 3.07Å; F83-Q85 VanDerWaalsContact O-N 3.13Å
84	P	31.1	Very low	33.5	Very low	129 Å²	129	144.3 Å²	144.3	84%	0.838	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-59.7	118.5	166.7	-15.5	28.3	0	0	0	108.9	I86	P84-I86 PolarHBondContact O-N 3.25Å
85	Q	28.2	Very low	32	Very low	167 Å²	167	142 Å²	142	78%	0.78	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.4	120.9	176.2	-64.9	-70.3	-52.2	0	0	109.2	F83 P87	F83-Q85 PolarHBondContact O-N 3.07Å; F83-Q85 VanDerWaalsContact O-N 3.13Å; Q85-P87 WeakPolarHBondContact O-CD 3.3Å
86	I	27.5	Very low	30.3	Very low	152 Å²	152	146.2 Å²	146.2	78%	0.779	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-61.4	121.4	167.1	-62.5	164.6	0	0	0	106.4	P84 K88	P84-I86 PolarHBondContact O-N 3.25Å; I86-K88 PolarHBondContact O-N 3.45Å; I86-K88 VanDerWaalsContact O-N 3.14Å
87	P	28.5	Very low	29.4	Very low	121 Å²	121	145.5 Å²	145.5	79%	0.786	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-63.7	119	-172.5	-18.2	29.6	0	0	0	110.4	Q85 D89	Q85-P87 WeakPolarHBondContact O-CD 3.3Å; P87-D89 PolarHBondContact O-N 3.14Å
88	K	28.6	Very low	28.3	Very low	188 Å²	188	147.4 Å²	147.4	82%	0.817	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-72.7	116.9	168.5	-71.6	-179.1	176.5	178.2	0	108.5	I86 K90	I86-K88 PolarHBondContact O-N 3.45Å; I86-K88 VanDerWaalsContact O-N 3.14Å; K88-K90 PolarHBondContact O-N 2.91Å
89	D	26.7	Very low	27.4	Very low	159 Å²	159	147.9 Å²	147.9	85%	0.85	78%	0.781	S	S	*	*			trans	17.9	98.3	157.3	-53.7	-35.5	0	0	0	115.7	P87	P87-D89 PolarHBondContact O-N 3.14Å
90	K	28.1	Very low	26.8	Very low	209 Å²	209	151.4 Å²	151.4	91%	0.909	79%	0.788	S	S	*	*			trans	-88.2	106.9	153.7	-81.8	-174	175.5	-179.5	0	107.6	K88	K88-K90 PolarHBondContact O-N 2.91Å
91	E	27.3	Very low	26	Very low	171 Å²	171	151.4 Å²	151.4	80%	0.799	79%	0.788	S	S	*	*			trans	-47	132.6	161.2	-70.8	177.1	147.5	0	0	110.9	V93	E91-V93 PolarHBondContact O-N 3.34Å
92	D	22.6	Very low	25.2	Very low	159 Å²	159	151.9 Å²	151.9	85%	0.85	79%	0.792	S	S	*	*			trans	9.6	100.6	156.4	-59.5	-31.6	0	0	0	117.6
93	V	27.5	Very low	25	Very low	142 Å²	142	149.9 Å²	149.9	86%	0.861	79%	0.79	S	S	*	*			trans	-126.4	104.9	151.1	-177	0	0	0	0	108.4	E91	E91-V93 PolarHBondContact O-N 3.34Å
94	N	20.3	Very low	24.5	Very low	146 Å²	146	149.7 Å²	149.7	78%	0.781	80%	0.795	S	S	*	*			trans	-56.5	163.6	167.2	-87.2	-44.5	0	0	0	112.5
95	V	21	Very low	24.2	Very low	118 Å²	118	150.1 Å²	150.1	72%	0.715	79%	0.79	S	S	*	*			trans	101.5	102.6	151.6	-168.9	0	0	0	0	116.4
96	E	18.3	Very low	23.8	Very low	180 Å²	180	146.6 Å²	146.6	84%	0.841	78%	0.784	S	S	*	*			trans	44.9	121.5	130.7	-54.7	175.9	167.6	0	0	120.6
97	S	22.8	Very low	23.7	Very low	104 Å²	104	146 Å²	146	73%	0.727	78%	0.783	S	S	*	*			trans	179	113.1	130.4	53.8	0	0	0	0	108.3
98	E	19.7	Very low	23.4	Very low	180 Å²	180	145.5 Å²	145.5	84%	0.841	78%	0.777	S	S	*	*				64.6	97.7	103.3	-75	-173.7	164.6	0	0	112.5
99	S	20	Very low	23	Very low	96 Å²	96	144.7 Å²	144.7	67%	0.671	77%	0.774	S	S	*	*				81.3	121.1	91.8	72.7	0	0	0	0	113.5
100	Q	25	Very low	22.7	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	77%	0.766	S	S	*	*			trans	157.3	90.7	142.6	-89	171	3.8	0	0	106.8
101	D	21.9	Very low	22.4	Very low	143 Å²	143	142.9 Å²	142.9	77%	0.765	77%	0.768	S	S	*	*				71.4	93.3	89.2	-71.5	-30	0	0	0	111.8
102	D	20.8	Very low	22	Very low	152 Å²	152	141.7 Å²	141.7	81%	0.813	77%	0.767	S	S	*	*				24.4	138.3	120	-78.3	-19.5	0	0	0	117.5
103	P	25.5	Very low	22	Very low	105 Å²	105	142.6 Å²	142.6	68%	0.682	77%	0.766	S	S	*	*				-150.9	146.7	80.8	31.8	-10.2	0	0	0	118.4
104	L	22.5	Very low	21.6	Very low	145 Å²	145	143.2 Å²	143.2	76%	0.759	76%	0.759	S	S	*	*			trans	70.9	128.8	139.4	-64.4	151.8	0	0	0	116.1
105	D	25.1	Very low	21.6	Very low	139 Å²	139	142.7 Å²	142.7	74%	0.743	76%	0.756	S	S	*	*			cis	-153.7	130.5	28.1	-123.4	-29.2	0	0	0	110.8
106	S	21.2	Very low	21.5	Very low	93 Å²	93	141.8 Å²	141.8	65%	0.65	75%	0.751	S	S	*	*			trans	-78.6	144.9	165.5	52.9	0	0	0	0	111.2
107	N	23.9	Very low	21.5	Very low	140 Å²	140	139.5 Å²	139.5	75%	0.749	74%	0.744	S	S	*	*			trans	165.2	128.7	142.8	-86.2	-35	0	0	0	106
108	T	21.8	Very low	21.5	Very low	109 Å²	109	143.4 Å²	143.4	67%	0.669	75%	0.748	S	S	*	*			cis	-168.6	126.4	26.9	-8.9	0	0	0	0	105.1
109	K	20.4	Very low	21.4	Very low	172 Å²	172	139.5 Å²	139.5	75%	0.748	74%	0.741	S	S	*	*				61.6	105.1	108.6	-69.7	-167.5	178.3	178.9	0	114.1
110	D	20.4	Very low	21.6	Very low	130 Å²	130	144.6 Å²	144.6	70%	0.695	75%	0.754	S	S	*	*				79.3	100.2	88.1	-75.2	-33.2	0	0	0	111.2
111	E	23.2	Very low	21.4	Very low	200 Å²	200	144.8 Å²	144.8	94%	0.935	75%	0.754	S	S	*	*			trans	-137.4	97.8	137.6	-80.4	-169.7	164.5	0	0	107.9
112	N	18.8	Very low	21.4	Very low	146 Å²	146	145.1 Å²	145.1	78%	0.781	76%	0.756	S	S	*	*			trans	-65.8	132.9	154.1	-81	-43.7	0	0	0	108.5
113	Q	23	Very low	21.4	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	75%	0.746	S	S	*	*			trans	-164	104.7	135.8	-111.2	165.2	-1.1	0	0	108.8
114	E	18.9	Very low	21.2	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.724	75%	0.753	S	S	*	*				76.5	136.4	82.3	-120.5	179.1	-176.5	0	0	113.7
115	L	19.9	Very low	21.1	Very low	135 Å²	135	140.7 Å²	140.7	71%	0.707	75%	0.752	S	S	*	*			trans	85.1	130.6	151.6	-61.3	157.6	0	0	0	116.6
116	T	18.4	Very low	21	Very low	99 Å²	99	141 Å²	141	61%	0.607	75%	0.753	S	S	*	*			cis	173.9	158.2	-8.2	15.1	0	0	0	0	106.2
117	D	19.5	Very low	21.1	Very low	133 Å²	133	143.2 Å²	143.2	71%	0.711	76%	0.758	S	S	*	*			trans	72.9	110.7	140.7	-65.3	-11.7	0	0	0	121
118	K	22.4	Very low	20.9	Very low	186 Å²	186	142.4 Å²	142.4	81%	0.809	76%	0.758	S	S	*	*				161.5	103.8	108.7	-87.1	167.6	-174.3	177.5	0	108
119	S	18	Very low	20.8	Very low	98 Å²	98	143.4 Å²	143.4	69%	0.685	77%	0.766	S	S	*	*				48.6	109.5	84.8	76.2	0	0	0	0	114.1
120	E	23.9	Very low	20.7	Very low	202 Å²	202	138.7 Å²	138.7	94%	0.944	76%	0.759	S	S	*	*			trans	-152.6	137.1	137.9	-112.1	170.2	-153.9	0	0	110.5
121	H	19.2	Very low	20.8	Very low	181 Å²	181	137.7 Å²	137.7	84%	0.838	76%	0.763	S	S	*	*			trans	-94.5	146.5	-170.3	-89.8	-83.9	0	0	0	111.1
122	D	22.7	Very low	20.8	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	76%	0.758	S	S	*	*			trans	-161.7	111.2	135	-117.8	-19.8	0	0	0	107.3
123	S	21.3	Very low	20.8	Very low	85 Å²	85	135 Å²	135	59%	0.594	76%	0.757	S	S	*	*				60.4	128.5	94.1	80.1	0	0	0	0	111.5
124	T	20.8	Very low	20.7	Very low	136 Å²	136	134.1 Å²	134.1	83%	0.834	76%	0.757	S	S	*	*			cis	-163	150.6	18.4	14.3	0	0	0	0	107.6
125	A	19.3	Very low	21.2	Very low	89 Å²	89	131.5 Å²	131.5	74%	0.736	75%	0.753	S	S	*	*			trans	-67.1	146.7	169.7	0	0	0	0	0	112
126	D	23.2	Very low	21.1	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	76%	0.758	S	S	*	*				-165.7	126.2	128	-98.8	-25.4	0	0	0	112.7
127	N	24.6	Very low	21.3	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	77%	0.765	S	S	*	*			trans	69	83	149.9	-58.8	-39.5	0	0	0	121.1
128	V	19.9	Very low	21.3	Very low	124 Å²	124	133.1 Å²	133.1	75%	0.752	77%	0.766	S	S	*	*			trans	-19	137	130.6	178.5	0	0	0	0	114.8	A130	V128-A130 HydrophobicContact CG1-CB 3.59Å
129	P	19.6	Very low	21.4	Very low	129 Å²	129	131.5 Å²	131.5	84%	0.838	77%	0.767	S	S	*	*				-115.3	124.8	114.8	31.6	-28.9	0	0	0	110.8
130	A	18.4	Very low	21.6	Very low	73 Å²	73	135.8 Å²	135.8	60%	0.603	78%	0.776	S	S	*	*			trans	-97.1	166.1	170.9	0	0	0	0	0	108.5	V128	V128-A130 HydrophobicContact CG1-CB 3.59Å
131	S	21.2	Very low	21.6	Very low	110 Å²	110	135 Å²	135	77%	0.769	77%	0.769	S	S	*	*			trans	84.7	125.4	-177.2	80.1	0	0	0	0	112.6
132	Q	23.7	Very low	21.7	Very low	179 Å²	179	132.9 Å²	132.9	84%	0.836	77%	0.769	S	S	*	*			cis	-146	127.2	39.2	-68.2	171.5	-14.6	0	0	111.7
133	S	18.5	Very low	21.7	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	77%	0.773	S	S	*	*			trans	-69.4	151.2	146.4	44.4	0	0	0	0	109.6
134	I	22.4	Very low	21.8	Very low	159 Å²	159	137.3 Å²	137.3	82%	0.815	78%	0.782	S	S	*	*			trans	160.3	139.2	154.1	-84.8	153.6	0	0	0	109.3
135	P	28	Very low	21.9	Very low	101 Å²	101	135.7 Å²	135.7	66%	0.656	78%	0.776	S	S	*	*				-127.6	178.3	-69.9	34.9	-12.1	0	0	0	112.2	I137	P135-I137 PolarHBondContact O-N 3.46Å
136	S	18.2	Very low	22.1	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	78%	0.781	S	S	*	*			trans	-56.6	129.2	166.6	-42.7	0	0	0	0	111.6
137	I	23.7	Very low	22.3	Very low	148 Å²	148	140.6 Å²	140.6	76%	0.759	78%	0.783	S	S	*	*			trans	-117.9	96.4	163.1	-64.8	175.6	0	0	0	107	P135	P135-I137 PolarHBondContact O-N 3.46Å
138	N	19.4	Very low	22.3	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	78%	0.784	S	S	*	*			trans	-62.9	121	148.2	-74.5	-11	0	0	0	106.8
139	D	24.2	Very low	22.7	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	78%	0.783	S	S	*	*			trans	-173	116.6	133.1	-93.2	-25.2	0	0	0	109.6	K141	D139-K141 PolarHBondContact O-N 2.86Å; D139-K141 VanDerWaalsContact O-N 3.14Å
140	E	21.3	Very low	23.3	Very low	188 Å²	188	138.3 Å²	138.3	88%	0.879	78%	0.78	S	S	*	*			trans	-49.5	110.9	160.4	-63	176.4	135.1	0	0	110.2
141	K	23.6	Very low	23.9	Very low	185 Å²	185	141.8 Å²	141.8	80%	0.804	79%	0.789	S	S	*	*			trans	-167.8	92.1	148.6	-104.2	154.3	-165.1	173.8	0	110.6	D139 V143	D139-K141 PolarHBondContact O-N 2.86Å; D139-K141 VanDerWaalsContact O-N 3.14Å; K141-V143 PolarHBondContact O-N 3.16Å
142	T	21.2	Very low	24.4	Very low	137 Å²	137	145.9 Å²	145.9	84%	0.84	79%	0.793	S	S	*	*			trans	13.9	78.6	139	-30.1	0	0	0	0	115.9	K144	T142-K144 PolarHBondContact O-N 3.24Å
143	V	23	Very low	25.1	Very low	144 Å²	144	146 Å²	146	87%	0.873	79%	0.793	S	S	*	*			trans	-79.4	107.5	160.9	179.1	0	0	0	0	107.1	K141 S145	K141-V143 PolarHBondContact O-N 3.16Å; V143-S145 PolarHBondContact O-N 3.35Å
144	K	24.1	Very low	26.2	Very low	183 Å²	183	149.3 Å²	149.3	80%	0.796	80%	0.797	S	S	*	*			trans	-56.5	128.9	171.9	-81.1	178.9	175	177.3	0	109.8	T142 I146	T142-K144 PolarHBondContact O-N 3.24Å; K144-I146 PolarHBondContact O-N 2.58Å
145	S	23	Very low	27.1	Very low	102 Å²	102	149.8 Å²	149.8	71%	0.713	80%	0.801	S	S	*	*			trans	-36.4	116.8	163.8	168.3	0	0	0	0	112.5	V143 H147	V143-S145 PolarHBondContact O-N 3.35Å; S145-H147 PolarHBondContact OG-N 2.85Å
146	I	23.5	Very low	28.4	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	81%	0.806	S	S	*	*			trans	-120.2	74.5	144.6	-55.7	172.7	0	0	0	104.5	K144	K144-I146 PolarHBondContact O-N 2.58Å
147	H	28	Very low	30.1	Very low	176 Å²	176	153.2 Å²	153.2	82%	0.815	81%	0.808	S	S	*	*			trans	-143.6	115.5	156.8	-100.5	60.6	0	0	0	106.9	S145	S145-H147 PolarHBondContact OG-N 2.85Å
148	S	23.7	Very low	32.4	Very low	111 Å²	111	150.4 Å²	150.4	78%	0.776	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-52.3	148.8	176.3	-51.1	0	0	0	0	111
149	P	28.5	Very low	35.5	Very low	112 Å²	112	147.2 Å²	147.2	73%	0.727	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-61.1	147.4	-179.6	17.2	-19.2	0	0	0	110.7	D151	P149-D151 PolarHBondContact O-N 3.41Å
150	P	32.8	Very low	38.7	Very low	120 Å²	120	144.8 Å²	144.8	78%	0.779	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-58.9	133.6	178.8	-11.8	25.1	0	0	0	108.9	K152	P150-K152 PolarHBondContact O-N 3.41Å
151	D	29.2	Very low	42	Very low	147 Å²	147	136.2 Å²	136.2	79%	0.786	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-49.3	130.9	172.7	-74.3	-45.6	0	0	0	109.4	P149 H153	P149-D151 PolarHBondContact O-N 3.41Å; D151-H153 PolarHBondContact O-N 3.38Å
152	K	32.1	Very low	45.3	Very low	196 Å²	196	130.3 Å²	130.3	85%	0.852	71%	0.714	S	S	*	*			trans	-56.7	110.8	167.1	-71.7	176.2	175.3	179.7	0	106.3	P150 E154	P150-K152 PolarHBondContact O-N 3.41Å; K152-E154 VanDerWaalsContact C-N 3.31Å; K152-E154 PolarHBondContact O-N 2.77Å
153	H	39.2	Very low	48.6	Very low	181 Å²	181	129 Å²	129	84%	0.838	70%	0.698	S	S	*	*			trans	-57.6	100.7	166.2	-70.8	-73.3	0	0	0	107.2	D151 D155	D151-H153 PolarHBondContact O-N 3.38Å; H153-D155 PolarHBondContact O-N 3.26Å
154	E	40.4	Very low	52	Low	179 Å²	179	123.4 Å²	123.4	84%	0.836	66%	0.663	S	S	*	*			trans	-55.4	129.6	157.9	-74.8	176.7	154.5	0	0	106.5	K152 S156	K152-E154 VanDerWaalsContact C-N 3.31Å; K152-E154 PolarHBondContact O-N 2.77Å; E154-S156 VanDerWaalsContact C-N 3.35Å; E154-S156 PolarHBondContact O-N 3.26Å
155	D	43.1	Very low	55.3	Low	168 Å²	168	116.1 Å²	116.1	90%	0.898	63%	0.631	S	S	*	*			trans	-52.3	97.4	178.6	-63.9	-54.4	0	0	0	109.2	H153 E157	H153-D155 PolarHBondContact O-N 3.26Å; D155-E157 PolarHBondContact O-N 3.12Å
156	S	54.1	Low	58.6	Low	109 Å²	109	114.9 Å²	114.9	76%	0.762	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-65.3	123.7	-179.2	56.4	0	0	0	0	108.3	E154	E154-S156 VanDerWaalsContact C-N 3.35Å; E154-S156 PolarHBondContact O-N 3.26Å
157	E	54.7	Low	61.9	Low	180 Å²	180	111.4 Å²	111.4	84%	0.841	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-48.5	138	172.7	-73.7	-177.3	163.9	0	0	110.2	D155 S159	D155-E157 PolarHBondContact O-N 3.12Å; E157-S159 PolarHBondContact O-N 3.07Å
158	P	71	Confident	64.8	Low	88 Å²	88	103 Å²	103	57%	0.571	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-55.5	139.1	180	21.7	-31.2	0	0	0	110	Q162	P158-Q162 HydrophobicContact CB-CB 4.13Å; P158-Q162 HydrophobicContact CB-CG 3.95Å
159	S	86	Confident	67.8	Low	70 Å²	70	99.7 Å²	99.7	49%	0.49	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-57.9	153	176.4	71.6	0	0	0	0	110.5	E157 A161 Q162 H163	E157-S159 PolarHBondContact O-N 3.07Å; S159-A161 PolarHBondContact O-N 2.86Å; S159-A161 VanDerWaalsContact O-N 3.1Å; S159-Q162 WeakPolarHBondContact O-CB 3.23Å; S159-Q162 PolarHBondContact O-N 3.49Å; S159-Q162 PolarHBondContact OG-N 3.3Å; S159-H163 PolarHBondContact O-N 3.41Å; S159-H163 VanDerWaalsContact O-N 3.1Å
160	V	90	Very high	70.5	Confident	103 Å²	103	97.5 Å²	97.5	62%	0.624	52%	0.518	S	S	*	.	H	α-helix	trans	-51.3	-38.6	175.9	177.6	0	0	0	0	111	H163 L164	V160-H163 PolarHBondContact O-N 2.83Å; V160-L164 HydrophobicContact CG1-CD1 4.23Å; V160-L164 WeakPolarHBondContact O-CG 3.36Å; V160-L164 PolarHBondContact O-N 3.38Å; V160-L164 VanDerWaalsContact O-N 3.1Å
161	A	90.1	Very high	72.9	Confident	7 Å²	7	93.2 Å²	93.2	6%	0.058	49%	0.488	C	S	.	.	H	α-helix	trans	-66.3	-37.3	177.6	0	0	0	0	0	113.6	S159 Y165 Q195 H197	S159-A161 PolarHBondContact O-N 2.86Å; S159-A161 VanDerWaalsContact O-N 3.1Å; A161-Y165 WeakPolarHBondContact O-CB 3.37Å; A161-Y165 PolarHBondContact O-N 2.88Å; A161-Q195 HydrophobicContact CB-CB 3.76Å; A161-H197 HydrophobicContact CB-CB 4.02Å
162	Q	93	Very high	75.2	Confident	61 Å²	61	87.8 Å²	87.8	29%	0.285	46%	0.459	S	S	.	.	H	α-helix	trans	-65.9	-44.3	175.6	179.6	63.3	41.9	0	0	110.9	P158 S159 L164 Y165 D166 H197	P158-Q162 HydrophobicContact CB-CB 4.13Å; P158-Q162 HydrophobicContact CB-CG 3.95Å; S159-Q162 WeakPolarHBondContact O-CB 3.23Å; S159-Q162 PolarHBondContact O-N 3.49Å; S159-Q162 PolarHBondContact OG-N 3.3Å; Q162-L164 PolarHBondContact O-N 3.35Å; Q162-Y165 WeakPolarHBondContact O-CB 3.34Å; Q162-Y165 PolarHBondContact O-N 3.06Å; Q162-D166 PolarHBondContact NE2-OD1 3.33Å; Q162-D166 PolarHBondContact NE2-OD2 2.93Å; Q162-D166 PolarHBondContact O-N 3.07Å; Q162-H197 PolarHBondContact OE1-NE2 2.94Å; Q162-H197 VanDerWaalsContact OE1-NE2 3.12Å
163	H	92.2	Very high	77	Confident	110 Å²	110	83.1 Å²	83.1	51%	0.509	44%	0.44	S	S	.	.	H	α-helix	trans	-60.4	-45.5	176.8	-176.6	-71.2	0	0	0	111.9	S159 V160 Y165 D166 E167	S159-H163 PolarHBondContact O-N 3.41Å; S159-H163 VanDerWaalsContact O-N 3.1Å; V160-H163 PolarHBondContact O-N 2.83Å; H163-Y165 VanDerWaalsContact C-N 3.29Å; H163-Y165 PolarHBondContact O-N 3.14Å; H163-D166 PolarHBondContact O-N 3.05Å; H163-E167 IonicContact CE1-OE2 3.54Å; H163-E167 IonicContact ND1-OE2 2.7Å; H163-E167 WeakPolarHBondContact O-CB 3.46Å; H163-E167 PolarHBondContact O-N 3.14Å
164	L	93.8	Very high	78.3	Confident	26 Å²	26	79.3 Å²	79.3	14%	0.136	43%	0.43	C	S	.	.	H	α-helix	trans	-60.1	-40.1	176.6	-71.6	170.3	0	0	0	112.1	V160 Q162 A168 L188 E191 A192	V160-L164 HydrophobicContact CG1-CD1 4.23Å; V160-L164 WeakPolarHBondContact O-CG 3.36Å; V160-L164 PolarHBondContact O-N 3.38Å; V160-L164 VanDerWaalsContact O-N 3.1Å; Q162-L164 PolarHBondContact O-N 3.35Å; L164-A168 WeakPolarHBondContact O-CB 3.16Å; L164-A168 PolarHBondContact O-N 3.06Å; L164-L188 HydrophobicContact CD2-CD2 3.72Å; L164-E191 HydrophobicContact CD1-CB 4.11Å; L164-E191 HydrophobicContact CD1-CG 3.6Å; L164-A192 HydrophobicContact CB-CB 3.99Å
165	Y	93.8	Very high	79.1	Confident	30 Å²	30	74.8 Å²	74.8	12%	0.118	41%	0.409	C	S	.	.	H	α-helix	trans	-65.3	-47.3	175.8	172.9	-94.4	0	0	0	111.9	A161 Q162 H163 E167 A168 M169 L189 H197 K199 A200 Q203	A161-Y165 WeakPolarHBondContact O-CB 3.37Å; A161-Y165 PolarHBondContact O-N 2.88Å; Q162-Y165 WeakPolarHBondContact O-CB 3.34Å; Q162-Y165 PolarHBondContact O-N 3.06Å; H163-Y165 VanDerWaalsContact C-N 3.29Å; H163-Y165 PolarHBondContact O-N 3.14Å; Y165-E167 VanDerWaalsContact C-N 3.34Å; Y165-E167 PolarHBondContact O-N 3.45Å; Y165-A168 PolarHBondContact O-N 2.84Å; Y165-M169 HydrophobicContact CD1-CG 4.15Å; Y165-M169 HydrophobicContact CD2-CG 4.22Å; Y165-M169 HydrophobicContact CE1-CG 3.69Å; Y165-M169 HydrophobicContact CE2-CG 3.8Å; Y165-M169 HydrophobicContact CE2-SD 4.04Å; Y165-M169 HydrophobicContact CG-CG 4.39Å; Y165-M169 VanDerWaalsContact CZ-CG 3.49Å; Y165-M169 WeakPolarHBondContact O-CB 3.29Å; Y165-M169 VanDerWaalsContact O-CG 3.32Å; Y165-M169 WeakPolarHBondContact O-CG 3.45Å; Y165-M169 PolarHBondContact O-N 3.01Å; Y165-L189 HydrophobicContact CD2-CD2 3.78Å; Y165-L189 HydrophobicContact CE2-CD2 4.24Å; Y165-H197 AromaticContact CD1-CE1 3.7Å; Y165-H197 AromaticContact CD2-CE1 3.53Å; Y165-H197 AromaticContact CD2-ND1 3.74Å; Y165-H197 AromaticContact CG-CE1 3.29Å; Y165-H197 AromaticContact CG-ND1 3.81Å; Y165-K199 HydrophobicContact CD2-CB 4.38Å; Y165-K199 HydrophobicContact CE1-CD 4.47Å; Y165-K199 HydrophobicContact CE2-CB 3.7Å; Y165-A200 HydrophobicContact CD2-CB 4.04Å; Y165-Q203 HydrophobicContact CE2-CG 4.27Å
166	D	92.2	Very high	79.6	Confident	77 Å²	77	69 Å²	69	41%	0.412	38%	0.381	S	S	.	.	H	α-helix	trans	-64.7	-39.5	-179	-68.4	-28.7	0	0	0	111.7	Q162 H163 M169 S170	Q162-D166 PolarHBondContact NE2-OD1 3.33Å; Q162-D166 PolarHBondContact NE2-OD2 2.93Å; Q162-D166 PolarHBondContact O-N 3.07Å; H163-D166 PolarHBondContact O-N 3.05Å; D166-M169 PolarHBondContact O-N 3.04Å; D166-S170 WeakPolarHBondContact O-CB 3.34Å; D166-S170 PolarHBondContact O-N 3.45Å
167	E	91.5	Very high	79.5	Confident	89 Å²	89	69.8 Å²	69.8	42%	0.416	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-46.2	173.2	-173	176.8	174.7	0	0	111.4	H163 Y165 S170 I171 L188	H163-E167 IonicContact CE1-OE2 3.54Å; H163-E167 IonicContact ND1-OE2 2.7Å; H163-E167 WeakPolarHBondContact O-CB 3.46Å; H163-E167 PolarHBondContact O-N 3.14Å; Y165-E167 VanDerWaalsContact C-N 3.34Å; Y165-E167 PolarHBondContact O-N 3.45Å; E167-S170 WeakPolarHBondContact O-CB 3.31Å; E167-S170 PolarHBondContact O-N 3.23Å; E167-I171 WeakPolarHBondContact O-CG1 3.07Å; E167-I171 PolarHBondContact O-N 3.44Å; E167-I171 VanDerWaalsContact O-N 3.08Å; E167-L188 HydrophobicContact CB-CD1 4.37Å; E167-L188 HydrophobicContact CG-CD1 3.92Å
168	A	89.7	Confident	79.4	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-43.4	177.6	0	0	0	0	0	112.6	L164 Y165 S170 I171 L172 A185 L188 L189	L164-A168 WeakPolarHBondContact O-CB 3.16Å; L164-A168 PolarHBondContact O-N 3.06Å; Y165-A168 PolarHBondContact O-N 2.84Å; A168-S170 VanDerWaalsContact C-N 3.33Å; A168-I171 PolarHBondContact O-N 3.41Å; A168-L172 WeakPolarHBondContact O-CG 3.4Å; A168-L172 PolarHBondContact O-N 3.33Å; A168-A185 HydrophobicContact CB-CB 4.48Å; A168-L188 HydrophobicContact CB-CB 3.73Å; A168-L188 HydrophobicContact CB-CD1 4.27Å; A168-L189 HydrophobicContact CB-CD2 3.93Å; A168-L189 HydrophobicContact CB-CG 3.71Å
169	M	87.4	Confident	78.8	Confident	40 Å²	40	64.8 Å²	64.8	20%	0.197	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-37.8	177.5	-70.1	-53.1	-56.5	0	0	111.6	Y165 D166 I171 L172 E173 Q203	Y165-M169 HydrophobicContact CD1-CG 4.15Å; Y165-M169 HydrophobicContact CD2-CG 4.22Å; Y165-M169 HydrophobicContact CE1-CG 3.69Å; Y165-M169 HydrophobicContact CE2-CG 3.8Å; Y165-M169 HydrophobicContact CE2-SD 4.04Å; Y165-M169 HydrophobicContact CG-CG 4.39Å; Y165-M169 VanDerWaalsContact CZ-CG 3.49Å; Y165-M169 WeakPolarHBondContact O-CB 3.29Å; Y165-M169 VanDerWaalsContact O-CG 3.32Å; Y165-M169 WeakPolarHBondContact O-CG 3.45Å; Y165-M169 PolarHBondContact O-N 3.01Å; D166-M169 PolarHBondContact O-N 3.04Å; M169-I171 VanDerWaalsContact C-N 3.35Å; M169-I171 PolarHBondContact O-N 3.21Å; M169-L172 PolarHBondContact O-N 3.16Å; M169-L172 HydrophobicContact SD-CD1 4.16Å; M169-E173 WeakPolarHBondContact O-CB 3.47Å; M169-E173 WeakPolarHBondContact O-CG 3.33Å; M169-E173 PolarHBondContact O-N 3.49Å; M169-Q203 HydrophobicContact SD-CG 4.26Å
170	S	84.4	Confident	77.4	Confident	66 Å²	66	65 Å²	65	46%	0.462	35%	0.347	S	S	.	.	H	α-helix	trans	-58.6	-46.3	172.9	-176.5	0	0	0	0	111.2	D166 E167 A168 L172 E173 T174	D166-S170 WeakPolarHBondContact O-CB 3.34Å; D166-S170 PolarHBondContact O-N 3.45Å; E167-S170 WeakPolarHBondContact O-CB 3.31Å; E167-S170 PolarHBondContact O-N 3.23Å; A168-S170 VanDerWaalsContact C-N 3.33Å; S170-L172 PolarHBondContact O-N 3.46Å; S170-E173 PolarHBondContact O-N 2.91Å; S170-T174 WeakPolarHBondContact O-CG2 3.32Å; S170-T174 PolarHBondContact O-N 3.08Å; S170-T174 PolarHBondContact O-OG1 3.16Å
171	I	82.6	Confident	75.9	Confident	30 Å²	30	60.3 Å²	60.3	15%	0.154	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-46.2	178	-66.6	165.9	0	0	0	110.9	E167 A168 M169 E173 T174 E175 A181 T184 A185 L188	E167-I171 WeakPolarHBondContact O-CG1 3.07Å; E167-I171 PolarHBondContact O-N 3.44Å; E167-I171 VanDerWaalsContact O-N 3.08Å; A168-I171 PolarHBondContact O-N 3.41Å; M169-I171 VanDerWaalsContact C-N 3.35Å; M169-I171 PolarHBondContact O-N 3.21Å; I171-E173 VanDerWaalsContact C-N 3.28Å; I171-E173 PolarHBondContact O-N 3.08Å; I171-T174 PolarHBondContact O-N 3.14Å; I171-T174 PolarHBondContact O-OG1 3.08Å; I171-E175 WeakPolarHBondContact O-CB 3.21Å; I171-E175 PolarHBondContact O-N 3.49Å; I171-A181 HydrophobicContact CG2-CB 3.93Å; I171-T184 HydrophobicContact CD1-CG2 4.16Å; I171-A185 HydrophobicContact CB-CB 4.43Å; I171-A185 HydrophobicContact CG2-CB 4.19Å; I171-L188 HydrophobicContact CD1-CD1 3.72Å
172	L	77.3	Confident	75	Confident	34 Å²	34	61.5 Å²	61.5	18%	0.178	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-33	178.7	-69.8	174.4	0	0	0	112.6	A168 M169 S170 S176 A185 L189	A168-L172 WeakPolarHBondContact O-CG 3.4Å; A168-L172 PolarHBondContact O-N 3.33Å; M169-L172 PolarHBondContact O-N 3.16Å; M169-L172 HydrophobicContact SD-CD1 4.16Å; S170-L172 PolarHBondContact O-N 3.46Å; L172-S176 WeakPolarHBondContact O-CB 3.45Å; L172-A185 HydrophobicContact CD1-CB 4.27Å; L172-A185 HydrophobicContact CD2-CB 3.68Å; L172-A185 HydrophobicContact CG-CB 3.67Å; L172-L189 HydrophobicContact CD1-CD1 4.13Å
173	E	70.8	Confident	74.3	Confident	98 Å²	98	64.2 Å²	64.2	46%	0.458	33%	0.334	S	S	.	.	H	α-helix	trans	-74.7	-36.7	177.6	-75.4	-173.5	175.8	0	0	112.8	M169 S170 I171 R545	M169-E173 WeakPolarHBondContact O-CB 3.47Å; M169-E173 WeakPolarHBondContact O-CG 3.33Å; M169-E173 PolarHBondContact O-N 3.49Å; S170-E173 PolarHBondContact O-N 2.91Å; I171-E173 VanDerWaalsContact C-N 3.28Å; I171-E173 PolarHBondContact O-N 3.08Å; E173-R545 IonicContact OE1-NH1 2.71Å; E173-R545 PolarHBondContact OE1-NH1 3.48Å
174	T	66.2	Low	73.9	Confident	101 Å²	101	62.3 Å²	62.3	62%	0.62	33%	0.331	S	S	*	.	H	α-helix	trans	-89.3	-35.7	-176.3	55.4	0	0	0	0	114.3	S170 I171	S170-T174 WeakPolarHBondContact O-CG2 3.32Å; S170-T174 PolarHBondContact O-N 3.08Å; S170-T174 PolarHBondContact O-OG1 3.16Å; I171-T174 PolarHBondContact O-N 3.14Å; I171-T174 PolarHBondContact O-OG1 3.08Å
175	E	57.4	Low	73.5	Confident	84 Å²	84	61 Å²	61	39%	0.393	32%	0.324	S	S	.	.			trans	-118.2	26.2	-167.5	-58.3	-161.2	157	0	0	114.2	I171 H177 K178 A181	I171-E175 WeakPolarHBondContact O-CB 3.21Å; I171-E175 PolarHBondContact O-N 3.49Å; E175-H177 PolarHBondContact O-N 2.7Å; E175-K178 PolarHBondContact O-N 3.35Å; E175-K178 VanDerWaalsContact O-N 3.11Å; E175-A181 HydrophobicContact CB-CB 3.54Å; E175-A181 WeakPolarHBondContact OE2-CB 3.39Å
176	S	52.7	Low	73.1	Confident	45 Å²	45	61 Å²	61	32%	0.315	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	3.8	-168.1	68.7	0	0	0	0	118.7	L172	L172-S176 WeakPolarHBondContact O-CB 3.45Å
177	H	53.3	Low	72.9	Confident	126 Å²	126	63.8 Å²	63.8	58%	0.583	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	-6.3	-178.4	-62.9	-48.6	0	0	0	114.3	E175	E175-H177 PolarHBondContact O-N 2.7Å
178	K	52.7	Low	73	Confident	93 Å²	93	61 Å²	61	40%	0.404	32%	0.324	S	S	.	.			trans	-99.1	117.2	-179.8	-66.2	176.3	-172	162	0	109.7	E175 S180 A181 D182 E381	E175-K178 PolarHBondContact O-N 3.35Å; E175-K178 VanDerWaalsContact O-N 3.11Å; K178-S180 PolarHBondContact O-N 3.39Å; K178-A181 HydrophobicContact CB-CB 4.06Å; K178-A181 WeakPolarHBondContact O-CA 3.4Å; K178-A181 VanDerWaalsContact O-CB 3.31Å; K178-A181 WeakPolarHBondContact O-CB 3.14Å; K178-A181 PolarHBondContact O-N 2.92Å; K178-D182 PolarHBondContact O-N 3.27Å; K178-E381 IonicContact NZ-OE1 3.1Å
179	T	58.2	Low	73.1	Confident	71 Å²	71	61 Å²	61	44%	0.436	32%	0.324	S	S	.	.	H	α-helix	trans	-56.1	-23.7	174.7	-41.5	0	0	0	0	113	K183	T179-K183 WeakPolarHBondContact O-CG 3.41Å; T179-K183 PolarHBondContact O-N 3.39Å
180	S	56.3	Low	73.4	Confident	75 Å²	75	61.6 Å²	61.6	52%	0.524	33%	0.332	S	S	.	.	H	α-helix	trans	-70.3	-39.7	171.7	56.1	0	0	0	0	112.9	K178 D182 K183 T184	K178-S180 PolarHBondContact O-N 3.39Å; S180-D182 VanDerWaalsContact C-N 3.34Å; S180-K183 PolarHBondContact O-N 2.87Å; S180-T184 PolarHBondContact O-N 2.97Å; S180-T184 VanDerWaalsContact O-N 3.17Å; S180-T184 PolarHBondContact O-OG1 2.93Å
181	A	59.2	Low	73.8	Confident	3 Å²	3	61.4 Å²	61.4	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-40.3	178.3	0	0	0	0	0	110.9	I171 E175 K178 K183 T184 A185	I171-A181 HydrophobicContact CG2-CB 3.93Å; E175-A181 HydrophobicContact CB-CB 3.54Å; E175-A181 WeakPolarHBondContact OE2-CB 3.39Å; K178-A181 HydrophobicContact CB-CB 4.06Å; K178-A181 WeakPolarHBondContact O-CA 3.4Å; K178-A181 VanDerWaalsContact O-CB 3.31Å; K178-A181 WeakPolarHBondContact O-CB 3.14Å; K178-A181 PolarHBondContact O-N 2.92Å; A181-K183 VanDerWaalsContact C-N 3.27Å; A181-K183 PolarHBondContact O-N 2.94Å; A181-T184 PolarHBondContact O-N 3.33Å; A181-A185 WeakPolarHBondContact O-CB 3.48Å; A181-A185 PolarHBondContact O-N 3.35Å
182	D	69.8	Low	74.4	Confident	32 Å²	32	60 Å²	60	17%	0.171	32%	0.317	C	S	.	.	H	α-helix	trans	-60.3	-37.2	175.8	-59.8	-30.5	0	0	0	112	K178 S180 L186	K178-D182 PolarHBondContact O-N 3.27Å; S180-D182 VanDerWaalsContact C-N 3.34Å; D182-L186 WeakPolarHBondContact O-CB 3.11Å; D182-L186 PolarHBondContact O-N 2.94Å
183	K	78.6	Confident	75.2	Confident	118 Å²	118	59.7 Å²	59.7	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-48.3	177.3	-72	179.2	-178.3	-174.6	0	112.1	T179 S180 A181 A185 L186 E187	T179-K183 WeakPolarHBondContact O-CG 3.41Å; T179-K183 PolarHBondContact O-N 3.39Å; S180-K183 PolarHBondContact O-N 2.87Å; A181-K183 VanDerWaalsContact C-N 3.27Å; A181-K183 PolarHBondContact O-N 2.94Å; K183-A185 VanDerWaalsContact C-N 3.34Å; K183-A185 PolarHBondContact O-N 3.46Å; K183-L186 PolarHBondContact O-N 3.38Å; K183-E187 WeakPolarHBondContact O-CG 3.32Å; K183-E187 PolarHBondContact O-N 3.29Å
184	T	84.5	Confident	76.3	Confident	70 Å²	70	64 Å²	64	43%	0.429	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-43.1	178.6	-57.1	0	0	0	0	111.1	I171 S180 A181 L186 E187 L188	I171-T184 HydrophobicContact CD1-CG2 4.16Å; S180-T184 PolarHBondContact O-N 2.97Å; S180-T184 VanDerWaalsContact O-N 3.17Å; S180-T184 PolarHBondContact O-OG1 2.93Å; A181-T184 PolarHBondContact O-N 3.33Å; T184-L186 PolarHBondContact O-N 2.99Å; T184-E187 PolarHBondContact O-N 3.19Å; T184-L188 WeakPolarHBondContact O-CG 3.35Å; T184-L188 PolarHBondContact O-N 2.67Å; T184-L188 VanDerWaalsContact O-N 3.15Å
185	A	84.5	Confident	77.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-41.4	174.2	0	0	0	0	0	112	A168 I171 L172 A181 K183 E187 L188 L189	A168-A185 HydrophobicContact CB-CB 4.48Å; I171-A185 HydrophobicContact CB-CB 4.43Å; I171-A185 HydrophobicContact CG2-CB 4.19Å; L172-A185 HydrophobicContact CD1-CB 4.27Å; L172-A185 HydrophobicContact CD2-CB 3.68Å; L172-A185 HydrophobicContact CG-CB 3.67Å; A181-A185 WeakPolarHBondContact O-CB 3.48Å; A181-A185 PolarHBondContact O-N 3.35Å; K183-A185 VanDerWaalsContact C-N 3.34Å; K183-A185 PolarHBondContact O-N 3.46Å; A185-E187 PolarHBondContact O-N 3.48Å; A185-L188 PolarHBondContact O-N 3.25Å; A185-L189 WeakPolarHBondContact O-CB 3.27Å; A185-L189 VanDerWaalsContact O-CG 3.26Å; A185-L189 WeakPolarHBondContact O-CG 3.12Å; A185-L189 PolarHBondContact O-N 2.86Å
186	L	85.5	Confident	79.1	Confident	29 Å²	29	61.6 Å²	61.6	15%	0.152	32%	0.324	C	S	.	.	H	α-helix	trans	-64.1	-37.7	177.8	-177	63.8	0	0	0	112.5	D182 K183 T184 S190 L207 Y213	D182-L186 WeakPolarHBondContact O-CB 3.11Å; D182-L186 PolarHBondContact O-N 2.94Å; K183-L186 PolarHBondContact O-N 3.38Å; T184-L186 PolarHBondContact O-N 2.99Å; L186-S190 VanDerWaalsContact O-CB 3.25Å; L186-S190 WeakPolarHBondContact O-CB 3.27Å; L186-S190 PolarHBondContact O-N 3.46Å; L186-S190 PolarHBondContact O-OG 2.85Å; L186-L207 HydrophobicContact CD1-CB 4.18Å; L186-L207 HydrophobicContact CD1-CD1 3.99Å; L186-Y213 HydrophobicContact CD2-CD2 3.77Å; L186-Y213 HydrophobicContact CD2-CE2 4.25Å; L186-Y213 HydrophobicContact CD2-CG 4.07Å
187	E	89	Confident	81.1	Confident	136 Å²	136	60.6 Å²	60.6	64%	0.636	32%	0.315	S	S	*	.	H	α-helix	trans	-63.4	-47.5	175	-74.1	173.7	-173.4	0	0	111.4	K183 T184 A185 S190 E191	K183-E187 WeakPolarHBondContact O-CG 3.32Å; K183-E187 PolarHBondContact O-N 3.29Å; T184-E187 PolarHBondContact O-N 3.19Å; A185-E187 PolarHBondContact O-N 3.48Å; E187-S190 PolarHBondContact O-N 2.95Å; E187-E191 PolarHBondContact O-N 3.47Å
188	L	92.9	Very high	83.1	Confident	30 Å²	30	57.6 Å²	57.6	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-43.6	176.5	-68.7	172.3	0	0	0	112.1	L164 E167 A168 I171 T184 A185 S190 E191 A192	L164-L188 HydrophobicContact CD2-CD2 3.72Å; E167-L188 HydrophobicContact CB-CD1 4.37Å; E167-L188 HydrophobicContact CG-CD1 3.92Å; A168-L188 HydrophobicContact CB-CB 3.73Å; A168-L188 HydrophobicContact CB-CD1 4.27Å; I171-L188 HydrophobicContact CD1-CD1 3.72Å; T184-L188 WeakPolarHBondContact O-CG 3.35Å; T184-L188 PolarHBondContact O-N 2.67Å; T184-L188 VanDerWaalsContact O-N 3.15Å; A185-L188 PolarHBondContact O-N 3.25Å; L188-S190 VanDerWaalsContact C-N 3.34Å; L188-S190 PolarHBondContact O-N 3.44Å; L188-E191 PolarHBondContact O-N 3.23Å; L188-A192 PolarHBondContact O-N 2.93Å
189	L	92.9	Very high	85.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-39.3	175.2	-74.2	170.5	0	0	0	111.9	Y165 A168 L172 A185 E191 A192 S193 A200 Q203 V204 L207	Y165-L189 HydrophobicContact CD2-CD2 3.78Å; Y165-L189 HydrophobicContact CE2-CD2 4.24Å; A168-L189 HydrophobicContact CB-CD2 3.93Å; A168-L189 HydrophobicContact CB-CG 3.71Å; L172-L189 HydrophobicContact CD1-CD1 4.13Å; A185-L189 WeakPolarHBondContact O-CB 3.27Å; A185-L189 VanDerWaalsContact O-CG 3.26Å; A185-L189 WeakPolarHBondContact O-CG 3.12Å; A185-L189 PolarHBondContact O-N 2.86Å; L189-E191 VanDerWaalsContact C-N 3.33Å; L189-A192 PolarHBondContact O-N 3.39Å; L189-S193 WeakPolarHBondContact O-CB 3.38Å; L189-S193 PolarHBondContact O-N 3.31Å; L189-A200 HydrophobicContact CD2-CB 4.22Å; L189-Q203 HydrophobicContact CD1-CB 3.89Å; L189-Q203 HydrophobicContact CD2-CB 4.1Å; L189-Q203 HydrophobicContact CD2-CG 4.47Å; L189-V204 HydrophobicContact CB-CG2 3.8Å; L189-L207 HydrophobicContact CD1-CD1 3.58Å
190	S	92	Very high	86.9	Confident	52 Å²	52	55.4 Å²	55.4	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-65.8	-38.2	177.6	-61.9	0	0	0	0	111.5	L186 E187 L188 S193 R194	L186-S190 VanDerWaalsContact O-CB 3.25Å; L186-S190 WeakPolarHBondContact O-CB 3.27Å; L186-S190 PolarHBondContact O-N 3.46Å; L186-S190 PolarHBondContact O-OG 2.85Å; E187-S190 PolarHBondContact O-N 2.95Å; L188-S190 VanDerWaalsContact C-N 3.34Å; L188-S190 PolarHBondContact O-N 3.44Å; S190-S193 WeakPolarHBondContact O-CB 3.37Å; S190-S193 PolarHBondContact O-N 2.95Å; S190-R194 WeakPolarHBondContact O-CB 3.5Å; S190-R194 PolarHBondContact O-N 3.23Å
191	E	94	Very high	88.7	Confident	62 Å²	62	53.3 Å²	53.3	29%	0.29	27%	0.27	S	S	.	.	H	α-helix	trans	-66.4	-47.4	174.8	-172.1	59.2	-135.4	0	0	111.8	L164 E187 L188 L189 S193 R194 Q195	L164-E191 HydrophobicContact CD1-CB 4.11Å; L164-E191 HydrophobicContact CD1-CG 3.6Å; E187-E191 PolarHBondContact O-N 3.47Å; L188-E191 PolarHBondContact O-N 3.23Å; L189-E191 VanDerWaalsContact C-N 3.33Å; E191-S193 VanDerWaalsContact C-N 3.29Å; E191-S193 PolarHBondContact O-N 3.42Å; E191-R194 PolarHBondContact O-N 3.07Å; E191-R194 IonicContact OE1-CZ 3.69Å; E191-R194 IonicContact OE1-NE 2.82Å; E191-R194 PolarHBondContact OE1-NE 2.94Å; E191-R194 IonicContact OE1-NH2 2.73Å; E191-R194 PolarHBondContact OE1-NH2 2.85Å; E191-R194 IonicContact OE2-CZ 2.78Å; E191-R194 VanDerWaalsContact OE2-CZ 3.23Å; E191-R194 IonicContact OE2-NE 4Å; E191-R194 IonicContact OE2-NH1 2.75Å; E191-R194 IonicContact OE2-NH2 3.72Å; E191-R194 PolarHBondContact OE2-NH2 3.11Å; E191-Q195 WeakPolarHBondContact O-CG 3.37Å; E191-Q195 PolarHBondContact O-N 3.44Å
192	A	95	Very high	90.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-40	174.6	0	0	0	0	0	111.7	L164 L188 L189 Q195 G196 H197 A200	L164-A192 HydrophobicContact CB-CB 3.99Å; L188-A192 PolarHBondContact O-N 2.93Å; L189-A192 PolarHBondContact O-N 3.39Å; A192-Q195 PolarHBondContact O-N 3.42Å; A192-G196 PolarHBondContact O-N 3Å; A192-H197 HydrophobicContact CB-CB 4.26Å; A192-H197 WeakPolarHBondContact O-CB 3.38Å; A192-H197 PolarHBondContact O-N 3.19Å; A192-H197 VanDerWaalsContact O-N 3.11Å; A192-A200 HydrophobicContact CB-CB 3.62Å
193	S	94	Very high	91.5	Very high	29 Å²	29	55.5 Å²	55.5	20%	0.203	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-44.4	176	175.2	0	0	0	0	111.8	L189 S190 E191 Q195 G196 R201	L189-S193 WeakPolarHBondContact O-CB 3.38Å; L189-S193 PolarHBondContact O-N 3.31Å; S190-S193 WeakPolarHBondContact O-CB 3.37Å; S190-S193 PolarHBondContact O-N 2.95Å; E191-S193 VanDerWaalsContact C-N 3.29Å; E191-S193 PolarHBondContact O-N 3.42Å; S193-Q195 PolarHBondContact O-N 3.18Å; S193-G196 PolarHBondContact O-N 3.47Å; S193-R201 WeakPolarHBondContact OG-CG 3.33Å
194	R	93.2	Very high	92.1	Very high	187 Å²	187	51.1 Å²	51.1	71%	0.706	26%	0.262	S	S	*	.	H	α-helix	trans	-63.4	-27.4	175.9	-173.5	174	67	-174.1	4	112.9	S190 E191 G196	S190-R194 WeakPolarHBondContact O-CB 3.5Å; S190-R194 PolarHBondContact O-N 3.23Å; E191-R194 PolarHBondContact O-N 3.07Å; E191-R194 IonicContact OE1-CZ 3.69Å; E191-R194 IonicContact OE1-NE 2.82Å; E191-R194 PolarHBondContact OE1-NE 2.94Å; E191-R194 IonicContact OE1-NH2 2.73Å; E191-R194 PolarHBondContact OE1-NH2 2.85Å; E191-R194 IonicContact OE2-CZ 2.78Å; E191-R194 VanDerWaalsContact OE2-CZ 3.23Å; E191-R194 IonicContact OE2-NE 4Å; E191-R194 IonicContact OE2-NH1 2.75Å; E191-R194 IonicContact OE2-NH2 3.72Å; E191-R194 PolarHBondContact OE2-NH2 3.11Å; R194-G196 PolarHBondContact O-N 3.42Å
195	Q	93.4	Very high	92.5	Very high	87 Å²	87	47.8 Å²	47.8	41%	0.407	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6.9	173.2	-64.9	-178.9	41.8	0	0	113.3	A161 E191 A192 S193	A161-Q195 HydrophobicContact CB-CB 3.76Å; E191-Q195 WeakPolarHBondContact O-CG 3.37Å; E191-Q195 PolarHBondContact O-N 3.44Å; A192-Q195 PolarHBondContact O-N 3.42Å; S193-Q195 PolarHBondContact O-N 3.18Å
196	G	90.4	Very high	92.9	Very high	48 Å²	48	48.2 Å²	48.2	50%	0.495	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	11.4	176.5	0	0	0	0	0	114.6	A192 S193 R194 T198	A192-G196 PolarHBondContact O-N 3Å; S193-G196 PolarHBondContact O-N 3.47Å; R194-G196 PolarHBondContact O-N 3.42Å; G196-T198 PolarHBondContact O-N 3.44Å; G196-T198 VanDerWaalsContact O-N 3.13Å
197	H	94.4	Very high	93	Very high	25 Å²	25	48.4 Å²	48.4	12%	0.116	25%	0.245	C	C	.	.			trans	-70	109.4	178.8	-172.6	-95.4	0	0	0	111.3	A161 Q162 Y165 A192 K199 A200 R201	A161-H197 HydrophobicContact CB-CB 4.02Å; Q162-H197 PolarHBondContact OE1-NE2 2.94Å; Q162-H197 VanDerWaalsContact OE1-NE2 3.12Å; Y165-H197 AromaticContact CD1-CE1 3.7Å; Y165-H197 AromaticContact CD2-CE1 3.53Å; Y165-H197 AromaticContact CD2-ND1 3.74Å; Y165-H197 AromaticContact CG-CE1 3.29Å; Y165-H197 AromaticContact CG-ND1 3.81Å; A192-H197 HydrophobicContact CB-CB 4.26Å; A192-H197 WeakPolarHBondContact O-CB 3.38Å; A192-H197 PolarHBondContact O-N 3.19Å; A192-H197 VanDerWaalsContact O-N 3.11Å; H197-K199 PolarHBondContact O-N 3.27Å; H197-A200 HydrophobicContact CB-CB 3.99Å; H197-A200 WeakPolarHBondContact ND1-CB 3.44Å; H197-A200 PolarHBondContact ND1-N 3.41Å; H197-A200 VanDerWaalsContact ND1-N 3.11Å; H197-A200 WeakPolarHBondContact O-CB 3.43Å; H197-A200 PolarHBondContact O-N 2.85Å; H197-R201 PolarHBondContact O-N 3.36Å
198	T	95.1	Very high	93	Very high	62 Å²	62	42.7 Å²	42.7	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-57	-49.6	-172	-47.8	0	0	0	0	113.2	G196 A200 R201 E202 L228 N233	G196-T198 PolarHBondContact O-N 3.44Å; G196-T198 VanDerWaalsContact O-N 3.13Å; T198-A200 PolarHBondContact O-N 3.41Å; T198-R201 WeakPolarHBondContact O-CB 3.25Å; T198-R201 PolarHBondContact O-N 3.25Å; T198-R201 VanDerWaalsContact O-N 3.14Å; T198-E202 WeakPolarHBondContact O-CG 3.47Å; T198-E202 PolarHBondContact O-N 2.88Å; T198-L228 HydrophobicContact CG2-CD2 4.46Å; T198-N233 VanDerWaalsContact CG2-ND2 3.28Å; T198-N233 WeakPolarHBondContact CG2-ND2 3.3Å
199	K	94.9	Very high	92.9	Very high	119 Å²	119	41.3 Å²	41.3	52%	0.517	21%	0.212	S	C	.	.	H	α-helix	trans	-65.1	-27.4	178.9	-65.3	-179	179.5	175	0	112.7	Y165 H197 E202 Q203	Y165-K199 HydrophobicContact CD2-CB 4.38Å; Y165-K199 HydrophobicContact CE1-CD 4.47Å; Y165-K199 HydrophobicContact CE2-CB 3.7Å; H197-K199 PolarHBondContact O-N 3.27Å; K199-E202 WeakPolarHBondContact O-CB 3.34Å; K199-Q203 WeakPolarHBondContact O-CG 3.38Å; K199-Q203 PolarHBondContact O-N 3.3Å; K199-Q203 VanDerWaalsContact O-N 3.13Å
200	A	94.8	Very high	92.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72	-43	175	0	0	0	0	0	110.5	Y165 L189 A192 H197 T198 E202 Q203 V204	Y165-A200 HydrophobicContact CD2-CB 4.04Å; L189-A200 HydrophobicContact CD2-CB 4.22Å; A192-A200 HydrophobicContact CB-CB 3.62Å; H197-A200 HydrophobicContact CB-CB 3.99Å; H197-A200 WeakPolarHBondContact ND1-CB 3.44Å; H197-A200 PolarHBondContact ND1-N 3.41Å; H197-A200 VanDerWaalsContact ND1-N 3.11Å; H197-A200 WeakPolarHBondContact O-CB 3.43Å; H197-A200 PolarHBondContact O-N 2.85Å; T198-A200 PolarHBondContact O-N 3.41Å; A200-E202 VanDerWaalsContact C-N 3.29Å; A200-E202 PolarHBondContact O-N 3.02Å; A200-Q203 PolarHBondContact O-N 3.11Å; A200-Q203 VanDerWaalsContact O-N 3.17Å; A200-V204 VanDerWaalsContact O-CG2 3.32Å; A200-V204 WeakPolarHBondContact O-CG2 3.45Å; A200-V204 PolarHBondContact O-N 2.95Å
201	R	95.4	Very high	92.1	Very high	30 Å²	30	40.4 Å²	40.4	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-56	-44.4	172.9	-68.9	167.1	69	-152.7	3.2	111.6	S193 H197 T198 V204 A205 E227 L228 E231	S193-R201 WeakPolarHBondContact OG-CG 3.33Å; H197-R201 PolarHBondContact O-N 3.36Å; T198-R201 WeakPolarHBondContact O-CB 3.25Å; T198-R201 PolarHBondContact O-N 3.25Å; T198-R201 VanDerWaalsContact O-N 3.14Å; R201-V204 PolarHBondContact O-N 2.97Å; R201-A205 WeakPolarHBondContact O-CB 3.41Å; R201-A205 PolarHBondContact O-N 3.26Å; R201-E227 IonicContact CZ-OE1 2.62Å; R201-E227 IonicContact NE-OE1 3.86Å; R201-E227 VanDerWaalsContact NH2-CD 3.26Å; R201-E227 IonicContact NH2-OE1 3.49Å; R201-E227 PolarHBondContact NH2-OE1 2.84Å; R201-L228 HydrophobicContact CB-CD1 4.48Å; R201-L228 HydrophobicContact CB-CD2 4Å; R201-E231 IonicContact CZ-OE1 3.2Å; R201-E231 IonicContact CZ-OE2 3.93Å; R201-E231 VanDerWaalsContact NH1-CD 3.3Å; R201-E231 IonicContact NH1-OE1 2.81Å; R201-E231 PolarHBondContact NH1-OE1 3.02Å; R201-E231 VanDerWaalsContact NH1-OE1 3.1Å; R201-E231 IonicContact NH1-OE2 3.43Å; R201-E231 PolarHBondContact NH1-OE2 3.48Å; R201-E231 IonicContact NH2-OE1 3.45Å; R201-E231 PolarHBondContact NH2-OE1 3.06Å; R201-E231 IonicContact NH2-OE2 3.6Å
202	E	95.5	Very high	90.8	Very high	30 Å²	30	39 Å²	39	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-56.2	-50.1	173.9	-71.2	177.7	-151.5	0	0	112.6	T198 K199 A200 A205 M206 L228 N233 R235	T198-E202 WeakPolarHBondContact O-CG 3.47Å; T198-E202 PolarHBondContact O-N 2.88Å; K199-E202 WeakPolarHBondContact O-CB 3.34Å; A200-E202 VanDerWaalsContact C-N 3.29Å; A200-E202 PolarHBondContact O-N 3.02Å; E202-A205 PolarHBondContact O-N 3.32Å; E202-M206 WeakPolarHBondContact O-CG 3.39Å; E202-M206 PolarHBondContact O-N 2.81Å; E202-L228 HydrophobicContact CG-CD1 4.27Å; E202-N233 PolarHBondContact OE1-ND2 3.42Å; E202-R235 HydrophobicContact CB-CB 4.3Å; E202-R235 HydrophobicContact CB-CG 3.93Å; E202-R235 HydrophobicContact CG-CB 3.75Å; E202-R235 HydrophobicContact CG-CG 3.93Å
203	Q	91.4	Very high	89.4	Confident	51 Å²	51	43 Å²	43	24%	0.238	22%	0.223	C	C	.	.	H	α-helix	trans	-66.3	-40.9	179.4	-66.8	-54.2	-41.2	0	0	111.9	Y165 M169 L189 K199 A200 A205 M206 L207	Y165-Q203 HydrophobicContact CE2-CG 4.27Å; M169-Q203 HydrophobicContact SD-CG 4.26Å; L189-Q203 HydrophobicContact CD1-CB 3.89Å; L189-Q203 HydrophobicContact CD2-CB 4.1Å; L189-Q203 HydrophobicContact CD2-CG 4.47Å; K199-Q203 WeakPolarHBondContact O-CG 3.38Å; K199-Q203 PolarHBondContact O-N 3.3Å; K199-Q203 VanDerWaalsContact O-N 3.13Å; A200-Q203 PolarHBondContact O-N 3.11Å; A200-Q203 VanDerWaalsContact O-N 3.17Å; Q203-A205 PolarHBondContact O-N 3.26Å; Q203-M206 PolarHBondContact O-N 2.67Å; Q203-L207 VanDerWaalsContact O-CB 3.31Å; Q203-L207 WeakPolarHBondContact O-CB 3.44Å; Q203-L207 VanDerWaalsContact O-CG 3.26Å; Q203-L207 WeakPolarHBondContact O-CG 3.34Å; Q203-L207 PolarHBondContact O-N 3.32Å
204	V	91.3	Very high	88.3	Confident	26 Å²	26	44 Å²	44	16%	0.158	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-44.9	176.2	172	0	0	0	0	110.7	L189 A200 R201 L207 T208	L189-V204 HydrophobicContact CB-CG2 3.8Å; A200-V204 VanDerWaalsContact O-CG2 3.32Å; A200-V204 WeakPolarHBondContact O-CG2 3.45Å; A200-V204 PolarHBondContact O-N 2.95Å; R201-V204 PolarHBondContact O-N 2.97Å; V204-L207 PolarHBondContact O-N 2.69Å; V204-T208 VanDerWaalsContact O-CB 3.29Å; V204-T208 WeakPolarHBondContact O-CB 3.41Å; V204-T208 PolarHBondContact O-N 2.93Å; V204-T208 PolarHBondContact O-OG1 3.4Å
205	A	93.3	Very high	87.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-45.6	177.2	0	0	0	0	0	111.6	R201 E202 Q203 T208 L209 A224 F225 L228	R201-A205 WeakPolarHBondContact O-CB 3.41Å; R201-A205 PolarHBondContact O-N 3.26Å; E202-A205 PolarHBondContact O-N 3.32Å; Q203-A205 PolarHBondContact O-N 3.26Å; A205-T208 PolarHBondContact O-N 3Å; A205-L209 PolarHBondContact O-N 3.35Å; A205-A224 HydrophobicContact CB-CB 3.8Å; A205-F225 HydrophobicContact CB-CD1 3.81Å; A205-F225 HydrophobicContact CB-CE1 3.49Å; A205-F225 VanDerWaalsContact CB-CE1 3.49Å; A205-F225 HydrophobicContact CB-CZ 3.98Å; A205-L228 HydrophobicContact CB-CD1 4.37Å
206	M	92.8	Very high	86.9	Confident	9 Å²	9	40.2 Å²	40.2	4%	0.044	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-44.5	177	-71.6	-61.2	-57.1	0	0	112.9	E202 Q203 T208 L209 L210 F225 R235 F271 L571	E202-M206 WeakPolarHBondContact O-CG 3.39Å; E202-M206 PolarHBondContact O-N 2.81Å; Q203-M206 PolarHBondContact O-N 2.67Å; M206-T208 VanDerWaalsContact C-N 3.32Å; M206-T208 PolarHBondContact O-N 2.82Å; M206-L209 WeakPolarHBondContact O-CB 3.49Å; M206-L209 PolarHBondContact O-N 2.94Å; M206-L210 HydrophobicContact CE-CD1 4.38Å; M206-L210 WeakPolarHBondContact O-CB 3.26Å; M206-L210 VanDerWaalsContact O-CG 3.29Å; M206-L210 WeakPolarHBondContact O-CG 3.26Å; M206-L210 PolarHBondContact O-N 3.34Å; M206-F225 HydrophobicContact CG-CE1 4.35Å; M206-F225 HydrophobicContact CG-CZ 4.39Å; M206-F225 HydrophobicContact SD-CE1 3.91Å; M206-F225 HydrophobicContact SD-CZ 3.65Å; M206-R235 HydrophobicContact CG-CG 4.37Å; M206-F271 HydrophobicContact CE-CE2 4.15Å; M206-L571 HydrophobicContact CE-CD2 3.8Å
207	L	88	Confident	86.7	Confident	33 Å²	33	38.6 Å²	38.6	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-34.9	177.8	-72.8	173.1	0	0	0	111.8	L186 L189 Q203 V204 L210 G211	L186-L207 HydrophobicContact CD1-CB 4.18Å; L186-L207 HydrophobicContact CD1-CD1 3.99Å; L189-L207 HydrophobicContact CD1-CD1 3.58Å; Q203-L207 VanDerWaalsContact O-CB 3.31Å; Q203-L207 WeakPolarHBondContact O-CB 3.44Å; Q203-L207 VanDerWaalsContact O-CG 3.26Å; Q203-L207 WeakPolarHBondContact O-CG 3.34Å; Q203-L207 PolarHBondContact O-N 3.32Å; V204-L207 PolarHBondContact O-N 2.69Å; L207-L210 PolarHBondContact O-N 3.24Å; L207-G211 WeakPolarHBondContact O-CA 3.35Å; L207-G211 PolarHBondContact O-N 3.24Å
208	T	89.3	Confident	86.5	Confident	17 Å²	17	38.6 Å²	38.6	10%	0.104	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-45.2	174.2	-59.1	0	0	0	0	110.9	V204 A205 M206 T214 P217 A221	V204-T208 VanDerWaalsContact O-CB 3.29Å; V204-T208 WeakPolarHBondContact O-CB 3.41Å; V204-T208 PolarHBondContact O-N 2.93Å; V204-T208 PolarHBondContact O-OG1 3.4Å; A205-T208 PolarHBondContact O-N 3Å; M206-T208 VanDerWaalsContact C-N 3.32Å; M206-T208 PolarHBondContact O-N 2.82Å; T208-T214 HydrophobicContact CG2-CG2 3.94Å; T208-P217 WeakPolarHBondContact O-CB 3.32Å; T208-A221 HydrophobicContact CG2-CB 4.47Å
209	L	90.7	Very high	86.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-46.6	175.6	178.9	67.2	0	0	0	112	A205 M206 F218 A221 F225 F242 L243 V567	A205-L209 PolarHBondContact O-N 3.35Å; M206-L209 WeakPolarHBondContact O-CB 3.49Å; M206-L209 PolarHBondContact O-N 2.94Å; L209-F218 HydrophobicContact CD1-CD1 3.93Å; L209-F218 HydrophobicContact CD1-CE1 4.19Å; L209-A221 HydrophobicContact CB-CB 3.83Å; L209-A221 HydrophobicContact CD1-CB 4.17Å; L209-F225 HydrophobicContact CB-CE2 4.36Å; L209-F225 HydrophobicContact CD2-CE2 4Å; L209-F225 HydrophobicContact CD2-CZ 4.2Å; L209-F242 HydrophobicContact CD1-CE1 4.37Å; L209-F242 HydrophobicContact CD2-CD1 3.84Å; L209-F242 HydrophobicContact CD2-CE1 3.81Å; L209-L243 HydrophobicContact CD1-CD2 3.98Å; L209-V567 HydrophobicContact CD1-CG1 4.18Å; L209-V567 HydrophobicContact CG-CG1 4.05Å
210	L	89.3	Confident	86.2	Confident	21 Å²	21	36.3 Å²	36.3	11%	0.11	21%	0.214	C	C	.	.	H	α-helix	trans	-83.1	-44	-171.8	-64.4	178.3	0	0	0	113.5	M206 L207 M549 E564 V567 L571	M206-L210 HydrophobicContact CE-CD1 4.38Å; M206-L210 WeakPolarHBondContact O-CB 3.26Å; M206-L210 VanDerWaalsContact O-CG 3.29Å; M206-L210 WeakPolarHBondContact O-CG 3.26Å; M206-L210 PolarHBondContact O-N 3.34Å; L207-L210 PolarHBondContact O-N 3.24Å; L210-M549 HydrophobicContact CD1-CE 4.06Å; L210-E564 WeakPolarHBondContact O-CA 3.31Å; L210-E564 WeakPolarHBondContact O-CB 3.49Å; L210-E564 VanDerWaalsContact O-CG 3.31Å; L210-E564 WeakPolarHBondContact O-CG 3.26Å; L210-V567 HydrophobicContact CD2-CG1 4.18Å; L210-L571 HydrophobicContact CD1-CD2 4.25Å; L210-L571 HydrophobicContact CD2-CD2 3.97Å
211	G	77.6	Confident	86.2	Confident	13 Å²	13	36.3 Å²	36.3	13%	0.134	21%	0.214	C	C	.	.	H	α-helix	trans	-90.6	-14.3	-166.4	0	0	0	0	0	116	L207 Y213	L207-G211 WeakPolarHBondContact O-CA 3.35Å; L207-G211 PolarHBondContact O-N 3.24Å; G211-Y213 VanDerWaalsContact C-N 3.25Å; G211-Y213 PolarHBondContact O-N 2.84Å
212	G	66.4	Low	86.2	Confident	31 Å²	31	36.4 Å²	36.4	32%	0.32	21%	0.214	S	C	.	.			trans	64.6	23.3	175.8	0	0	0	0	0	115.1	T214	G212-T214 PolarHBondContact O-N 3.26Å
213	Y	67.3	Low	86.3	Confident	85 Å²	85	37.6 Å²	37.6	33%	0.333	23%	0.226	S	C	.	.			trans	-68.3	-14.9	-178	-56.4	-71.6	0	0	0	114	L186 G211	L186-Y213 HydrophobicContact CD2-CD2 3.77Å; L186-Y213 HydrophobicContact CD2-CE2 4.25Å; L186-Y213 HydrophobicContact CD2-CG 4.07Å; G211-Y213 VanDerWaalsContact C-N 3.25Å; G211-Y213 PolarHBondContact O-N 2.84Å
214	T	69.6	Low	86.4	Confident	51 Å²	51	36.5 Å²	36.5	31%	0.313	23%	0.226	S	C	.	.	S	Bend	trans	-104.6	155.5	-177.5	54	0	0	0	0	111.4	T208 G212 D216 P217	T208-T214 HydrophobicContact CG2-CG2 3.94Å; G212-T214 PolarHBondContact O-N 3.26Å; T214-D216 VanDerWaalsContact C-N 3.3Å; T214-D216 PolarHBondContact O-N 2.99Å; T214-P217 WeakPolarHBondContact OG1-CA 3.44Å
215	A	75	Confident	86.8	Confident	118 Å²	118	35.3 Å²	35.3	98%	0.975	22%	0.218	S	C	*	.	S	Bend	trans	-61.3	-35.2	-179.6	0	0	0	0	0	113.7
216	D	83.5	Confident	87	Confident	76 Å²	76	39.1 Å²	39.1	41%	0.406	24%	0.236	S	C	.	.	S	Bend	trans	-129.2	87.9	171	-172.6	-10.8	0	0	0	109.5	T214 F218 Q219 S220	T214-D216 VanDerWaalsContact C-N 3.3Å; T214-D216 PolarHBondContact O-N 2.99Å; D216-F218 VanDerWaalsContact C-N 3.31Å; D216-F218 PolarHBondContact O-N 3.23Å; D216-F218 PolarHBondContact OD1-N 3.04Å; D216-Q219 HydrophobicContact CB-CB 4.23Å; D216-Q219 PolarHBondContact OD1-N 2.98Å; D216-Q219 VanDerWaalsContact OD1-N 3.17Å; D216-Q219 WeakPolarHBondContact OD2-CB 3.03Å; D216-S220 WeakPolarHBondContact O-CB 3.26Å; D216-S220 PolarHBondContact O-N 3.18Å; D216-S220 VanDerWaalsContact O-N 3.17Å; D216-S220 PolarHBondContact O-OG 3.47Å
217	P	86.1	Confident	87.2	Confident	14 Å²	14	43.8 Å²	43.8	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-33.9	-174.8	25.7	-32.5	0	0	0	113	T208 T214 A221	T208-P217 WeakPolarHBondContact O-CB 3.32Å; T214-P217 WeakPolarHBondContact OG1-CA 3.44Å; P217-A221 WeakPolarHBondContact O-CB 3.14Å; P217-A221 PolarHBondContact O-N 3.25Å
218	F	89.9	Confident	87.7	Confident	24 Å²	24	42.3 Å²	42.3	11%	0.105	25%	0.25	C	C	.	.	H	α-helix	trans	-76.1	-43.7	-177.2	-60.7	-62.8	0	0	0	112.6	L209 D216 S220 A221 Y222 L243 L248 H249 H563 V567	L209-F218 HydrophobicContact CD1-CD1 3.93Å; L209-F218 HydrophobicContact CD1-CE1 4.19Å; D216-F218 VanDerWaalsContact C-N 3.31Å; D216-F218 PolarHBondContact O-N 3.23Å; D216-F218 PolarHBondContact OD1-N 3.04Å; F218-S220 VanDerWaalsContact C-N 3.33Å; F218-S220 PolarHBondContact O-N 3.37Å; F218-A221 PolarHBondContact O-N 3.3Å; F218-Y222 VanDerWaalsContact O-CB 3.24Å; F218-Y222 WeakPolarHBondContact O-CB 3.32Å; F218-Y222 PolarHBondContact O-N 2.92Å; F218-L243 HydrophobicContact CD1-CD2 4.49Å; F218-L248 HydrophobicContact CD1-CB 4.24Å; F218-L248 HydrophobicContact CE1-CB 4.04Å; F218-L248 HydrophobicContact CE1-CD1 3.92Å; F218-L248 HydrophobicContact CE1-CD2 4.49Å; F218-L248 HydrophobicContact CE1-CG 4.37Å; F218-L248 HydrophobicContact CZ-CB 4.49Å; F218-L248 HydrophobicContact CZ-CD1 4.35Å; F218-L248 HydrophobicContact CZ-CD2 4.23Å; F218-H249 HydrophobicContact CB-CB 3.43Å; F218-H249 VanDerWaalsContact CB-CB 3.43Å; F218-H249 HydrophobicContact CG-CB 4.15Å; F218-H563 AromaticContact CE2-NE2 3.26Å; F218-H563 VanDerWaalsContact CE2-NE2 3.26Å; F218-H563 WeakPolarHBondContact CE2-NE2 3.36Å; F218-H563 AromaticContact CZ-CE1 3.87Å; F218-H563 AromaticContact CZ-NE2 3.22Å; F218-H563 WeakPolarHBondContact CZ-NE2 3.44Å; F218-V567 HydrophobicContact CE1-CG1 4.36Å; F218-V567 HydrophobicContact CE1-CG2 3.75Å; F218-V567 HydrophobicContact CZ-CG2 3.65Å
219	Q	92.1	Very high	88.1	Confident	88 Å²	88	42.2 Å²	42.2	41%	0.411	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-42.1	176	178.9	64.8	69.2	0	0	111.3	D216 Y222 S223 H249	D216-Q219 HydrophobicContact CB-CB 4.23Å; D216-Q219 PolarHBondContact OD1-N 2.98Å; D216-Q219 VanDerWaalsContact OD1-N 3.17Å; D216-Q219 WeakPolarHBondContact OD2-CB 3.03Å; Q219-Y222 PolarHBondContact O-N 3.43Å; Q219-S223 PolarHBondContact O-N 3.04Å; Q219-S223 PolarHBondContact O-OG 3.08Å; Q219-H249 PolarHBondContact OE1-CE1 3.25Å; Q219-H249 PolarHBondContact OE1-NE2 2.91Å
220	S	91.8	Very high	88.4	Confident	45 Å²	45	48.6 Å²	48.6	32%	0.315	28%	0.284	S	S	.	.	H	α-helix	trans	-63.9	-48.6	179.2	-55	0	0	0	0	110.7	D216 F218 Y222 S223 A224	D216-S220 WeakPolarHBondContact O-CB 3.26Å; D216-S220 PolarHBondContact O-N 3.18Å; D216-S220 VanDerWaalsContact O-N 3.17Å; D216-S220 PolarHBondContact O-OG 3.47Å; F218-S220 VanDerWaalsContact C-N 3.33Å; F218-S220 PolarHBondContact O-N 3.37Å; S220-Y222 PolarHBondContact O-N 2.88Å; S220-S223 PolarHBondContact O-N 3.45Å; S220-S223 PolarHBondContact O-OG 3.32Å; S220-A224 PolarHBondContact O-N 2.86Å; S220-A224 VanDerWaalsContact O-N 3.13Å
221	A	93.3	Very high	88.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-42.7	176.1	0	0	0	0	0	112.1	T208 L209 P217 F218 S223 A224 F225	T208-A221 HydrophobicContact CG2-CB 4.47Å; L209-A221 HydrophobicContact CB-CB 3.83Å; L209-A221 HydrophobicContact CD1-CB 4.17Å; P217-A221 WeakPolarHBondContact O-CB 3.14Å; P217-A221 PolarHBondContact O-N 3.25Å; F218-A221 PolarHBondContact O-N 3.3Å; A221-S223 PolarHBondContact O-N 3.44Å; A221-A224 PolarHBondContact O-N 3.24Å; A221-F225 HydrophobicContact CB-CD2 4.26Å; A221-F225 HydrophobicContact CB-CE2 3.92Å; A221-F225 WeakPolarHBondContact O-CB 3.37Å; A221-F225 WeakPolarHBondContact O-CD2 3.45Å; A221-F225 WeakPolarHBondContact O-CG 3.35Å; A221-F225 PolarHBondContact O-N 3.11Å
222	Y	96.1	Very high	89.7	Confident	33 Å²	33	54.3 Å²	54.3	13%	0.129	32%	0.319	C	S	.	.	H	α-helix	trans	-56.3	-50.9	176.9	-179.5	-83.4	0	0	0	111.1	F218 Q219 S220 A224 F225 E226 L240 L243 H249 V250	F218-Y222 VanDerWaalsContact O-CB 3.24Å; F218-Y222 WeakPolarHBondContact O-CB 3.32Å; F218-Y222 PolarHBondContact O-N 2.92Å; Q219-Y222 PolarHBondContact O-N 3.43Å; S220-Y222 PolarHBondContact O-N 2.88Å; Y222-A224 VanDerWaalsContact C-N 3.34Å; Y222-A224 PolarHBondContact O-N 3.43Å; Y222-F225 PolarHBondContact O-N 3.48Å; Y222-E226 HydrophobicContact CE1-CB 4.36Å; Y222-E226 WeakPolarHBondContact O-CB 3.36Å; Y222-E226 PolarHBondContact O-N 2.81Å; Y222-E226 PolarHBondContact OH-OE1 3.3Å; Y222-L240 HydrophobicContact CD2-CD2 3.9Å; Y222-L240 HydrophobicContact CE2-CD2 3.72Å; Y222-L243 HydrophobicContact CD2-CD1 3.87Å; Y222-L243 HydrophobicContact CG-CD1 4.44Å; Y222-H249 AromaticContact CG-CD2 3.96Å; Y222-V250 HydrophobicContact CD2-CG1 3.88Å; Y222-V250 HydrophobicContact CE2-CG1 3.62Å
223	S	96.6	Very high	91.2	Very high	55 Å²	55	53.5 Å²	53.5	39%	0.385	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-40.5	180	62.7	0	0	0	0	112.9	Q219 S220 A221 E226 E227	Q219-S223 PolarHBondContact O-N 3.04Å; Q219-S223 PolarHBondContact O-OG 3.08Å; S220-S223 PolarHBondContact O-N 3.45Å; S220-S223 PolarHBondContact O-OG 3.32Å; A221-S223 PolarHBondContact O-N 3.44Å; S223-E226 PolarHBondContact O-N 3.44Å; S223-E227 PolarHBondContact O-N 3.49Å
224	A	95.4	Very high	92.7	Very high	28 Å²	28	51 Å²	51	23%	0.231	30%	0.301	C	S	.	.	H	α-helix	trans	-67.8	-39.9	177.4	0	0	0	0	0	112.3	A205 S220 A221 Y222 L228	A205-A224 HydrophobicContact CB-CB 3.8Å; S220-A224 PolarHBondContact O-N 2.86Å; S220-A224 VanDerWaalsContact O-N 3.13Å; A221-A224 PolarHBondContact O-N 3.24Å; Y222-A224 VanDerWaalsContact C-N 3.34Å; Y222-A224 PolarHBondContact O-N 3.43Å; A224-L228 WeakPolarHBondContact O-CB 3.22Å; A224-L228 WeakPolarHBondContact O-CG 3.39Å; A224-L228 PolarHBondContact O-N 3.34Å; A224-L228 VanDerWaalsContact O-N 3.1Å
225	F	98	Very high	94	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.9	-35.3	175.3	-69	-46.9	0	0	0	112.5	A205 M206 L209 A221 Y222 S229 L240 L243	A205-F225 HydrophobicContact CB-CD1 3.81Å; A205-F225 HydrophobicContact CB-CE1 3.49Å; A205-F225 VanDerWaalsContact CB-CE1 3.49Å; A205-F225 HydrophobicContact CB-CZ 3.98Å; M206-F225 HydrophobicContact CG-CE1 4.35Å; M206-F225 HydrophobicContact CG-CZ 4.39Å; M206-F225 HydrophobicContact SD-CE1 3.91Å; M206-F225 HydrophobicContact SD-CZ 3.65Å; L209-F225 HydrophobicContact CB-CE2 4.36Å; L209-F225 HydrophobicContact CD2-CE2 4Å; L209-F225 HydrophobicContact CD2-CZ 4.2Å; A221-F225 HydrophobicContact CB-CD2 4.26Å; A221-F225 HydrophobicContact CB-CE2 3.92Å; A221-F225 WeakPolarHBondContact O-CB 3.37Å; A221-F225 WeakPolarHBondContact O-CD2 3.45Å; A221-F225 WeakPolarHBondContact O-CG 3.35Å; A221-F225 PolarHBondContact O-N 3.11Å; Y222-F225 PolarHBondContact O-N 3.48Å; F225-S229 WeakPolarHBondContact O-CB 3.3Å; F225-S229 PolarHBondContact O-N 3.3Å; F225-L240 HydrophobicContact CB-CD2 3.98Å; F225-L240 HydrophobicContact CB-CG 4.04Å; F225-L243 HydrophobicContact CD2-CD1 4.21Å
226	E	98.1	Very high	95.1	Very high	80 Å²	80	44.5 Å²	44.5	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-46.1	175	-173.9	172.7	-118.5	0	0	111.5	Y222 S223 S229 N230	Y222-E226 HydrophobicContact CE1-CB 4.36Å; Y222-E226 WeakPolarHBondContact O-CB 3.36Å; Y222-E226 PolarHBondContact O-N 2.81Å; Y222-E226 PolarHBondContact OH-OE1 3.3Å; S223-E226 PolarHBondContact O-N 3.44Å; E226-S229 PolarHBondContact O-N 2.88Å; E226-N230 WeakPolarHBondContact O-CB 3.27Å; E226-N230 PolarHBondContact O-N 3.33Å; E226-N230 PolarHBondContact O-ND2 3.42Å; E226-N230 VanDerWaalsContact O-ND2 3.16Å
227	E	97.8	Very high	95.8	Very high	108 Å²	108	42.1 Å²	42.1	51%	0.505	23%	0.232	S	C	.	.	H	α-helix	trans	-58.1	-50.5	174.7	-166.1	-171.1	146.2	0	0	111.5	R201 S223 S229 N230 E231	R201-E227 IonicContact CZ-OE1 2.62Å; R201-E227 IonicContact NE-OE1 3.86Å; R201-E227 VanDerWaalsContact NH2-CD 3.26Å; R201-E227 IonicContact NH2-OE1 3.49Å; R201-E227 PolarHBondContact NH2-OE1 2.84Å; S223-E227 PolarHBondContact O-N 3.49Å; E227-S229 PolarHBondContact O-N 3.34Å; E227-N230 PolarHBondContact O-N 2.99Å; E227-E231 PolarHBondContact O-N 3.18Å
228	L	98.1	Very high	96.4	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-43.9	176.1	-76.4	170.9	0	0	0	112	T198 R201 E202 A205 A224 N230 E231 G232 N233	T198-L228 HydrophobicContact CG2-CD2 4.46Å; R201-L228 HydrophobicContact CB-CD1 4.48Å; R201-L228 HydrophobicContact CB-CD2 4Å; E202-L228 HydrophobicContact CG-CD1 4.27Å; A205-L228 HydrophobicContact CB-CD1 4.37Å; A224-L228 WeakPolarHBondContact O-CB 3.22Å; A224-L228 WeakPolarHBondContact O-CG 3.39Å; A224-L228 PolarHBondContact O-N 3.34Å; A224-L228 VanDerWaalsContact O-N 3.1Å; L228-N230 VanDerWaalsContact C-N 3.34Å; L228-N230 PolarHBondContact O-N 3.25Å; L228-E231 WeakPolarHBondContact O-CB 3.37Å; L228-E231 PolarHBondContact O-N 3.42Å; L228-G232 PolarHBondContact O-N 2.83Å; L228-N233 HydrophobicContact CB-CB 3.92Å; L228-N233 HydrophobicContact CD2-CB 4.12Å; L228-N233 WeakPolarHBondContact O-CB 3.5Å; L228-N233 PolarHBondContact O-N 3.01Å
229	S	97.9	Very high	96.8	Very high	16 Å²	16	40.4 Å²	40.4	11%	0.112	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-38.3	-179.2	-178	0	0	0	0	112	F225 E226 E227 E231 G232 Q237	F225-S229 WeakPolarHBondContact O-CB 3.3Å; F225-S229 PolarHBondContact O-N 3.3Å; E226-S229 PolarHBondContact O-N 2.88Å; E227-S229 PolarHBondContact O-N 3.34Å; S229-E231 PolarHBondContact O-N 2.92Å; S229-G232 WeakPolarHBondContact O-CA 3.37Å; S229-G232 PolarHBondContact O-N 3.31Å; S229-Q237 WeakPolarHBondContact OG-CG 3.2Å
230	N	97.5	Very high	97.1	Very high	134 Å²	134	36.3 Å²	36.3	72%	0.717	20%	0.204	S	C	*	.	H	α-helix	trans	-65.6	-26.2	176.8	-72.5	-27.6	0	0	0	112.5	E226 E227 L228	E226-N230 WeakPolarHBondContact O-CB 3.27Å; E226-N230 PolarHBondContact O-N 3.33Å; E226-N230 PolarHBondContact O-ND2 3.42Å; E226-N230 VanDerWaalsContact O-ND2 3.16Å; E227-N230 PolarHBondContact O-N 2.99Å; L228-N230 VanDerWaalsContact C-N 3.34Å; L228-N230 PolarHBondContact O-N 3.25Å
231	E	96.5	Very high	97.4	Very high	111 Å²	111	34.1 Å²	34.1	52%	0.519	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-0.6	171.4	-65.1	172.6	-163.2	0	0	113.3	R201 E227 L228 S229	R201-E231 IonicContact CZ-OE1 3.2Å; R201-E231 IonicContact CZ-OE2 3.93Å; R201-E231 VanDerWaalsContact NH1-CD 3.3Å; R201-E231 IonicContact NH1-OE1 2.81Å; R201-E231 PolarHBondContact NH1-OE1 3.02Å; R201-E231 VanDerWaalsContact NH1-OE1 3.1Å; R201-E231 IonicContact NH1-OE2 3.43Å; R201-E231 PolarHBondContact NH1-OE2 3.48Å; R201-E231 IonicContact NH2-OE1 3.45Å; R201-E231 PolarHBondContact NH2-OE1 3.06Å; R201-E231 IonicContact NH2-OE2 3.6Å; E227-E231 PolarHBondContact O-N 3.18Å; L228-E231 WeakPolarHBondContact O-CB 3.37Å; L228-E231 PolarHBondContact O-N 3.42Å; S229-E231 PolarHBondContact O-N 2.92Å
232	G	96.1	Very high	97.6	Very high	43 Å²	43	34.2 Å²	34.2	44%	0.443	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	17.1	-175.7	0	0	0	0	0	113.9	L228 S229	L228-G232 PolarHBondContact O-N 2.83Å; S229-G232 WeakPolarHBondContact O-CA 3.37Å; S229-G232 PolarHBondContact O-N 3.31Å
233	N	98	Very high	97.6	Very high	13 Å²	13	32.7 Å²	32.7	7%	0.07	18%	0.183	C	C	.	.			trans	-70.3	127.4	179.7	-177.2	-85.8	0	0	0	111.4	T198 E202 L228 R235 G236 Q237	T198-N233 VanDerWaalsContact CG2-ND2 3.28Å; T198-N233 WeakPolarHBondContact CG2-ND2 3.3Å; E202-N233 PolarHBondContact OE1-ND2 3.42Å; L228-N233 HydrophobicContact CB-CB 3.92Å; L228-N233 HydrophobicContact CD2-CB 4.12Å; L228-N233 WeakPolarHBondContact O-CB 3.5Å; L228-N233 PolarHBondContact O-N 3.01Å; N233-R235 PolarHBondContact O-N 2.94Å; N233-R235 WeakPolarHBondContact OD1-CA 3.08Å; N233-R235 WeakPolarHBondContact OD1-CB 3.34Å; N233-R235 PolarHBondContact OD1-N 3.5Å; N233-G236 PolarHBondContact O-N 3.43Å; N233-G236 PolarHBondContact OD1-N 3.1Å; N233-Q237 WeakPolarHBondContact O-CG 3.28Å; N233-Q237 PolarHBondContact O-N 2.73Å; N233-Q237 VanDerWaalsContact O-N 3.1Å
234	P	98.3	Very high	97.7	Very high	32 Å²	32	31.9 Å²	31.9	21%	0.208	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-39.7	-177	-22.5	32.9	0	0	0	113.5	Q237 F238 S264 G267 D269	P234-Q237 PolarHBondContact O-N 3.01Å; P234-F238 PolarHBondContact O-N 3.02Å; P234-S264 VanDerWaalsContact O-CB 3.29Å; P234-S264 WeakPolarHBondContact O-CB 3.25Å; P234-S264 PolarHBondContact O-OG 3.36Å; P234-G267 VanDerWaalsContact CG-O 3.24Å; P234-G267 WeakPolarHBondContact CG-O 3.04Å; P234-D269 HydrophobicContact CB-CB 4Å
235	R	97.8	Very high	97.8	Very high	33 Å²	33	31.5 Å²	31.5	13%	0.125	17%	0.169	C	C	.	.	H	α-helix	trans	-70.9	-35.5	179	178	69	67.5	-148.9	-10	111.8	E202 M206 N233 F238 G239 D269 F271	E202-R235 HydrophobicContact CB-CB 4.3Å; E202-R235 HydrophobicContact CB-CG 3.93Å; E202-R235 HydrophobicContact CG-CB 3.75Å; E202-R235 HydrophobicContact CG-CG 3.93Å; M206-R235 HydrophobicContact CG-CG 4.37Å; N233-R235 PolarHBondContact O-N 2.94Å; N233-R235 WeakPolarHBondContact OD1-CA 3.08Å; N233-R235 WeakPolarHBondContact OD1-CB 3.34Å; N233-R235 PolarHBondContact OD1-N 3.5Å; R235-F238 WeakPolarHBondContact O-CB 3.15Å; R235-F238 PolarHBondContact O-N 2.95Å; R235-G239 PolarHBondContact O-N 3.43Å; R235-D269 IonicContact CZ-OD1 3.3Å; R235-D269 IonicContact CZ-OD2 3.99Å; R235-D269 IonicContact NE-OD1 3.36Å; R235-D269 PolarHBondContact NE-OD1 2.77Å; R235-D269 IonicContact NH1-OD1 2.73Å; R235-D269 PolarHBondContact NH1-OD1 2.91Å; R235-D269 IonicContact NH1-OD2 3.57Å; R235-D269 PolarHBondContact NH1-OD2 3.13Å; R235-D269 IonicContact NH2-OD1 2.73Å; R235-D269 PolarHBondContact NH2-OD1 3.32Å; R235-D269 IonicContact NH2-OD2 3.54Å; R235-F271 VanDerWaalsContact NH1-CG 3.26Å
236	G	98.2	Very high	97.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.9	-50.1	170.8	0	0	0	0	0	112	N233 F238 G239 L240	N233-G236 PolarHBondContact O-N 3.43Å; N233-G236 PolarHBondContact OD1-N 3.1Å; G236-F238 PolarHBondContact O-N 3.32Å; G236-G239 PolarHBondContact O-N 3.45Å; G236-L240 PolarHBondContact O-N 2.99Å; G236-L240 VanDerWaalsContact O-N 3.15Å
237	Q	98.5	Very high	97.3	Very high	26 Å²	26	28.4 Å²	28.4	12%	0.121	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-43.7	175	-67.3	165.8	-5.5	0	0	111.6	S229 N233 P234 G239 L240 G241 Y260 F263 S264	S229-Q237 WeakPolarHBondContact OG-CG 3.2Å; N233-Q237 WeakPolarHBondContact O-CG 3.28Å; N233-Q237 PolarHBondContact O-N 2.73Å; N233-Q237 VanDerWaalsContact O-N 3.1Å; P234-Q237 PolarHBondContact O-N 3.01Å; Q237-G239 VanDerWaalsContact C-N 3.32Å; Q237-G239 PolarHBondContact O-N 3.05Å; Q237-L240 PolarHBondContact O-N 3.23Å; Q237-G241 PolarHBondContact O-N 3.27Å; Q237-Y260 HydrophobicContact CB-CD1 4.46Å; Q237-Y260 WeakPolarHBondContact O-CB 3.47Å; Q237-F263 PolarHBondContact OE1-O 3.16Å; Q237-S264 VanDerWaalsContact OE1-N 3.11Å
238	F	98.6	Very high	97	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.009	13%	0.134	C	C	.	.	H	α-helix	trans	-55.9	-47.3	174.3	170.8	-98.6	0	0	0	111.8	P234 R235 G236 L240 G241 F242 L261 S264 F271 A272 L571 L575	P234-F238 PolarHBondContact O-N 3.02Å; R235-F238 WeakPolarHBondContact O-CB 3.15Å; R235-F238 PolarHBondContact O-N 2.95Å; G236-F238 PolarHBondContact O-N 3.32Å; F238-L240 PolarHBondContact O-N 3.19Å; F238-G241 CarbonylContact O-C 3.17Å; F238-G241 PolarHBondContact O-N 3.41Å; F238-G241 VanDerWaalsContact O-N 3.15Å; F238-F242 HydrophobicContact CE1-CB 4.35Å; F238-F242 HydrophobicContact CZ-CB 4.23Å; F238-F242 WeakPolarHBondContact O-CB 3.3Å; F238-F242 PolarHBondContact O-N 3.26Å; F238-L261 HydrophobicContact CD2-CD2 3.75Å; F238-L261 HydrophobicContact CE2-CD2 4.07Å; F238-S264 VanDerWaalsContact CB-OG 3.31Å; F238-S264 WeakPolarHBondContact CB-OG 3.22Å; F238-S264 PolarHBondContact N-OG 2.96Å; F238-F271 HydrophobicContact CD1-CB 4.22Å; F238-F271 HydrophobicContact CD1-CD2 4.19Å; F238-F271 HydrophobicContact CD2-CB 3.7Å; F238-F271 HydrophobicContact CE1-CB 3.93Å; F238-F271 AromaticContact CE1-CD2 3.62Å; F238-F271 HydrophobicContact CE1-CD2 3.62Å; F238-F271 HydrophobicContact CE1-CG 4.29Å; F238-F271 HydrophobicContact CE2-CB 3.37Å; F238-F271 HydrophobicContact CE2-CG 4.46Å; F238-F271 HydrophobicContact CG-CB 4.12Å; F238-F271 HydrophobicContact CZ-CB 3.49Å; F238-F271 VanDerWaalsContact CZ-CB 3.49Å; F238-F271 AromaticContact CZ-CD2 3.84Å; F238-F271 HydrophobicContact CZ-CD2 3.84Å; F238-F271 HydrophobicContact CZ-CG 4.13Å; F238-A272 HydrophobicContact CD2-CB 4.16Å; F238-L571 HydrophobicContact CE1-CD1 3.6Å; F238-L571 HydrophobicContact CZ-CD1 3.43Å; F238-L571 VanDerWaalsContact CZ-CD1 3.43Å; F238-L575 HydrophobicContact CE2-CD2 4.12Å; F238-L575 HydrophobicContact CZ-CD2 4.12Å
239	G	97.8	Very high	96.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58.3	-46.5	-179.2	0	0	0	0	0	112.5	R235 G236 Q237 F242 L243	R235-G239 PolarHBondContact O-N 3.43Å; G236-G239 PolarHBondContact O-N 3.45Å; Q237-G239 VanDerWaalsContact C-N 3.32Å; Q237-G239 PolarHBondContact O-N 3.05Å; G239-F242 PolarHBondContact O-N 3.45Å; G239-L243 WeakPolarHBondContact O-CG 3.48Å; G239-L243 PolarHBondContact O-N 3.38Å
240	L	98.4	Very high	96.4	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-45.1	173.2	-66	-178.5	0	0	0	111.9	Y222 F225 G236 Q237 F238 F242 L243 Y244 Y260	Y222-L240 HydrophobicContact CD2-CD2 3.9Å; Y222-L240 HydrophobicContact CE2-CD2 3.72Å; F225-L240 HydrophobicContact CB-CD2 3.98Å; F225-L240 HydrophobicContact CB-CG 4.04Å; G236-L240 PolarHBondContact O-N 2.99Å; G236-L240 VanDerWaalsContact O-N 3.15Å; Q237-L240 PolarHBondContact O-N 3.23Å; F238-L240 PolarHBondContact O-N 3.19Å; L240-F242 VanDerWaalsContact C-N 3.28Å; L240-F242 PolarHBondContact O-N 3.1Å; L240-L243 PolarHBondContact O-N 3.32Å; L240-Y244 VanDerWaalsContact O-CD2 3.23Å; L240-Y244 WeakPolarHBondContact O-CD2 3.46Å; L240-Y244 PolarHBondContact O-N 3.11Å; L240-Y260 HydrophobicContact CB-CD1 4.1Å; L240-Y260 HydrophobicContact CB-CD2 4.06Å; L240-Y260 HydrophobicContact CB-CE1 4.23Å; L240-Y260 HydrophobicContact CB-CE2 4.21Å; L240-Y260 HydrophobicContact CB-CG 4.03Å; L240-Y260 HydrophobicContact CD1-CD1 4.15Å; L240-Y260 HydrophobicContact CD1-CE1 3.59Å; L240-Y260 HydrophobicContact CD1-CE2 4.44Å
241	G	98.1	Very high	96.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-56.8	-41.8	177	0	0	0	0	0	112.6	Q237 F238 A245 A257	Q237-G241 PolarHBondContact O-N 3.27Å; F238-G241 CarbonylContact O-C 3.17Å; F238-G241 PolarHBondContact O-N 3.41Å; F238-G241 VanDerWaalsContact O-N 3.15Å; G241-A245 VanDerWaalsContact O-CB 3.23Å; G241-A245 WeakPolarHBondContact O-CB 3.45Å; G241-A245 PolarHBondContact O-N 3.45Å; G241-A257 WeakPolarHBondContact O-CB 3.31Å
242	F	97.8	Very high	96	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-45.1	174.7	168.4	-104.3	0	0	0	112.7	L209 F238 G239 L240 A245 S246 L248 Q570 L571 E574	L209-F242 HydrophobicContact CD1-CE1 4.37Å; L209-F242 HydrophobicContact CD2-CD1 3.84Å; L209-F242 HydrophobicContact CD2-CE1 3.81Å; F238-F242 HydrophobicContact CE1-CB 4.35Å; F238-F242 HydrophobicContact CZ-CB 4.23Å; F238-F242 WeakPolarHBondContact O-CB 3.3Å; F238-F242 PolarHBondContact O-N 3.26Å; G239-F242 PolarHBondContact O-N 3.45Å; L240-F242 VanDerWaalsContact C-N 3.28Å; L240-F242 PolarHBondContact O-N 3.1Å; F242-A245 PolarHBondContact O-N 3.45Å; F242-S246 WeakPolarHBondContact O-CB 3.31Å; F242-S246 PolarHBondContact O-N 2.73Å; F242-S246 PolarHBondContact O-OG 2.76Å; F242-L248 HydrophobicContact CE1-CD1 4.21Å; F242-L248 HydrophobicContact CZ-CD1 4.1Å; F242-Q570 HydrophobicContact CE2-CB 4.49Å; F242-Q570 HydrophobicContact CE2-CG 3.98Å; F242-Q570 HydrophobicContact CZ-CB 4.26Å; F242-Q570 HydrophobicContact CZ-CG 3.93Å; F242-L571 HydrophobicContact CD2-CD1 3.97Å; F242-L571 VanDerWaalsContact CE2-CA 3.4Å; F242-L571 HydrophobicContact CE2-CB 4.09Å; F242-L571 HydrophobicContact CE2-CD1 4.21Å; F242-L571 HydrophobicContact CG-CD1 4.18Å; F242-L571 HydrophobicContact CZ-CB 4.17Å; F242-E574 HydrophobicContact CD2-CB 4.13Å; F242-E574 HydrophobicContact CD2-CG 3.92Å; F242-E574 HydrophobicContact CE2-CB 4.38Å; F242-E574 HydrophobicContact CE2-CG 3.95Å
243	L	97	Very high	96.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-43.6	178.9	-69.2	173.1	0	0	0	111.4	L209 F218 Y222 F225 G239 L240 S246 G247 L248 V250	L209-L243 HydrophobicContact CD1-CD2 3.98Å; F218-L243 HydrophobicContact CD1-CD2 4.49Å; Y222-L243 HydrophobicContact CD2-CD1 3.87Å; Y222-L243 HydrophobicContact CG-CD1 4.44Å; F225-L243 HydrophobicContact CD2-CD1 4.21Å; G239-L243 WeakPolarHBondContact O-CG 3.48Å; G239-L243 PolarHBondContact O-N 3.38Å; L240-L243 PolarHBondContact O-N 3.32Å; L243-S246 PolarHBondContact O-OG 2.85Å; L243-G247 WeakPolarHBondContact O-CA 3.25Å; L243-G247 PolarHBondContact O-N 2.89Å; L243-L248 HydrophobicContact CD2-CB 4.11Å; L243-L248 PolarHBondContact O-N 3.19Å; L243-V250 HydrophobicContact CB-CG2 4.03Å; L243-V250 WeakPolarHBondContact O-CG2 3.23Å
244	Y	97.7	Very high	95.9	Very high	39 Å²	39	29.2 Å²	29.2	15%	0.153	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-33.9	173.8	-78.2	-68	0	0	0	113.2	L240 V250 A252 S253 H256 Y260	L240-Y244 VanDerWaalsContact O-CD2 3.23Å; L240-Y244 WeakPolarHBondContact O-CD2 3.46Å; L240-Y244 PolarHBondContact O-N 3.11Å; Y244-V250 HydrophobicContact CD1-CB 4.31Å; Y244-V250 HydrophobicContact CD1-CG2 3.76Å; Y244-V250 HydrophobicContact CE1-CB 4.11Å; Y244-V250 HydrophobicContact CE1-CG2 4.02Å; Y244-V250 HydrophobicContact CG-CG2 4.1Å; Y244-A252 CarbonylContact O-C 3.21Å; Y244-A252 WeakPolarHBondContact O-CA 3.21Å; Y244-S253 PolarHBondContact O-N 2.04Å; Y244-H256 HydrophobicContact CD1-CB 3.89Å; Y244-H256 HydrophobicContact CD2-CB 4.04Å; Y244-H256 HydrophobicContact CE1-CB 4.29Å; Y244-H256 HydrophobicContact CE2-CB 4.46Å; Y244-H256 HydrophobicContact CG-CB 3.76Å; Y244-Y260 AromaticContact CD2-CD2 3.89Å; Y244-Y260 HydrophobicContact CD2-CD2 3.89Å; Y244-Y260 AromaticContact CD2-CE2 3.8Å; Y244-Y260 HydrophobicContact CD2-CE2 3.8Å; Y244-Y260 HydrophobicContact CE2-CD2 4.18Å; Y244-Y260 AromaticContact CE2-CE2 3.6Å; Y244-Y260 HydrophobicContact CE2-CE2 3.6Å
245	A	96.7	Very high	95.9	Very high	20 Å²	20	31.8 Å²	31.8	17%	0.165	18%	0.183	C	C	.	.	H	α-helix	trans	-70.2	-42.6	177.4	0	0	0	0	0	112.5	G241 F242 A257 E574	G241-A245 VanDerWaalsContact O-CB 3.23Å; G241-A245 WeakPolarHBondContact O-CB 3.45Å; G241-A245 PolarHBondContact O-N 3.45Å; F242-A245 PolarHBondContact O-N 3.45Å; A245-A257 HydrophobicContact CB-CB 3.84Å; A245-E574 HydrophobicContact CB-CG 4.46Å
246	S	94.2	Very high	95.9	Very high	7 Å²	7	34.7 Å²	34.7	5%	0.049	20%	0.197	C	C	.	.	H	α-helix	trans	-84.8	-19.7	-176.8	59.9	0	0	0	0	113.5	F242 L243 L248 R604	F242-S246 WeakPolarHBondContact O-CB 3.31Å; F242-S246 PolarHBondContact O-N 2.73Å; F242-S246 PolarHBondContact O-OG 2.76Å; L243-S246 PolarHBondContact O-OG 2.85Å; S246-L248 VanDerWaalsContact C-N 3.3Å; S246-L248 WeakPolarHBondContact OG-CG 3.42Å; S246-R604 PolarHBondContact O-NH1 2.76Å
247	G	92.9	Very high	95.9	Very high	8 Å²	8	34.7 Å²	34.7	8%	0.082	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	37.5	-174.3	0	0	0	0	0	112.3	L243 V250 R604	L243-G247 WeakPolarHBondContact O-CA 3.25Å; L243-G247 PolarHBondContact O-N 2.89Å; G247-V250 CarbonylContact C-O 3.01Å; G247-V250 VanDerWaalsContact CA-O 3.22Å; G247-V250 WeakPolarHBondContact CA-O 3.38Å; G247-R604 PolarHBondContact O-NH2 3.4Å
248	L	90.7	Very high	95.8	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	20%	0.198	C	C	.	.	S	Bend	trans	-95.4	124.5	173.4	-66.1	174.6	0	0	0	108.1	F218 F242 L243 S246 V250 F566 Q570 I596	F218-L248 HydrophobicContact CD1-CB 4.24Å; F218-L248 HydrophobicContact CE1-CB 4.04Å; F218-L248 HydrophobicContact CE1-CD1 3.92Å; F218-L248 HydrophobicContact CE1-CD2 4.49Å; F218-L248 HydrophobicContact CE1-CG 4.37Å; F218-L248 HydrophobicContact CZ-CB 4.49Å; F218-L248 HydrophobicContact CZ-CD1 4.35Å; F218-L248 HydrophobicContact CZ-CD2 4.23Å; F242-L248 HydrophobicContact CE1-CD1 4.21Å; F242-L248 HydrophobicContact CZ-CD1 4.1Å; L243-L248 HydrophobicContact CD2-CB 4.11Å; L243-L248 PolarHBondContact O-N 3.19Å; S246-L248 VanDerWaalsContact C-N 3.3Å; S246-L248 WeakPolarHBondContact OG-CG 3.42Å; L248-V250 PolarHBondContact O-N 2.87Å; L248-F566 HydrophobicContact CD2-CE1 4.02Å; L248-Q570 HydrophobicContact CD1-CG 4.23Å; L248-I596 HydrophobicContact CD2-CD1 3.95Å
249	H	89.9	Confident	95.8	Very high	82 Å²	82	39.1 Å²	39.1	38%	0.38	22%	0.221	S	C	.	.	S	Bend	trans	65.1	-35.6	-175.7	178.6	79.3	0	0	0	116.2	F218 Q219 Y222	F218-H249 HydrophobicContact CB-CB 3.43Å; F218-H249 VanDerWaalsContact CB-CB 3.43Å; F218-H249 HydrophobicContact CG-CB 4.15Å; Q219-H249 PolarHBondContact OE1-CE1 3.25Å; Q219-H249 PolarHBondContact OE1-NE2 2.91Å; Y222-H249 AromaticContact CG-CD2 3.96Å
250	V	93.5	Very high	95.8	Very high	24 Å²	24	41.9 Å²	41.9	15%	0.145	23%	0.232	C	C	.	.	S	Bend	trans	-107.8	158.6	171.2	-62.4	0	0	0	0	111	Y222 L243 Y244 G247 L248 A252	Y222-V250 HydrophobicContact CD2-CG1 3.88Å; Y222-V250 HydrophobicContact CE2-CG1 3.62Å; L243-V250 HydrophobicContact CB-CG2 4.03Å; L243-V250 WeakPolarHBondContact O-CG2 3.23Å; Y244-V250 HydrophobicContact CD1-CB 4.31Å; Y244-V250 HydrophobicContact CD1-CG2 3.76Å; Y244-V250 HydrophobicContact CE1-CB 4.11Å; Y244-V250 HydrophobicContact CE1-CG2 4.02Å; Y244-V250 HydrophobicContact CG-CG2 4.1Å; G247-V250 CarbonylContact C-O 3.01Å; G247-V250 VanDerWaalsContact CA-O 3.22Å; G247-V250 WeakPolarHBondContact CA-O 3.38Å; L248-V250 PolarHBondContact O-N 2.87Å; V250-A252 PolarHBondContact O-N 3.36Å
251	N	93.2	Very high	95.8	Very high	148 Å²	148	42 Å²	42	79%	0.791	23%	0.232	S	C	*	.			trans	-63	137.2	172.1	-71	-23.8	0	0	0	110.3	S253	N251-S253 PolarHBondContact O-N 2.93Å
252	A	93.3	Very high	95.9	Very high	70 Å²	70	44.6 Å²	44.6	58%	0.579	25%	0.248	S	C	*	.			trans	-59.3	127.1	176.2	0	0	0	0	0	110.4	Y244 V250	Y244-A252 CarbonylContact O-C 3.21Å; Y244-A252 WeakPolarHBondContact O-CA 3.21Å; V250-A252 PolarHBondContact O-N 3.36Å
253	S	96.9	Very high	95.9	Very high	26 Å²	26	50 Å²	50	18%	0.182	27%	0.272	C	S	.	.			trans	-146.3	106.8	178.6	163.9	0	0	0	0	110.8	Y244 N251 H256 A257	Y244-S253 PolarHBondContact O-N 2.04Å; N251-S253 PolarHBondContact O-N 2.93Å; S253-H256 WeakPolarHBondContact OG-CB 3.41Å; S253-H256 PolarHBondContact OG-N 3.44Å; S253-H256 PolarHBondContact OG-ND1 2.83Å; S253-A257 WeakPolarHBondContact O-CB 3.27Å; S253-A257 PolarHBondContact O-N 2.87Å
254	I	95.6	Very high	96	Very high	88 Å²	88	50 Å²	50	45%	0.451	27%	0.272	S	S	.	.	H	α-helix	trans	-58.9	-46.3	177.1	-62.2	171.4	0	0	0	112.2	A257 L258	I254-A257 PolarHBondContact O-N 3.47Å; I254-L258 HydrophobicContact CG2-CD1 3.81Å; I254-L258 HydrophobicContact CG2-CG 4.23Å; I254-L258 VanDerWaalsContact O-CG 3.32Å; I254-L258 WeakPolarHBondContact O-CG 3.43Å; I254-L258 PolarHBondContact O-N 3.31Å
255	P	97.2	Very high	96	Very high	86 Å²	86	48.3 Å²	48.3	56%	0.558	27%	0.266	S	S	*	.	H	α-helix	trans	-61.1	-49.7	-179.8	-25.6	36	0	0	0	113.5	A257 L258 I259	P255-A257 VanDerWaalsContact C-N 3.32Å; P255-A257 PolarHBondContact O-N 3.24Å; P255-L258 PolarHBondContact O-N 3.29Å; P255-I259 WeakPolarHBondContact O-CG1 3.34Å; P255-I259 PolarHBondContact O-N 3Å
256	H	97	Very high	96.1	Very high	93 Å²	93	53.6 Å²	53.6	43%	0.431	29%	0.29	S	S	.	.	H	α-helix	trans	-56	-46.4	174.4	-70	95.4	0	0	0	111.8	Y244 S253 L258 I259 Y260	Y244-H256 HydrophobicContact CD1-CB 3.89Å; Y244-H256 HydrophobicContact CD2-CB 4.04Å; Y244-H256 HydrophobicContact CE1-CB 4.29Å; Y244-H256 HydrophobicContact CE2-CB 4.46Å; Y244-H256 HydrophobicContact CG-CB 3.76Å; S253-H256 WeakPolarHBondContact OG-CB 3.41Å; S253-H256 PolarHBondContact OG-N 3.44Å; S253-H256 PolarHBondContact OG-ND1 2.83Å; H256-L258 VanDerWaalsContact C-N 3.34Å; H256-L258 PolarHBondContact O-N 3.39Å; H256-I259 PolarHBondContact O-N 3.06Å; H256-Y260 WeakPolarHBondContact O-CD2 3.21Å; H256-Y260 PolarHBondContact O-N 3.05Å; H256-Y260 VanDerWaalsContact O-N 3.11Å
257	A	98.1	Very high	96.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-46.3	177.5	0	0	0	0	0	112.1	G241 A245 S253 I254 P255 I259 Y260 L261	G241-A257 WeakPolarHBondContact O-CB 3.31Å; A245-A257 HydrophobicContact CB-CB 3.84Å; S253-A257 WeakPolarHBondContact O-CB 3.27Å; S253-A257 PolarHBondContact O-N 2.87Å; I254-A257 PolarHBondContact O-N 3.47Å; P255-A257 VanDerWaalsContact C-N 3.32Å; P255-A257 PolarHBondContact O-N 3.24Å; A257-I259 PolarHBondContact O-N 2.94Å; A257-Y260 PolarHBondContact O-N 3.48Å; A257-L261 VanDerWaalsContact O-CB 3.29Å; A257-L261 WeakPolarHBondContact O-CB 3.45Å; A257-L261 WeakPolarHBondContact O-CG 3.29Å; A257-L261 PolarHBondContact O-N 2.83Å
258	L	98.1	Very high	96.4	Very high	27 Å²	27	57.2 Å²	57.2	14%	0.141	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-40.5	179.8	-69.4	171.3	0	0	0	112.6	I254 P255 H256 T262 L276 G285 V286	I254-L258 HydrophobicContact CG2-CD1 3.81Å; I254-L258 HydrophobicContact CG2-CG 4.23Å; I254-L258 VanDerWaalsContact O-CG 3.32Å; I254-L258 WeakPolarHBondContact O-CG 3.43Å; I254-L258 PolarHBondContact O-N 3.31Å; P255-L258 PolarHBondContact O-N 3.29Å; H256-L258 VanDerWaalsContact C-N 3.34Å; H256-L258 PolarHBondContact O-N 3.39Å; L258-T262 VanDerWaalsContact O-CB 3.27Å; L258-T262 WeakPolarHBondContact O-CB 3.4Å; L258-T262 PolarHBondContact O-N 3.07Å; L258-T262 PolarHBondContact O-OG1 3.11Å; L258-L276 HydrophobicContact CD2-CD2 4.32Å; L258-G285 VanDerWaalsContact CD1-O 3.24Å; L258-G285 WeakPolarHBondContact CD1-O 3.35Å; L258-V286 HydrophobicContact CD1-CG1 3.82Å; L258-V286 HydrophobicContact CD2-CG1 3.75Å; L258-V286 HydrophobicContact CG-CG1 4.43Å
259	I	97.8	Very high	96.7	Very high	95 Å²	95	57.3 Å²	57.3	49%	0.487	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-53.5	177.4	-68.1	166.9	0	0	0	110	P255 H256 A257 L261 T262 F263	P255-I259 WeakPolarHBondContact O-CG1 3.34Å; P255-I259 PolarHBondContact O-N 3Å; H256-I259 PolarHBondContact O-N 3.06Å; A257-I259 PolarHBondContact O-N 2.94Å; I259-L261 PolarHBondContact O-N 3.26Å; I259-T262 PolarHBondContact O-N 3.29Å; I259-F263 HydrophobicContact CG2-CD2 3.94Å; I259-F263 HydrophobicContact CG2-CE2 3.88Å; I259-F263 VanDerWaalsContact O-CD2 3.3Å; I259-F263 WeakPolarHBondContact O-CD2 3.19Å; I259-F263 PolarHBondContact O-N 2.92Å; I259-F263 VanDerWaalsContact O-N 3.12Å
260	Y	98.6	Very high	97.1	Very high	58 Å²	58	55.1 Å²	55.1	23%	0.227	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-43.3	-179.5	-77.8	-61.3	0	0	0	112.7	Q237 L240 Y244 H256 A257 T262 S264	Q237-Y260 HydrophobicContact CB-CD1 4.46Å; Q237-Y260 WeakPolarHBondContact O-CB 3.47Å; L240-Y260 HydrophobicContact CB-CD1 4.1Å; L240-Y260 HydrophobicContact CB-CD2 4.06Å; L240-Y260 HydrophobicContact CB-CE1 4.23Å; L240-Y260 HydrophobicContact CB-CE2 4.21Å; L240-Y260 HydrophobicContact CB-CG 4.03Å; L240-Y260 HydrophobicContact CD1-CD1 4.15Å; L240-Y260 HydrophobicContact CD1-CE1 3.59Å; L240-Y260 HydrophobicContact CD1-CE2 4.44Å; Y244-Y260 AromaticContact CD2-CD2 3.89Å; Y244-Y260 HydrophobicContact CD2-CD2 3.89Å; Y244-Y260 AromaticContact CD2-CE2 3.8Å; Y244-Y260 HydrophobicContact CD2-CE2 3.8Å; Y244-Y260 HydrophobicContact CE2-CD2 4.18Å; Y244-Y260 AromaticContact CE2-CE2 3.6Å; Y244-Y260 HydrophobicContact CE2-CE2 3.6Å; H256-Y260 WeakPolarHBondContact O-CD2 3.21Å; H256-Y260 PolarHBondContact O-N 3.05Å; H256-Y260 VanDerWaalsContact O-N 3.11Å; A257-Y260 PolarHBondContact O-N 3.48Å; Y260-T262 VanDerWaalsContact C-N 3.31Å; Y260-T262 PolarHBondContact O-N 3.29Å; Y260-S264 WeakPolarHBondContact O-CB 3.06Å; Y260-S264 PolarHBondContact O-N 3.02Å
261	L	98.6	Very high	97.3	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-36.6	176.2	-69.9	172.8	0	0	0	111.9	F238 A257 I259 S264 S265 A272 A275 L276	F238-L261 HydrophobicContact CD2-CD2 3.75Å; F238-L261 HydrophobicContact CE2-CD2 4.07Å; A257-L261 VanDerWaalsContact O-CB 3.29Å; A257-L261 WeakPolarHBondContact O-CB 3.45Å; A257-L261 WeakPolarHBondContact O-CG 3.29Å; A257-L261 PolarHBondContact O-N 2.83Å; I259-L261 PolarHBondContact O-N 3.26Å; L261-S264 PolarHBondContact O-N 2.95Å; L261-S265 VanDerWaalsContact O-CB 3.32Å; L261-S265 WeakPolarHBondContact O-CB 3.37Å; L261-S265 PolarHBondContact O-N 3.28Å; L261-A272 HydrophobicContact CD2-CB 4.27Å; L261-A275 HydrophobicContact CD1-CB 4.22Å; L261-A275 HydrophobicContact CD2-CB 4.17Å; L261-L276 HydrophobicContact CB-CD1 4.47Å; L261-L276 HydrophobicContact CB-CD2 3.97Å; L261-L276 HydrophobicContact CB-CG 4.11Å
262	T	98.4	Very high	97.6	Very high	56 Å²	56	47.6 Å²	47.6	34%	0.344	28%	0.279	S	S	.	.	H	α-helix	trans	-65.4	-50.3	178.6	-59	0	0	0	0	111.2	L258 I259 Y260 S264 S265 L266	L258-T262 VanDerWaalsContact O-CB 3.27Å; L258-T262 WeakPolarHBondContact O-CB 3.4Å; L258-T262 PolarHBondContact O-N 3.07Å; L258-T262 PolarHBondContact O-OG1 3.11Å; I259-T262 PolarHBondContact O-N 3.29Å; Y260-T262 VanDerWaalsContact C-N 3.31Å; Y260-T262 PolarHBondContact O-N 3.29Å; T262-S264 VanDerWaalsContact C-N 3.3Å; T262-S264 PolarHBondContact O-N 3.09Å; T262-S265 PolarHBondContact O-N 2.96Å; T262-L266 HydrophobicContact CG2-CD1 4.38Å; T262-L266 WeakPolarHBondContact O-CG 3.3Å; T262-L266 PolarHBondContact O-N 2.84Å
263	F	98.4	Very high	97.8	Very high	116 Å²	116	44.4 Å²	44.4	51%	0.509	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-37.8	176.5	-75.5	-66.7	0	0	0	112.2	Q237 I259 S265 L266 G267	Q237-F263 PolarHBondContact OE1-O 3.16Å; I259-F263 HydrophobicContact CG2-CD2 3.94Å; I259-F263 HydrophobicContact CG2-CE2 3.88Å; I259-F263 VanDerWaalsContact O-CD2 3.3Å; I259-F263 WeakPolarHBondContact O-CD2 3.19Å; I259-F263 PolarHBondContact O-N 2.92Å; I259-F263 VanDerWaalsContact O-N 3.12Å; F263-S265 PolarHBondContact O-N 2.99Å; F263-L266 HydrophobicContact CD1-CD1 4.42Å; F263-L266 PolarHBondContact O-N 2.75Å; F263-G267 PolarHBondContact O-N 2.86Å
264	S	98.7	Very high	97.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-43.1	175.8	-177.4	0	0	0	0	112.6	P234 Q237 F238 Y260 L261 T262 G267 G268 D269 A272	P234-S264 VanDerWaalsContact O-CB 3.29Å; P234-S264 WeakPolarHBondContact O-CB 3.25Å; P234-S264 PolarHBondContact O-OG 3.36Å; Q237-S264 VanDerWaalsContact OE1-N 3.11Å; F238-S264 VanDerWaalsContact CB-OG 3.31Å; F238-S264 WeakPolarHBondContact CB-OG 3.22Å; F238-S264 PolarHBondContact N-OG 2.96Å; Y260-S264 WeakPolarHBondContact O-CB 3.06Å; Y260-S264 PolarHBondContact O-N 3.02Å; L261-S264 PolarHBondContact O-N 2.95Å; T262-S264 VanDerWaalsContact C-N 3.3Å; T262-S264 PolarHBondContact O-N 3.09Å; S264-G267 CarbonylContact O-C 3.57Å; S264-G267 WeakPolarHBondContact O-CA 3.25Å; S264-G267 PolarHBondContact O-N 3.32Å; S264-G268 PolarHBondContact O-N 3.13Å; S264-D269 WeakPolarHBondContact O-CB 3.5Å; S264-D269 PolarHBondContact O-N 2.97Å; S264-D269 WeakPolarHBondContact OG-CB 3.24Å; S264-A272 VanDerWaalsContact OG-CB 3.25Å; S264-A272 WeakPolarHBondContact OG-CB 3.13Å
265	S	98.5	Very high	98	Very high	2 Å²	2	39 Å²	39	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-65.4	-39.8	175	166.8	0	0	0	0	112.4	L261 T262 F263 G267 G268 D273 H296 R299	L261-S265 VanDerWaalsContact O-CB 3.32Å; L261-S265 WeakPolarHBondContact O-CB 3.37Å; L261-S265 PolarHBondContact O-N 3.28Å; T262-S265 PolarHBondContact O-N 2.96Å; F263-S265 PolarHBondContact O-N 2.99Å; S265-G267 PolarHBondContact O-N 2.91Å; S265-G268 PolarHBondContact O-N 3.08Å; S265-D273 WeakPolarHBondContact CB-OD1 3.48Å; S265-D273 PolarHBondContact OG-OD1 3.19Å; S265-H296 PolarHBondContact OG-CE1 2.96Å; S265-H296 VanDerWaalsContact OG-CE1 3.25Å; S265-H296 PolarHBondContact OG-ND1 3.2Å; S265-R299 PolarHBondContact O-NH1 3.45Å; S265-R299 PolarHBondContact OG-NH1 2.82Å; S265-R299 PolarHBondContact OG-NH2 2.9Å
266	L	98.1	Very high	98.1	Very high	131 Å²	131	35 Å²	35	69%	0.686	20%	0.196	S	C	*	.	H	α-helix	trans	-63.7	-32.3	173.3	-71	172.7	0	0	0	111.7	T262 F263 G268	T262-L266 HydrophobicContact CG2-CD1 4.38Å; T262-L266 WeakPolarHBondContact O-CG 3.3Å; T262-L266 PolarHBondContact O-N 2.84Å; F263-L266 HydrophobicContact CD1-CD1 4.42Å; F263-L266 PolarHBondContact O-N 2.75Å; L266-G268 PolarHBondContact O-N 3.5Å
267	G	97.2	Very high	98.2	Very high	43 Å²	43	30.6 Å²	30.6	44%	0.443	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.2	172.3	0	0	0	0	0	115.3	P234 F263 S264 S265	P234-G267 VanDerWaalsContact CG-O 3.24Å; P234-G267 WeakPolarHBondContact CG-O 3.04Å; F263-G267 PolarHBondContact O-N 2.86Å; S264-G267 CarbonylContact O-C 3.57Å; S264-G267 WeakPolarHBondContact O-CA 3.25Å; S264-G267 PolarHBondContact O-N 3.32Å; S265-G267 PolarHBondContact O-N 2.91Å
268	G	96.5	Very high	98.2	Very high	48 Å²	48	30.8 Å²	30.8	50%	0.495	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	21.6	178.1	0	0	0	0	0	114.9	S264 S265 L266 N270	S264-G268 PolarHBondContact O-N 3.13Å; S265-G268 PolarHBondContact O-N 3.08Å; L266-G268 PolarHBondContact O-N 3.5Å; G268-N270 PolarHBondContact O-N 3.2Å
269	D	97.7	Very high	98.1	Very high	8 Å²	8	29.6 Å²	29.6	4%	0.043	17%	0.17	C	C	.	.			trans	-76.3	117.3	174.9	-166.1	89.9	0	0	0	112.4	P234 R235 S264 F271 A272 D273	P234-D269 HydrophobicContact CB-CB 4Å; R235-D269 IonicContact CZ-OD1 3.3Å; R235-D269 IonicContact CZ-OD2 3.99Å; R235-D269 IonicContact NE-OD1 3.36Å; R235-D269 PolarHBondContact NE-OD1 2.77Å; R235-D269 IonicContact NH1-OD1 2.73Å; R235-D269 PolarHBondContact NH1-OD1 2.91Å; R235-D269 IonicContact NH1-OD2 3.57Å; R235-D269 PolarHBondContact NH1-OD2 3.13Å; R235-D269 IonicContact NH2-OD1 2.73Å; R235-D269 PolarHBondContact NH2-OD1 3.32Å; R235-D269 IonicContact NH2-OD2 3.54Å; S264-D269 WeakPolarHBondContact O-CB 3.5Å; S264-D269 PolarHBondContact O-N 2.97Å; S264-D269 WeakPolarHBondContact OG-CB 3.24Å; D269-F271 VanDerWaalsContact C-N 3.27Å; D269-F271 PolarHBondContact O-N 3.33Å; D269-F271 WeakPolarHBondContact OD2-CA 3.44Å; D269-F271 VanDerWaalsContact OD2-CB 3.28Å; D269-F271 WeakPolarHBondContact OD2-CB 3.19Å; D269-F271 PolarHBondContact OD2-N 2.83Å; D269-A272 HydrophobicContact CB-CB 4.02Å; D269-A272 PolarHBondContact O-N 3.15Å; D269-A272 PolarHBondContact OD2-N 3.41Å; D269-A272 VanDerWaalsContact OD2-N 3.12Å; D269-D273 PolarHBondContact O-N 2.89Å
270	N	97.6	Very high	98.2	Very high	35 Å²	35	28 Å²	28	19%	0.187	16%	0.158	C	C	.	.	H	α-helix	trans	-61	-31.8	-179.7	-66.3	-33.3	0	0	0	113.7	G268 M274 V300 W546	G268-N270 PolarHBondContact O-N 3.2Å; N270-M274 VanDerWaalsContact O-CG 3.29Å; N270-M274 WeakPolarHBondContact O-CG 3.04Å; N270-M274 PolarHBondContact O-N 3.36Å; N270-V300 HydrophobicContact CB-CG1 4.44Å; N270-W546 HydrophobicContact CB-CH2 4.14Å; N270-W546 HydrophobicContact CB-CZ3 4.17Å
271	F	98.2	Very high	98.1	Very high	15 Å²	15	28.6 Å²	28.6	7%	0.066	16%	0.16	C	C	.	.	H	α-helix	trans	-74.9	-37.3	179.9	-68.9	-2.9	0	0	0	110.9	M206 R235 F238 D269 D273 M274 A275 W546 M549 L571 L575	M206-F271 HydrophobicContact CE-CE2 4.15Å; R235-F271 VanDerWaalsContact NH1-CG 3.26Å; F238-F271 HydrophobicContact CD1-CB 4.22Å; F238-F271 HydrophobicContact CD1-CD2 4.19Å; F238-F271 HydrophobicContact CD2-CB 3.7Å; F238-F271 HydrophobicContact CE1-CB 3.93Å; F238-F271 AromaticContact CE1-CD2 3.62Å; F238-F271 HydrophobicContact CE1-CD2 3.62Å; F238-F271 HydrophobicContact CE1-CG 4.29Å; F238-F271 HydrophobicContact CE2-CB 3.37Å; F238-F271 HydrophobicContact CE2-CG 4.46Å; F238-F271 HydrophobicContact CG-CB 4.12Å; F238-F271 HydrophobicContact CZ-CB 3.49Å; F238-F271 VanDerWaalsContact CZ-CB 3.49Å; F238-F271 AromaticContact CZ-CD2 3.84Å; F238-F271 HydrophobicContact CZ-CD2 3.84Å; F238-F271 HydrophobicContact CZ-CG 4.13Å; D269-F271 VanDerWaalsContact C-N 3.27Å; D269-F271 PolarHBondContact O-N 3.33Å; D269-F271 WeakPolarHBondContact OD2-CA 3.44Å; D269-F271 VanDerWaalsContact OD2-CB 3.28Å; D269-F271 WeakPolarHBondContact OD2-CB 3.19Å; D269-F271 PolarHBondContact OD2-N 2.83Å; F271-D273 VanDerWaalsContact C-N 3.35Å; F271-M274 PolarHBondContact O-N 3.33Å; F271-A275 WeakPolarHBondContact O-CB 3.31Å; F271-A275 PolarHBondContact O-N 3.37Å; F271-W546 HydrophobicContact CD1-CD2 4.43Å; F271-W546 HydrophobicContact CD1-CG 4.44Å; F271-W546 HydrophobicContact CE1-CB 3.44Å; F271-W546 VanDerWaalsContact CE1-CB 3.44Å; F271-W546 AromaticContact CE1-CD2 3.74Å; F271-W546 HydrophobicContact CE1-CD2 3.74Å; F271-W546 AromaticContact CE1-CE3 3.92Å; F271-W546 HydrophobicContact CE1-CE3 3.92Å; F271-W546 AromaticContact CE1-CG 3.56Å; F271-W546 HydrophobicContact CE1-CG 3.56Å; F271-W546 HydrophobicContact CZ-CB 3.64Å; F271-W546 HydrophobicContact CZ-CG 4.28Å; F271-M549 HydrophobicContact CE2-CE 4.1Å; F271-M549 HydrophobicContact CZ-CE 3.91Å; F271-L571 HydrophobicContact CE2-CD2 4.41Å; F271-L575 HydrophobicContact CB-CD2 3.67Å; F271-L575 HydrophobicContact CD1-CD1 3.98Å; F271-L575 HydrophobicContact CE1-CD1 4.34Å; F271-L575 HydrophobicContact CG-CD1 4.18Å; F271-L575 HydrophobicContact CG-CD2 4.11Å; F271-L575 VanDerWaalsContact O-CD2 3.28Å; F271-L575 WeakPolarHBondContact O-CD2 3.49Å
272	A	98.7	Very high	98	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-42	171.8	0	0	0	0	0	111.9	F238 L261 S264 D269 A275 L276	F238-A272 HydrophobicContact CD2-CB 4.16Å; L261-A272 HydrophobicContact CD2-CB 4.27Å; S264-A272 VanDerWaalsContact OG-CB 3.25Å; S264-A272 WeakPolarHBondContact OG-CB 3.13Å; D269-A272 HydrophobicContact CB-CB 4.02Å; D269-A272 PolarHBondContact O-N 3.15Å; D269-A272 PolarHBondContact OD2-N 3.41Å; D269-A272 VanDerWaalsContact OD2-N 3.12Å; A272-A275 PolarHBondContact O-N 3.2Å; A272-L276 WeakPolarHBondContact O-CB 3.46Å; A272-L276 WeakPolarHBondContact O-CG 3.4Å; A272-L276 PolarHBondContact O-N 3.37Å
273	D	98.6	Very high	97.8	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-43	173.7	-83.6	-30.3	0	0	0	112.5	S265 D269 F271 A275 G277 H296 R299 V300	S265-D273 WeakPolarHBondContact CB-OD1 3.48Å; S265-D273 PolarHBondContact OG-OD1 3.19Å; D269-D273 PolarHBondContact O-N 2.89Å; F271-D273 VanDerWaalsContact C-N 3.35Å; D273-A275 PolarHBondContact O-N 2.99Å; D273-G277 PolarHBondContact O-N 3.35Å; D273-H296 WeakPolarHBondContact O-CB 3.37Å; D273-H296 IonicContact OD1-CE1 2.93Å; D273-H296 IonicContact OD1-CG 2.94Å; D273-H296 IonicContact OD1-ND1 3.28Å; D273-H296 PolarHBondContact OD1-ND1 3.42Å; D273-R299 VanDerWaalsContact CG-CZ 3.47Å; D273-R299 IonicContact OD1-CZ 3.32Å; D273-R299 IonicContact OD1-NE 3.04Å; D273-R299 IonicContact OD1-NH1 3.96Å; D273-R299 PolarHBondContact OD1-NH1 3.33Å; D273-R299 IonicContact OD1-NH2 3.24Å; D273-R299 PolarHBondContact OD1-NH2 3.36Å; D273-R299 IonicContact OD2-CZ 3.99Å; D273-R299 VanDerWaalsContact OD2-CZ 3.28Å; D273-R299 IonicContact OD2-NE 2.88Å; D273-R299 IonicContact OD2-NH1 2.81Å; D273-R299 PolarHBondContact OD2-NH1 3.47Å; D273-V300 HydrophobicContact CB-CG2 3.34Å
274	M	98.4	Very high	97.5	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-45.8	173.8	-76.4	-66.1	-70.1	0	0	112.4	N270 F271 Y278 Y297 V300 A541 E542 L575 Y577	N270-M274 VanDerWaalsContact O-CG 3.29Å; N270-M274 WeakPolarHBondContact O-CG 3.04Å; N270-M274 PolarHBondContact O-N 3.36Å; F271-M274 PolarHBondContact O-N 3.33Å; M274-Y278 WeakPolarHBondContact O-CB 3.24Å; M274-Y278 PolarHBondContact O-N 3.27Å; M274-Y297 HydrophobicContact CE-CE1 4.14Å; M274-Y297 HydrophobicContact SD-CD1 3.89Å; M274-Y297 HydrophobicContact SD-CE1 3.82Å; M274-V300 HydrophobicContact CG-CG1 3.98Å; M274-V300 HydrophobicContact CG-CG2 4.11Å; M274-V300 HydrophobicContact SD-CB 4.3Å; M274-V300 HydrophobicContact SD-CG1 3.92Å; M274-V300 HydrophobicContact SD-CG2 4.38Å; M274-A541 HydrophobicContact CE-CB 4.3Å; M274-A541 HydrophobicContact SD-CB 3.39Å; M274-A541 WeakPolarHBondContact SD-CB 3.38Å; M274-E542 HydrophobicContact CE-CG 3.88Å; M274-L575 HydrophobicContact CB-CB 4.07Å; M274-L575 HydrophobicContact CB-CD2 4.14Å; M274-Y577 HydrophobicContact CE-CE2 4.24Å
275	A	98.5	Very high	97.2	Very high	1 Å²	1	26 Å²	26	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-66.7	-44.1	-178.7	0	0	0	0	0	112.2	L261 F271 A272 D273 Y278 R279 E574 L575	L261-A275 HydrophobicContact CD1-CB 4.22Å; L261-A275 HydrophobicContact CD2-CB 4.17Å; F271-A275 WeakPolarHBondContact O-CB 3.31Å; F271-A275 PolarHBondContact O-N 3.37Å; A272-A275 PolarHBondContact O-N 3.2Å; D273-A275 PolarHBondContact O-N 2.99Å; A275-Y278 PolarHBondContact O-N 3.45Å; A275-R279 WeakPolarHBondContact O-CD 3.05Å; A275-R279 WeakPolarHBondContact O-CG 3.32Å; A275-R279 PolarHBondContact O-N 2.75Å; A275-E574 WeakPolarHBondContact CA-O 3.4Å; A275-E574 WeakPolarHBondContact CB-O 3.49Å; A275-L575 HydrophobicContact CB-CD2 4.45Å
276	L	98.6	Very high	97.2	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-68.5	-41.6	175.8	-71.5	177	0	0	0	111.8	L258 L261 A272 Y278 R279 Y280	L258-L276 HydrophobicContact CD2-CD2 4.32Å; L261-L276 HydrophobicContact CB-CD1 4.47Å; L261-L276 HydrophobicContact CB-CD2 3.97Å; L261-L276 HydrophobicContact CB-CG 4.11Å; A272-L276 WeakPolarHBondContact O-CB 3.46Å; A272-L276 WeakPolarHBondContact O-CG 3.4Å; A272-L276 PolarHBondContact O-N 3.37Å; L276-Y278 PolarHBondContact O-N 3.43Å; L276-R279 PolarHBondContact O-N 3.29Å; L276-R279 VanDerWaalsContact O-N 3.08Å; L276-Y280 HydrophobicContact CB-CD2 4.36Å; L276-Y280 HydrophobicContact CB-CE2 4.37Å; L276-Y280 VanDerWaalsContact O-CD2 3.23Å; L276-Y280 WeakPolarHBondContact O-CD2 3.27Å; L276-Y280 PolarHBondContact O-N 2.98Å
277	G	98.2	Very high	97.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-54.4	-44	173.7	0	0	0	0	0	111.6	D273 W281 A293 Y297	D273-G277 PolarHBondContact O-N 3.35Å; G277-W281 WeakPolarHBondContact O-CB 3.13Å; G277-W281 PolarHBondContact O-N 3.32Å; G277-A293 WeakPolarHBondContact O-CB 3.48Å; G277-Y297 VanDerWaalsContact C-CE2 3.44Å; G277-Y297 WeakPolarHBondContact O-CE2 3.49Å
278	Y	98.1	Very high	97.1	Very high	3 Å²	3	34 Å²	34	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-42.4	175	173.7	-112.6	0	0	0	113.1	M274 A275 L276 W281 T282 Y297 G576 Q581 R611 Q615	M274-Y278 WeakPolarHBondContact O-CB 3.24Å; M274-Y278 PolarHBondContact O-N 3.27Å; A275-Y278 PolarHBondContact O-N 3.45Å; L276-Y278 PolarHBondContact O-N 3.43Å; Y278-W281 PolarHBondContact O-N 3.42Å; Y278-T282 HydrophobicContact CD2-CG2 3.92Å; Y278-T282 HydrophobicContact CE2-CG2 3.39Å; Y278-T282 PolarHBondContact O-N 2.82Å; Y278-T282 PolarHBondContact O-OG1 2.92Å; Y278-Y297 WeakPolarHBondContact CA-OH 3.45Å; Y278-Y297 WeakPolarHBondContact CB-OH 3.42Å; Y278-Y297 PolarHBondContact N-OH 3.39Å; Y278-Y297 VanDerWaalsContact N-OH 3.13Å; Y278-G576 VanDerWaalsContact CD2-CA 3.46Å; Y278-Q581 PolarHBondContact OH-NE2 3.01Å; Y278-Q581 VanDerWaalsContact OH-NE2 3.14Å; Y278-R611 WeakPolarHBondContact OH-CB 3.12Å; Y278-R611 WeakPolarHBondContact OH-CG 3.19Å; Y278-Q615 HydrophobicContact CE2-CG 4.49Å
279	R	97.9	Very high	97.1	Very high	3 Å²	3	35 Å²	35	1%	0.011	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-45.4	-178.7	-73.3	166.6	179.1	-82.1	-2.3	112.1	A275 L276 W281 T282 G283 V284 V286 E574	A275-R279 WeakPolarHBondContact O-CD 3.05Å; A275-R279 WeakPolarHBondContact O-CG 3.32Å; A275-R279 PolarHBondContact O-N 2.75Å; L276-R279 PolarHBondContact O-N 3.29Å; L276-R279 VanDerWaalsContact O-N 3.08Å; R279-W281 VanDerWaalsContact C-N 3.31Å; R279-T282 PolarHBondContact O-N 3.2Å; R279-G283 WeakPolarHBondContact O-CA 3.21Å; R279-G283 PolarHBondContact O-N 3.25Å; R279-V284 HydrophobicContact CG-CB 4.29Å; R279-V284 WeakPolarHBondContact CG-O 3.45Å; R279-V284 PolarHBondContact NH1-O 3.08Å; R279-V284 PolarHBondContact O-N 3.36Å; R279-V284 VanDerWaalsContact O-N 3.1Å; R279-V286 HydrophobicContact CB-CG2 4.01Å; R279-V286 WeakPolarHBondContact O-CG2 3.22Å; R279-E574 IonicContact CZ-OE2 3.61Å; R279-E574 IonicContact NH2-OE2 2.69Å; R279-E574 PolarHBondContact NH2-OE2 3.28Å
280	Y	98.3	Very high	97.1	Very high	61 Å²	61	36.8 Å²	36.8	24%	0.239	20%	0.199	C	C	.	.	H	α-helix	trans	-66.7	-32.9	173.3	-74.6	-64.9	0	0	0	112.4	L276 V286 E288 D289 A292 H296	L276-Y280 HydrophobicContact CB-CD2 4.36Å; L276-Y280 HydrophobicContact CB-CE2 4.37Å; L276-Y280 VanDerWaalsContact O-CD2 3.23Å; L276-Y280 WeakPolarHBondContact O-CD2 3.27Å; L276-Y280 PolarHBondContact O-N 2.98Å; Y280-V286 HydrophobicContact CD1-CB 4.17Å; Y280-V286 HydrophobicContact CD1-CG2 3.66Å; Y280-V286 HydrophobicContact CE1-CB 3.98Å; Y280-V286 HydrophobicContact CE1-CG1 4.31Å; Y280-V286 HydrophobicContact CE1-CG2 3.93Å; Y280-V286 HydrophobicContact CG-CG2 4.13Å; Y280-E288 CarbonylContact O-C 3.58Å; Y280-E288 WeakPolarHBondContact O-CA 3.4Å; Y280-D289 HydrophobicContact CD1-CB 4.12Å; Y280-D289 PolarHBondContact O-N 3.43Å; Y280-A292 HydrophobicContact CD1-CB 3.79Å; Y280-A292 HydrophobicContact CD2-CB 3.85Å; Y280-A292 HydrophobicContact CE1-CB 4.16Å; Y280-A292 HydrophobicContact CE2-CB 4.21Å; Y280-A292 HydrophobicContact CG-CB 3.62Å; Y280-H296 AromaticContact CD2-CD2 3.73Å; Y280-H296 AromaticContact CD2-NE2 3.89Å; Y280-H296 AromaticContact CE2-CD2 3.92Å; Y280-H296 AromaticContact CE2-NE2 3.57Å
281	W	97.1	Very high	97.2	Very high	70 Å²	70	38.5 Å²	38.5	27%	0.265	21%	0.206	S	C	.	.	H	α-helix	trans	-68.4	-33	176.1	-178.7	-89	0	0	0	113.4	G277 Y278 R279 A293 Y297 S531 A534 E535	G277-W281 WeakPolarHBondContact O-CB 3.13Å; G277-W281 PolarHBondContact O-N 3.32Å; Y278-W281 PolarHBondContact O-N 3.42Å; R279-W281 VanDerWaalsContact C-N 3.31Å; W281-A293 HydrophobicContact CB-CB 3.95Å; W281-A293 HydrophobicContact CE3-CB 4.16Å; W281-Y297 HydrophobicContact CB-CE2 4.4Å; W281-S531 WeakPolarHBondContact CH2-O 3.5Å; W281-S531 VanDerWaalsContact CZ3-O 3.24Å; W281-S531 WeakPolarHBondContact CZ3-O 3.45Å; W281-A534 HydrophobicContact CE3-CB 3.62Å; W281-A534 HydrophobicContact CH2-CB 4.42Å; W281-A534 HydrophobicContact CZ3-CB 3.34Å; W281-E535 HydrophobicContact CH2-CB 3.94Å; W281-E535 HydrophobicContact CZ2-CB 4.25Å
282	T	95.8	Very high	97.2	Very high	23 Å²	23	38.7 Å²	38.7	14%	0.141	21%	0.21	C	C	.	.	H	α-helix	trans	-115	-1.7	-172.7	55.2	0	0	0	0	115.3	Y278 R279 V284	Y278-T282 HydrophobicContact CD2-CG2 3.92Å; Y278-T282 HydrophobicContact CE2-CG2 3.39Å; Y278-T282 PolarHBondContact O-N 2.82Å; Y278-T282 PolarHBondContact O-OG1 2.92Å; R279-T282 PolarHBondContact O-N 3.2Å; T282-V284 VanDerWaalsContact OG1-CG2 3.3Å; T282-V284 WeakPolarHBondContact OG1-CG2 3.37Å
283	G	95.5	Very high	97.1	Very high	28 Å²	28	38.7 Å²	38.7	29%	0.289	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	25	-179.2	0	0	0	0	0	114.4	R279 G285 V286 E288	R279-G283 WeakPolarHBondContact O-CA 3.21Å; R279-G283 PolarHBondContact O-N 3.25Å; G283-G285 PolarHBondContact O-N 3.45Å; G283-G285 VanDerWaalsContact O-N 3.13Å; G283-V286 CarbonylContact C-O 3.41Å; G283-V286 WeakPolarHBondContact CA-O 3.48Å; G283-V286 VanDerWaalsContact O-O 3.14Å; G283-E288 VanDerWaalsContact CA-CG 3.45Å
284	V	92.3	Very high	97.1	Very high	29 Å²	29	39.3 Å²	39.3	18%	0.176	21%	0.213	C	C	.	.	S	Bend	trans	-85.6	91.8	-174.9	178.6	0	0	0	0	110.9	R279 T282 V286	R279-V284 HydrophobicContact CG-CB 4.29Å; R279-V284 WeakPolarHBondContact CG-O 3.45Å; R279-V284 PolarHBondContact NH1-O 3.08Å; R279-V284 PolarHBondContact O-N 3.36Å; R279-V284 VanDerWaalsContact O-N 3.1Å; T282-V284 VanDerWaalsContact OG1-CG2 3.3Å; T282-V284 WeakPolarHBondContact OG1-CG2 3.37Å; V284-V286 VanDerWaalsContact C-N 3.26Å
285	G	92.3	Very high	97.1	Very high	41 Å²	41	42.8 Å²	42.8	42%	0.423	23%	0.234	S	C	.	.	S	Bend	trans	85.8	-5.1	179.4	0	0	0	0	0	114.4	L258 G283	L258-G285 VanDerWaalsContact CD1-O 3.24Å; L258-G285 WeakPolarHBondContact CD1-O 3.35Å; G283-G285 PolarHBondContact O-N 3.45Å; G283-G285 VanDerWaalsContact O-N 3.13Å
286	V	96.8	Very high	97.1	Very high	33 Å²	33	43.6 Å²	43.6	20%	0.2	24%	0.238	C	C	.	.	S	Bend	trans	-135.4	163.2	176.4	-64.8	0	0	0	0	108.4	L258 R279 Y280 G283 V284	L258-V286 HydrophobicContact CD1-CG1 3.82Å; L258-V286 HydrophobicContact CD2-CG1 3.75Å; L258-V286 HydrophobicContact CG-CG1 4.43Å; R279-V286 HydrophobicContact CB-CG2 4.01Å; R279-V286 WeakPolarHBondContact O-CG2 3.22Å; Y280-V286 HydrophobicContact CD1-CB 4.17Å; Y280-V286 HydrophobicContact CD1-CG2 3.66Å; Y280-V286 HydrophobicContact CE1-CB 3.98Å; Y280-V286 HydrophobicContact CE1-CG1 4.31Å; Y280-V286 HydrophobicContact CE1-CG2 3.93Å; Y280-V286 HydrophobicContact CG-CG2 4.13Å; G283-V286 CarbonylContact C-O 3.41Å; G283-V286 WeakPolarHBondContact CA-O 3.48Å; G283-V286 VanDerWaalsContact O-O 3.14Å; V284-V286 VanDerWaalsContact C-N 3.26Å
287	E	96.6	Very high	97.1	Very high	171 Å²	171	43.5 Å²	43.5	80%	0.799	24%	0.238	S	C	*	.			trans	-64.7	146.4	170.8	-171.4	170.9	-178	0	0	110.6	D289	E287-D289 PolarHBondContact O-N 3.23Å
288	E	97.1	Very high	97.2	Very high	140 Å²	140	45.9 Å²	45.9	65%	0.654	25%	0.248	S	C	*	.			trans	-65.3	118.2	174.1	-72.1	-180	-171.8	0	0	110	Y280 G283	Y280-E288 CarbonylContact O-C 3.58Å; Y280-E288 WeakPolarHBondContact O-CA 3.4Å; G283-E288 VanDerWaalsContact CA-CG 3.45Å
289	D	97.9	Very high	97.2	Very high	70 Å²	70	49.4 Å²	49.4	37%	0.374	26%	0.262	S	S	.	.			trans	-138.8	109.3	179.6	-176.9	-17.8	0	0	0	109.9	Y280 E287 E291 A292 A293	Y280-D289 HydrophobicContact CD1-CB 4.12Å; Y280-D289 PolarHBondContact O-N 3.43Å; E287-D289 PolarHBondContact O-N 3.23Å; D289-E291 VanDerWaalsContact C-N 3.34Å; D289-E291 PolarHBondContact O-N 3.41Å; D289-E291 WeakPolarHBondContact OD1-CA 3.1Å; D289-E291 PolarHBondContact OD1-N 3.18Å; D289-A292 HydrophobicContact CB-CB 3.86Å; D289-A292 PolarHBondContact OD1-N 3.46Å; D289-A293 WeakPolarHBondContact O-CB 3.21Å; D289-A293 PolarHBondContact O-N 3.4Å
290	C	97.6	Very high	97.2	Very high	45 Å²	45	49.3 Å²	49.3	30%	0.304	26%	0.261	S	S	.	.	H	α-helix	trans	-69.3	-30.1	-179.1	69.2	0	0	0	0	113.3	L294 C530	C290-L294 WeakPolarHBondContact O-CB 3.33Å; C290-L294 PolarHBondContact O-N 3.16Å; C290-C530 HydrophobicContact CB-CB 3.77Å; C290-C530 WeakPolarHBondContact CB-SG 3.42Å; C290-C530 WeakPolarHBondContact SG-CB 3.39Å; C290-C530 CovalentContact SG-SG 2.04Å; C290-C530 PolarHBondContact SG-SG 3.41Å
291	E	97.9	Very high	97.2	Very high	71 Å²	71	46.4 Å²	46.4	33%	0.332	25%	0.25	S	C	.	.	H	α-helix	trans	-77.7	-39.5	-179	-66.5	-67.6	172.1	0	0	110.6	D289 L294 T295 R528 C530	D289-E291 VanDerWaalsContact C-N 3.34Å; D289-E291 PolarHBondContact O-N 3.41Å; D289-E291 WeakPolarHBondContact OD1-CA 3.1Å; D289-E291 PolarHBondContact OD1-N 3.18Å; E291-L294 PolarHBondContact O-N 3.36Å; E291-T295 WeakPolarHBondContact O-CB 3.29Å; E291-T295 PolarHBondContact O-N 3.42Å; E291-T295 PolarHBondContact O-OG1 3.33Å; E291-R528 IonicContact OE1-CZ 2.58Å; E291-R528 IonicContact OE1-NE 2.81Å; E291-R528 IonicContact OE1-NH2 3.61Å; E291-R528 PolarHBondContact OE1-NH2 3.43Å; E291-R528 IonicContact OE2-CZ 2.82Å; E291-R528 IonicContact OE2-NH2 3.97Å; E291-R528 PolarHBondContact OE2-NH2 3.18Å; E291-C530 HydrophobicContact CG-CB 4.48Å; E291-C530 WeakPolarHBondContact OE1-CB 3.39Å
292	A	98.2	Very high	97.2	Very high	19 Å²	19	47 Å²	47	16%	0.157	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-47.9	170.6	0	0	0	0	0	110.8	Y280 D289 L294 T295 H296	Y280-A292 HydrophobicContact CD1-CB 3.79Å; Y280-A292 HydrophobicContact CD2-CB 3.85Å; Y280-A292 HydrophobicContact CE1-CB 4.16Å; Y280-A292 HydrophobicContact CE2-CB 4.21Å; Y280-A292 HydrophobicContact CG-CB 3.62Å; D289-A292 HydrophobicContact CB-CB 3.86Å; D289-A292 PolarHBondContact OD1-N 3.46Å; A292-L294 VanDerWaalsContact C-N 3.34Å; A292-L294 PolarHBondContact O-N 2.88Å; A292-T295 PolarHBondContact O-N 3.44Å; A292-H296 PolarHBondContact O-CD2 3.23Å; A292-H296 PolarHBondContact O-N 3.02Å; A292-H296 VanDerWaalsContact O-N 3.08Å
293	A	98.5	Very high	97.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.1	-45.2	176	0	0	0	0	0	112.3	G277 W281 D289 T295 H296 Y297	G277-A293 WeakPolarHBondContact O-CB 3.48Å; W281-A293 HydrophobicContact CB-CB 3.95Å; W281-A293 HydrophobicContact CE3-CB 4.16Å; D289-A293 WeakPolarHBondContact O-CB 3.21Å; D289-A293 PolarHBondContact O-N 3.4Å; A293-T295 VanDerWaalsContact C-N 3.34Å; A293-T295 PolarHBondContact O-N 3.03Å; A293-H296 PolarHBondContact O-N 3.48Å; A293-Y297 WeakPolarHBondContact O-CB 3.34Å; A293-Y297 VanDerWaalsContact O-CD2 3.25Å; A293-Y297 WeakPolarHBondContact O-CD2 3.41Å; A293-Y297 PolarHBondContact O-N 3.15Å
294	L	98.4	Very high	97.2	Very high	16 Å²	16	46.9 Å²	46.9	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-47.2	175.4	-176.4	162	0	0	0	111.1	C290 E291 A292 H296 Y297 H298 A521 C530 A533 A534 F537	C290-L294 WeakPolarHBondContact O-CB 3.33Å; C290-L294 PolarHBondContact O-N 3.16Å; E291-L294 PolarHBondContact O-N 3.36Å; A292-L294 VanDerWaalsContact C-N 3.34Å; A292-L294 PolarHBondContact O-N 2.88Å; L294-H296 PolarHBondContact O-N 2.91Å; L294-Y297 PolarHBondContact O-N 3.41Å; L294-H298 HydrophobicContact CD2-CB 4.36Å; L294-H298 WeakPolarHBondContact O-CB 3.16Å; L294-H298 PolarHBondContact O-N 2.93Å; L294-A521 HydrophobicContact CD1-CB 4.1Å; L294-C530 HydrophobicContact CD1-CB 4.4Å; L294-A533 HydrophobicContact CD1-CB 3.69Å; L294-A533 HydrophobicContact CG-CB 4.44Å; L294-A534 HydrophobicContact CB-CB 3.97Å; L294-F537 HydrophobicContact CG-CD2 4.32Å; L294-F537 HydrophobicContact CG-CE2 4.5Å
295	T	98.3	Very high	97.4	Very high	72 Å²	72	48 Å²	48	44%	0.442	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-46.1	-178	-60.6	0	0	0	0	111.8	E291 A292 A293 R299	E291-T295 WeakPolarHBondContact O-CB 3.29Å; E291-T295 PolarHBondContact O-N 3.42Å; E291-T295 PolarHBondContact O-OG1 3.33Å; A292-T295 PolarHBondContact O-N 3.44Å; A293-T295 VanDerWaalsContact C-N 3.34Å; A293-T295 PolarHBondContact O-N 3.03Å; T295-R299 PolarHBondContact O-N 2.83Å
296	H	98.7	Very high	97.5	Very high	19 Å²	19	52.2 Å²	52.2	9%	0.088	26%	0.257	C	S	.	.	H	α-helix	trans	-65.7	-49.7	177.3	-75.4	-69.9	0	0	0	112.1	S265 D273 Y280 A292 A293 L294 H298 R299 V300	S265-H296 PolarHBondContact OG-CE1 2.96Å; S265-H296 VanDerWaalsContact OG-CE1 3.25Å; S265-H296 PolarHBondContact OG-ND1 3.2Å; D273-H296 WeakPolarHBondContact O-CB 3.37Å; D273-H296 IonicContact OD1-CE1 2.93Å; D273-H296 IonicContact OD1-CG 2.94Å; D273-H296 IonicContact OD1-ND1 3.28Å; D273-H296 PolarHBondContact OD1-ND1 3.42Å; Y280-H296 AromaticContact CD2-CD2 3.73Å; Y280-H296 AromaticContact CD2-NE2 3.89Å; Y280-H296 AromaticContact CE2-CD2 3.92Å; Y280-H296 AromaticContact CE2-NE2 3.57Å; A292-H296 PolarHBondContact O-CD2 3.23Å; A292-H296 PolarHBondContact O-N 3.02Å; A292-H296 VanDerWaalsContact O-N 3.08Å; A293-H296 PolarHBondContact O-N 3.48Å; L294-H296 PolarHBondContact O-N 2.91Å; H296-H298 VanDerWaalsContact C-N 3.31Å; H296-H298 PolarHBondContact O-N 2.77Å; H296-R299 PolarHBondContact CE1-NH2 2.92Å; H296-R299 VanDerWaalsContact CE1-NH2 3.29Å; H296-R299 PolarHBondContact ND1-NH2 3.03Å; H296-R299 VanDerWaalsContact ND1-NH2 3.14Å; H296-R299 PolarHBondContact O-N 3.43Å; H296-V300 PolarHBondContact O-N 3.42Å
297	Y	98.7	Very high	97.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-34.1	178.8	-75.8	-51.6	0	0	0	113	M274 G277 Y278 W281 A293 L294 V300 A301 K538 A541	M274-Y297 HydrophobicContact CE-CE1 4.14Å; M274-Y297 HydrophobicContact SD-CD1 3.89Å; M274-Y297 HydrophobicContact SD-CE1 3.82Å; G277-Y297 VanDerWaalsContact C-CE2 3.44Å; G277-Y297 WeakPolarHBondContact O-CE2 3.49Å; Y278-Y297 WeakPolarHBondContact CA-OH 3.45Å; Y278-Y297 WeakPolarHBondContact CB-OH 3.42Å; Y278-Y297 PolarHBondContact N-OH 3.39Å; Y278-Y297 VanDerWaalsContact N-OH 3.13Å; W281-Y297 HydrophobicContact CB-CE2 4.4Å; A293-Y297 WeakPolarHBondContact O-CB 3.34Å; A293-Y297 VanDerWaalsContact O-CD2 3.25Å; A293-Y297 WeakPolarHBondContact O-CD2 3.41Å; A293-Y297 PolarHBondContact O-N 3.15Å; L294-Y297 PolarHBondContact O-N 3.41Å; Y297-V300 PolarHBondContact O-N 3.37Å; Y297-A301 WeakPolarHBondContact O-CB 3.25Å; Y297-A301 PolarHBondContact O-N 2.95Å; Y297-K538 HydrophobicContact CD1-CB 3.94Å; Y297-K538 HydrophobicContact CD1-CG 4.26Å; Y297-K538 HydrophobicContact CD2-CB 3.93Å; Y297-K538 HydrophobicContact CE1-CB 3.91Å; Y297-K538 HydrophobicContact CE1-CD 4.36Å; Y297-K538 HydrophobicContact CE1-CG 3.75Å; Y297-K538 HydrophobicContact CE2-CB 3.87Å; Y297-K538 HydrophobicContact CE2-CD 4.1Å; Y297-K538 HydrophobicContact CE2-CG 4.13Å; Y297-K538 HydrophobicContact CG-CB 3.96Å; Y297-A541 HydrophobicContact CD1-CB 4.3Å
298	H	98.5	Very high	96.7	Very high	49 Å²	49	45.5 Å²	45.5	23%	0.227	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-45.2	176.2	175.6	-105.5	0	0	0	111.6	L294 H296 V300 A301 Q302 F537	L294-H298 HydrophobicContact CD2-CB 4.36Å; L294-H298 WeakPolarHBondContact O-CB 3.16Å; L294-H298 PolarHBondContact O-N 2.93Å; H296-H298 VanDerWaalsContact C-N 3.31Å; H296-H298 PolarHBondContact O-N 2.77Å; H298-V300 VanDerWaalsContact C-N 3.34Å; H298-V300 PolarHBondContact O-N 3.13Å; H298-A301 PolarHBondContact O-N 2.81Å; H298-Q302 PolarHBondContact CE1-NE2 2.76Å; H298-Q302 WeakPolarHBondContact O-CG 3.26Å; H298-Q302 PolarHBondContact O-N 3.35Å; H298-F537 HydrophobicContact CB-CD2 4.15Å; H298-F537 HydrophobicContact CB-CE2 4.25Å; H298-F537 HydrophobicContact CB-CG 4.41Å; H298-F537 AromaticContact CD2-CE1 3.67Å; H298-F537 AromaticContact CD2-CE2 3.8Å; H298-F537 AromaticContact CD2-CZ 3.4Å; H298-F537 VanDerWaalsContact CD2-CZ 3.4Å; H298-F537 WeakPolarHBondContact CD2-CZ 3.49Å
299	R	98.5	Very high	96.2	Very high	78 Å²	78	39.5 Å²	39.5	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-56.7	-47.4	176.2	-76.4	-169.1	-79.4	157	-19.4	112	S265 D273 T295 H296 Q302 V303	S265-R299 PolarHBondContact O-NH1 3.45Å; S265-R299 PolarHBondContact OG-NH1 2.82Å; S265-R299 PolarHBondContact OG-NH2 2.9Å; D273-R299 VanDerWaalsContact CG-CZ 3.47Å; D273-R299 IonicContact OD1-CZ 3.32Å; D273-R299 IonicContact OD1-NE 3.04Å; D273-R299 IonicContact OD1-NH1 3.96Å; D273-R299 PolarHBondContact OD1-NH1 3.33Å; D273-R299 IonicContact OD1-NH2 3.24Å; D273-R299 PolarHBondContact OD1-NH2 3.36Å; D273-R299 IonicContact OD2-CZ 3.99Å; D273-R299 VanDerWaalsContact OD2-CZ 3.28Å; D273-R299 IonicContact OD2-NE 2.88Å; D273-R299 IonicContact OD2-NH1 2.81Å; D273-R299 PolarHBondContact OD2-NH1 3.47Å; T295-R299 PolarHBondContact O-N 2.83Å; H296-R299 PolarHBondContact CE1-NH2 2.92Å; H296-R299 VanDerWaalsContact CE1-NH2 3.29Å; H296-R299 PolarHBondContact ND1-NH2 3.03Å; H296-R299 VanDerWaalsContact ND1-NH2 3.14Å; H296-R299 PolarHBondContact O-N 3.43Å; R299-Q302 PolarHBondContact O-N 3.03Å; R299-V303 PolarHBondContact O-N 3.46Å
300	V	98.5	Very high	95.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-41.7	178.3	-173.4	0	0	0	0	111.1	N270 D273 M274 H296 Y297 H298 Q302 V303 V304 A541 W546	N270-V300 HydrophobicContact CB-CG1 4.44Å; D273-V300 HydrophobicContact CB-CG2 3.34Å; M274-V300 HydrophobicContact CG-CG1 3.98Å; M274-V300 HydrophobicContact CG-CG2 4.11Å; M274-V300 HydrophobicContact SD-CB 4.3Å; M274-V300 HydrophobicContact SD-CG1 3.92Å; M274-V300 HydrophobicContact SD-CG2 4.38Å; H296-V300 PolarHBondContact O-N 3.42Å; Y297-V300 PolarHBondContact O-N 3.37Å; H298-V300 VanDerWaalsContact C-N 3.34Å; H298-V300 PolarHBondContact O-N 3.13Å; V300-Q302 VanDerWaalsContact C-N 3.28Å; V300-Q302 PolarHBondContact O-N 3.27Å; V300-V303 WeakPolarHBondContact O-CB 3.47Å; V300-V303 PolarHBondContact O-N 3.41Å; V300-V303 VanDerWaalsContact O-N 3.15Å; V300-V304 WeakPolarHBondContact O-CG2 3.39Å; V300-V304 PolarHBondContact O-N 3.18Å; V300-A541 HydrophobicContact CB-CB 3.83Å; V300-A541 HydrophobicContact CG1-CB 3.65Å; V300-W546 HydrophobicContact CG1-CH2 3.5Å; V300-W546 VanDerWaalsContact CG1-CH2 3.5Å; V300-W546 HydrophobicContact CG1-CZ2 3.38Å
301	A	98.3	Very high	94.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-33.6	178.7	0	0	0	0	0	112.4	Y297 H298 V304 Y305 Y514 F537 V540	Y297-A301 WeakPolarHBondContact O-CB 3.25Å; Y297-A301 PolarHBondContact O-N 2.95Å; H298-A301 PolarHBondContact O-N 2.81Å; A301-V304 PolarHBondContact O-N 3.17Å; A301-Y305 WeakPolarHBondContact O-CB 3.44Å; A301-Y305 PolarHBondContact O-N 2.78Å; A301-Y514 HydrophobicContact CB-CD2 4.25Å; A301-F537 HydrophobicContact CB-CB 4.14Å; A301-F537 HydrophobicContact CB-CD1 3.56Å; A301-F537 HydrophobicContact CB-CE1 4.43Å; A301-F537 HydrophobicContact CB-CG 4.24Å; A301-V540 HydrophobicContact CB-CB 3.91Å; A301-V540 HydrophobicContact CB-CG1 3.76Å
302	Q	98.1	Very high	94	Very high	84 Å²	84	39.4 Å²	39.4	39%	0.393	19%	0.191	S	C	.	.	H	α-helix	trans	-63.4	-42.4	173.1	-75.9	-179.7	-41.4	0	0	112.1	H298 R299 V300 Y305 K306 Y514	H298-Q302 PolarHBondContact CE1-NE2 2.76Å; H298-Q302 WeakPolarHBondContact O-CG 3.26Å; H298-Q302 PolarHBondContact O-N 3.35Å; R299-Q302 PolarHBondContact O-N 3.03Å; V300-Q302 VanDerWaalsContact C-N 3.28Å; V300-Q302 PolarHBondContact O-N 3.27Å; Q302-Y305 PolarHBondContact O-N 3.15Å; Q302-K306 WeakPolarHBondContact O-CB 3.32Å; Q302-K306 PolarHBondContact O-N 2.81Å; Q302-Y514 HydrophobicContact CG-CE2 4Å
303	V	96.6	Very high	93	Very high	48 Å²	48	43.7 Å²	43.7	29%	0.291	21%	0.208	S	C	.	.	H	α-helix	trans	-61.8	-49.2	175.4	178.2	0	0	0	0	110.1	R299 V300 Y305 K306 E307	R299-V303 PolarHBondContact O-N 3.46Å; V300-V303 WeakPolarHBondContact O-CB 3.47Å; V300-V303 PolarHBondContact O-N 3.41Å; V300-V303 VanDerWaalsContact O-N 3.15Å; V303-Y305 PolarHBondContact O-N 2.8Å; V303-K306 PolarHBondContact O-N 2.93Å; V303-E307 WeakPolarHBondContact O-CG 3.38Å; V303-E307 PolarHBondContact O-N 3.24Å
304	V	94.7	Very high	91.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-42.8	178.5	179.8	0	0	0	0	111.5	V300 A301 K306 E307 V308 V510 V540 R543 G544 W546	V300-V304 WeakPolarHBondContact O-CG2 3.39Å; V300-V304 PolarHBondContact O-N 3.18Å; A301-V304 PolarHBondContact O-N 3.17Å; V304-K306 VanDerWaalsContact C-N 3.35Å; V304-K306 PolarHBondContact O-N 3.26Å; V304-E307 PolarHBondContact O-N 2.95Å; V304-V308 HydrophobicContact CG1-CG2 4.02Å; V304-V308 WeakPolarHBondContact O-CB 3.4Å; V304-V308 WeakPolarHBondContact O-CG2 2.85Å; V304-V308 PolarHBondContact O-N 3.47Å; V304-V510 HydrophobicContact CG1-CG1 4.44Å; V304-V540 HydrophobicContact CB-CG1 4.18Å; V304-V540 HydrophobicContact CG1-CG1 4.18Å; V304-V540 WeakPolarHBondContact CG1-O 3.3Å; V304-R543 HydrophobicContact CG1-CB 4.47Å; V304-G544 VanDerWaalsContact CG2-CA 3.47Å; V304-W546 HydrophobicContact CG2-CH2 3.72Å; V304-W546 HydrophobicContact CG2-CZ2 3.92Å
305	Y	94.6	Very high	90.1	Very high	53 Å²	53	47.1 Å²	47.1	21%	0.208	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-46.3	176.8	165.4	-104.3	0	0	0	111.6	A301 Q302 V303 V308 S309 I511 Y514	A301-Y305 WeakPolarHBondContact O-CB 3.44Å; A301-Y305 PolarHBondContact O-N 2.78Å; Q302-Y305 PolarHBondContact O-N 3.15Å; V303-Y305 PolarHBondContact O-N 2.8Å; Y305-V308 PolarHBondContact O-N 3.17Å; Y305-S309 VanDerWaalsContact CE2-OG 3.25Å; Y305-S309 WeakPolarHBondContact CE2-OG 3.41Å; Y305-S309 VanDerWaalsContact O-CB 3.22Å; Y305-S309 WeakPolarHBondContact O-CB 3.39Å; Y305-S309 PolarHBondContact O-N 3.07Å; Y305-S309 PolarHBondContact O-OG 3.22Å; Y305-I511 HydrophobicContact CD2-CG1 4.27Å; Y305-I511 HydrophobicContact CD2-CG2 4.17Å; Y305-I511 HydrophobicContact CE2-CB 4.46Å; Y305-I511 HydrophobicContact CE2-CG1 4.34Å; Y305-I511 HydrophobicContact CE2-CG2 3.66Å; Y305-Y514 HydrophobicContact CD1-CD1 4.2Å; Y305-Y514 AromaticContact CD1-CE1 3.95Å; Y305-Y514 HydrophobicContact CD1-CE1 3.95Å; Y305-Y514 HydrophobicContact CD1-CE2 4.48Å; Y305-Y514 AromaticContact CD2-CD1 3.54Å; Y305-Y514 HydrophobicContact CD2-CD1 3.54Å; Y305-Y514 HydrophobicContact CD2-CD2 4.4Å; Y305-Y514 HydrophobicContact CD2-CE1 4.13Å; Y305-Y514 AromaticContact CD2-CG 3.72Å; Y305-Y514 HydrophobicContact CD2-CG 3.72Å; Y305-Y514 HydrophobicContact CE1-CD1 4.46Å; Y305-Y514 HydrophobicContact CE1-CE1 4.14Å; Y305-Y514 AromaticContact CE2-CD1 3.85Å; Y305-Y514 HydrophobicContact CE2-CD1 3.85Å; Y305-Y514 HydrophobicContact CE2-CE1 4.31Å; Y305-Y514 HydrophobicContact CE2-CG 4.46Å; Y305-Y514 AromaticContact CG-CD1 3.72Å; Y305-Y514 HydrophobicContact CG-CD1 3.72Å; Y305-Y514 HydrophobicContact CG-CD2 4.02Å; Y305-Y514 AromaticContact CG-CE1 3.93Å; Y305-Y514 HydrophobicContact CG-CE1 3.93Å; Y305-Y514 HydrophobicContact CG-CE2 4.21Å; Y305-Y514 AromaticContact CG-CG 3.79Å; Y305-Y514 HydrophobicContact CG-CG 3.79Å
306	K	94.3	Very high	88.4	Confident	129 Å²	129	43.8 Å²	43.8	56%	0.561	21%	0.214	S	C	*	.	H	α-helix	trans	-60.4	-51.4	177.3	-178.9	178	173.2	-178.3	0	111	Q302 V303 V304 V308 S309 E310	Q302-K306 WeakPolarHBondContact O-CB 3.32Å; Q302-K306 PolarHBondContact O-N 2.81Å; V303-K306 PolarHBondContact O-N 2.93Å; V304-K306 VanDerWaalsContact C-N 3.35Å; V304-K306 PolarHBondContact O-N 3.26Å; K306-V308 VanDerWaalsContact C-N 3.34Å; K306-V308 PolarHBondContact O-N 3.39Å; K306-S309 PolarHBondContact O-N 3.45Å; K306-E310 WeakPolarHBondContact CE-OE1 3.45Å; K306-E310 HydrophobicContact CG-CG 4.46Å; K306-E310 WeakPolarHBondContact CG-OE1 3.37Å; K306-E310 IonicContact NZ-OE1 3.77Å; K306-E310 WeakPolarHBondContact O-CB 3.14Å; K306-E310 WeakPolarHBondContact O-CG 3.19Å; K306-E310 PolarHBondContact O-N 3.44Å
307	E	88.8	Confident	86.3	Confident	43 Å²	43	43.6 Å²	43.6	20%	0.201	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-39.9	179.7	-71.3	-177.2	-164.9	0	0	113.2	V303 V304 R311 R545	V303-E307 WeakPolarHBondContact O-CG 3.38Å; V303-E307 PolarHBondContact O-N 3.24Å; V304-E307 PolarHBondContact O-N 2.95Å; E307-R311 WeakPolarHBondContact O-CB 3.5Å; E307-R311 PolarHBondContact O-N 3.33Å; E307-R311 VanDerWaalsContact O-N 3.13Å; E307-R545 IonicContact OE1-NE 2.8Å; E307-R545 WeakPolarHBondContact OE2-CD 3.47Å; E307-R545 VanDerWaalsContact OE2-CG 3.27Å; E307-R545 WeakPolarHBondContact OE2-CG 3.34Å; E307-R545 IonicContact OE2-NE 3.63Å; E307-R545 PolarHBondContact OE2-NE 3.16Å
308	V	88.3	Confident	84.3	Confident	20 Å²	20	43.7 Å²	43.7	12%	0.121	22%	0.215	C	C	.	.	H	α-helix	trans	-71.5	-39.3	178.5	174.8	0	0	0	0	110.9	V304 Y305 K306 R311 S312 V510 I511	V304-V308 HydrophobicContact CG1-CG2 4.02Å; V304-V308 WeakPolarHBondContact O-CB 3.4Å; V304-V308 WeakPolarHBondContact O-CG2 2.85Å; V304-V308 PolarHBondContact O-N 3.47Å; Y305-V308 PolarHBondContact O-N 3.17Å; K306-V308 VanDerWaalsContact C-N 3.34Å; K306-V308 PolarHBondContact O-N 3.39Å; V308-R311 PolarHBondContact O-N 2.81Å; V308-S312 WeakPolarHBondContact O-CB 3.07Å; V308-S312 PolarHBondContact O-N 3.38Å; V308-V510 HydrophobicContact CG1-CB 4.31Å; V308-V510 HydrophobicContact CG2-CG1 4.43Å; V308-I511 HydrophobicContact CG1-CD1 4.21Å; V308-I511 HydrophobicContact CG1-CG1 4.01Å
309	S	88.1	Confident	82.4	Confident	13 Å²	13	42.6 Å²	42.6	9%	0.091	21%	0.211	C	C	.	.	H	α-helix	trans	-66	-45.7	177.6	-60.1	0	0	0	0	111.3	Y305 K306 R311 S312 E313	Y305-S309 VanDerWaalsContact CE2-OG 3.25Å; Y305-S309 WeakPolarHBondContact CE2-OG 3.41Å; Y305-S309 VanDerWaalsContact O-CB 3.22Å; Y305-S309 WeakPolarHBondContact O-CB 3.39Å; Y305-S309 PolarHBondContact O-N 3.07Å; Y305-S309 PolarHBondContact O-OG 3.22Å; K306-S309 PolarHBondContact O-N 3.45Å; S309-R311 VanDerWaalsContact C-N 3.32Å; S309-R311 PolarHBondContact O-N 2.61Å; S309-S312 PolarHBondContact O-N 2.79Å; S309-E313 WeakPolarHBondContact O-CB 3.25Å; S309-E313 WeakPolarHBondContact O-CG 3.47Å; S309-E313 PolarHBondContact O-N 2.94Å
310	E	86.2	Confident	80.4	Confident	102 Å²	102	42.7 Å²	42.7	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-43.3	175.2	-73.6	171.6	177.1	0	0	111.3	K306 E313 S314	K306-E310 WeakPolarHBondContact CE-OE1 3.45Å; K306-E310 HydrophobicContact CG-CG 4.46Å; K306-E310 WeakPolarHBondContact CG-OE1 3.37Å; K306-E310 IonicContact NZ-OE1 3.77Å; K306-E310 WeakPolarHBondContact O-CB 3.14Å; K306-E310 WeakPolarHBondContact O-CG 3.19Å; K306-E310 PolarHBondContact O-N 3.44Å; E310-E313 PolarHBondContact O-N 3.46Å; E310-S314 WeakPolarHBondContact O-CB 3.47Å; E310-S314 PolarHBondContact O-N 3.3Å; E310-S314 PolarHBondContact O-OG 3.46Å
311	R	80	Confident	78.5	Confident	60 Å²	60	43.1 Å²	43.1	23%	0.226	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-41.1	175.8	-172.7	-175.2	-59	133.9	7.2	112.8	E307 V308 S309 E313 S314 G315 L319 G321	E307-R311 WeakPolarHBondContact O-CB 3.5Å; E307-R311 PolarHBondContact O-N 3.33Å; E307-R311 VanDerWaalsContact O-N 3.13Å; V308-R311 PolarHBondContact O-N 2.81Å; S309-R311 VanDerWaalsContact C-N 3.32Å; S309-R311 PolarHBondContact O-N 2.61Å; R311-E313 VanDerWaalsContact C-N 3.35Å; R311-S314 PolarHBondContact O-OG 2.88Å; R311-G315 WeakPolarHBondContact O-CA 3.43Å; R311-G315 PolarHBondContact O-N 3.34Å; R311-L319 HydrophobicContact CG-CD2 4.33Å; R311-G321 VanDerWaalsContact CD-CA 3.47Å
312	S	80	Confident	76.7	Confident	23 Å²	23	46.3 Å²	46.3	16%	0.161	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-40.2	177.1	175.9	0	0	0	0	111.1	V308 S309 G316	V308-S312 WeakPolarHBondContact O-CB 3.07Å; V308-S312 PolarHBondContact O-N 3.38Å; S309-S312 PolarHBondContact O-N 2.79Å; S312-G316 CarbonylContact O-C 3.59Å; S312-G316 WeakPolarHBondContact O-CA 3.4Å; S312-G316 PolarHBondContact O-N 2.89Å
313	E	76.3	Confident	75.1	Confident	109 Å²	109	47.2 Å²	47.2	51%	0.509	25%	0.248	S	C	.	.	H	α-helix	trans	-68.5	-41	177.2	-73.3	178.1	-173.8	0	0	112.4	S309 E310 R311	S309-E313 WeakPolarHBondContact O-CB 3.25Å; S309-E313 WeakPolarHBondContact O-CG 3.47Å; S309-E313 PolarHBondContact O-N 2.94Å; E310-E313 PolarHBondContact O-N 3.46Å; R311-E313 VanDerWaalsContact C-N 3.35Å
314	S	72.4	Confident	74.1	Confident	81 Å²	81	46.6 Å²	46.6	57%	0.566	24%	0.244	S	C	*	.	H	α-helix	trans	-78.3	-27.7	178.9	71.4	0	0	0	0	113.8	E310 R311 V412	E310-S314 WeakPolarHBondContact O-CB 3.47Å; E310-S314 PolarHBondContact O-N 3.3Å; E310-S314 PolarHBondContact O-OG 3.46Å; R311-S314 PolarHBondContact O-OG 2.88Å; S314-V412 WeakPolarHBondContact O-CG1 3.43Å
315	G	63.7	Low	73.2	Confident	6 Å²	6	53.4 Å²	53.4	6%	0.062	27%	0.27	C	S	.	.	H	α-helix	trans	-102.3	-17.9	-172.9	0	0	0	0	0	114.8	R311 Y374	R311-G315 WeakPolarHBondContact O-CA 3.43Å; R311-G315 PolarHBondContact O-N 3.34Å; G315-Y374 PolarHBondContact O-OH 3.38Å; G315-Y374 VanDerWaalsContact O-OH 3.11Å
316	G	63.1	Low	72.9	Confident	2 Å²	2	54.2 Å²	54.2	2%	0.021	27%	0.273	C	S	.	.			trans	93.2	171.9	-172.8	0	0	0	0	0	113.4	S312 T318 L319 E408	S312-G316 CarbonylContact O-C 3.59Å; S312-G316 WeakPolarHBondContact O-CA 3.4Å; S312-G316 PolarHBondContact O-N 2.89Å; G316-T318 PolarHBondContact O-N 2.95Å; G316-T318 VanDerWaalsContact O-N 3.09Å; G316-L319 PolarHBondContact O-N 3.45Å; G316-E408 WeakPolarHBondContact CA-OE1 3.38Å
317	P	55.8	Low	72.5	Confident	15 Å²	15	48.2 Å²	48.2	10%	0.097	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.5	-173.2	25.2	-36.3	0	0	0	115.3	E408 T441 L445 E475	P317-E408 VanDerWaalsContact CD-CD 3.44Å; P317-E408 VanDerWaalsContact CD-OE1 3.27Å; P317-E408 WeakPolarHBondContact CD-OE1 2.91Å; P317-T441 HydrophobicContact CB-CG2 4.37Å; P317-L445 HydrophobicContact CB-CD1 3.79Å; P317-L445 HydrophobicContact CG-CD1 4.04Å; P317-E475 HydrophobicContact CB-CG 3.84Å
318	T	56.3	Low	72.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-25.4	-179.3	64.6	0	0	0	0	112.9	G316 L320 Y374 Y375 Y405 E408 I438 W473	G316-T318 PolarHBondContact O-N 2.95Å; G316-T318 VanDerWaalsContact O-N 3.09Å; T318-L320 PolarHBondContact O-N 3.25Å; T318-Y374 VanDerWaalsContact OG1-CE1 3.27Å; T318-Y374 WeakPolarHBondContact OG1-CE1 3.5Å; T318-Y375 WeakPolarHBondContact CB-OH 3.18Å; T318-Y375 WeakPolarHBondContact O-CE1 3.14Å; T318-Y375 PolarHBondContact O-OH 3.18Å; T318-Y405 HydrophobicContact CG2-CD1 4.31Å; T318-Y405 HydrophobicContact CG2-CE1 3.69Å; T318-Y405 WeakPolarHBondContact OG1-CE1 3.29Å; T318-E408 WeakPolarHBondContact CB-OE2 3.49Å; T318-E408 WeakPolarHBondContact CG2-OE2 3.47Å; T318-E408 PolarHBondContact N-OE1 2.91Å; T318-E408 PolarHBondContact OG1-OE1 3.2Å; T318-E408 PolarHBondContact OG1-OE2 3.29Å; T318-I438 HydrophobicContact CG2-CG2 3.46Å; T318-I438 VanDerWaalsContact CG2-CG2 3.46Å; T318-W473 HydrophobicContact CG2-CH2 4.48Å; T318-W473 HydrophobicContact CG2-CZ2 4.15Å
319	L	57.7	Low	72.8	Confident	26 Å²	26	47.6 Å²	47.6	14%	0.136	24%	0.241	C	C	.	.			trans	-76.5	87.7	-175.3	-165.6	72.5	0	0	0	112.5	R311 G316 G321 Y374 Y375	R311-L319 HydrophobicContact CG-CD2 4.33Å; G316-L319 PolarHBondContact O-N 3.45Å; L319-G321 VanDerWaalsContact C-N 3.29Å; L319-G321 PolarHBondContact O-N 3.4Å; L319-Y374 HydrophobicContact CB-CE1 4.49Å; L319-Y374 HydrophobicContact CD1-CE1 4.16Å; L319-Y375 HydrophobicContact CD1-CD1 4.31Å
320	L	56.8	Low	72.8	Confident	80 Å²	80	48.3 Å²	48.3	42%	0.419	24%	0.243	S	C	.	.			trans	-78.3	-5.9	179.5	-65.5	165.6	0	0	0	114.3	T318 M323	T318-L320 PolarHBondContact O-N 3.25Å; L320-M323 HydrophobicContact CB-CE 4.1Å; L320-M323 HydrophobicContact CD1-CE 3.86Å
321	G	59.5	Low	72.7	Confident	10 Å²	10	46.2 Å²	46.2	10%	0.103	24%	0.235	C	C	.	.			trans	82.3	-177.9	-172.1	0	0	0	0	0	114.3	R311 L319 M323	R311-G321 VanDerWaalsContact CD-CA 3.47Å; L319-G321 VanDerWaalsContact C-N 3.29Å; L319-G321 PolarHBondContact O-N 3.4Å; G321-M323 PolarHBondContact O-N 3.33Å
322	P	59.2	Low	72.5	Confident	67 Å²	67	44 Å²	44	44%	0.435	23%	0.228	S	C	.	.			trans	-66.6	126.1	-176	26.7	-33	0	0	0	110.7	V324	P322-V324 PolarHBondContact O-N 2.83Å
323	M	65	Low	72	Confident	102 Å²	102	46 Å²	46	50%	0.502	24%	0.236	S	C	.	.			trans	-79.5	119.7	176.8	-71.3	-72.6	-178.3	0	0	109.9	L320 G321	L320-M323 HydrophobicContact CB-CE 4.1Å; L320-M323 HydrophobicContact CD1-CE 3.86Å; G321-M323 PolarHBondContact O-N 3.33Å
324	V	74.5	Confident	71.4	Confident	36 Å²	36	47 Å²	47	22%	0.218	25%	0.245	C	C	.	.			trans	-97.1	115.8	176.8	176.6	0	0	0	0	109.7	P322 R326 S547 K548 F550 M551	P322-V324 PolarHBondContact O-N 2.83Å; V324-R326 HydrophobicContact CG1-CG 4.5Å; V324-S547 WeakPolarHBondContact CG1-O 3.36Å; V324-S547 WeakPolarHBondContact CG2-OG 3.41Å; V324-K548 HydrophobicContact CG2-CG 4.36Å; V324-F550 HydrophobicContact CG1-CB 4.1Å; V324-M551 HydrophobicContact CG1-CG 4.47Å; V324-M551 HydrophobicContact CG2-SD 4.47Å
325	R	76.2	Confident	70.6	Confident	142 Å²	142	44.9 Å²	44.9	54%	0.536	23%	0.232	S	C	.	.			trans	-87.7	125.8	167.2	176.2	167.2	164.1	172	-2.4	109.7	A327 E332 L344	R325-A327 PolarHBondContact O-N 3.48Å; R325-E332 IonicContact CZ-OE1 3.58Å; R325-E332 IonicContact NE-OE1 3.92Å; R325-E332 IonicContact NH2-OE1 3.62Å; R325-E332 PolarHBondContact NH2-OE1 3.42Å; R325-L344 HydrophobicContact CB-CD2 3.84Å; R325-L344 HydrophobicContact CG-CD2 3.85Å
326	R	88.5	Confident	69.8	Low	71 Å²	71	48.4 Å²	48.4	27%	0.268	25%	0.248	S	C	.	.			trans	-94.6	87.2	175.9	-54.4	176.3	-166.5	163.8	0.4	108.2	V324 E542 F550 V579	V324-R326 HydrophobicContact CG1-CG 4.5Å; R326-E542 IonicContact CZ-OE2 3.88Å; R326-E542 IonicContact NH1-OE2 3.95Å; R326-E542 PolarHBondContact NH1-OE2 3.46Å; R326-E542 VanDerWaalsContact NH2-CB 3.31Å; R326-E542 PolarHBondContact NH2-O 2.86Å; R326-E542 IonicContact NH2-OE2 2.8Å; R326-F550 HydrophobicContact CB-CD1 3.99Å; R326-F550 HydrophobicContact CB-CE1 4.08Å; R326-F550 HydrophobicContact CB-CG 4.26Å; R326-F550 HydrophobicContact CB-CZ 4.42Å; R326-F550 HydrophobicContact CG-CD1 4.18Å; R326-F550 HydrophobicContact CG-CD2 3.9Å; R326-F550 HydrophobicContact CG-CE1 4.32Å; R326-F550 HydrophobicContact CG-CE2 4.04Å; R326-F550 HydrophobicContact CG-CG 3.97Å; R326-F550 HydrophobicContact CG-CZ 4.25Å; R326-V579 HydrophobicContact CB-CB 4.27Å; R326-V579 HydrophobicContact CB-CG1 4.19Å; R326-V579 HydrophobicContact CB-CG2 4.14Å
327	A	85.3	Confident	69.1	Low	3 Å²	3	51.5 Å²	51.5	3%	0.025	28%	0.28	C	S	.	.			trans	-73	131.1	-178.6	0	0	0	0	0	111	R325 E332 Y554 V579 N583	R325-A327 PolarHBondContact O-N 3.48Å; A327-E332 HydrophobicContact CB-CG 4.28Å; A327-Y554 HydrophobicContact CB-CD2 3.79Å; A327-Y554 HydrophobicContact CB-CE2 3.91Å; A327-Y554 HydrophobicContact CB-CG 4.45Å; A327-V579 WeakPolarHBondContact O-CG1 3.49Å; A327-N583 PolarHBondContact O-ND2 2.75Å
328	R	91.9	Very high	68.5	Low	47 Å²	47	56.5 Å²	56.5	18%	0.177	31%	0.306	C	S	.	.			trans	-91.1	116.9	171.9	-175.1	172.9	-58.8	103.2	-2.9	108.8	L330 D331 E332 E578 V579 S582 N583	R328-L330 VanDerWaalsContact C-N 3.25Å; R328-L330 HydrophobicContact CG-CB 4.29Å; R328-L330 PolarHBondContact O-N 2.9Å; R328-D331 HydrophobicContact CB-CB 4.43Å; R328-D331 WeakPolarHBondContact CB-OD2 3.48Å; R328-D331 WeakPolarHBondContact CD-OD2 3.39Å; R328-D331 IonicContact CZ-OD2 2.78Å; R328-D331 IonicContact NE-OD2 2.71Å; R328-D331 IonicContact NH1-OD2 3.85Å; R328-D331 PolarHBondContact NH1-OD2 2.95Å; R328-D331 PolarHBondContact O-N 3.29Å; R328-D331 VanDerWaalsContact O-N 3.15Å; R328-E332 WeakPolarHBondContact O-CG 3.4Å; R328-E332 PolarHBondContact O-N 3.49Å; R328-E332 VanDerWaalsContact O-N 3.16Å; R328-E578 IonicContact CZ-OE1 3.41Å; R328-E578 IonicContact CZ-OE2 2.71Å; R328-E578 IonicContact NE-OE1 3.74Å; R328-E578 VanDerWaalsContact NH2-CD 3.31Å; R328-E578 IonicContact NH2-OE1 3.12Å; R328-E578 PolarHBondContact NH2-OE1 3.14Å; R328-E578 VanDerWaalsContact NH2-OE1 3.14Å; R328-E578 IonicContact NH2-OE2 3.11Å; R328-E578 PolarHBondContact NH2-OE2 2.91Å; R328-V579 HydrophobicContact CB-CG1 4.19Å; R328-S582 WeakPolarHBondContact CG-OG 3.44Å; R328-S582 PolarHBondContact NE-OG 3.46Å; R328-N583 WeakPolarHBondContact CA-OD1 3.46Å
329	L	92	Very high	67.7	Low	2 Å²	2	65.1 Å²	65.1	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-34.5	-173.5	-64.6	179.1	0	0	0	112.9	E332 I333 Y554 F557 Y569 N583 F586 I587	L329-E332 PolarHBondContact O-N 2.84Å; L329-I333 PolarHBondContact O-N 3.42Å; L329-Y554 HydrophobicContact CD2-CD2 3.86Å; L329-Y554 HydrophobicContact CD2-CE2 4.07Å; L329-F557 HydrophobicContact CD1-CD1 4.23Å; L329-F557 HydrophobicContact CD1-CD2 3.85Å; L329-F557 HydrophobicContact CD1-CE1 4.25Å; L329-F557 HydrophobicContact CD1-CE2 3.89Å; L329-F557 HydrophobicContact CD1-CG 4.03Å; L329-F557 HydrophobicContact CD1-CZ 4.09Å; L329-F557 HydrophobicContact CD2-CD1 3.59Å; L329-F557 HydrophobicContact CD2-CE1 3.85Å; L329-F557 HydrophobicContact CD2-CG 4.04Å; L329-F557 HydrophobicContact CD2-CZ 4.49Å; L329-Y569 HydrophobicContact CD1-CE2 3.99Å; L329-N583 HydrophobicContact CD1-CB 3.96Å; L329-N583 HydrophobicContact CG-CB 4.15Å; L329-N583 PolarHBondContact N-OD1 2.84Å; L329-F586 HydrophobicContact CB-CD1 3.6Å; L329-F586 HydrophobicContact CB-CE1 4.11Å; L329-F586 HydrophobicContact CB-CG 4.13Å; L329-F586 HydrophobicContact CD1-CD1 3.97Å; L329-F586 HydrophobicContact CG-CD1 4.46Å; L329-I587 HydrophobicContact CD1-CD1 3.91Å; L329-I587 HydrophobicContact CD1-CG1 3.86Å
330	L	88.6	Confident	67.2	Low	28 Å²	28	71.1 Å²	71.1	15%	0.147	38%	0.383	C	S	.	.	H	α-helix	trans	-59.9	-47.9	176.3	-177.6	64.4	0	0	0	111.4	R328 F586 W609 K623	R328-L330 VanDerWaalsContact C-N 3.25Å; R328-L330 HydrophobicContact CG-CB 4.29Å; R328-L330 PolarHBondContact O-N 2.9Å; L330-F586 HydrophobicContact CB-CD2 4.28Å; L330-F586 HydrophobicContact CD1-CD2 4.07Å; L330-F586 HydrophobicContact CD1-CE2 4.35Å; L330-W609 HydrophobicContact CD2-CH2 3.89Å; L330-W609 HydrophobicContact CD2-CZ3 4.41Å; L330-K623 HydrophobicContact CD2-CG 4.1Å
331	D	84.1	Confident	66.5	Low	58 Å²	58	68 Å²	68	31%	0.31	37%	0.37	S	S	.	.	H	α-helix	trans	-73.4	-28.1	-177	-53.4	-23.1	0	0	0	111.7	R328 A335 S619	R328-D331 HydrophobicContact CB-CB 4.43Å; R328-D331 WeakPolarHBondContact CB-OD2 3.48Å; R328-D331 WeakPolarHBondContact CD-OD2 3.39Å; R328-D331 IonicContact CZ-OD2 2.78Å; R328-D331 IonicContact NE-OD2 2.71Å; R328-D331 IonicContact NH1-OD2 3.85Å; R328-D331 PolarHBondContact NH1-OD2 2.95Å; R328-D331 PolarHBondContact O-N 3.29Å; R328-D331 VanDerWaalsContact O-N 3.15Å; D331-A335 PolarHBondContact O-N 2.99Å; D331-S619 PolarHBondContact OD1-OG 2.92Å
332	E	75.9	Confident	65.7	Low	15 Å²	15	68.7 Å²	68.7	7%	0.07	38%	0.378	C	S	.	.	H	α-helix	trans	-73.5	-27.3	179.5	-67.1	-70.6	165	0	0	112.8	R325 A327 R328 L329 D334 A335 M336 Y554	R325-E332 IonicContact CZ-OE1 3.58Å; R325-E332 IonicContact NE-OE1 3.92Å; R325-E332 IonicContact NH2-OE1 3.62Å; R325-E332 PolarHBondContact NH2-OE1 3.42Å; A327-E332 HydrophobicContact CB-CG 4.28Å; R328-E332 WeakPolarHBondContact O-CG 3.4Å; R328-E332 PolarHBondContact O-N 3.49Å; R328-E332 VanDerWaalsContact O-N 3.16Å; L329-E332 PolarHBondContact O-N 2.84Å; E332-D334 VanDerWaalsContact C-N 3.34Å; E332-A335 CarbonylContact O-C 3.59Å; E332-A335 WeakPolarHBondContact O-CB 3.38Å; E332-A335 PolarHBondContact O-N 3.41Å; E332-A335 VanDerWaalsContact O-N 3.15Å; E332-M336 VanDerWaalsContact O-CG 3.29Å; E332-M336 WeakPolarHBondContact O-CG 3.45Å; E332-M336 PolarHBondContact O-N 3.25Å; E332-Y554 HydrophobicContact CG-CE2 4.33Å
333	I	69.6	Low	65.3	Low	65 Å²	65	70.1 Å²	70.1	33%	0.333	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-40.5	175.8	-74	164.4	0	0	0	111.4	L329 A335 M336 F586	L329-I333 PolarHBondContact O-N 3.42Å; I333-A335 PolarHBondContact O-N 3.43Å; I333-M336 HydrophobicContact CB-CE 4.06Å; I333-M336 HydrophobicContact CD1-CE 4.49Å; I333-M336 HydrophobicContact CG1-CE 3.28Å; I333-M336 PolarHBondContact O-N 3.06Å; I333-M336 VanDerWaalsContact O-N 3.15Å; I333-F586 HydrophobicContact CD1-CE1 3.81Å; I333-F586 HydrophobicContact CD1-CE2 3.5Å; I333-F586 HydrophobicContact CD1-CZ 3Å; I333-F586 HydrophobicContact CG1-CZ 4.43Å
334	D	62.6	Low	64.8	Low	130 Å²	130	67 Å²	67	70%	0.695	37%	0.367	S	S	*	.	H	α-helix	trans	-61.2	-32.3	174.5	-63.5	-25.1	0	0	0	110.7	E332	E332-D334 VanDerWaalsContact C-N 3.34Å
335	A	55.9	Low	64	Low	36 Å²	36	67.9 Å²	67.9	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-79.1	-31.8	174.3	0	0	0	0	0	114.3	D331 E332 I333 G337 N338	D331-A335 PolarHBondContact O-N 2.99Å; E332-A335 CarbonylContact O-C 3.59Å; E332-A335 WeakPolarHBondContact O-CB 3.38Å; E332-A335 PolarHBondContact O-N 3.41Å; E332-A335 VanDerWaalsContact O-N 3.15Å; I333-A335 PolarHBondContact O-N 3.43Å; A335-G337 PolarHBondContact O-N 3.2Å; A335-N338 WeakPolarHBondContact O-CB 3Å; A335-N338 PolarHBondContact O-N 3.18Å; A335-N338 VanDerWaalsContact O-N 3.1Å
336	M	47.8	Very low	63.5	Low	79 Å²	79	62.3 Å²	62.3	39%	0.389	35%	0.353	S	S	.	.	H	α-helix	trans	-67.6	-16.9	-179.5	-78.2	-169.7	-65	0	0	114	E332 I333 N338 R558	E332-M336 VanDerWaalsContact O-CG 3.29Å; E332-M336 WeakPolarHBondContact O-CG 3.45Å; E332-M336 PolarHBondContact O-N 3.25Å; I333-M336 HydrophobicContact CB-CE 4.06Å; I333-M336 HydrophobicContact CD1-CE 4.49Å; I333-M336 HydrophobicContact CG1-CE 3.28Å; I333-M336 PolarHBondContact O-N 3.06Å; I333-M336 VanDerWaalsContact O-N 3.15Å; M336-N338 PolarHBondContact O-N 2.96Å; M336-R558 PolarHBondContact SD-NH1 3.35Å; M336-R558 VanDerWaalsContact SD-NH1 3.35Å
337	G	48.1	Very low	62.5	Low	68 Å²	68	61.4 Å²	61.4	70%	0.701	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.1	169.3	0	0	0	0	0	113.4	A335	A335-G337 PolarHBondContact O-N 3.2Å
338	N	41.9	Very low	62	Low	119 Å²	119	66.7 Å²	66.7	64%	0.636	38%	0.382	S	S	*	.	S	Bend	trans	-82.4	127.1	168	-66.1	-37.7	0	0	0	108.7	A335 M336 D340 G341	A335-N338 WeakPolarHBondContact O-CB 3Å; A335-N338 PolarHBondContact O-N 3.18Å; A335-N338 VanDerWaalsContact O-N 3.1Å; M336-N338 PolarHBondContact O-N 2.96Å; N338-D340 PolarHBondContact O-N 3.4Å; N338-G341 WeakPolarHBondContact O-CA 3.39Å; N338-G341 PolarHBondContact O-N 3.25Å
339	L	41.1	Very low	61.4	Low	184 Å²	184	70.4 Å²	70.4	96%	0.963	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-6.4	-175.3	-83.8	134.4	0	0	0	116.1
340	D	46.2	Very low	61	Low	151 Å²	151	73.7 Å²	73.7	81%	0.807	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	28.5	173.3	-96.2	-20.2	0	0	0	112.7	N338 G342	N338-D340 PolarHBondContact O-N 3.4Å; D340-G342 PolarHBondContact O-N 3.04Å
341	G	41.7	Very low	60.8	Low	15 Å²	15	73.4 Å²	73.4	16%	0.155	42%	0.42	C	S	.	.			trans	-58.6	99.5	-171.5	0	0	0	0	0	115.5	N338 D343	N338-G341 WeakPolarHBondContact O-CA 3.39Å; N338-G341 PolarHBondContact O-N 3.25Å; G341-D343 PolarHBondContact O-N 3.32Å
342	G	44.7	Very low	61	Low	25 Å²	25	75.2 Å²	75.2	26%	0.258	43%	0.427	S	S	.	.			trans	68.5	44.3	143.1	0	0	0	0	0	115.6	D340 L344 Y554	D340-G342 PolarHBondContact O-N 3.04Å; G342-L344 PolarHBondContact O-N 3.02Å; G342-Y554 PolarHBondContact O-OH 3.46Å
343	D	49.9	Very low	61.6	Low	97 Å²	97	80.5 Å²	80.5	52%	0.519	45%	0.447	S	S	.	.			trans	-67.5	131.4	165.4	-153.8	-9.3	0	0	0	109.4	G341 T345	G341-D343 PolarHBondContact O-N 3.32Å; D343-T345 CarbonylContact C-O 3.57Å; D343-T345 PolarHBondContact O-N 3.49Å; D343-T345 PolarHBondContact OD1-N 2.99Å; D343-T345 PolarHBondContact OD1-OG1 3.48Å; D343-T345 PolarHBondContact OD2-OG1 3.03Å
344	L	53.7	Low	62.6	Low	35 Å²	35	81.6 Å²	81.6	18%	0.183	45%	0.447	C	S	.	.	S	Bend	trans	-62.2	-19.3	169.8	-76.1	169.1	0	0	0	110.5	R325 G342 H378 Y554	R325-L344 HydrophobicContact CB-CD2 3.84Å; R325-L344 HydrophobicContact CG-CD2 3.85Å; G342-L344 PolarHBondContact O-N 3.02Å; L344-H378 WeakPolarHBondContact O-CA 3.39Å; L344-Y554 HydrophobicContact CD1-CD1 3.17Å; L344-Y554 HydrophobicContact CD1-CE1 3.57Å; L344-Y554 HydrophobicContact CD1-CG 3.91Å; L344-Y554 HydrophobicContact CG-CD1 3.94Å; L344-Y554 HydrophobicContact CG-CE1 3.8Å
345	T	58.2	Low	63.9	Low	56 Å²	56	78.6 Å²	78.6	34%	0.344	43%	0.429	S	S	.	.	S	Bend	trans	-88.3	148.9	175.9	82.5	0	0	0	0	110.9	D343 S347 H378	D343-T345 CarbonylContact C-O 3.57Å; D343-T345 PolarHBondContact O-N 3.49Å; D343-T345 PolarHBondContact OD1-N 2.99Å; D343-T345 PolarHBondContact OD1-OG1 3.48Å; D343-T345 PolarHBondContact OD2-OG1 3.03Å; T345-S347 PolarHBondContact O-N 3.11Å; T345-H378 CarbonylContact C-O 3.55Å; T345-H378 VanDerWaalsContact CA-O 3.22Å; T345-H378 WeakPolarHBondContact CA-O 3.16Å
346	I	66.6	Low	65.8	Low	25 Å²	25	81.9 Å²	81.9	13%	0.128	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-56.9	127.5	162.7	-80.5	157.9	0	0	0	106	E348 L350 F351 L372 H378 V380	I346-E348 PolarHBondContact O-N 3.45Å; I346-L350 HydrophobicContact CG2-CB 3.92Å; I346-L350 HydrophobicContact CG2-CD2 4.21Å; I346-L350 HydrophobicContact CG2-CG 4.05Å; I346-F351 HydrophobicContact CG2-CB 3.64Å; I346-F351 HydrophobicContact CG2-CD2 4.32Å; I346-F351 HydrophobicContact CG2-CG 4.47Å; I346-F351 VanDerWaalsContact CG2-N 3.35Å; I346-L372 HydrophobicContact CD1-CD1 3.48Å; I346-L372 VanDerWaalsContact CD1-CD1 3.48Å; I346-L372 HydrophobicContact CD1-CD2 3.55Å; I346-L372 HydrophobicContact CD1-CG 4.17Å; I346-H378 HydrophobicContact CB-CB 4.29Å; I346-H378 HydrophobicContact CD1-CB 3.78Å; I346-H378 HydrophobicContact CG1-CB 3.53Å; I346-H378 PolarHBondContact N-O 2.98Å; I346-V380 HydrophobicContact CD1-CG2 4.32Å
347	S	67.5	Low	67.9	Low	51 Å²	51	80 Å²	80	36%	0.357	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-53.1	133.2	173.2	61.4	0	0	0	0	109	T345 D349 L350 F351	T345-S347 PolarHBondContact O-N 3.11Å; S347-D349 PolarHBondContact O-N 2.98Å; S347-L350 WeakPolarHBondContact O-CA 3.21Å; S347-L350 WeakPolarHBondContact O-CB 3.14Å; S347-L350 PolarHBondContact O-N 3.49Å; S347-L350 WeakPolarHBondContact OG-CB 3.01Å; S347-L350 PolarHBondContact OG-N 3.13Å; S347-F351 PolarHBondContact O-N 3.13Å
348	E	74.1	Confident	70	Confident	115 Å²	115	76.9 Å²	76.9	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-50	-38.5	-176.4	-177.8	57.3	-147.6	0	0	111.2	I346 F351 Q352	I346-E348 PolarHBondContact O-N 3.45Å; E348-F351 WeakPolarHBondContact O-CB 3.15Å; E348-F351 PolarHBondContact O-N 3.34Å; E348-Q352 WeakPolarHBondContact O-CB 3.43Å; E348-Q352 VanDerWaalsContact O-CG 3.31Å; E348-Q352 WeakPolarHBondContact O-CG 3.49Å; E348-Q352 PolarHBondContact O-N 3.02Å; E348-Q352 PolarHBondContact OE1-NE2 3.35Å
349	D	79.8	Confident	72.4	Confident	124 Å²	124	80.4 Å²	80.4	66%	0.663	40%	0.401	S	S	*	.	H	α-helix	trans	-61.5	-43.8	174.9	-64.8	-11.2	0	0	0	113.4	S347 Y353	S347-D349 PolarHBondContact O-N 2.98Å; D349-Y353 WeakPolarHBondContact O-CB 3.47Å; D349-Y353 PolarHBondContact O-N 3.45Å
350	L	82.8	Confident	74.9	Confident	72 Å²	72	77.8 Å²	77.8	38%	0.377	38%	0.382	S	S	.	.	H	α-helix	trans	-68.4	-36.7	176.3	178.6	62.3	0	0	0	111	I346 S347 Y353 Y354	I346-L350 HydrophobicContact CG2-CB 3.92Å; I346-L350 HydrophobicContact CG2-CD2 4.21Å; I346-L350 HydrophobicContact CG2-CG 4.05Å; S347-L350 WeakPolarHBondContact O-CA 3.21Å; S347-L350 WeakPolarHBondContact O-CB 3.14Å; S347-L350 PolarHBondContact O-N 3.49Å; S347-L350 WeakPolarHBondContact OG-CB 3.01Å; S347-L350 PolarHBondContact OG-N 3.13Å; L350-Y353 HydrophobicContact CD1-CD1 4.34Å; L350-Y353 WeakPolarHBondContact O-CB 3.21Å; L350-Y353 PolarHBondContact O-N 3.36Å; L350-Y354 HydrophobicContact CD1-CD2 4.18Å; L350-Y354 HydrophobicContact CD1-CE2 3.72Å; L350-Y354 HydrophobicContact CD2-CE2 4.25Å; L350-Y354 HydrophobicContact CG-CD2 4.1Å; L350-Y354 HydrophobicContact CG-CE2 3.75Å; L350-Y354 WeakPolarHBondContact O-CD2 3.31Å; L350-Y354 PolarHBondContact O-N 3.06Å
351	F	85.8	Confident	77.1	Confident	22 Å²	22	78.1 Å²	78.1	10%	0.096	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-47.8	175.5	-167.3	-115	0	0	0	111.4	I346 S347 E348 Y353 Y354 Q355 L369 L372 Y373 V380	I346-F351 HydrophobicContact CG2-CB 3.64Å; I346-F351 HydrophobicContact CG2-CD2 4.32Å; I346-F351 HydrophobicContact CG2-CG 4.47Å; I346-F351 VanDerWaalsContact CG2-N 3.35Å; S347-F351 PolarHBondContact O-N 3.13Å; E348-F351 WeakPolarHBondContact O-CB 3.15Å; E348-F351 PolarHBondContact O-N 3.34Å; F351-Y353 VanDerWaalsContact C-N 3.29Å; F351-Y353 PolarHBondContact O-N 2.78Å; F351-Y354 PolarHBondContact O-N 2.89Å; F351-Y354 VanDerWaalsContact O-N 3.16Å; F351-Q355 HydrophobicContact CE1-CG 4.45Å; F351-Q355 PolarHBondContact O-N 3.25Å; F351-L369 HydrophobicContact CD2-CD2 4.43Å; F351-L369 HydrophobicContact CE2-CD2 3.95Å; F351-L369 HydrophobicContact CZ-CD2 4.44Å; F351-L372 HydrophobicContact CE2-CD1 4.35Å; F351-Y373 HydrophobicContact CZ-CE1 4.16Å; F351-Y373 HydrophobicContact CZ-CE2 4.26Å; F351-Y373 AromaticContact CZ-CZ 3.66Å; F351-Y373 VanDerWaalsContact CZ-OH 3.27Å; F351-Y373 WeakPolarHBondContact CZ-OH 3.36Å; F351-V380 HydrophobicContact CD2-CG2 3.99Å; F351-V380 HydrophobicContact CE2-CG1 4.2Å; F351-V380 HydrophobicContact CE2-CG2 3.58Å; F351-V380 HydrophobicContact CZ-CG1 4.22Å; F351-V380 HydrophobicContact CZ-CG2 4.2Å
352	Q	86.4	Confident	79.6	Confident	96 Å²	96	80.2 Å²	80.2	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-61.8	-37	175.4	-71.2	177.5	20.9	0	0	111.9	E348 Q355 F356	E348-Q352 WeakPolarHBondContact O-CB 3.43Å; E348-Q352 VanDerWaalsContact O-CG 3.31Å; E348-Q352 WeakPolarHBondContact O-CG 3.49Å; E348-Q352 PolarHBondContact O-N 3.02Å; E348-Q352 PolarHBondContact OE1-NE2 3.35Å; Q352-Q355 PolarHBondContact O-N 3.39Å; Q352-F356 WeakPolarHBondContact O-CB 3.15Å; Q352-F356 PolarHBondContact O-N 2.86Å
353	Y	89	Confident	81.9	Confident	126 Å²	126	81.2 Å²	81.2	49%	0.494	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-45.9	172.6	174.3	-96.6	0	0	0	112.2	D349 L350 F351 Q355 F356 M357	D349-Y353 WeakPolarHBondContact O-CB 3.47Å; D349-Y353 PolarHBondContact O-N 3.45Å; L350-Y353 HydrophobicContact CD1-CD1 4.34Å; L350-Y353 WeakPolarHBondContact O-CB 3.21Å; L350-Y353 PolarHBondContact O-N 3.36Å; F351-Y353 VanDerWaalsContact C-N 3.29Å; F351-Y353 PolarHBondContact O-N 2.78Å; Y353-Q355 PolarHBondContact O-N 2.53Å; Y353-F356 PolarHBondContact O-N 3.37Å; Y353-M357 HydrophobicContact CD1-CG 4.21Å; Y353-M357 HydrophobicContact CD2-CG 4.35Å; Y353-M357 HydrophobicContact CE1-CG 3.74Å; Y353-M357 HydrophobicContact CE2-CG 3.9Å; Y353-M357 HydrophobicContact CE2-SD 4.18Å; Y353-M357 HydrophobicContact CG-CG 4.49Å; Y353-M357 WeakPolarHBondContact O-CB 3.43Å; Y353-M357 VanDerWaalsContact O-CG 3.31Å; Y353-M357 WeakPolarHBondContact O-CG 3.34Å; Y353-M357 PolarHBondContact O-N 3.39Å
354	Y	90.3	Very high	84	Confident	87 Å²	87	81.1 Å²	81.1	34%	0.341	39%	0.392	S	S	.	.	H	α-helix	trans	-61.4	-43	175.3	-80.5	-66.2	0	0	0	112	L350 F351 F356 M357 A358 A365	L350-Y354 HydrophobicContact CD1-CD2 4.18Å; L350-Y354 HydrophobicContact CD1-CE2 3.72Å; L350-Y354 HydrophobicContact CD2-CE2 4.25Å; L350-Y354 HydrophobicContact CG-CD2 4.1Å; L350-Y354 HydrophobicContact CG-CE2 3.75Å; L350-Y354 WeakPolarHBondContact O-CD2 3.31Å; L350-Y354 PolarHBondContact O-N 3.06Å; F351-Y354 PolarHBondContact O-N 2.89Å; F351-Y354 VanDerWaalsContact O-N 3.16Å; Y354-F356 VanDerWaalsContact C-N 3.34Å; Y354-F356 PolarHBondContact O-N 3.29Å; Y354-M357 PolarHBondContact O-N 3.14Å; Y354-A358 WeakPolarHBondContact O-CB 3.08Å; Y354-A358 PolarHBondContact O-N 2.93Å; Y354-A365 HydrophobicContact CD1-CB 4.39Å
355	Q	91.6	Very high	85.9	Confident	68 Å²	68	79.7 Å²	79.7	32%	0.318	39%	0.385	S	S	.	.	H	α-helix	trans	-59.5	-44.4	175.3	-70	-179	-16.4	0	0	112	F351 Q352 Y353 A358 Y359 L369	F351-Q355 HydrophobicContact CE1-CG 4.45Å; F351-Q355 PolarHBondContact O-N 3.25Å; Q352-Q355 PolarHBondContact O-N 3.39Å; Y353-Q355 PolarHBondContact O-N 2.53Å; Q355-A358 PolarHBondContact O-N 2.88Å; Q355-Y359 PolarHBondContact O-N 2.78Å; Q355-L369 HydrophobicContact CG-CD1 4.28Å; Q355-L369 HydrophobicContact CG-CD2 4.25Å
356	F	94.2	Very high	87.7	Confident	104 Å²	104	77 Å²	77	46%	0.456	37%	0.369	S	S	.	.	H	α-helix	trans	-63.7	-41.2	176.2	176.3	-106.4	0	0	0	112.6	Q352 Y353 Y354 Y359 K360	Q352-F356 WeakPolarHBondContact O-CB 3.15Å; Q352-F356 PolarHBondContact O-N 2.86Å; Y353-F356 PolarHBondContact O-N 3.37Å; Y354-F356 VanDerWaalsContact C-N 3.34Å; Y354-F356 PolarHBondContact O-N 3.29Å; F356-Y359 WeakPolarHBondContact O-CB 3.48Å; F356-Y359 PolarHBondContact O-N 3.39Å; F356-K360 HydrophobicContact CD1-CD 4.42Å; F356-K360 HydrophobicContact CE1-CD 3.87Å; F356-K360 VanDerWaalsContact CE1-CE 3.43Å; F356-K360 VanDerWaalsContact CE1-NZ 3.31Å; F356-K360 HydrophobicContact CZ-CD 4.07Å; F356-K360 VanDerWaalsContact CZ-NZ 3.34Å; F356-K360 PolarHBondContact O-N 3.26Å
357	M	93.4	Very high	89	Confident	39 Å²	39	76.4 Å²	76.4	19%	0.192	37%	0.366	C	S	.	.	H	α-helix	trans	-67.1	-38	176.2	-71.6	-62.2	-71.1	0	0	112.1	Y353 Y354 K360 K361 N362 A365	Y353-M357 HydrophobicContact CD1-CG 4.21Å; Y353-M357 HydrophobicContact CD2-CG 4.35Å; Y353-M357 HydrophobicContact CE1-CG 3.74Å; Y353-M357 HydrophobicContact CE2-CG 3.9Å; Y353-M357 HydrophobicContact CE2-SD 4.18Å; Y353-M357 HydrophobicContact CG-CG 4.49Å; Y353-M357 WeakPolarHBondContact O-CB 3.43Å; Y353-M357 VanDerWaalsContact O-CG 3.31Å; Y353-M357 WeakPolarHBondContact O-CG 3.34Å; Y353-M357 PolarHBondContact O-N 3.39Å; Y354-M357 PolarHBondContact O-N 3.14Å; M357-K360 CarbonylContact O-C 3.5Å; M357-K360 WeakPolarHBondContact O-CB 3.35Å; M357-K360 PolarHBondContact O-N 2.91Å; M357-K361 PolarHBondContact O-N 2.89Å; M357-N362 HydrophobicContact CB-CB 4.35Å; M357-N362 HydrophobicContact CE-CB 4.31Å; M357-N362 WeakPolarHBondContact CE-ND2 3.49Å; M357-N362 VanDerWaalsContact O-CB 3.23Å; M357-N362 WeakPolarHBondContact O-CB 3.43Å; M357-N362 PolarHBondContact O-N 3.08Å; M357-A365 HydrophobicContact CB-CB 3.69Å
358	A	92.1	Very high	90.1	Very high	3 Å²	3	74.9 Å²	74.9	3%	0.025	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-39.8	173.1	0	0	0	0	0	111.7	Y354 Q355 K360 K361 A365 M366 L369 Y390	Y354-A358 WeakPolarHBondContact O-CB 3.08Å; Y354-A358 PolarHBondContact O-N 2.93Å; Q355-A358 PolarHBondContact O-N 2.88Å; A358-K360 VanDerWaalsContact C-N 3.26Å; A358-K360 PolarHBondContact O-N 3.04Å; A358-K361 WeakPolarHBondContact O-CA 3.5Å; A358-K361 PolarHBondContact O-N 3.06Å; A358-A365 HydrophobicContact CB-CB 4.25Å; A358-M366 HydrophobicContact CB-CG 4.01Å; A358-M366 WeakPolarHBondContact O-CE 3.23Å; A358-L369 HydrophobicContact CB-CD1 3.49Å; A358-L369 VanDerWaalsContact CB-CD1 3.49Å; A358-Y390 HydrophobicContact CB-CD1 4.46Å; A358-Y390 HydrophobicContact CB-CE1 4.11Å
359	Y	92.3	Very high	91	Very high	194 Å²	194	69.4 Å²	69.4	76%	0.761	33%	0.333	S	S	*	.	H	α-helix	trans	-59	-37.8	171.8	177.9	-97.3	0	0	0	112.1	Q355 F356 K361	Q355-Y359 PolarHBondContact O-N 2.78Å; F356-Y359 WeakPolarHBondContact O-CB 3.48Å; F356-Y359 PolarHBondContact O-N 3.39Å; Y359-K361 PolarHBondContact O-N 2.88Å; Y359-K361 VanDerWaalsContact O-N 3.07Å
360	K	93.3	Very high	91.6	Very high	129 Å²	129	63.5 Å²	63.5	56%	0.561	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	10.3	171.8	-75.9	-174.7	168.9	177.7	0	114.9	F356 M357 A358 N362	F356-K360 HydrophobicContact CD1-CD 4.42Å; F356-K360 HydrophobicContact CE1-CD 3.87Å; F356-K360 VanDerWaalsContact CE1-CE 3.43Å; F356-K360 VanDerWaalsContact CE1-NZ 3.31Å; F356-K360 HydrophobicContact CZ-CD 4.07Å; F356-K360 VanDerWaalsContact CZ-NZ 3.34Å; F356-K360 PolarHBondContact O-N 3.26Å; M357-K360 CarbonylContact O-C 3.5Å; M357-K360 WeakPolarHBondContact O-CB 3.35Å; M357-K360 PolarHBondContact O-N 2.91Å; A358-K360 VanDerWaalsContact C-N 3.26Å; A358-K360 PolarHBondContact O-N 3.04Å; K360-N362 VanDerWaalsContact C-N 3.33Å; K360-N362 PolarHBondContact O-N 3.31Å
361	K	91.5	Very high	91.9	Very high	157 Å²	157	62.9 Å²	62.9	68%	0.683	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	28	-178.7	-57.4	-171.6	176.7	-172.2	0	115.3	M357 A358 Y359 V363 M366	M357-K361 PolarHBondContact O-N 2.89Å; A358-K361 WeakPolarHBondContact O-CA 3.5Å; A358-K361 PolarHBondContact O-N 3.06Å; Y359-K361 PolarHBondContact O-N 2.88Å; Y359-K361 VanDerWaalsContact O-N 3.07Å; K361-V363 PolarHBondContact O-N 3.43Å; K361-M366 HydrophobicContact CB-CE 4.01Å; K361-M366 HydrophobicContact CG-CE 4.39Å
362	N	94.3	Very high	91.9	Very high	59 Å²	59	62.8 Å²	62.8	32%	0.316	30%	0.297	S	S	.	.			trans	-73.7	112.4	171.2	-174.4	-40.7	0	0	0	110.2	M357 K360 S364 A365 M366	M357-N362 HydrophobicContact CB-CB 4.35Å; M357-N362 HydrophobicContact CE-CB 4.31Å; M357-N362 WeakPolarHBondContact CE-ND2 3.49Å; M357-N362 VanDerWaalsContact O-CB 3.23Å; M357-N362 WeakPolarHBondContact O-CB 3.43Å; M357-N362 PolarHBondContact O-N 3.08Å; K360-N362 VanDerWaalsContact C-N 3.33Å; K360-N362 PolarHBondContact O-N 3.31Å; N362-S364 VanDerWaalsContact C-N 3.35Å; N362-S364 PolarHBondContact O-N 3.01Å; N362-S364 WeakPolarHBondContact OD1-CB 3.43Å; N362-S364 PolarHBondContact OD1-N 3.13Å; N362-A365 HydrophobicContact CB-CB 3.98Å; N362-A365 PolarHBondContact O-N 3.01Å; N362-A365 PolarHBondContact OD1-N 2.83Å; N362-M366 WeakPolarHBondContact O-CG 3.41Å; N362-M366 PolarHBondContact O-N 2.92Å
363	V	94.2	Very high	92	Very high	47 Å²	47	58.9 Å²	58.9	29%	0.285	28%	0.278	S	S	.	.	H	α-helix	trans	-58.8	-42.7	-178.3	-175.8	0	0	0	0	112.2	K361 A365 M366 V367 A394 S397	K361-V363 PolarHBondContact O-N 3.43Å; V363-A365 VanDerWaalsContact C-N 3.32Å; V363-A365 PolarHBondContact O-N 3.47Å; V363-M366 PolarHBondContact O-N 2.99Å; V363-V367 HydrophobicContact CG1-CG2 4.48Å; V363-V367 WeakPolarHBondContact O-CG2 3.44Å; V363-V367 PolarHBondContact O-N 3.06Å; V363-A394 HydrophobicContact CG1-CB 4.43Å; V363-S397 VanDerWaalsContact CG2-CB 3.47Å
364	S	93.8	Very high	91.8	Very high	95 Å²	95	53.2 Å²	53.2	66%	0.664	26%	0.256	S	S	*	.	H	α-helix	trans	-63.7	-38.5	178.3	-61.8	0	0	0	0	112	N362 V367 G368	N362-S364 VanDerWaalsContact C-N 3.35Å; N362-S364 PolarHBondContact O-N 3.01Å; N362-S364 WeakPolarHBondContact OD1-CB 3.43Å; N362-S364 PolarHBondContact OD1-N 3.13Å; S364-V367 PolarHBondContact O-N 2.73Å; S364-G368 PolarHBondContact O-N 3.4Å
365	A	92.9	Very high	91.3	Very high	5 Å²	5	50 Å²	50	4%	0.041	24%	0.243	C	C	.	.	H	α-helix	trans	-67.2	-39.2	176.1	0	0	0	0	0	111.8	Y354 M357 A358 N362 V363 G368 L369	Y354-A365 HydrophobicContact CD1-CB 4.39Å; M357-A365 HydrophobicContact CB-CB 3.69Å; A358-A365 HydrophobicContact CB-CB 4.25Å; N362-A365 HydrophobicContact CB-CB 3.98Å; N362-A365 PolarHBondContact O-N 3.01Å; N362-A365 PolarHBondContact OD1-N 2.83Å; V363-A365 VanDerWaalsContact C-N 3.32Å; V363-A365 PolarHBondContact O-N 3.47Å; A365-G368 PolarHBondContact O-N 3.15Å; A365-L369 WeakPolarHBondContact O-CB 3.47Å; A365-L369 WeakPolarHBondContact O-CG 3.49Å; A365-L369 PolarHBondContact O-N 3.36Å
366	M	95.7	Very high	90.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.7	-46.2	174.6	-63.9	169.7	-167	0	0	112.1	A358 K361 N362 V363 G368 L369 G370 L393 A394	A358-M366 HydrophobicContact CB-CG 4.01Å; A358-M366 WeakPolarHBondContact O-CE 3.23Å; K361-M366 HydrophobicContact CB-CE 4.01Å; K361-M366 HydrophobicContact CG-CE 4.39Å; N362-M366 WeakPolarHBondContact O-CG 3.41Å; N362-M366 PolarHBondContact O-N 2.92Å; V363-M366 PolarHBondContact O-N 2.99Å; M366-G368 VanDerWaalsContact C-N 3.32Å; M366-G368 PolarHBondContact O-N 3.44Å; M366-L369 PolarHBondContact O-N 3.3Å; M366-G370 PolarHBondContact O-N 2.82Å; M366-L393 HydrophobicContact CE-CD2 3.47Å; M366-L393 VanDerWaalsContact CE-CD2 3.47Å; M366-L393 HydrophobicContact CE-CG 3.61Å; M366-L393 HydrophobicContact CG-CD2 4.13Å; M366-L393 HydrophobicContact CG-CG 4.49Å; M366-L393 HydrophobicContact SD-CB 3.9Å; M366-L393 HydrophobicContact SD-CD2 3.68Å; M366-L393 HydrophobicContact SD-CG 3.48Å; M366-L393 WeakPolarHBondContact SD-CG 3.3Å; M366-A394 HydrophobicContact CB-CB 3.83Å; M366-A394 HydrophobicContact SD-CB 4.24Å
367	V	94.3	Very high	89.3	Confident	11 Å²	11	46.5 Å²	46.5	7%	0.067	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-45.5	176.3	173.4	0	0	0	0	110.2	V363 S364 G370 Q371 A394 S399 I401 A402	V363-V367 HydrophobicContact CG1-CG2 4.48Å; V363-V367 WeakPolarHBondContact O-CG2 3.44Å; V363-V367 PolarHBondContact O-N 3.06Å; S364-V367 PolarHBondContact O-N 2.73Å; V367-G370 PolarHBondContact O-N 2.88Å; V367-Q371 HydrophobicContact CG1-CG 4.43Å; V367-Q371 WeakPolarHBondContact O-CB 3.28Å; V367-Q371 WeakPolarHBondContact O-CG 3.47Å; V367-Q371 PolarHBondContact O-N 3.49Å; V367-A394 HydrophobicContact CG2-CB 3.8Å; V367-S399 WeakPolarHBondContact CG2-OG 3.4Å; V367-I401 HydrophobicContact CG1-CB 4.3Å; V367-I401 HydrophobicContact CG1-CG2 3.68Å; V367-A402 HydrophobicContact CG2-CB 4.28Å
368	G	90.8	Very high	88.1	Confident	19 Å²	19	50 Å²	50	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-49	177.5	0	0	0	0	0	112.6	S364 A365 M366 G370 Q371 L372	S364-G368 PolarHBondContact O-N 3.4Å; A365-G368 PolarHBondContact O-N 3.15Å; M366-G368 VanDerWaalsContact C-N 3.32Å; M366-G368 PolarHBondContact O-N 3.44Å; G368-G370 PolarHBondContact O-N 2.69Å; G368-Q371 PolarHBondContact O-N 2.92Å; G368-L372 VanDerWaalsContact O-CG 3.3Å; G368-L372 WeakPolarHBondContact O-CG 3.23Å; G368-L372 PolarHBondContact O-N 2.82Å
369	L	92	Very high	86.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-42.1	175.3	-73.7	173.3	0	0	0	112.3	F351 Q355 A358 A365 M366 Q371 L372 Y373 Y390	F351-L369 HydrophobicContact CD2-CD2 4.43Å; F351-L369 HydrophobicContact CE2-CD2 3.95Å; F351-L369 HydrophobicContact CZ-CD2 4.44Å; Q355-L369 HydrophobicContact CG-CD1 4.28Å; Q355-L369 HydrophobicContact CG-CD2 4.25Å; A358-L369 HydrophobicContact CB-CD1 3.49Å; A358-L369 VanDerWaalsContact CB-CD1 3.49Å; A365-L369 WeakPolarHBondContact O-CB 3.47Å; A365-L369 WeakPolarHBondContact O-CG 3.49Å; A365-L369 PolarHBondContact O-N 3.36Å; M366-L369 PolarHBondContact O-N 3.3Å; L369-Q371 VanDerWaalsContact C-N 3.33Å; L369-Q371 PolarHBondContact O-N 2.97Å; L369-L372 HydrophobicContact CD2-CD1 4.44Å; L369-L372 PolarHBondContact O-N 2.94Å; L369-Y373 VanDerWaalsContact O-CD2 3.22Å; L369-Y373 WeakPolarHBondContact O-CD2 3.48Å; L369-Y373 PolarHBondContact O-N 3.34Å; L369-Y390 HydrophobicContact CB-CD1 4.24Å; L369-Y390 HydrophobicContact CB-CD2 4.09Å; L369-Y390 HydrophobicContact CB-CE1 4.45Å; L369-Y390 HydrophobicContact CB-CE2 4.34Å; L369-Y390 HydrophobicContact CB-CG 4.06Å; L369-Y390 HydrophobicContact CD1-CD1 4.1Å; L369-Y390 HydrophobicContact CD1-CE1 3.64Å; L369-Y390 HydrophobicContact CD1-CE2 4.44Å
370	G	92.4	Very high	86.1	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.3	-48.2	174.7	0	0	0	0	0	111.3	M366 V367 G368 Y373 Y374 F391	M366-G370 PolarHBondContact O-N 2.82Å; V367-G370 PolarHBondContact O-N 2.88Å; G368-G370 PolarHBondContact O-N 2.69Å; G370-Y373 PolarHBondContact O-N 2.92Å; G370-Y374 WeakPolarHBondContact O-CB 3.44Å; G370-Y374 PolarHBondContact O-N 3.13Å; G370-F391 WeakPolarHBondContact O-CZ 3.43Å
371	Q	89.1	Confident	85.2	Confident	59 Å²	59	44.7 Å²	44.7	28%	0.276	25%	0.247	S	C	.	.	H	α-helix	trans	-65.3	-39.1	176.6	-72.2	175.8	-35.5	0	0	113	V367 G368 L369 Y374 Y375 F391 Y405	V367-Q371 HydrophobicContact CG1-CG 4.43Å; V367-Q371 WeakPolarHBondContact O-CB 3.28Å; V367-Q371 WeakPolarHBondContact O-CG 3.47Å; V367-Q371 PolarHBondContact O-N 3.49Å; G368-Q371 PolarHBondContact O-N 2.92Å; L369-Q371 VanDerWaalsContact C-N 3.33Å; L369-Q371 PolarHBondContact O-N 2.97Å; Q371-Y374 PolarHBondContact O-N 3.38Å; Q371-Y375 HydrophobicContact CB-CD2 4.22Å; Q371-Y375 HydrophobicContact CB-CE2 4.17Å; Q371-Y375 HydrophobicContact CG-CE2 4.33Å; Q371-Y375 WeakPolarHBondContact O-CB 3.17Å; Q371-Y375 WeakPolarHBondContact O-CD2 3.39Å; Q371-Y375 PolarHBondContact O-N 3.02Å; Q371-F391 HydrophobicContact CG-CE1 4.14Å; Q371-F391 HydrophobicContact CG-CZ 4.13Å; Q371-Y405 HydrophobicContact CG-CE2 3.8Å; Q371-Y405 VanDerWaalsContact NE2-CE2 3.35Å; Q371-Y405 PolarHBondContact NE2-OH 3.36Å
372	L	86.5	Confident	84.6	Confident	20 Å²	20	42.5 Å²	42.5	11%	0.105	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-48.2	176.9	-74.1	172.3	0	0	0	111.3	I346 F351 G368 L369 G376 R377	I346-L372 HydrophobicContact CD1-CD1 3.48Å; I346-L372 VanDerWaalsContact CD1-CD1 3.48Å; I346-L372 HydrophobicContact CD1-CD2 3.55Å; I346-L372 HydrophobicContact CD1-CG 4.17Å; F351-L372 HydrophobicContact CE2-CD1 4.35Å; G368-L372 VanDerWaalsContact O-CG 3.3Å; G368-L372 WeakPolarHBondContact O-CG 3.23Å; G368-L372 PolarHBondContact O-N 2.82Å; L369-L372 HydrophobicContact CD2-CD1 4.44Å; L369-L372 PolarHBondContact O-N 2.94Å; L372-G376 WeakPolarHBondContact O-CA 3.29Å; L372-G376 PolarHBondContact O-N 3.35Å; L372-R377 HydrophobicContact CD2-CB 4.26Å; L372-R377 PolarHBondContact O-N 3.4Å
373	Y	87.5	Confident	84.2	Confident	15 Å²	15	42.1 Å²	42.1	6%	0.059	24%	0.238	C	C	.	.	H	α-helix	trans	-70.1	-31.8	176	-74.7	-58.8	0	0	0	113	F351 L369 G370 V380 M382 N383 K386 Y390	F351-Y373 HydrophobicContact CZ-CE1 4.16Å; F351-Y373 HydrophobicContact CZ-CE2 4.26Å; F351-Y373 AromaticContact CZ-CZ 3.66Å; F351-Y373 VanDerWaalsContact CZ-OH 3.27Å; F351-Y373 WeakPolarHBondContact CZ-OH 3.36Å; L369-Y373 VanDerWaalsContact O-CD2 3.22Å; L369-Y373 WeakPolarHBondContact O-CD2 3.48Å; L369-Y373 PolarHBondContact O-N 3.34Å; G370-Y373 PolarHBondContact O-N 2.92Å; Y373-V380 HydrophobicContact CD1-CG1 3.64Å; Y373-V380 HydrophobicContact CE1-CG1 3.71Å; Y373-V380 HydrophobicContact CG-CG1 4.43Å; Y373-M382 CarbonylContact O-C 3.07Å; Y373-M382 VanDerWaalsContact O-CA 3.31Å; Y373-M382 WeakPolarHBondContact O-CA 3.43Å; Y373-N383 HydrophobicContact CD1-CB 4.1Å; Y373-N383 PolarHBondContact O-N 2.96Å; Y373-K386 HydrophobicContact CD1-CB 4.2Å; Y373-K386 HydrophobicContact CD1-CD 4.16Å; Y373-K386 HydrophobicContact CD2-CB 3.86Å; Y373-K386 HydrophobicContact CE1-CB 4.47Å; Y373-K386 HydrophobicContact CE1-CD 3.7Å; Y373-K386 HydrophobicContact CE2-CB 4.15Å; Y373-K386 HydrophobicContact CE2-CD 4.15Å; Y373-K386 HydrophobicContact CG-CB 3.88Å; Y373-Y390 AromaticContact CD2-CD2 3.89Å; Y373-Y390 HydrophobicContact CD2-CD2 3.89Å; Y373-Y390 AromaticContact CD2-CE2 3.9Å; Y373-Y390 HydrophobicContact CD2-CE2 3.9Å; Y373-Y390 HydrophobicContact CE2-CD2 4.01Å; Y373-Y390 AromaticContact CE2-CE2 3.52Å; Y373-Y390 HydrophobicContact CE2-CE2 3.52Å
374	Y	85.9	Confident	83.8	Confident	7 Å²	7	42.4 Å²	42.4	3%	0.027	24%	0.236	C	C	.	.	H	α-helix	trans	-70.8	-42	179.9	-174.3	-106.1	0	0	0	112.2	G315 T318 L319 G370 Q371 A387 F391 Y405 E408 M409	G315-Y374 PolarHBondContact O-OH 3.38Å; G315-Y374 VanDerWaalsContact O-OH 3.11Å; T318-Y374 VanDerWaalsContact OG1-CE1 3.27Å; T318-Y374 WeakPolarHBondContact OG1-CE1 3.5Å; L319-Y374 HydrophobicContact CB-CE1 4.49Å; L319-Y374 HydrophobicContact CD1-CE1 4.16Å; G370-Y374 WeakPolarHBondContact O-CB 3.44Å; G370-Y374 PolarHBondContact O-N 3.13Å; Q371-Y374 PolarHBondContact O-N 3.38Å; Y374-A387 HydrophobicContact CD2-CB 4.37Å; Y374-F391 HydrophobicContact CD2-CE2 4.3Å; Y374-F391 HydrophobicContact CG-CE2 4.17Å; Y374-Y405 HydrophobicContact CD1-CD1 4.24Å; Y374-Y405 HydrophobicContact CD1-CE1 4.17Å; Y374-Y405 HydrophobicContact CE1-CD1 4.24Å; Y374-Y405 HydrophobicContact CE1-CE1 4.26Å; Y374-E408 PolarHBondContact OH-OE1 3.32Å; Y374-M409 HydrophobicContact CD2-CE 4.39Å; Y374-M409 HydrophobicContact CD2-CG 4.41Å; Y374-M409 HydrophobicContact CD2-SD 4.31Å; Y374-M409 HydrophobicContact CE2-CE 4.48Å; Y374-M409 HydrophobicContact CE2-CG 3.84Å; Y374-M409 HydrophobicContact CE2-SD 4.32Å
375	Y	78.9	Confident	83.6	Confident	20 Å²	20	44.4 Å²	44.4	8%	0.078	24%	0.235	C	C	.	.	H	α-helix	trans	-94.2	-18.3	-178.3	-61.4	-49.9	0	0	0	114.9	T318 L319 Q371 Y405	T318-Y375 WeakPolarHBondContact CB-OH 3.18Å; T318-Y375 WeakPolarHBondContact O-CE1 3.14Å; T318-Y375 PolarHBondContact O-OH 3.18Å; L319-Y375 HydrophobicContact CD1-CD1 4.31Å; Q371-Y375 HydrophobicContact CB-CD2 4.22Å; Q371-Y375 HydrophobicContact CB-CE2 4.17Å; Q371-Y375 HydrophobicContact CG-CE2 4.33Å; Q371-Y375 WeakPolarHBondContact O-CB 3.17Å; Q371-Y375 WeakPolarHBondContact O-CD2 3.39Å; Q371-Y375 PolarHBondContact O-N 3.02Å; Y375-Y405 WeakPolarHBondContact OH-CE1 3.31Å; Y375-Y405 PolarHBondContact OH-OH 3.07Å
376	G	74.8	Confident	83.5	Confident	25 Å²	25	48.8 Å²	48.8	26%	0.258	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	51.8	-171.6	0	0	0	0	0	113.3	L372 V380	L372-G376 WeakPolarHBondContact O-CA 3.29Å; L372-G376 PolarHBondContact O-N 3.35Å; G376-V380 CarbonylContact C-O 3.59Å; G376-V380 WeakPolarHBondContact CA-O 3.32Å
377	R	70.5	Confident	83.3	Confident	73 Å²	73	48.8 Å²	48.8	28%	0.275	25%	0.253	S	S	.	.			trans	-97.8	154.1	-176.6	-70.2	177.6	-173.2	-165.8	4.1	112.3	L372 G379 V380	L372-R377 HydrophobicContact CD2-CB 4.26Å; L372-R377 PolarHBondContact O-N 3.4Å; R377-G379 PolarHBondContact O-N 3.48Å; R377-V380 WeakPolarHBondContact O-CB 3.27Å; R377-V380 PolarHBondContact O-N 2.84Å
378	H	68.1	Low	83.3	Confident	112 Å²	112	50.6 Å²	50.6	52%	0.519	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	49	175.1	-47.5	101.2	0	0	0	113.4	L344 T345 I346 V380	L344-H378 WeakPolarHBondContact O-CA 3.39Å; T345-H378 CarbonylContact C-O 3.55Å; T345-H378 VanDerWaalsContact CA-O 3.22Å; T345-H378 WeakPolarHBondContact CA-O 3.16Å; I346-H378 HydrophobicContact CB-CB 4.29Å; I346-H378 HydrophobicContact CD1-CB 3.78Å; I346-H378 HydrophobicContact CG1-CB 3.53Å; I346-H378 PolarHBondContact N-O 2.98Å; H378-V380 PolarHBondContact O-N 3.48Å
379	G	66.5	Low	83.5	Confident	54 Å²	54	56.6 Å²	56.6	56%	0.557	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	-3.6	178.3	0	0	0	0	0	115.6	R377	R377-G379 PolarHBondContact O-N 3.48Å
380	V	76.4	Confident	83.7	Confident	20 Å²	20	58.3 Å²	58.3	12%	0.121	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-79.3	127.7	173.4	-177	0	0	0	0	109.1	I346 F351 Y373 G376 R377 H378	I346-V380 HydrophobicContact CD1-CG2 4.32Å; F351-V380 HydrophobicContact CD2-CG2 3.99Å; F351-V380 HydrophobicContact CE2-CG1 4.2Å; F351-V380 HydrophobicContact CE2-CG2 3.58Å; F351-V380 HydrophobicContact CZ-CG1 4.22Å; F351-V380 HydrophobicContact CZ-CG2 4.2Å; Y373-V380 HydrophobicContact CD1-CG1 3.64Å; Y373-V380 HydrophobicContact CE1-CG1 3.71Å; Y373-V380 HydrophobicContact CG-CG1 4.43Å; G376-V380 CarbonylContact C-O 3.59Å; G376-V380 WeakPolarHBondContact CA-O 3.32Å; R377-V380 WeakPolarHBondContact O-CB 3.27Å; R377-V380 PolarHBondContact O-N 2.84Å; H378-V380 PolarHBondContact O-N 3.48Å
381	E	73.2	Confident	83.8	Confident	140 Å²	140	58.3 Å²	58.3	65%	0.654	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-67.7	141.8	175.1	-68.6	179.3	173.5	0	0	111.3	K178 N383	K178-E381 IonicContact NZ-OE1 3.1Å; E381-N383 PolarHBondContact O-N 2.89Å
382	M	78.4	Confident	84.2	Confident	112 Å²	112	57.1 Å²	57.1	55%	0.552	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-64.4	123.5	175.6	-179	175	55.1	0	0	110	Y373 H384	Y373-M382 CarbonylContact O-C 3.07Å; Y373-M382 VanDerWaalsContact O-CA 3.31Å; Y373-M382 WeakPolarHBondContact O-CA 3.43Å; M382-H384 PolarHBondContact SD-NE2 3.5Å; M382-H384 VanDerWaalsContact SD-NE2 3.44Å
383	N	85.7	Confident	84.6	Confident	50 Å²	50	58.3 Å²	58.3	27%	0.267	29%	0.286	S	S	.	.			trans	-143.6	98.9	179.1	-172.5	-43.5	0	0	0	110	Y373 E381 E385 K386 A387	Y373-N383 HydrophobicContact CD1-CB 4.1Å; Y373-N383 PolarHBondContact O-N 2.96Å; E381-N383 PolarHBondContact O-N 2.89Å; N383-E385 VanDerWaalsContact C-N 3.27Å; N383-E385 PolarHBondContact O-N 3.25Å; N383-E385 WeakPolarHBondContact OD1-CB 3.3Å; N383-E385 PolarHBondContact OD1-N 2.89Å; N383-E385 VanDerWaalsContact OD1-N 3.13Å; N383-K386 HydrophobicContact CB-CB 4.24Å; N383-K386 HydrophobicContact CB-CD 4.47Å; N383-K386 HydrophobicContact CB-CG 4.48Å; N383-K386 PolarHBondContact O-N 3.06Å; N383-K386 PolarHBondContact OD1-N 3.05Å; N383-A387 WeakPolarHBondContact O-CB 3.24Å; N383-A387 PolarHBondContact O-N 3.29Å
384	H	85.8	Confident	85	Confident	53 Å²	53	57.6 Å²	57.6	25%	0.245	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-29.1	-176.9	-64.8	-179.5	0	0	0	112.9	M382 F388 M409 A416	M382-H384 PolarHBondContact SD-NE2 3.5Å; M382-H384 VanDerWaalsContact SD-NE2 3.44Å; H384-F388 WeakPolarHBondContact O-CB 3.48Å; H384-F388 PolarHBondContact O-N 3.2Å; H384-M409 HydrophobicContact CB-CE 4.35Å; H384-M409 WeakPolarHBondContact O-CE 3.29Å; H384-A416 HydrophobicContact CB-CB 4.39Å
385	E	90.3	Very high	85.4	Confident	137 Å²	137	57.9 Å²	57.9	64%	0.64	29%	0.287	S	S	*	.	H	α-helix	trans	-69.4	-47.8	178.1	-172.4	-177	-178.7	0	0	111.2	N383 F388 Y389 A416	N383-E385 VanDerWaalsContact C-N 3.27Å; N383-E385 PolarHBondContact O-N 3.25Å; N383-E385 WeakPolarHBondContact OD1-CB 3.3Å; N383-E385 PolarHBondContact OD1-N 2.89Å; N383-E385 VanDerWaalsContact OD1-N 3.13Å; E385-F388 WeakPolarHBondContact O-CB 3.19Å; E385-F388 PolarHBondContact O-N 3.37Å; E385-Y389 PolarHBondContact O-N 3.44Å; E385-A416 HydrophobicContact CB-CB 4.2Å
386	K	91.6	Very high	86.2	Confident	97 Å²	97	64.5 Å²	64.5	42%	0.422	32%	0.319	S	S	.	.	H	α-helix	trans	-64.6	-41.6	174.4	-71.7	-175.7	-176.8	177.6	0	111.5	Y373 N383 F388 Y389 Y390	Y373-K386 HydrophobicContact CD1-CB 4.2Å; Y373-K386 HydrophobicContact CD1-CD 4.16Å; Y373-K386 HydrophobicContact CD2-CB 3.86Å; Y373-K386 HydrophobicContact CE1-CB 4.47Å; Y373-K386 HydrophobicContact CE1-CD 3.7Å; Y373-K386 HydrophobicContact CE2-CB 4.15Å; Y373-K386 HydrophobicContact CE2-CD 4.15Å; Y373-K386 HydrophobicContact CG-CB 3.88Å; N383-K386 HydrophobicContact CB-CB 4.24Å; N383-K386 HydrophobicContact CB-CD 4.47Å; N383-K386 HydrophobicContact CB-CG 4.48Å; N383-K386 PolarHBondContact O-N 3.06Å; N383-K386 PolarHBondContact OD1-N 3.05Å; K386-F388 VanDerWaalsContact C-N 3.33Å; K386-F388 PolarHBondContact O-N 3.25Å; K386-Y389 WeakPolarHBondContact O-CB 3.5Å; K386-Y389 PolarHBondContact O-N 3.11Å; K386-Y390 WeakPolarHBondContact O-CD2 3.42Å; K386-Y390 PolarHBondContact O-N 3.03Å
387	A	91.8	Very high	87	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-49.2	174.9	0	0	0	0	0	111.1	Y374 N383 Y389 Y390 F391	Y374-A387 HydrophobicContact CD2-CB 4.37Å; N383-A387 WeakPolarHBondContact O-CB 3.24Å; N383-A387 PolarHBondContact O-N 3.29Å; A387-Y389 VanDerWaalsContact C-N 3.34Å; A387-Y389 PolarHBondContact O-N 3.22Å; A387-Y390 PolarHBondContact O-N 2.79Å; A387-F391 HydrophobicContact CB-CD2 4.3Å; A387-F391 HydrophobicContact CB-CE2 4.07Å; A387-F391 WeakPolarHBondContact O-CB 3.22Å; A387-F391 WeakPolarHBondContact O-CD2 3.18Å; A387-F391 VanDerWaalsContact O-CG 3.31Å; A387-F391 WeakPolarHBondContact O-CG 3.49Å; A387-F391 PolarHBondContact O-N 3.49Å
388	F	93.9	Very high	88	Confident	49 Å²	49	64.6 Å²	64.6	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-58.2	-43.6	176.8	-177.5	-104.5	0	0	0	112.2	H384 E385 K386 F391 N392 L406 M409 Y410 V417	H384-F388 WeakPolarHBondContact O-CB 3.48Å; H384-F388 PolarHBondContact O-N 3.2Å; E385-F388 WeakPolarHBondContact O-CB 3.19Å; E385-F388 PolarHBondContact O-N 3.37Å; K386-F388 VanDerWaalsContact C-N 3.33Å; K386-F388 PolarHBondContact O-N 3.25Å; F388-F391 PolarHBondContact O-N 3.47Å; F388-N392 WeakPolarHBondContact CD1-ND2 3.09Å; F388-N392 WeakPolarHBondContact CE1-ND2 3.31Å; F388-N392 WeakPolarHBondContact CE2-ND2 3.37Å; F388-N392 WeakPolarHBondContact CZ-ND2 3.47Å; F388-N392 PolarHBondContact O-N 2.87Å; F388-N392 PolarHBondContact O-ND2 3.4Å; F388-L406 HydrophobicContact CD2-CD2 3.67Å; F388-L406 HydrophobicContact CE2-CD2 3.78Å; F388-M409 HydrophobicContact CB-CE 3.75Å; F388-M409 HydrophobicContact CB-SD 4.44Å; F388-M409 HydrophobicContact CD2-CE 4.26Å; F388-M409 HydrophobicContact CD2-SD 4.36Å; F388-M409 HydrophobicContact CG-CE 4.5Å; F388-Y410 HydrophobicContact CE2-CE1 4.26Å; F388-Y410 HydrophobicContact CE2-CE2 4.02Å; F388-Y410 AromaticContact CE2-CZ 3.69Å; F388-Y410 HydrophobicContact CZ-CE1 4.47Å; F388-Y410 AromaticContact CZ-CZ 3.89Å; F388-Y410 VanDerWaalsContact CZ-OH 3.29Å; F388-Y410 WeakPolarHBondContact CZ-OH 3.25Å; F388-V417 HydrophobicContact CB-CG2 3.83Å; F388-V417 HydrophobicContact CD1-CG2 4.18Å; F388-V417 HydrophobicContact CD2-CB 4.43Å; F388-V417 HydrophobicContact CD2-CG1 3.93Å; F388-V417 HydrophobicContact CD2-CG2 3.57Å; F388-V417 HydrophobicContact CE2-CG1 3.75Å; F388-V417 HydrophobicContact CE2-CG2 4.1Å; F388-V417 HydrophobicContact CG-CG2 3.6Å; F388-V417 HydrophobicContact CZ-CG1 4.4Å
389	Y	94.8	Very high	89.3	Confident	145 Å²	145	60 Å²	60	57%	0.569	31%	0.314	S	S	*	.	H	α-helix	trans	-58.4	-51.9	176.9	174.2	-99.9	0	0	0	112.3	E385 K386 A387 N392 L393	E385-Y389 PolarHBondContact O-N 3.44Å; K386-Y389 WeakPolarHBondContact O-CB 3.5Å; K386-Y389 PolarHBondContact O-N 3.11Å; A387-Y389 VanDerWaalsContact C-N 3.34Å; A387-Y389 PolarHBondContact O-N 3.22Å; Y389-N392 PolarHBondContact O-N 2.91Å; Y389-L393 PolarHBondContact O-N 3.46Å
390	Y	95.2	Very high	90.7	Very high	37 Å²	37	58.2 Å²	58.2	15%	0.145	29%	0.294	C	S	.	.	H	α-helix	trans	-67.7	-36.6	-179.9	-74.3	-69	0	0	0	112.8	A358 L369 Y373 K386 A387 L393 A394	A358-Y390 HydrophobicContact CB-CD1 4.46Å; A358-Y390 HydrophobicContact CB-CE1 4.11Å; L369-Y390 HydrophobicContact CB-CD1 4.24Å; L369-Y390 HydrophobicContact CB-CD2 4.09Å; L369-Y390 HydrophobicContact CB-CE1 4.45Å; L369-Y390 HydrophobicContact CB-CE2 4.34Å; L369-Y390 HydrophobicContact CB-CG 4.06Å; L369-Y390 HydrophobicContact CD1-CD1 4.1Å; L369-Y390 HydrophobicContact CD1-CE1 3.64Å; L369-Y390 HydrophobicContact CD1-CE2 4.44Å; Y373-Y390 AromaticContact CD2-CD2 3.89Å; Y373-Y390 HydrophobicContact CD2-CD2 3.89Å; Y373-Y390 AromaticContact CD2-CE2 3.9Å; Y373-Y390 HydrophobicContact CD2-CE2 3.9Å; Y373-Y390 HydrophobicContact CE2-CD2 4.01Å; Y373-Y390 AromaticContact CE2-CE2 3.52Å; Y373-Y390 HydrophobicContact CE2-CE2 3.52Å; K386-Y390 WeakPolarHBondContact O-CD2 3.42Å; K386-Y390 PolarHBondContact O-N 3.03Å; A387-Y390 PolarHBondContact O-N 2.79Å; Y390-L393 PolarHBondContact O-N 3.28Å; Y390-A394 WeakPolarHBondContact O-CB 3.36Å; Y390-A394 PolarHBondContact O-N 3.35Å
391	F	96.3	Very high	91.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.6	-38.4	175.4	-69.8	-44.7	0	0	0	112.6	G370 Q371 Y374 A387 F388 A394 A395 A402 Y405 L406 M409	G370-F391 WeakPolarHBondContact O-CZ 3.43Å; Q371-F391 HydrophobicContact CG-CE1 4.14Å; Q371-F391 HydrophobicContact CG-CZ 4.13Å; Y374-F391 HydrophobicContact CD2-CE2 4.3Å; Y374-F391 HydrophobicContact CG-CE2 4.17Å; A387-F391 HydrophobicContact CB-CD2 4.3Å; A387-F391 HydrophobicContact CB-CE2 4.07Å; A387-F391 WeakPolarHBondContact O-CB 3.22Å; A387-F391 WeakPolarHBondContact O-CD2 3.18Å; A387-F391 VanDerWaalsContact O-CG 3.31Å; A387-F391 WeakPolarHBondContact O-CG 3.49Å; A387-F391 PolarHBondContact O-N 3.49Å; F388-F391 PolarHBondContact O-N 3.47Å; F391-A394 PolarHBondContact O-N 3.28Å; F391-A395 VanDerWaalsContact O-CB 3.25Å; F391-A395 WeakPolarHBondContact O-CB 3.23Å; F391-A395 PolarHBondContact O-N 3.15Å; F391-A402 HydrophobicContact CB-CB 4.44Å; F391-A402 HydrophobicContact CD1-CB 4.23Å; F391-A402 WeakPolarHBondContact O-CB 3.37Å; F391-Y405 HydrophobicContact CD1-CD2 4.29Å; F391-Y405 HydrophobicContact CD1-CG 4.41Å; F391-Y405 AromaticContact CE1-CD2 3.59Å; F391-Y405 HydrophobicContact CE1-CD2 3.59Å; F391-Y405 HydrophobicContact CE1-CE2 4.27Å; F391-Y405 AromaticContact CE1-CG 3.8Å; F391-Y405 HydrophobicContact CE1-CG 3.8Å; F391-Y405 HydrophobicContact CE2-CD1 4.22Å; F391-Y405 AromaticContact CE2-CG 3.91Å; F391-Y405 HydrophobicContact CE2-CG 3.91Å; F391-Y405 AromaticContact CZ-CD1 3.91Å; F391-Y405 HydrophobicContact CZ-CD1 3.91Å; F391-Y405 AromaticContact CZ-CD2 3.73Å; F391-Y405 HydrophobicContact CZ-CD2 3.73Å; F391-Y405 HydrophobicContact CZ-CE1 4.47Å; F391-Y405 HydrophobicContact CZ-CE2 4.33Å; F391-Y405 AromaticContact CZ-CG 3.51Å; F391-Y405 HydrophobicContact CZ-CG 3.51Å; F391-L406 HydrophobicContact CB-CD2 3.77Å; F391-L406 HydrophobicContact CB-CG 3.89Å; F391-M409 HydrophobicContact CD2-SD 3.8Å; F391-M409 HydrophobicContact CE2-SD 4.2Å
392	N	95.7	Very high	92.7	Very high	33 Å²	33	53.7 Å²	53.7	18%	0.176	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-46.8	173.4	-78.9	-62.1	0	0	0	111.5	F388 Y389 A394 A395 E396	F388-N392 WeakPolarHBondContact CD1-ND2 3.09Å; F388-N392 WeakPolarHBondContact CE1-ND2 3.31Å; F388-N392 WeakPolarHBondContact CE2-ND2 3.37Å; F388-N392 WeakPolarHBondContact CZ-ND2 3.47Å; F388-N392 PolarHBondContact O-N 2.87Å; F388-N392 PolarHBondContact O-ND2 3.4Å; Y389-N392 PolarHBondContact O-N 2.91Å; N392-A394 VanDerWaalsContact C-N 3.28Å; N392-A394 PolarHBondContact O-N 3.33Å; N392-A395 PolarHBondContact O-N 3.37Å; N392-A395 VanDerWaalsContact O-N 3.15Å; N392-E396 WeakPolarHBondContact O-CG 3.37Å; N392-E396 PolarHBondContact O-N 3.49Å
393	L	95	Very high	93.5	Very high	45 Å²	45	49 Å²	49	24%	0.236	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-38.7	178.5	-169	65.5	0	0	0	112.3	M366 Y389 Y390 S397	M366-L393 HydrophobicContact CE-CD2 3.47Å; M366-L393 VanDerWaalsContact CE-CD2 3.47Å; M366-L393 HydrophobicContact CE-CG 3.61Å; M366-L393 HydrophobicContact CG-CD2 4.13Å; M366-L393 HydrophobicContact CG-CG 4.49Å; M366-L393 HydrophobicContact SD-CB 3.9Å; M366-L393 HydrophobicContact SD-CD2 3.68Å; M366-L393 HydrophobicContact SD-CG 3.48Å; M366-L393 WeakPolarHBondContact SD-CG 3.3Å; Y389-L393 PolarHBondContact O-N 3.46Å; Y390-L393 PolarHBondContact O-N 3.28Å; L393-S397 PolarHBondContact O-N 3.37Å; L393-S397 PolarHBondContact O-OG 2.93Å
394	A	96.2	Very high	93.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.1	-38.9	175.2	0	0	0	0	0	112.8	V363 M366 V367 Y390 F391 N392 S397 G398 S399 A402	V363-A394 HydrophobicContact CG1-CB 4.43Å; M366-A394 HydrophobicContact CB-CB 3.83Å; M366-A394 HydrophobicContact SD-CB 4.24Å; V367-A394 HydrophobicContact CG2-CB 3.8Å; Y390-A394 WeakPolarHBondContact O-CB 3.36Å; Y390-A394 PolarHBondContact O-N 3.35Å; F391-A394 PolarHBondContact O-N 3.28Å; N392-A394 VanDerWaalsContact C-N 3.28Å; N392-A394 PolarHBondContact O-N 3.33Å; A394-S397 CarbonylContact O-C 3.57Å; A394-S397 WeakPolarHBondContact O-CB 3.46Å; A394-S397 PolarHBondContact O-N 2.89Å; A394-G398 PolarHBondContact O-N 2.82Å; A394-S399 WeakPolarHBondContact O-CB 3.34Å; A394-S399 PolarHBondContact O-N 3.34Å; A394-A402 HydrophobicContact CB-CB 3.49Å; A394-A402 VanDerWaalsContact CB-CB 3.49Å
395	A	95.4	Very high	94.3	Very high	13 Å²	13	44.2 Å²	44.2	11%	0.107	23%	0.226	C	C	.	.	H	α-helix	trans	-69.2	-37.3	178.6	0	0	0	0	0	112.2	F391 N392 S397 G398 A402 M403 L406	F391-A395 VanDerWaalsContact O-CB 3.25Å; F391-A395 WeakPolarHBondContact O-CB 3.23Å; F391-A395 PolarHBondContact O-N 3.15Å; N392-A395 PolarHBondContact O-N 3.37Å; N392-A395 VanDerWaalsContact O-N 3.15Å; A395-S397 PolarHBondContact O-N 3.22Å; A395-G398 PolarHBondContact O-N 3.03Å; A395-A402 HydrophobicContact CB-CB 4.12Å; A395-M403 HydrophobicContact CB-CG 3.89Å; A395-L406 HydrophobicContact CB-CD1 3.46Å; A395-L406 VanDerWaalsContact CB-CD1 3.46Å
396	E	94.3	Very high	94.5	Very high	159 Å²	159	37.7 Å²	37.7	74%	0.743	20%	0.195	S	C	*	.	H	α-helix	trans	-60.1	-31.7	170.7	-74.6	178.8	177.5	0	0	112.1	N392 G398	N392-E396 WeakPolarHBondContact O-CG 3.37Å; N392-E396 PolarHBondContact O-N 3.49Å; E396-G398 PolarHBondContact O-N 3.07Å
397	S	92.2	Very high	94.5	Very high	61 Å²	61	33.1 Å²	33.1	43%	0.427	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	5.7	174.5	-53.1	0	0	0	0	113.4	V363 L393 A394 A395	V363-S397 VanDerWaalsContact CG2-CB 3.47Å; L393-S397 PolarHBondContact O-N 3.37Å; L393-S397 PolarHBondContact O-OG 2.93Å; A394-S397 CarbonylContact O-C 3.57Å; A394-S397 WeakPolarHBondContact O-CB 3.46Å; A394-S397 PolarHBondContact O-N 2.89Å; A395-S397 PolarHBondContact O-N 3.22Å
398	G	91.6	Very high	94.4	Very high	40 Å²	40	33.4 Å²	33.4	41%	0.412	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.9	22.1	177.6	0	0	0	0	0	115	A394 A395 E396 A400	A394-G398 PolarHBondContact O-N 2.82Å; A395-G398 PolarHBondContact O-N 3.03Å; E396-G398 PolarHBondContact O-N 3.07Å; G398-A400 PolarHBondContact O-N 3.44Å
399	S	95.9	Very high	94.2	Very high	15 Å²	15	31.5 Å²	31.5	11%	0.105	17%	0.169	C	C	.	.			trans	-76	109.3	177.7	-176.5	0	0	0	0	112.5	V367 A394 I401 A402 M403	V367-S399 WeakPolarHBondContact CG2-OG 3.4Å; A394-S399 WeakPolarHBondContact O-CB 3.34Å; A394-S399 PolarHBondContact O-N 3.34Å; S399-I401 PolarHBondContact O-N 2.96Å; S399-A402 PolarHBondContact O-N 2.9Å; S399-A402 VanDerWaalsContact O-N 3.16Å; S399-A402 PolarHBondContact OG-N 3.46Å; S399-M403 WeakPolarHBondContact O-CG 3.41Å; S399-M403 PolarHBondContact O-N 3.34Å
400	A	95.7	Very high	94.1	Very high	17 Å²	17	25.9 Å²	25.9	14%	0.14	15%	0.147	C	C	.	.	H	α-helix	trans	-51.1	-40.4	171.6	0	0	0	0	0	113.3	G398 M403 A404 S431 E434 N436	G398-A400 PolarHBondContact O-N 3.44Å; A400-M403 PolarHBondContact O-N 3.16Å; A400-A404 PolarHBondContact O-N 2.61Å; A400-S431 WeakPolarHBondContact O-CB 3.49Å; A400-S431 PolarHBondContact O-OG 3.02Å; A400-E434 VanDerWaalsContact CA-OE2 3.26Å; A400-E434 WeakPolarHBondContact CA-OE2 3.49Å; A400-E434 HydrophobicContact CB-CB 3.79Å; A400-E434 WeakPolarHBondContact CB-OE2 3.29Å; A400-E434 PolarHBondContact N-OE2 3.12Å; A400-N436 HydrophobicContact CB-CB 3.92Å
401	I	94.6	Very high	93.8	Very high	65 Å²	65	25.9 Å²	25.9	33%	0.333	15%	0.148	S	C	.	.	H	α-helix	trans	-66.2	-48	-179	-63.1	168.4	0	0	0	109.7	V367 S399 M403 A404 Y405 N436 I438	V367-I401 HydrophobicContact CG1-CB 4.3Å; V367-I401 HydrophobicContact CG1-CG2 3.68Å; S399-I401 PolarHBondContact O-N 2.96Å; I401-M403 VanDerWaalsContact C-N 3.31Å; I401-M403 PolarHBondContact O-N 2.98Å; I401-A404 VanDerWaalsContact O-CB 3.29Å; I401-A404 WeakPolarHBondContact O-CB 3.42Å; I401-A404 PolarHBondContact O-N 3.19Å; I401-A404 VanDerWaalsContact O-N 3.1Å; I401-Y405 HydrophobicContact CG2-CD2 3.83Å; I401-Y405 HydrophobicContact CG2-CE2 3.53Å; I401-Y405 WeakPolarHBondContact O-CD2 3.31Å; I401-Y405 PolarHBondContact O-N 3.2Å; I401-Y405 VanDerWaalsContact O-N 3.13Å; I401-N436 VanDerWaalsContact CG1-ND2 3.35Å; I401-N436 WeakPolarHBondContact CG1-ND2 3.28Å; I401-I438 HydrophobicContact CG2-CD1 4.46Å
402	A	95.6	Very high	93.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-38.6	178.1	0	0	0	0	0	111.9	V367 F391 A394 A395 S399 A404 Y405 L406	V367-A402 HydrophobicContact CG2-CB 4.28Å; F391-A402 HydrophobicContact CB-CB 4.44Å; F391-A402 HydrophobicContact CD1-CB 4.23Å; F391-A402 WeakPolarHBondContact O-CB 3.37Å; A394-A402 HydrophobicContact CB-CB 3.49Å; A394-A402 VanDerWaalsContact CB-CB 3.49Å; A395-A402 HydrophobicContact CB-CB 4.12Å; S399-A402 PolarHBondContact O-N 2.9Å; S399-A402 VanDerWaalsContact O-N 3.16Å; S399-A402 PolarHBondContact OG-N 3.46Å; A402-A404 VanDerWaalsContact C-N 3.29Å; A402-A404 PolarHBondContact O-N 3.01Å; A402-Y405 PolarHBondContact O-N 3.19Å; A402-L406 WeakPolarHBondContact O-CG 3.42Å; A402-L406 PolarHBondContact O-N 3.21Å
403	M	96.6	Very high	92.7	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.059	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-38.3	172.6	-66.9	-171.5	-131.1	0	0	111.8	A395 S399 A400 I401 L406 G407 Y427 K430	A395-M403 HydrophobicContact CB-CG 3.89Å; S399-M403 WeakPolarHBondContact O-CG 3.41Å; S399-M403 PolarHBondContact O-N 3.34Å; A400-M403 PolarHBondContact O-N 3.16Å; I401-M403 VanDerWaalsContact C-N 3.31Å; I401-M403 PolarHBondContact O-N 2.98Å; M403-L406 PolarHBondContact O-N 3.38Å; M403-G407 PolarHBondContact O-N 3.01Å; M403-Y427 HydrophobicContact CB-CD1 4.2Å; M403-Y427 HydrophobicContact CG-CD1 4.07Å; M403-Y427 WeakPolarHBondContact O-CB 3.38Å; M403-K430 HydrophobicContact SD-CB 3.72Å; M403-K430 HydrophobicContact SD-CD 4Å
404	A	94.5	Very high	92	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-50.5	175.4	0	0	0	0	0	111.7	A400 I401 A402 G407 E408 S431 I438	A400-A404 PolarHBondContact O-N 2.61Å; I401-A404 VanDerWaalsContact O-CB 3.29Å; I401-A404 WeakPolarHBondContact O-CB 3.42Å; I401-A404 PolarHBondContact O-N 3.19Å; I401-A404 VanDerWaalsContact O-N 3.1Å; A402-A404 VanDerWaalsContact C-N 3.29Å; A402-A404 PolarHBondContact O-N 3.01Å; A404-G407 PolarHBondContact O-N 3.49Å; A404-E408 PolarHBondContact O-N 3.41Å; A404-S431 VanDerWaalsContact CB-OG 3.31Å; A404-S431 WeakPolarHBondContact CB-OG 3.2Å; A404-I438 HydrophobicContact CB-CB 3.66Å; A404-I438 HydrophobicContact CB-CG2 3.66Å
405	Y	93.2	Very high	91.2	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-44	178.8	-77.3	-70.5	0	0	0	112.3	T318 Q371 Y374 Y375 F391 I401 A402 G407 E408 M409 I438	T318-Y405 HydrophobicContact CG2-CD1 4.31Å; T318-Y405 HydrophobicContact CG2-CE1 3.69Å; T318-Y405 WeakPolarHBondContact OG1-CE1 3.29Å; Q371-Y405 HydrophobicContact CG-CE2 3.8Å; Q371-Y405 VanDerWaalsContact NE2-CE2 3.35Å; Q371-Y405 PolarHBondContact NE2-OH 3.36Å; Y374-Y405 HydrophobicContact CD1-CD1 4.24Å; Y374-Y405 HydrophobicContact CD1-CE1 4.17Å; Y374-Y405 HydrophobicContact CE1-CD1 4.24Å; Y374-Y405 HydrophobicContact CE1-CE1 4.26Å; Y375-Y405 WeakPolarHBondContact OH-CE1 3.31Å; Y375-Y405 PolarHBondContact OH-OH 3.07Å; F391-Y405 HydrophobicContact CD1-CD2 4.29Å; F391-Y405 HydrophobicContact CD1-CG 4.41Å; F391-Y405 AromaticContact CE1-CD2 3.59Å; F391-Y405 HydrophobicContact CE1-CD2 3.59Å; F391-Y405 HydrophobicContact CE1-CE2 4.27Å; F391-Y405 AromaticContact CE1-CG 3.8Å; F391-Y405 HydrophobicContact CE1-CG 3.8Å; F391-Y405 HydrophobicContact CE2-CD1 4.22Å; F391-Y405 AromaticContact CE2-CG 3.91Å; F391-Y405 HydrophobicContact CE2-CG 3.91Å; F391-Y405 AromaticContact CZ-CD1 3.91Å; F391-Y405 HydrophobicContact CZ-CD1 3.91Å; F391-Y405 AromaticContact CZ-CD2 3.73Å; F391-Y405 HydrophobicContact CZ-CD2 3.73Å; F391-Y405 HydrophobicContact CZ-CE1 4.47Å; F391-Y405 HydrophobicContact CZ-CE2 4.33Å; F391-Y405 AromaticContact CZ-CG 3.51Å; F391-Y405 HydrophobicContact CZ-CG 3.51Å; I401-Y405 HydrophobicContact CG2-CD2 3.83Å; I401-Y405 HydrophobicContact CG2-CE2 3.53Å; I401-Y405 WeakPolarHBondContact O-CD2 3.31Å; I401-Y405 PolarHBondContact O-N 3.2Å; I401-Y405 VanDerWaalsContact O-N 3.13Å; A402-Y405 PolarHBondContact O-N 3.19Å; Y405-G407 VanDerWaalsContact C-N 3.3Å; Y405-G407 PolarHBondContact O-N 3.06Å; Y405-E408 PolarHBondContact O-N 3.21Å; Y405-M409 WeakPolarHBondContact O-CB 3.36Å; Y405-M409 WeakPolarHBondContact O-CG 3.17Å; Y405-M409 PolarHBondContact O-N 3.44Å; Y405-I438 HydrophobicContact CE2-CD1 4.04Å
406	L	94	Very high	90.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-43.2	174.6	-70.8	172.9	0	0	0	111.4	F388 F391 A395 A402 M403 E408 M409 Y410 Y427	F388-L406 HydrophobicContact CD2-CD2 3.67Å; F388-L406 HydrophobicContact CE2-CD2 3.78Å; F391-L406 HydrophobicContact CB-CD2 3.77Å; F391-L406 HydrophobicContact CB-CG 3.89Å; A395-L406 HydrophobicContact CB-CD1 3.46Å; A395-L406 VanDerWaalsContact CB-CD1 3.46Å; A402-L406 WeakPolarHBondContact O-CG 3.42Å; A402-L406 PolarHBondContact O-N 3.21Å; M403-L406 PolarHBondContact O-N 3.38Å; L406-E408 VanDerWaalsContact C-N 3.3Å; L406-E408 PolarHBondContact O-N 3.35Å; L406-M409 PolarHBondContact O-N 3.28Å; L406-Y410 WeakPolarHBondContact O-CD2 3.26Å; L406-Y410 PolarHBondContact O-N 3.49Å; L406-Y427 HydrophobicContact CB-CD2 4.26Å; L406-Y427 HydrophobicContact CB-CG 4.25Å; L406-Y427 HydrophobicContact CD1-CD1 4.47Å; L406-Y427 HydrophobicContact CD1-CE1 4.14Å
407	G	92.7	Very high	90.1	Very high	0 Å²	0	29 Å²	29	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.9	-44.2	176.6	0	0	0	0	0	112.5	M403 A404 Y405 M411 A424	M403-G407 PolarHBondContact O-N 3.01Å; A404-G407 PolarHBondContact O-N 3.49Å; Y405-G407 VanDerWaalsContact C-N 3.3Å; Y405-G407 PolarHBondContact O-N 3.06Å; G407-M411 WeakPolarHBondContact O-CB 3.45Å; G407-M411 PolarHBondContact O-N 3.28Å; G407-A424 VanDerWaalsContact O-CB 3.3Å; G407-A424 WeakPolarHBondContact O-CB 3.27Å
408	E	88.7	Confident	89.9	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.028	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-45.6	175.6	-179.5	172.5	172.1	0	0	112.9	G316 P317 T318 Y374 A404 Y405 L406 Y410 M411 V412	G316-E408 WeakPolarHBondContact CA-OE1 3.38Å; P317-E408 VanDerWaalsContact CD-CD 3.44Å; P317-E408 VanDerWaalsContact CD-OE1 3.27Å; P317-E408 WeakPolarHBondContact CD-OE1 2.91Å; T318-E408 WeakPolarHBondContact CB-OE2 3.49Å; T318-E408 WeakPolarHBondContact CG2-OE2 3.47Å; T318-E408 PolarHBondContact N-OE1 2.91Å; T318-E408 PolarHBondContact OG1-OE1 3.2Å; T318-E408 PolarHBondContact OG1-OE2 3.29Å; Y374-E408 PolarHBondContact OH-OE1 3.32Å; A404-E408 PolarHBondContact O-N 3.41Å; Y405-E408 PolarHBondContact O-N 3.21Å; L406-E408 VanDerWaalsContact C-N 3.3Å; L406-E408 PolarHBondContact O-N 3.35Å; E408-Y410 VanDerWaalsContact C-N 3.31Å; E408-Y410 PolarHBondContact O-N 3.48Å; E408-M411 WeakPolarHBondContact O-CA 3.47Å; E408-M411 WeakPolarHBondContact O-CB 3.43Å; E408-M411 PolarHBondContact O-N 3.18Å; E408-V412 HydrophobicContact CG-CG2 4.45Å; E408-V412 WeakPolarHBondContact O-CB 3.49Å; E408-V412 PolarHBondContact O-N 3.41Å
409	M	89.8	Confident	89.9	Confident	10 Å²	10	31.9 Å²	31.9	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-42.9	177.3	-70.1	178.6	84.3	0	0	111.7	Y374 H384 F388 F391 Y405 L406 M411 G413 V417	Y374-M409 HydrophobicContact CD2-CE 4.39Å; Y374-M409 HydrophobicContact CD2-CG 4.41Å; Y374-M409 HydrophobicContact CD2-SD 4.31Å; Y374-M409 HydrophobicContact CE2-CE 4.48Å; Y374-M409 HydrophobicContact CE2-CG 3.84Å; Y374-M409 HydrophobicContact CE2-SD 4.32Å; H384-M409 HydrophobicContact CB-CE 4.35Å; H384-M409 WeakPolarHBondContact O-CE 3.29Å; F388-M409 HydrophobicContact CB-CE 3.75Å; F388-M409 HydrophobicContact CB-SD 4.44Å; F388-M409 HydrophobicContact CD2-CE 4.26Å; F388-M409 HydrophobicContact CD2-SD 4.36Å; F388-M409 HydrophobicContact CG-CE 4.5Å; F391-M409 HydrophobicContact CD2-SD 3.8Å; F391-M409 HydrophobicContact CE2-SD 4.2Å; Y405-M409 WeakPolarHBondContact O-CB 3.36Å; Y405-M409 WeakPolarHBondContact O-CG 3.17Å; Y405-M409 PolarHBondContact O-N 3.44Å; L406-M409 PolarHBondContact O-N 3.28Å; M409-M411 VanDerWaalsContact C-N 3.34Å; M409-G413 PolarHBondContact O-N 2.92Å; M409-V417 HydrophobicContact CE-CG2 4.12Å
410	Y	92.6	Very high	89.8	Confident	27 Å²	27	33 Å²	33	11%	0.106	21%	0.212	C	C	.	.	H	α-helix	trans	-71.5	-26.1	174	-75.6	-61.3	0	0	0	113.5	F388 L406 E408 V417 A419 D420 K423 Y427	F388-Y410 HydrophobicContact CE2-CE1 4.26Å; F388-Y410 HydrophobicContact CE2-CE2 4.02Å; F388-Y410 AromaticContact CE2-CZ 3.69Å; F388-Y410 HydrophobicContact CZ-CE1 4.47Å; F388-Y410 AromaticContact CZ-CZ 3.89Å; F388-Y410 VanDerWaalsContact CZ-OH 3.29Å; F388-Y410 WeakPolarHBondContact CZ-OH 3.25Å; L406-Y410 WeakPolarHBondContact O-CD2 3.26Å; L406-Y410 PolarHBondContact O-N 3.49Å; E408-Y410 VanDerWaalsContact C-N 3.31Å; E408-Y410 PolarHBondContact O-N 3.48Å; Y410-V417 HydrophobicContact CD1-CG1 4.01Å; Y410-V417 HydrophobicContact CE1-CG1 4Å; Y410-A419 CarbonylContact O-C 3.48Å; Y410-A419 VanDerWaalsContact O-CA 3.25Å; Y410-A419 WeakPolarHBondContact O-CA 3.33Å; Y410-D420 HydrophobicContact CD1-CB 3.88Å; Y410-D420 PolarHBondContact O-N 2.96Å; Y410-K423 HydrophobicContact CD1-CB 4.38Å; Y410-K423 HydrophobicContact CD1-CD 4.43Å; Y410-K423 HydrophobicContact CD2-CB 3.98Å; Y410-K423 HydrophobicContact CE1-CD 3.91Å; Y410-K423 HydrophobicContact CE2-CB 4.23Å; Y410-K423 HydrophobicContact CE2-CD 4.27Å; Y410-K423 HydrophobicContact CG-CB 4.07Å; Y410-Y427 AromaticContact CD2-CD2 3.9Å; Y410-Y427 HydrophobicContact CD2-CD2 3.9Å; Y410-Y427 HydrophobicContact CD2-CE2 4.07Å; Y410-Y427 AromaticContact CE2-CD2 3.92Å; Y410-Y427 HydrophobicContact CE2-CD2 3.92Å; Y410-Y427 AromaticContact CE2-CE2 3.6Å; Y410-Y427 HydrophobicContact CE2-CE2 3.6Å
411	M	88.5	Confident	89.6	Confident	36 Å²	36	34.8 Å²	34.8	18%	0.177	22%	0.223	C	C	.	.	H	α-helix	trans	-72.5	-44.2	177.6	-171	68.1	71.1	0	0	111.2	G407 E408 M409 A424 L425 L428 A446 R451 A452	G407-M411 WeakPolarHBondContact O-CB 3.45Å; G407-M411 PolarHBondContact O-N 3.28Å; E408-M411 WeakPolarHBondContact O-CA 3.47Å; E408-M411 WeakPolarHBondContact O-CB 3.43Å; E408-M411 PolarHBondContact O-N 3.18Å; M409-M411 VanDerWaalsContact C-N 3.34Å; M411-A424 HydrophobicContact CB-CB 4.02Å; M411-A424 HydrophobicContact CE-CB 3.85Å; M411-A424 HydrophobicContact SD-CB 4.31Å; M411-L425 HydrophobicContact CE-CD2 3.99Å; M411-L425 HydrophobicContact CE-CG 4.46Å; M411-L428 HydrophobicContact CE-CD1 3.58Å; M411-A446 HydrophobicContact CE-CB 4.18Å; M411-R451 HydrophobicContact SD-CB 4.28Å; M411-A452 HydrophobicContact CE-CB 3.94Å; M411-A452 HydrophobicContact SD-CB 3.7Å
412	V	84.8	Confident	89.6	Confident	50 Å²	50	36.9 Å²	36.9	30%	0.303	24%	0.239	S	C	.	.	H	α-helix	trans	-78.5	-50.2	-176.6	165.1	0	0	0	0	111.1	S314 E408	S314-V412 WeakPolarHBondContact O-CG1 3.43Å; E408-V412 HydrophobicContact CG-CG2 4.45Å; E408-V412 WeakPolarHBondContact O-CB 3.49Å; E408-V412 PolarHBondContact O-N 3.41Å
413	G	84.7	Confident	89.5	Confident	23 Å²	23	41.2 Å²	41.2	24%	0.237	26%	0.258	C	S	.	.			trans	74.5	140.8	-172.2	0	0	0	0	0	113.6	M409 V417	M409-G413 PolarHBondContact O-N 2.92Å; G413-V417 CarbonylContact C-O 3.16Å; G413-V417 VanDerWaalsContact CA-O 3.3Å; G413-V417 WeakPolarHBondContact CA-O 3.3Å
414	S	80.1	Confident	89.3	Confident	38 Å²	38	40.6 Å²	40.6	27%	0.266	26%	0.255	S	S	.	.			trans	-143	174.9	171.4	72.4	0	0	0	0	110.2	A416 V417	S414-A416 PolarHBondContact O-N 2.89Å; S414-V417 PolarHBondContact N-O 2.92Å; S414-V417 CarbonylContact O-C 3.53Å; S414-V417 PolarHBondContact O-N 2.66Å; S414-V417 VanDerWaalsContact O-N 3.15Å; S414-V417 VanDerWaalsContact O-O 3.1Å; S414-V417 PolarHBondContact OG-N 3.3Å
415	T	79.3	Confident	89.3	Confident	154 Å²	154	41.8 Å²	41.8	95%	0.945	26%	0.261	S	S	*	.	S	Bend	trans	-54.2	-40.5	174.4	51.2	0	0	0	0	112.6
416	A	79.6	Confident	89.4	Confident	47 Å²	47	47.7 Å²	47.7	39%	0.388	29%	0.287	S	S	.	.	S	Bend	trans	-75.2	-32.4	177	0	0	0	0	0	114.6	H384 E385 S414	H384-A416 HydrophobicContact CB-CB 4.39Å; E385-A416 HydrophobicContact CB-CB 4.2Å; S414-A416 PolarHBondContact O-N 2.89Å
417	V	87	Confident	89.5	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.018	30%	0.297	C	S	.	.	S	Bend	trans	-135.6	96.7	-174.2	-177.1	0	0	0	0	108.5	F388 M409 Y410 G413 S414	F388-V417 HydrophobicContact CB-CG2 3.83Å; F388-V417 HydrophobicContact CD1-CG2 4.18Å; F388-V417 HydrophobicContact CD2-CB 4.43Å; F388-V417 HydrophobicContact CD2-CG1 3.93Å; F388-V417 HydrophobicContact CD2-CG2 3.57Å; F388-V417 HydrophobicContact CE2-CG1 3.75Å; F388-V417 HydrophobicContact CE2-CG2 4.1Å; F388-V417 HydrophobicContact CG-CG2 3.6Å; F388-V417 HydrophobicContact CZ-CG1 4.4Å; M409-V417 HydrophobicContact CE-CG2 4.12Å; Y410-V417 HydrophobicContact CD1-CG1 4.01Å; Y410-V417 HydrophobicContact CE1-CG1 4Å; G413-V417 CarbonylContact C-O 3.16Å; G413-V417 VanDerWaalsContact CA-O 3.3Å; G413-V417 WeakPolarHBondContact CA-O 3.3Å; S414-V417 PolarHBondContact N-O 2.92Å; S414-V417 CarbonylContact O-C 3.53Å; S414-V417 PolarHBondContact O-N 2.66Å; S414-V417 VanDerWaalsContact O-N 3.15Å; S414-V417 VanDerWaalsContact O-O 3.1Å; S414-V417 PolarHBondContact OG-N 3.3Å
418	P	89.6	Confident	89.6	Confident	97 Å²	97	50.6 Å²	50.6	63%	0.63	30%	0.298	S	S	*	.			trans	-59.1	146.7	-179.8	-24.9	34.3	0	0	0	112.4	D420	P418-D420 PolarHBondContact O-N 3.5Å
419	A	90.2	Very high	90	Very high	65 Å²	65	53.4 Å²	53.4	54%	0.537	31%	0.312	S	S	.	.			trans	-61.4	133.2	175.4	0	0	0	0	0	111	Y410	Y410-A419 CarbonylContact O-C 3.48Å; Y410-A419 VanDerWaalsContact O-CA 3.25Å; Y410-A419 WeakPolarHBondContact O-CA 3.33Å
420	D	93.4	Very high	90.2	Very high	39 Å²	39	57.2 Å²	57.2	21%	0.209	33%	0.328	C	S	.	.			trans	-142.9	92.7	176.6	-176	-24.8	0	0	0	108.7	Y410 P418 T422 K423 A424	Y410-D420 HydrophobicContact CD1-CB 3.88Å; Y410-D420 PolarHBondContact O-N 2.96Å; P418-D420 PolarHBondContact O-N 3.5Å; D420-T422 PolarHBondContact O-N 3.29Å; D420-T422 VanDerWaalsContact O-N 3.14Å; D420-T422 PolarHBondContact OD1-N 3.43Å; D420-T422 VanDerWaalsContact OD1-N 3.16Å; D420-T422 PolarHBondContact OD1-OG1 2.89Å; D420-K423 HydrophobicContact CB-CB 4.2Å; D420-K423 HydrophobicContact CB-CD 4.39Å; D420-K423 HydrophobicContact CB-CG 4.49Å; D420-K423 PolarHBondContact O-N 3.12Å; D420-K423 PolarHBondContact OD1-N 3.44Å; D420-K423 VanDerWaalsContact OD1-N 3.11Å; D420-K423 WeakPolarHBondContact OD2-CD 3.38Å; D420-K423 WeakPolarHBondContact OD2-CE 3.24Å; D420-K423 WeakPolarHBondContact OD2-CG 3.46Å; D420-K423 IonicContact OD2-NZ 3.88Å; D420-K423 PolarHBondContact OD2-NZ 3.42Å; D420-A424 VanDerWaalsContact O-CB 3.28Å; D420-A424 WeakPolarHBondContact O-CB 3.32Å; D420-A424 PolarHBondContact O-N 2.87Å
421	S	92	Very high	90.4	Very high	55 Å²	55	56 Å²	56	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-55.4	-33.6	-176.9	-58.6	0	0	0	0	113.2	L425	S421-L425 WeakPolarHBondContact O-CG 3.43Å; S421-L425 PolarHBondContact O-N 3.06Å; S421-L425 VanDerWaalsContact O-N 3.08Å
422	T	94.2	Very high	90.7	Very high	109 Å²	109	55 Å²	55	67%	0.669	32%	0.32	S	S	*	.	H	α-helix	trans	-72.8	-44.8	-178.1	67.5	0	0	0	0	111.8	D420 K426	D420-T422 PolarHBondContact O-N 3.29Å; D420-T422 VanDerWaalsContact O-N 3.14Å; D420-T422 PolarHBondContact OD1-N 3.43Å; D420-T422 VanDerWaalsContact OD1-N 3.16Å; D420-T422 PolarHBondContact OD1-OG1 2.89Å; T422-K426 WeakPolarHBondContact O-CB 3.37Å; T422-K426 PolarHBondContact O-N 3.24Å; T422-K426 VanDerWaalsContact O-N 3.08Å
423	K	93.8	Very high	91.2	Very high	90 Å²	90	60 Å²	60	39%	0.391	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-40.2	173.9	-72.9	-178.9	-163.5	134.8	0	111.3	Y410 D420 L425 K426 Y427	Y410-K423 HydrophobicContact CD1-CB 4.38Å; Y410-K423 HydrophobicContact CD1-CD 4.43Å; Y410-K423 HydrophobicContact CD2-CB 3.98Å; Y410-K423 HydrophobicContact CE1-CD 3.91Å; Y410-K423 HydrophobicContact CE2-CB 4.23Å; Y410-K423 HydrophobicContact CE2-CD 4.27Å; Y410-K423 HydrophobicContact CG-CB 4.07Å; D420-K423 HydrophobicContact CB-CB 4.2Å; D420-K423 HydrophobicContact CB-CD 4.39Å; D420-K423 HydrophobicContact CB-CG 4.49Å; D420-K423 PolarHBondContact O-N 3.12Å; D420-K423 PolarHBondContact OD1-N 3.44Å; D420-K423 VanDerWaalsContact OD1-N 3.11Å; D420-K423 WeakPolarHBondContact OD2-CD 3.38Å; D420-K423 WeakPolarHBondContact OD2-CE 3.24Å; D420-K423 WeakPolarHBondContact OD2-CG 3.46Å; D420-K423 IonicContact OD2-NZ 3.88Å; D420-K423 PolarHBondContact OD2-NZ 3.42Å; K423-L425 PolarHBondContact O-N 3.26Å; K423-K426 PolarHBondContact O-N 3.42Å; K423-Y427 HydrophobicContact CB-CD2 4.4Å; K423-Y427 HydrophobicContact CB-CE2 4.44Å; K423-Y427 WeakPolarHBondContact O-CD2 3.42Å; K423-Y427 PolarHBondContact O-N 3.3Å
424	A	93	Very high	91.7	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-53.3	-56.3	177.3	0	0	0	0	0	111	G407 M411 D420 K426 Y427 L428	G407-A424 VanDerWaalsContact O-CB 3.3Å; G407-A424 WeakPolarHBondContact O-CB 3.27Å; M411-A424 HydrophobicContact CB-CB 4.02Å; M411-A424 HydrophobicContact CE-CB 3.85Å; M411-A424 HydrophobicContact SD-CB 4.31Å; D420-A424 VanDerWaalsContact O-CB 3.28Å; D420-A424 WeakPolarHBondContact O-CB 3.32Å; D420-A424 PolarHBondContact O-N 2.87Å; A424-K426 PolarHBondContact O-N 2.86Å; A424-Y427 PolarHBondContact O-N 3.02Å; A424-L428 WeakPolarHBondContact O-CB 3.42Å; A424-L428 VanDerWaalsContact O-CG 3.31Å; A424-L428 WeakPolarHBondContact O-CG 3.28Å; A424-L428 PolarHBondContact O-N 2.84Å
425	L	94.8	Very high	92.4	Very high	25 Å²	25	66.2 Å²	66.2	13%	0.131	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-40.2	178.5	-69	177.4	0	0	0	112.3	M411 S421 K423 Y427 L428 H429 L443 A446 A452 L454	M411-L425 HydrophobicContact CE-CD2 3.99Å; M411-L425 HydrophobicContact CE-CG 4.46Å; S421-L425 WeakPolarHBondContact O-CG 3.43Å; S421-L425 PolarHBondContact O-N 3.06Å; S421-L425 VanDerWaalsContact O-N 3.08Å; K423-L425 PolarHBondContact O-N 3.26Å; L425-Y427 VanDerWaalsContact C-N 3.35Å; L425-Y427 PolarHBondContact O-N 3.12Å; L425-L428 PolarHBondContact O-N 3.26Å; L425-H429 WeakPolarHBondContact O-CB 3.4Å; L425-H429 PolarHBondContact O-CD2 2.71Å; L425-H429 PolarHBondContact O-N 2.84Å; L425-L443 HydrophobicContact CD2-CD1 4.31Å; L425-A446 HydrophobicContact CD2-CB 4.26Å; L425-A452 HydrophobicContact CD1-CB 3.78Å; L425-A452 HydrophobicContact CD2-CB 4.14Å; L425-A452 HydrophobicContact CG-CB 3.85Å; L425-L454 HydrophobicContact CD1-CD1 4.21Å; L425-L454 HydrophobicContact CD1-CD2 4.11Å; L425-L454 HydrophobicContact CD1-CG 3.96Å; L425-L454 HydrophobicContact CD2-CD1 3.56Å; L425-L454 HydrophobicContact CD2-CG 4.22Å
426	K	95.5	Very high	93.1	Very high	128 Å²	128	59.5 Å²	59.5	56%	0.557	32%	0.321	S	S	*	.	H	α-helix	trans	-58.6	-45.3	177.4	-177	-178.6	-179.3	-179.5	0	112.1	T422 K423 A424 K430	T422-K426 WeakPolarHBondContact O-CB 3.37Å; T422-K426 PolarHBondContact O-N 3.24Å; T422-K426 VanDerWaalsContact O-N 3.08Å; K423-K426 PolarHBondContact O-N 3.42Å; A424-K426 PolarHBondContact O-N 2.86Å; K426-K430 WeakPolarHBondContact O-CG 3.16Å; K426-K430 PolarHBondContact O-N 3.27Å
427	Y	95.6	Very high	93.9	Very high	55 Å²	55	58.3 Å²	58.3	22%	0.216	31%	0.309	C	S	.	.	H	α-helix	trans	-72.4	-41.1	178.9	-78.9	-63.8	0	0	0	112.4	M403 L406 Y410 K423 A424 L425 K430 S431	M403-Y427 HydrophobicContact CB-CD1 4.2Å; M403-Y427 HydrophobicContact CG-CD1 4.07Å; M403-Y427 WeakPolarHBondContact O-CB 3.38Å; L406-Y427 HydrophobicContact CB-CD2 4.26Å; L406-Y427 HydrophobicContact CB-CG 4.25Å; L406-Y427 HydrophobicContact CD1-CD1 4.47Å; L406-Y427 HydrophobicContact CD1-CE1 4.14Å; Y410-Y427 AromaticContact CD2-CD2 3.9Å; Y410-Y427 HydrophobicContact CD2-CD2 3.9Å; Y410-Y427 HydrophobicContact CD2-CE2 4.07Å; Y410-Y427 AromaticContact CE2-CD2 3.92Å; Y410-Y427 HydrophobicContact CE2-CD2 3.92Å; Y410-Y427 AromaticContact CE2-CE2 3.6Å; Y410-Y427 HydrophobicContact CE2-CE2 3.6Å; K423-Y427 HydrophobicContact CB-CD2 4.4Å; K423-Y427 HydrophobicContact CB-CE2 4.44Å; K423-Y427 WeakPolarHBondContact O-CD2 3.42Å; K423-Y427 PolarHBondContact O-N 3.3Å; A424-Y427 PolarHBondContact O-N 3.02Å; L425-Y427 VanDerWaalsContact C-N 3.35Å; L425-Y427 PolarHBondContact O-N 3.12Å; Y427-K430 PolarHBondContact O-N 3.22Å; Y427-S431 WeakPolarHBondContact O-CB 3.15Å; Y427-S431 PolarHBondContact O-N 3.37Å
428	L	94.7	Very high	94.1	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-42.1	175.7	-72	173.2	0	0	0	112.3	M411 A424 L425 S431 A432	M411-L428 HydrophobicContact CE-CD1 3.58Å; A424-L428 WeakPolarHBondContact O-CB 3.42Å; A424-L428 VanDerWaalsContact O-CG 3.31Å; A424-L428 WeakPolarHBondContact O-CG 3.28Å; A424-L428 PolarHBondContact O-N 2.84Å; L425-L428 PolarHBondContact O-N 3.26Å; L428-S431 PolarHBondContact O-N 3.1Å; L428-A432 VanDerWaalsContact O-CB 3.26Å; L428-A432 WeakPolarHBondContact O-CB 3.46Å; L428-A432 PolarHBondContact O-N 2.91Å
429	H	95.9	Very high	94.3	Very high	66 Å²	66	54.1 Å²	54.1	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-61.1	-50.8	175.5	-86.7	-65.3	0	0	0	111.8	L425 S431 A432 E433	L425-H429 WeakPolarHBondContact O-CB 3.4Å; L425-H429 PolarHBondContact O-CD2 2.71Å; L425-H429 PolarHBondContact O-N 2.84Å; H429-S431 VanDerWaalsContact C-N 3.3Å; H429-S431 PolarHBondContact O-N 2.8Å; H429-A432 PolarHBondContact O-N 3.37Å; H429-E433 WeakPolarHBondContact O-CB 3.46Å; H429-E433 VanDerWaalsContact O-CG 3.32Å; H429-E433 WeakPolarHBondContact O-CG 3.45Å; H429-E433 PolarHBondContact O-N 3.12Å
430	K	95.8	Very high	94.6	Very high	90 Å²	90	51.2 Å²	51.2	39%	0.391	26%	0.256	S	S	.	.	H	α-helix	trans	-57	-45	176.9	-74.1	-179.7	172	-161.8	0	112.2	M403 K426 Y427 E433 E434	M403-K430 HydrophobicContact SD-CB 3.72Å; M403-K430 HydrophobicContact SD-CD 4Å; K426-K430 WeakPolarHBondContact O-CG 3.16Å; K426-K430 PolarHBondContact O-N 3.27Å; Y427-K430 PolarHBondContact O-N 3.22Å; K430-E433 PolarHBondContact O-N 2.72Å; K430-E434 PolarHBondContact O-N 3.11Å; K430-E434 VanDerWaalsContact O-N 3.11Å
431	S	96.2	Very high	94.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-45.3	177.6	-174.8	0	0	0	0	111.8	A400 A404 Y427 L428 H429 E433 E434 N436	A400-S431 WeakPolarHBondContact O-CB 3.49Å; A400-S431 PolarHBondContact O-OG 3.02Å; A404-S431 VanDerWaalsContact CB-OG 3.31Å; A404-S431 WeakPolarHBondContact CB-OG 3.2Å; Y427-S431 WeakPolarHBondContact O-CB 3.15Å; Y427-S431 PolarHBondContact O-N 3.37Å; L428-S431 PolarHBondContact O-N 3.1Å; H429-S431 VanDerWaalsContact C-N 3.3Å; H429-S431 PolarHBondContact O-N 2.8Å; S431-E433 PolarHBondContact O-N 3.43Å; S431-E434 PolarHBondContact O-N 3.18Å; S431-N436 WeakPolarHBondContact O-CB 3.44Å; S431-N436 PolarHBondContact O-N 2.65Å; S431-N436 VanDerWaalsContact OG-CB 3.27Å; S431-N436 WeakPolarHBondContact OG-CB 3.38Å; S431-N436 PolarHBondContact OG-OD1 3.46Å
432	A	95.3	Very high	94.7	Very high	15 Å²	15	47.2 Å²	47.2	12%	0.124	23%	0.233	C	C	.	.	H	α-helix	trans	-66.8	-34.8	178.6	0	0	0	0	0	113.1	L428 H429 N435 Q440 L443	L428-A432 VanDerWaalsContact O-CB 3.26Å; L428-A432 WeakPolarHBondContact O-CB 3.46Å; L428-A432 PolarHBondContact O-N 2.91Å; H429-A432 PolarHBondContact O-N 3.37Å; A432-N435 WeakPolarHBondContact O-CA 3.35Å; A432-N435 PolarHBondContact O-N 2.96Å; A432-Q440 HydrophobicContact CB-CG 3.91Å; A432-L443 HydrophobicContact CB-CD2 4.25Å
433	E	95.2	Very high	94.6	Very high	155 Å²	155	42.4 Å²	42.4	72%	0.724	20%	0.203	S	C	*	.	H	α-helix	trans	-65	-37	173.9	-76.9	174	179.8	0	0	112.2	H429 K430 S431 N435	H429-E433 WeakPolarHBondContact O-CB 3.46Å; H429-E433 VanDerWaalsContact O-CG 3.32Å; H429-E433 WeakPolarHBondContact O-CG 3.45Å; H429-E433 PolarHBondContact O-N 3.12Å; K430-E433 PolarHBondContact O-N 2.72Å; S431-E433 PolarHBondContact O-N 3.43Å; E433-N435 PolarHBondContact O-N 3.3Å
434	E	94.5	Very high	94.7	Very high	101 Å²	101	38.1 Å²	38.1	47%	0.472	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	15.1	170.2	-68.5	-178.1	-171.1	0	0	112.9	A400 K430 S431 N436	A400-E434 VanDerWaalsContact CA-OE2 3.26Å; A400-E434 WeakPolarHBondContact CA-OE2 3.49Å; A400-E434 HydrophobicContact CB-CB 3.79Å; A400-E434 WeakPolarHBondContact CB-OE2 3.29Å; A400-E434 PolarHBondContact N-OE2 3.12Å; K430-E434 PolarHBondContact O-N 3.11Å; K430-E434 VanDerWaalsContact O-N 3.11Å; S431-E434 PolarHBondContact O-N 3.18Å; E434-N436 PolarHBondContact O-N 3.17Å
435	N	94.5	Very high	94.6	Very high	91 Å²	91	38.6 Å²	38.6	49%	0.487	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	25.4	179.8	-164.2	43.2	0	0	0	114.2	A432 E433 Q440 Q471	A432-N435 WeakPolarHBondContact O-CA 3.35Å; A432-N435 PolarHBondContact O-N 2.96Å; E433-N435 PolarHBondContact O-N 3.3Å; N435-Q440 PolarHBondContact OD1-NE2 3.25Å; N435-Q471 PolarHBondContact O-NE2 3.31Å; N435-Q471 PolarHBondContact O-OE1 3.48Å; N435-Q471 PolarHBondContact OD1-NE2 3.11Å
436	N	94.8	Very high	94.4	Very high	14 Å²	14	37.5 Å²	37.5	8%	0.075	18%	0.182	C	C	.	.			trans	-75.3	129.9	177.7	-176.5	-86.2	0	0	0	111.6	A400 I401 S431 E434 I438 G439 Q440	A400-N436 HydrophobicContact CB-CB 3.92Å; I401-N436 VanDerWaalsContact CG1-ND2 3.35Å; I401-N436 WeakPolarHBondContact CG1-ND2 3.28Å; S431-N436 WeakPolarHBondContact O-CB 3.44Å; S431-N436 PolarHBondContact O-N 2.65Å; S431-N436 VanDerWaalsContact OG-CB 3.27Å; S431-N436 WeakPolarHBondContact OG-CB 3.38Å; S431-N436 PolarHBondContact OG-OD1 3.46Å; E434-N436 PolarHBondContact O-N 3.17Å; N436-I438 PolarHBondContact O-N 2.93Å; N436-I438 WeakPolarHBondContact OD1-CA 3.3Å; N436-I438 VanDerWaalsContact OD1-CB 3.23Å; N436-I438 WeakPolarHBondContact OD1-CB 3.35Å; N436-I438 PolarHBondContact OD1-N 3.4Å; N436-G439 PolarHBondContact O-N 3.5Å; N436-G439 PolarHBondContact OD1-N 3.14Å; N436-Q440 VanDerWaalsContact O-CG 3.26Å; N436-Q440 WeakPolarHBondContact O-CG 3.45Å; N436-Q440 PolarHBondContact O-N 3.05Å
437	P	95.2	Very high	94.3	Very high	22 Å²	22	33.3 Å²	33.3	14%	0.143	16%	0.162	C	C	.	.	H	α-helix	trans	-72.7	-28	-175.2	27.8	-33	0	0	0	113.3	T441 A468 Q471 W473	P437-T441 WeakPolarHBondContact O-CB 3.24Å; P437-T441 PolarHBondContact O-N 3.01Å; P437-T441 PolarHBondContact O-OG1 3.26Å; P437-A468 HydrophobicContact CB-CB 3.95Å; P437-A468 WeakPolarHBondContact O-CB 3.47Å; P437-Q471 HydrophobicContact CB-CB 4.15Å; P437-Q471 HydrophobicContact CG-CB 4.41Å; P437-W473 HydrophobicContact CB-CB 3.78Å; P437-W473 HydrophobicContact CB-CG 4.15Å; P437-W473 HydrophobicContact CG-CB 4.46Å
438	I	92.6	Very high	94	Very high	11 Å²	11	30.9 Å²	30.9	6%	0.056	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-47.9	176.2	-51.7	176.2	0	0	0	109	T318 I401 A404 Y405 N436 Q440 T441 G442 W473	T318-I438 HydrophobicContact CG2-CG2 3.46Å; T318-I438 VanDerWaalsContact CG2-CG2 3.46Å; I401-I438 HydrophobicContact CG2-CD1 4.46Å; A404-I438 HydrophobicContact CB-CB 3.66Å; A404-I438 HydrophobicContact CB-CG2 3.66Å; Y405-I438 HydrophobicContact CE2-CD1 4.04Å; N436-I438 PolarHBondContact O-N 2.93Å; N436-I438 WeakPolarHBondContact OD1-CA 3.3Å; N436-I438 VanDerWaalsContact OD1-CB 3.23Å; N436-I438 WeakPolarHBondContact OD1-CB 3.35Å; N436-I438 PolarHBondContact OD1-N 3.4Å; I438-Q440 PolarHBondContact O-N 3.14Å; I438-T441 PolarHBondContact O-N 3.32Å; I438-G442 PolarHBondContact O-N 2.68Å; I438-W473 HydrophobicContact CD1-CH2 3.92Å; I438-W473 HydrophobicContact CD1-CZ2 4.38Å; I438-W473 HydrophobicContact CD1-CZ3 4.21Å; I438-W473 HydrophobicContact CG1-CD2 4.33Å; I438-W473 HydrophobicContact CG1-CE3 4.25Å; I438-W473 HydrophobicContact CG1-CH2 3.72Å; I438-W473 HydrophobicContact CG1-CZ2 3.78Å; I438-W473 HydrophobicContact CG1-CZ3 3.95Å
439	G	94.3	Very high	93.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-44.6	175.1	0	0	0	0	0	112.7	N436 T441 G442 L443	N436-G439 PolarHBondContact O-N 3.5Å; N436-G439 PolarHBondContact OD1-N 3.14Å; G439-T441 PolarHBondContact O-N 3.23Å; G439-G442 PolarHBondContact O-N 2.97Å; G439-L443 WeakPolarHBondContact O-CB 3.37Å; G439-L443 PolarHBondContact O-N 3.41Å
440	Q	96.5	Very high	93.4	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.019	16%	0.163	C	C	.	.	H	α-helix	trans	-59.6	-43.9	174.8	-73.7	169.4	3.6	0	0	112.1	A432 N435 N436 I438 A444 K467 A468	A432-Q440 HydrophobicContact CB-CG 3.91Å; N435-Q440 PolarHBondContact OD1-NE2 3.25Å; N436-Q440 VanDerWaalsContact O-CG 3.26Å; N436-Q440 WeakPolarHBondContact O-CG 3.45Å; N436-Q440 PolarHBondContact O-N 3.05Å; I438-Q440 PolarHBondContact O-N 3.14Å; Q440-A444 VanDerWaalsContact O-CB 3.25Å; Q440-A444 WeakPolarHBondContact O-CB 3.48Å; Q440-A444 PolarHBondContact O-N 3.45Å; Q440-K467 VanDerWaalsContact OE1-CB 3.32Å; Q440-A468 HydrophobicContact CB-CB 4.03Å; Q440-A468 VanDerWaalsContact OE1-N 3.13Å
441	T	94.3	Very high	92.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.7	-44.6	179	-56	0	0	0	0	111.7	P317 P437 I438 G439 L443 A444 L445 F465 A468 W473 E475 A476	P317-T441 HydrophobicContact CB-CG2 4.37Å; P437-T441 WeakPolarHBondContact O-CB 3.24Å; P437-T441 PolarHBondContact O-N 3.01Å; P437-T441 PolarHBondContact O-OG1 3.26Å; I438-T441 PolarHBondContact O-N 3.32Å; G439-T441 PolarHBondContact O-N 3.23Å; T441-L443 VanDerWaalsContact C-N 3.34Å; T441-L443 PolarHBondContact O-N 2.78Å; T441-A444 WeakPolarHBondContact O-CB 3.38Å; T441-A444 PolarHBondContact O-N 2.82Å; T441-L445 HydrophobicContact CG2-CD1 4.25Å; T441-L445 WeakPolarHBondContact O-CG 3.35Å; T441-L445 PolarHBondContact O-N 3.4Å; T441-F465 HydrophobicContact CG2-CD1 4.2Å; T441-F465 HydrophobicContact CG2-CE1 3.89Å; T441-A468 WeakPolarHBondContact OG1-CB 3.37Å; T441-W473 PolarHBondContact OG1-NE1 3.14Å; T441-E475 HydrophobicContact CG2-CB 4.21Å; T441-E475 HydrophobicContact CG2-CG 4.23Å; T441-A476 HydrophobicContact CG2-CB 4.48Å
442	G	91.4	Very high	92.3	Very high	10 Å²	10	33.2 Å²	33.2	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-42.5	176.4	0	0	0	0	0	112.1	I438 G439 L445 A446	I438-G442 PolarHBondContact O-N 2.68Å; G439-G442 PolarHBondContact O-N 2.97Å; G442-L445 PolarHBondContact O-N 2.68Å; G442-A446 PolarHBondContact O-N 3.14Å; G442-A446 VanDerWaalsContact O-N 3.08Å
443	L	93.9	Very high	91.8	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-66.6	-40.8	174.9	-174.6	63.3	0	0	0	112	L425 A432 G439 T441 L445 A446 Y447 L454 L464	L425-L443 HydrophobicContact CD2-CD1 4.31Å; A432-L443 HydrophobicContact CB-CD2 4.25Å; G439-L443 WeakPolarHBondContact O-CB 3.37Å; G439-L443 PolarHBondContact O-N 3.41Å; T441-L443 VanDerWaalsContact C-N 3.34Å; T441-L443 PolarHBondContact O-N 2.78Å; L443-L445 VanDerWaalsContact C-N 3.35Å; L443-L445 PolarHBondContact O-N 2.71Å; L443-A446 WeakPolarHBondContact O-CB 3.01Å; L443-A446 PolarHBondContact O-N 2.73Å; L443-Y447 HydrophobicContact CD1-CD2 4.19Å; L443-Y447 HydrophobicContact CD1-CE2 3.78Å; L443-Y447 HydrophobicContact CD2-CE2 4.28Å; L443-Y447 HydrophobicContact CG-CD2 4.02Å; L443-Y447 HydrophobicContact CG-CE2 3.81Å; L443-Y447 WeakPolarHBondContact O-CD2 3.36Å; L443-Y447 PolarHBondContact O-N 3.44Å; L443-L454 HydrophobicContact CD1-CD1 4.47Å; L443-L464 HydrophobicContact CB-CD1 4.23Å; L443-L464 HydrophobicContact CD2-CD1 3.89Å; L443-L464 HydrophobicContact CD2-CD2 4.41Å; L443-L464 HydrophobicContact CG-CD1 3.83Å
444	A	93.9	Very high	91.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60	-44.4	175.8	0	0	0	0	0	111.7	Q440 T441 A446 Y447 L448 A461 L464 F465	Q440-A444 VanDerWaalsContact O-CB 3.25Å; Q440-A444 WeakPolarHBondContact O-CB 3.48Å; Q440-A444 PolarHBondContact O-N 3.45Å; T441-A444 WeakPolarHBondContact O-CB 3.38Å; T441-A444 PolarHBondContact O-N 2.82Å; A444-A446 VanDerWaalsContact C-N 3.31Å; A444-A446 PolarHBondContact O-N 3.5Å; A444-Y447 PolarHBondContact O-N 3.43Å; A444-L448 WeakPolarHBondContact O-CB 3.41Å; A444-L448 PolarHBondContact O-N 3.21Å; A444-A461 HydrophobicContact CB-CB 4.39Å; A444-A461 WeakPolarHBondContact CB-O 3.34Å; A444-A461 VanDerWaalsContact O-CB 3.23Å; A444-A461 WeakPolarHBondContact O-CB 3.39Å; A444-L464 HydrophobicContact CB-CB 3.66Å; A444-L464 HydrophobicContact CB-CD1 4.33Å; A444-F465 HydrophobicContact CB-CD1 3.55Å; A444-F465 HydrophobicContact CB-CD2 3.96Å; A444-F465 HydrophobicContact CB-CE1 3.39Å; A444-F465 HydrophobicContact CB-CE2 3.8Å; A444-F465 HydrophobicContact CB-CG 3.82Å; A444-F465 HydrophobicContact CB-CZ 3.51Å
445	L	91.1	Very high	91.4	Very high	11 Å²	11	29 Å²	29	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-36.9	176.4	-72.3	168.2	0	0	0	112.4	P317 T441 G442 L443 L448 Y449 F465 H479	P317-L445 HydrophobicContact CB-CD1 3.79Å; P317-L445 HydrophobicContact CG-CD1 4.04Å; T441-L445 HydrophobicContact CG2-CD1 4.25Å; T441-L445 WeakPolarHBondContact O-CG 3.35Å; T441-L445 PolarHBondContact O-N 3.4Å; G442-L445 PolarHBondContact O-N 2.68Å; L443-L445 VanDerWaalsContact C-N 3.35Å; L443-L445 PolarHBondContact O-N 2.71Å; L445-L448 PolarHBondContact O-N 3.18Å; L445-Y449 HydrophobicContact CD2-CD2 4.15Å; L445-Y449 HydrophobicContact CD2-CE2 3.7Å; L445-Y449 PolarHBondContact O-N 3.04Å; L445-F465 HydrophobicContact CD2-CE1 4.19Å; L445-F465 HydrophobicContact CD2-CZ 3.71Å; L445-F465 HydrophobicContact CG-CE1 4Å; L445-F465 HydrophobicContact CG-CZ 3.88Å; L445-H479 WeakPolarHBondContact CD2-CE1 3.16Å; L445-H479 VanDerWaalsContact CD2-NE2 3.27Å; L445-H479 WeakPolarHBondContact CD2-NE2 3.43Å
446	A	91	Very high	91.2	Very high	2 Å²	2	29 Å²	29	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-42.1	175.1	0	0	0	0	0	111.6	M411 L425 G442 L443 A444 G450 R451 L454	M411-A446 HydrophobicContact CE-CB 4.18Å; L425-A446 HydrophobicContact CD2-CB 4.26Å; G442-A446 PolarHBondContact O-N 3.14Å; G442-A446 VanDerWaalsContact O-N 3.08Å; L443-A446 WeakPolarHBondContact O-CB 3.01Å; L443-A446 PolarHBondContact O-N 2.73Å; A444-A446 VanDerWaalsContact C-N 3.31Å; A444-A446 PolarHBondContact O-N 3.5Å; A446-G450 CarbonylContact O-C 3.12Å; A446-G450 VanDerWaalsContact O-CA 3.26Å; A446-G450 WeakPolarHBondContact O-CA 3.27Å; A446-G450 PolarHBondContact O-N 2.78Å; A446-R451 HydrophobicContact CB-CB 4.48Å; A446-R451 PolarHBondContact O-N 2.75Å; A446-L454 HydrophobicContact CB-CD1 3.82Å
447	Y	93	Very high	91.1	Very high	39 Å²	39	32.7 Å²	32.7	15%	0.153	19%	0.194	C	C	.	.	H	α-helix	trans	-70.2	-32.9	172.4	-80.2	-63.5	0	0	0	114	L443 A444 L454 V456 K457 I460 L464	L443-Y447 HydrophobicContact CD1-CD2 4.19Å; L443-Y447 HydrophobicContact CD1-CE2 3.78Å; L443-Y447 HydrophobicContact CD2-CE2 4.28Å; L443-Y447 HydrophobicContact CG-CD2 4.02Å; L443-Y447 HydrophobicContact CG-CE2 3.81Å; L443-Y447 WeakPolarHBondContact O-CD2 3.36Å; L443-Y447 PolarHBondContact O-N 3.44Å; A444-Y447 PolarHBondContact O-N 3.43Å; Y447-L454 HydrophobicContact CD1-CB 4.41Å; Y447-L454 HydrophobicContact CD1-CD1 4.22Å; Y447-L454 HydrophobicContact CE1-CD1 4.11Å; Y447-L454 HydrophobicContact CE1-CD2 4.25Å; Y447-L454 HydrophobicContact CE2-CD1 4.41Å; Y447-L454 HydrophobicContact CG-CD1 4.42Å; Y447-V456 CarbonylContact O-C 3.56Å; Y447-V456 VanDerWaalsContact O-CA 3.28Å; Y447-V456 WeakPolarHBondContact O-CA 3.42Å; Y447-K457 HydrophobicContact CD1-CB 4.15Å; Y447-K457 HydrophobicContact CD1-CD 4.44Å; Y447-K457 HydrophobicContact CE1-CD 4.46Å; Y447-K457 PolarHBondContact O-N 3.39Å; Y447-I460 HydrophobicContact CD2-CG2 4.04Å; Y447-I460 HydrophobicContact CE2-CG2 4.17Å; Y447-I460 HydrophobicContact CG-CG2 4.37Å; Y447-L464 HydrophobicContact CD2-CD1 3.95Å; Y447-L464 HydrophobicContact CE2-CD1 4.31Å
448	L	90.9	Very high	90.9	Very high	4 Å²	4	33 Å²	33	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-45.9	-177.5	-175.9	64.2	0	0	0	111.6	A444 L445 V456 P458 A461 F465 L483 H488	A444-L448 WeakPolarHBondContact O-CB 3.41Å; A444-L448 PolarHBondContact O-N 3.21Å; L445-L448 PolarHBondContact O-N 3.18Å; L448-V456 WeakPolarHBondContact O-CG1 3.27Å; L448-P458 HydrophobicContact CD1-CB 4.25Å; L448-A461 HydrophobicContact CB-CB 3.88Å; L448-A461 HydrophobicContact CD1-CB 4.37Å; L448-F465 HydrophobicContact CD2-CE2 4.09Å; L448-F465 HydrophobicContact CD2-CZ 4.37Å; L448-L483 HydrophobicContact CD1-CD2 3.7Å; L448-L483 HydrophobicContact CD2-CD2 4.21Å; L448-H488 HydrophobicContact CD1-CB 4.41Å
449	Y	89.1	Confident	90.7	Very high	79 Å²	79	34 Å²	34	31%	0.31	20%	0.203	S	C	.	.	H	α-helix	trans	-101.4	2.3	-176	-62.6	-63.2	0	0	0	113.7	L445 R451 H488	L445-Y449 HydrophobicContact CD2-CD2 4.15Å; L445-Y449 HydrophobicContact CD2-CE2 3.7Å; L445-Y449 PolarHBondContact O-N 3.04Å; Y449-R451 VanDerWaalsContact C-N 3.28Å; Y449-R451 PolarHBondContact O-N 3Å; Y449-H488 AromaticContact CE1-NE2 3.95Å
450	G	88.5	Confident	90.7	Very high	22 Å²	22	36.8 Å²	36.8	23%	0.227	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	30.1	-177.6	0	0	0	0	0	113.9	A446 L454	A446-G450 CarbonylContact O-C 3.12Å; A446-G450 VanDerWaalsContact O-CA 3.26Å; A446-G450 WeakPolarHBondContact O-CA 3.27Å; A446-G450 PolarHBondContact O-N 2.78Å; G450-L454 CarbonylContact C-O 3.54Å; G450-L454 WeakPolarHBondContact CA-O 2.99Å
451	R	84.8	Confident	90.5	Very high	82 Å²	82	36.6 Å²	36.6	31%	0.309	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-69.3	158.9	178.3	-61.2	-179.6	178.5	-174.7	-2.5	110.3	M411 A446 Y449 G453 L454	M411-R451 HydrophobicContact SD-CB 4.28Å; A446-R451 HydrophobicContact CB-CB 4.48Å; A446-R451 PolarHBondContact O-N 2.75Å; Y449-R451 VanDerWaalsContact C-N 3.28Å; Y449-R451 PolarHBondContact O-N 3Å; R451-G453 PolarHBondContact O-N 2.84Å; R451-G453 VanDerWaalsContact O-N 3.14Å; R451-L454 PolarHBondContact O-N 3.13Å
452	A	83	Confident	90.4	Very high	28 Å²	28	36.6 Å²	36.6	23%	0.231	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	57.3	22.9	-178.5	0	0	0	0	0	114.9	M411 L425 L454	M411-A452 HydrophobicContact CE-CB 3.94Å; M411-A452 HydrophobicContact SD-CB 3.7Å; L425-A452 HydrophobicContact CD1-CB 3.78Å; L425-A452 HydrophobicContact CD2-CB 4.14Å; L425-A452 HydrophobicContact CG-CB 3.85Å; A452-L454 VanDerWaalsContact C-N 3.29Å; A452-L454 PolarHBondContact O-N 3.16Å
453	G	85.6	Confident	90.6	Very high	76 Å²	76	40 Å²	40	78%	0.784	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	76.6	11.1	-179.7	0	0	0	0	0	114.5	R451	R451-G453 PolarHBondContact O-N 2.84Å; R451-G453 VanDerWaalsContact O-N 3.14Å
454	L	89.6	Confident	90.6	Very high	31 Å²	31	40.6 Å²	40.6	16%	0.162	23%	0.232	C	C	.	.			trans	-72.6	145.7	173.4	-71.5	178.7	0	0	0	111.1	L425 L443 A446 Y447 G450 R451 A452	L425-L454 HydrophobicContact CD1-CD1 4.21Å; L425-L454 HydrophobicContact CD1-CD2 4.11Å; L425-L454 HydrophobicContact CD1-CG 3.96Å; L425-L454 HydrophobicContact CD2-CD1 3.56Å; L425-L454 HydrophobicContact CD2-CG 4.22Å; L443-L454 HydrophobicContact CD1-CD1 4.47Å; A446-L454 HydrophobicContact CB-CD1 3.82Å; Y447-L454 HydrophobicContact CD1-CB 4.41Å; Y447-L454 HydrophobicContact CD1-CD1 4.22Å; Y447-L454 HydrophobicContact CE1-CD1 4.11Å; Y447-L454 HydrophobicContact CE1-CD2 4.25Å; Y447-L454 HydrophobicContact CE2-CD1 4.41Å; Y447-L454 HydrophobicContact CG-CD1 4.42Å; G450-L454 CarbonylContact C-O 3.54Å; G450-L454 WeakPolarHBondContact CA-O 2.99Å; R451-L454 PolarHBondContact O-N 3.13Å; A452-L454 VanDerWaalsContact C-N 3.29Å; A452-L454 PolarHBondContact O-N 3.16Å
455	P	90.8	Very high	90.7	Very high	75 Å²	75	40.6 Å²	40.6	49%	0.487	23%	0.232	S	C	.	.			trans	-67.8	140.8	171.3	28.7	-34.4	0	0	0	110.6	K457	P455-K457 HydrophobicContact CG-CD 4.32Å; P455-K457 HydrophobicContact CG-CG 4.43Å; P455-K457 PolarHBondContact O-N 2.83Å; P455-K457 VanDerWaalsContact O-N 3.16Å
456	V	91.5	Very high	90.9	Very high	90 Å²	90	40.9 Å²	40.9	55%	0.545	23%	0.234	S	C	.	.			trans	-63.1	114.9	174.8	174.8	0	0	0	0	109.5	Y447 L448	Y447-V456 CarbonylContact O-C 3.56Å; Y447-V456 VanDerWaalsContact O-CA 3.28Å; Y447-V456 WeakPolarHBondContact O-CA 3.42Å; L448-V456 WeakPolarHBondContact O-CG1 3.27Å
457	K	91.9	Very high	91.2	Very high	92 Å²	92	46 Å²	46	40%	0.4	26%	0.256	S	S	.	.			trans	-135	82.5	-178.5	-69.3	-172	178.8	-178.9	0	110.2	Y447 P455 V459 I460 A461	Y447-K457 HydrophobicContact CD1-CB 4.15Å; Y447-K457 HydrophobicContact CD1-CD 4.44Å; Y447-K457 HydrophobicContact CE1-CD 4.46Å; Y447-K457 PolarHBondContact O-N 3.39Å; P455-K457 HydrophobicContact CG-CD 4.32Å; P455-K457 HydrophobicContact CG-CG 4.43Å; P455-K457 PolarHBondContact O-N 2.83Å; P455-K457 VanDerWaalsContact O-N 3.16Å; K457-V459 VanDerWaalsContact C-N 3.3Å; K457-V459 PolarHBondContact O-N 3.45Å; K457-I460 HydrophobicContact CB-CB 4.18Å; K457-I460 HydrophobicContact CB-CD1 4.23Å; K457-I460 HydrophobicContact CB-CG1 4.22Å; K457-I460 HydrophobicContact CD-CD1 3.52Å; K457-I460 HydrophobicContact CD-CG1 4.37Å; K457-I460 HydrophobicContact CG-CD1 4.5Å; K457-I460 PolarHBondContact O-N 3.2Å; K457-A461 PolarHBondContact O-N 3.42Å
458	P	90.7	Very high	91.3	Very high	30 Å²	30	44.2 Å²	44.2	20%	0.195	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-33.5	-172.9	24.1	-33.6	0	0	0	113.1	L448 A461 M462 H488	L448-P458 HydrophobicContact CD1-CB 4.25Å; P458-A461 PolarHBondContact O-N 3.47Å; P458-M462 WeakPolarHBondContact O-CB 3.22Å; P458-M462 PolarHBondContact O-N 3.48Å; P458-H488 HydrophobicContact CB-CB 4.1Å
459	V	90	Very high	91.5	Very high	32 Å²	32	44.5 Å²	44.5	19%	0.194	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-49.3	176.3	166.9	0	0	0	0	111.8	I60 F63 K457 A461 M462 E463	I60-V459 HydrophobicContact CB-CG1 4.34Å; I60-V459 HydrophobicContact CD1-CG1 4.05Å; I60-V459 HydrophobicContact CG1-CG1 3.81Å; I60-V459 HydrophobicContact CG2-CG1 3.76Å; F63-V459 HydrophobicContact CB-CG2 4.21Å; F63-V459 HydrophobicContact CD2-CG2 4.2Å; F63-V459 HydrophobicContact CG-CG2 4.32Å; K457-V459 VanDerWaalsContact C-N 3.3Å; K457-V459 PolarHBondContact O-N 3.45Å; V459-A461 VanDerWaalsContact C-N 3.33Å; V459-A461 PolarHBondContact O-N 3.18Å; V459-M462 WeakPolarHBondContact O-CB 3.4Å; V459-M462 PolarHBondContact O-N 2.91Å; V459-E463 PolarHBondContact O-N 3.03Å
460	I	92.3	Very high	91.8	Very high	57 Å²	57	43.8 Å²	43.8	29%	0.292	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-41	178.5	-60.4	-173.6	0	0	0	110.5	Y447 K457 M462 E463 L464	Y447-I460 HydrophobicContact CD2-CG2 4.04Å; Y447-I460 HydrophobicContact CE2-CG2 4.17Å; Y447-I460 HydrophobicContact CG-CG2 4.37Å; K457-I460 HydrophobicContact CB-CB 4.18Å; K457-I460 HydrophobicContact CB-CD1 4.23Å; K457-I460 HydrophobicContact CB-CG1 4.22Å; K457-I460 HydrophobicContact CD-CD1 3.52Å; K457-I460 HydrophobicContact CD-CG1 4.37Å; K457-I460 HydrophobicContact CG-CD1 4.5Å; K457-I460 PolarHBondContact O-N 3.2Å; I460-M462 VanDerWaalsContact C-N 3.34Å; I460-M462 PolarHBondContact O-N 3.09Å; I460-E463 PolarHBondContact O-N 3.47Å; I460-L464 HydrophobicContact CG2-CD1 4.19Å; I460-L464 WeakPolarHBondContact O-CG 3.45Å; I460-L464 PolarHBondContact O-N 3.01Å
461	A	92.7	Very high	92.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-46.6	174.6	0	0	0	0	0	111.4	A444 L448 K457 P458 V459 E463 L464 F465	A444-A461 HydrophobicContact CB-CB 4.39Å; A444-A461 WeakPolarHBondContact CB-O 3.34Å; A444-A461 VanDerWaalsContact O-CB 3.23Å; A444-A461 WeakPolarHBondContact O-CB 3.39Å; L448-A461 HydrophobicContact CB-CB 3.88Å; L448-A461 HydrophobicContact CD1-CB 4.37Å; K457-A461 PolarHBondContact O-N 3.42Å; P458-A461 PolarHBondContact O-N 3.47Å; V459-A461 VanDerWaalsContact C-N 3.33Å; V459-A461 PolarHBondContact O-N 3.18Å; A461-E463 PolarHBondContact O-N 3.16Å; A461-L464 PolarHBondContact O-N 3.4Å; A461-F465 HydrophobicContact CB-CD2 4.46Å; A461-F465 HydrophobicContact CB-CE2 4.1Å; A461-F465 WeakPolarHBondContact O-CD2 3.31Å; A461-F465 WeakPolarHBondContact O-CG 3.22Å; A461-F465 PolarHBondContact O-N 2.87Å
462	M	93.7	Very high	92.5	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-43.3	177.1	-175.2	176.3	56.6	0	0	112.2	I56 I60 P458 V459 I460 L464 F465 L466 L480 L483 I490	I56-M462 HydrophobicContact CG2-CE 3.54Å; I56-M462 HydrophobicContact CG2-SD 4.01Å; I60-M462 HydrophobicContact CD1-CE 4.12Å; I60-M462 HydrophobicContact CG1-CE 3.72Å; P458-M462 WeakPolarHBondContact O-CB 3.22Å; P458-M462 PolarHBondContact O-N 3.48Å; V459-M462 WeakPolarHBondContact O-CB 3.4Å; V459-M462 PolarHBondContact O-N 2.91Å; I460-M462 VanDerWaalsContact C-N 3.34Å; I460-M462 PolarHBondContact O-N 3.09Å; M462-L464 PolarHBondContact O-N 3.04Å; M462-F465 PolarHBondContact O-N 3.35Å; M462-L466 HydrophobicContact CG-CD1 4.21Å; M462-L466 WeakPolarHBondContact O-CD1 3.47Å; M462-L466 VanDerWaalsContact O-CG 3.29Å; M462-L466 WeakPolarHBondContact O-CG 3.39Å; M462-L466 PolarHBondContact O-N 3.31Å; M462-L480 HydrophobicContact CG-CD2 3.96Å; M462-L483 HydrophobicContact CB-CD1 4.15Å; M462-L483 HydrophobicContact CG-CD1 4.4Å; M462-I490 HydrophobicContact SD-CD1 4.17Å
463	E	93.7	Very high	93	Very high	83 Å²	83	45.3 Å²	45.3	39%	0.388	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-42.1	175.4	-72	-175.7	175.9	0	0	112.9	I60 V459 I460 A461 L466 K467	I60-E463 HydrophobicContact CD1-CG 4.04Å; V459-E463 PolarHBondContact O-N 3.03Å; I460-E463 PolarHBondContact O-N 3.47Å; A461-E463 PolarHBondContact O-N 3.16Å; E463-L466 PolarHBondContact O-N 3.39Å; E463-K467 WeakPolarHBondContact O-CG 3.44Å; E463-K467 PolarHBondContact O-N 3.41Å; E463-K467 VanDerWaalsContact O-N 3.12Å
464	L	95.3	Very high	93.3	Very high	20 Å²	20	42.9 Å²	42.9	11%	0.105	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-42.3	176.6	-73.8	169.2	0	0	0	111.6	L443 A444 Y447 I460 A461 M462 L466 K467 A468	L443-L464 HydrophobicContact CB-CD1 4.23Å; L443-L464 HydrophobicContact CD2-CD1 3.89Å; L443-L464 HydrophobicContact CD2-CD2 4.41Å; L443-L464 HydrophobicContact CG-CD1 3.83Å; A444-L464 HydrophobicContact CB-CB 3.66Å; A444-L464 HydrophobicContact CB-CD1 4.33Å; Y447-L464 HydrophobicContact CD2-CD1 3.95Å; Y447-L464 HydrophobicContact CE2-CD1 4.31Å; I460-L464 HydrophobicContact CG2-CD1 4.19Å; I460-L464 WeakPolarHBondContact O-CG 3.45Å; I460-L464 PolarHBondContact O-N 3.01Å; A461-L464 PolarHBondContact O-N 3.4Å; M462-L464 PolarHBondContact O-N 3.04Å; L464-L466 VanDerWaalsContact C-N 3.29Å; L464-L466 PolarHBondContact O-N 3.36Å; L464-K467 PolarHBondContact O-N 3.14Å; L464-A468 PolarHBondContact O-N 2.93Å; L464-A468 VanDerWaalsContact O-N 3.07Å
465	F	96.1	Very high	93.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.6	-37.8	173.8	-69.4	-53.1	0	0	0	111.8	T441 A444 L445 L448 A461 M462 A468 A469 A476 H479 L480 L483	T441-F465 HydrophobicContact CG2-CD1 4.2Å; T441-F465 HydrophobicContact CG2-CE1 3.89Å; A444-F465 HydrophobicContact CB-CD1 3.55Å; A444-F465 HydrophobicContact CB-CD2 3.96Å; A444-F465 HydrophobicContact CB-CE1 3.39Å; A444-F465 HydrophobicContact CB-CE2 3.8Å; A444-F465 HydrophobicContact CB-CG 3.82Å; A444-F465 HydrophobicContact CB-CZ 3.51Å; L445-F465 HydrophobicContact CD2-CE1 4.19Å; L445-F465 HydrophobicContact CD2-CZ 3.71Å; L445-F465 HydrophobicContact CG-CE1 4Å; L445-F465 HydrophobicContact CG-CZ 3.88Å; L448-F465 HydrophobicContact CD2-CE2 4.09Å; L448-F465 HydrophobicContact CD2-CZ 4.37Å; A461-F465 HydrophobicContact CB-CD2 4.46Å; A461-F465 HydrophobicContact CB-CE2 4.1Å; A461-F465 WeakPolarHBondContact O-CD2 3.31Å; A461-F465 WeakPolarHBondContact O-CG 3.22Å; A461-F465 PolarHBondContact O-N 2.87Å; M462-F465 PolarHBondContact O-N 3.35Å; F465-A468 PolarHBondContact O-N 3.29Å; F465-A469 WeakPolarHBondContact O-CB 3.28Å; F465-A469 PolarHBondContact O-N 3.05Å; F465-A476 HydrophobicContact CB-CB 4.42Å; F465-A476 HydrophobicContact CD1-CB 4.12Å; F465-H479 HydrophobicContact CD1-CB 4.02Å; F465-H479 HydrophobicContact CD2-CB 4.17Å; F465-H479 HydrophobicContact CE1-CB 3.68Å; F465-H479 AromaticContact CE1-CD2 3.81Å; F465-H479 AromaticContact CE1-CG 3.91Å; F465-H479 HydrophobicContact CE2-CB 3.87Å; F465-H479 HydrophobicContact CG-CB 4.27Å; F465-H479 HydrophobicContact CZ-CB 3.61Å; F465-H479 AromaticContact CZ-CG 3.84Å; F465-L480 HydrophobicContact CB-CD1 4.21Å; F465-L480 HydrophobicContact CB-CD2 3.76Å; F465-L480 HydrophobicContact CB-CG 3.71Å; F465-L483 HydrophobicContact CD2-CD1 3.82Å; F465-L483 HydrophobicContact CE2-CD1 4.09Å
466	L	95.8	Very high	93.6	Very high	17 Å²	17	38.1 Å²	38.1	9%	0.089	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-42.6	175.7	-73.4	159.3	0	0	0	112.4	I56 M462 E463 L464 A468 A469 D470 L480 Y500	I56-L466 HydrophobicContact CB-CD1 4.34Å; I56-L466 HydrophobicContact CD1-CD1 3.38Å; I56-L466 HydrophobicContact CD1-CD2 3.38Å; I56-L466 HydrophobicContact CD1-CG 3.96Å; I56-L466 HydrophobicContact CG1-CD1 4.35Å; I56-L466 HydrophobicContact CG2-CD1 3.71Å; M462-L466 HydrophobicContact CG-CD1 4.21Å; M462-L466 WeakPolarHBondContact O-CD1 3.47Å; M462-L466 VanDerWaalsContact O-CG 3.29Å; M462-L466 WeakPolarHBondContact O-CG 3.39Å; M462-L466 PolarHBondContact O-N 3.31Å; E463-L466 PolarHBondContact O-N 3.39Å; L464-L466 VanDerWaalsContact C-N 3.29Å; L464-L466 PolarHBondContact O-N 3.36Å; L466-A468 VanDerWaalsContact C-N 3.28Å; L466-A468 PolarHBondContact O-N 2.92Å; L466-A469 PolarHBondContact O-N 3.27Å; L466-D470 VanDerWaalsContact O-CB 3.31Å; L466-D470 WeakPolarHBondContact O-CB 3.49Å; L466-D470 PolarHBondContact O-N 2.88Å; L466-L480 HydrophobicContact CD2-CD1 3.81Å; L466-L480 HydrophobicContact CD2-CD2 4.12Å; L466-L480 HydrophobicContact CG-CD1 4.19Å; L466-L480 HydrophobicContact CG-CD2 3.97Å; L466-Y500 WeakPolarHBondContact CD2-OH 3.43Å
467	K	96	Very high	93.8	Very high	110 Å²	110	34.3 Å²	34.3	48%	0.478	18%	0.176	S	C	.	.	H	α-helix	trans	-60.3	-39.7	175.1	-69.8	174.6	-176.4	175.3	0	111.6	Q440 E463 L464 Q471	Q440-K467 VanDerWaalsContact OE1-CB 3.32Å; E463-K467 WeakPolarHBondContact O-CG 3.44Å; E463-K467 PolarHBondContact O-N 3.41Å; E463-K467 VanDerWaalsContact O-N 3.12Å; L464-K467 PolarHBondContact O-N 3.14Å; K467-Q471 WeakPolarHBondContact O-CG 3.2Å; K467-Q471 PolarHBondContact O-NE2 2.89Å
468	A	96.1	Very high	93.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-74.6	-37.9	178.1	0	0	0	0	0	112.6	P437 Q440 T441 L464 F465 L466 Q471 G472 W473 A476	P437-A468 HydrophobicContact CB-CB 3.95Å; P437-A468 WeakPolarHBondContact O-CB 3.47Å; Q440-A468 HydrophobicContact CB-CB 4.03Å; Q440-A468 VanDerWaalsContact OE1-N 3.13Å; T441-A468 WeakPolarHBondContact OG1-CB 3.37Å; L464-A468 PolarHBondContact O-N 2.93Å; L464-A468 VanDerWaalsContact O-N 3.07Å; F465-A468 PolarHBondContact O-N 3.29Å; L466-A468 VanDerWaalsContact C-N 3.28Å; L466-A468 PolarHBondContact O-N 2.92Å; A468-Q471 WeakPolarHBondContact O-CB 3.22Å; A468-Q471 PolarHBondContact O-N 3.25Å; A468-G472 PolarHBondContact O-N 3.48Å; A468-W473 HydrophobicContact CB-CB 4.39Å; A468-W473 WeakPolarHBondContact O-CB 3.38Å; A468-W473 PolarHBondContact O-N 3.38Å; A468-W473 VanDerWaalsContact O-N 3.11Å; A468-A476 HydrophobicContact CB-CB 3.49Å; A468-A476 VanDerWaalsContact CB-CB 3.49Å
469	A	95.2	Very high	94.1	Very high	10 Å²	10	29 Å²	29	8%	0.083	15%	0.15	C	C	.	.	H	α-helix	trans	-70.5	-34.5	177.6	0	0	0	0	0	112.6	F465 L466 Q471 G472 A476 Q477 L480 Y500	F465-A469 WeakPolarHBondContact O-CB 3.28Å; F465-A469 PolarHBondContact O-N 3.05Å; L466-A469 PolarHBondContact O-N 3.27Å; A469-Q471 PolarHBondContact O-N 2.88Å; A469-G472 WeakPolarHBondContact O-CA 3.43Å; A469-G472 PolarHBondContact O-N 2.91Å; A469-A476 HydrophobicContact CB-CB 4.24Å; A469-Q477 HydrophobicContact CB-CG 3.77Å; A469-L480 HydrophobicContact CB-CD1 3.49Å; A469-L480 VanDerWaalsContact CB-CD1 3.49Å; A469-Y500 HydrophobicContact CB-CE1 4.23Å
470	D	94.8	Very high	94.3	Very high	65 Å²	65	27.5 Å²	27.5	35%	0.348	14%	0.14	S	C	.	.	H	α-helix	trans	-60	-26.4	170.6	-84.3	-1.5	0	0	0	111.2	K53 L466 G472	K53-D470 VanDerWaalsContact CE-OD2 3.25Å; K53-D470 WeakPolarHBondContact CE-OD2 3.14Å; K53-D470 IonicContact NZ-OD2 3.23Å; K53-D470 PolarHBondContact NZ-OD2 2.82Å; L466-D470 VanDerWaalsContact O-CB 3.31Å; L466-D470 WeakPolarHBondContact O-CB 3.49Å; L466-D470 PolarHBondContact O-N 2.88Å; D470-G472 VanDerWaalsContact C-N 3.32Å
471	Q	95	Very high	94.4	Very high	80 Å²	80	24.8 Å²	24.8	37%	0.374	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	2.6	173.1	-62	-179.8	65.2	0	0	113.5	N435 P437 K467 A468 A469	N435-Q471 PolarHBondContact O-NE2 3.31Å; N435-Q471 PolarHBondContact O-OE1 3.48Å; N435-Q471 PolarHBondContact OD1-NE2 3.11Å; P437-Q471 HydrophobicContact CB-CB 4.15Å; P437-Q471 HydrophobicContact CG-CB 4.41Å; K467-Q471 WeakPolarHBondContact O-CG 3.2Å; K467-Q471 PolarHBondContact O-NE2 2.89Å; A468-Q471 WeakPolarHBondContact O-CB 3.22Å; A468-Q471 PolarHBondContact O-N 3.25Å; A469-Q471 PolarHBondContact O-N 2.88Å
472	G	92.7	Very high	94.4	Very high	29 Å²	29	27.5 Å²	27.5	30%	0.299	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	11.8	178.5	0	0	0	0	0	115.1	A468 A469 D470 P474 Q507	A468-G472 PolarHBondContact O-N 3.48Å; A469-G472 WeakPolarHBondContact O-CA 3.43Å; A469-G472 PolarHBondContact O-N 2.91Å; D470-G472 VanDerWaalsContact C-N 3.32Å; G472-P474 WeakPolarHBondContact O-CD 3.47Å; G472-Q507 PolarHBondContact O-NE2 2.9Å; G472-Q507 PolarHBondContact O-OE1 3.4Å; G472-Q507 VanDerWaalsContact O-OE1 3.05Å
473	W	93.5	Very high	94.4	Very high	54 Å²	54	27.6 Å²	27.6	21%	0.205	14%	0.137	C	C	.	.			trans	-71.6	119.8	-176.3	-173.9	-113.9	0	0	0	112.9	T318 P437 I438 T441 A468 E475 A476 Q477	T318-W473 HydrophobicContact CG2-CH2 4.48Å; T318-W473 HydrophobicContact CG2-CZ2 4.15Å; P437-W473 HydrophobicContact CB-CB 3.78Å; P437-W473 HydrophobicContact CB-CG 4.15Å; P437-W473 HydrophobicContact CG-CB 4.46Å; I438-W473 HydrophobicContact CD1-CH2 3.92Å; I438-W473 HydrophobicContact CD1-CZ2 4.38Å; I438-W473 HydrophobicContact CD1-CZ3 4.21Å; I438-W473 HydrophobicContact CG1-CD2 4.33Å; I438-W473 HydrophobicContact CG1-CE3 4.25Å; I438-W473 HydrophobicContact CG1-CH2 3.72Å; I438-W473 HydrophobicContact CG1-CZ2 3.78Å; I438-W473 HydrophobicContact CG1-CZ3 3.95Å; T441-W473 PolarHBondContact OG1-NE1 3.14Å; A468-W473 HydrophobicContact CB-CB 4.39Å; A468-W473 WeakPolarHBondContact O-CB 3.38Å; A468-W473 PolarHBondContact O-N 3.38Å; A468-W473 VanDerWaalsContact O-N 3.11Å; W473-E475 PolarHBondContact O-N 3.11Å; W473-A476 HydrophobicContact CB-CB 4.35Å; W473-A476 PolarHBondContact O-N 3.15Å; W473-Q477 WeakPolarHBondContact O-CG 3.41Å; W473-Q477 PolarHBondContact O-N 3.05Å
474	P	92.7	Very high	94.4	Very high	25 Å²	25	23.7 Å²	23.7	16%	0.162	12%	0.119	C	C	.	.	H	α-helix	trans	-61.6	-38.4	-172.2	-11	13.4	0	0	0	114.1	G472 Q477 L478 Q507	G472-P474 WeakPolarHBondContact O-CD 3.47Å; P474-Q477 WeakPolarHBondContact O-CB 3.36Å; P474-Q477 PolarHBondContact O-N 2.94Å; P474-L478 PolarHBondContact O-N 3.34Å; P474-Q507 HydrophobicContact CB-CB 4.08Å; P474-Q507 HydrophobicContact CG-CB 3.81Å; P474-Q507 HydrophobicContact CG-CG 4.35Å
475	E	91.5	Very high	94.2	Very high	7 Å²	7	25.1 Å²	25.1	3%	0.033	13%	0.127	C	C	.	.	H	α-helix	trans	-70.8	-36.2	-175.8	-162.2	61.3	-160.8	0	0	111.5	P317 T441 W473 L478 H479 N509	P317-E475 HydrophobicContact CB-CG 3.84Å; T441-E475 HydrophobicContact CG2-CB 4.21Å; T441-E475 HydrophobicContact CG2-CG 4.23Å; W473-E475 PolarHBondContact O-N 3.11Å; E475-L478 WeakPolarHBondContact O-CB 3.41Å; E475-L478 PolarHBondContact O-N 3.21Å; E475-H479 PolarHBondContact O-CD2 3.08Å; E475-H479 PolarHBondContact O-N 3.21Å; E475-H479 IonicContact OE1-CD2 2.67Å; E475-H479 IonicContact OE1-NE2 3.25Å; E475-H479 PolarHBondContact OE1-NE2 3.5Å; E475-N509 PolarHBondContact OE2-ND2 2.97Å
476	A	94.7	Very high	93.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.2	-41.4	173.1	0	0	0	0	0	111.6	T441 F465 A468 A469 W473 L478 H479 L480	T441-A476 HydrophobicContact CG2-CB 4.48Å; F465-A476 HydrophobicContact CB-CB 4.42Å; F465-A476 HydrophobicContact CD1-CB 4.12Å; A468-A476 HydrophobicContact CB-CB 3.49Å; A468-A476 VanDerWaalsContact CB-CB 3.49Å; A469-A476 HydrophobicContact CB-CB 4.24Å; W473-A476 HydrophobicContact CB-CB 4.35Å; W473-A476 PolarHBondContact O-N 3.15Å; A476-L478 VanDerWaalsContact C-N 3.34Å; A476-H479 PolarHBondContact O-N 3.05Å; A476-L480 WeakPolarHBondContact O-CG 3.27Å; A476-L480 PolarHBondContact O-N 3.47Å
477	Q	96.1	Very high	93.1	Very high	9 Å²	9	28.3 Å²	28.3	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-61	-43.9	173.9	-66.4	166.9	-4.1	0	0	110.8	A469 W473 P474 H479 L480 G481 Y500 M503 A504	A469-Q477 HydrophobicContact CB-CG 3.77Å; W473-Q477 WeakPolarHBondContact O-CG 3.41Å; W473-Q477 PolarHBondContact O-N 3.05Å; P474-Q477 WeakPolarHBondContact O-CB 3.36Å; P474-Q477 PolarHBondContact O-N 2.94Å; Q477-H479 PolarHBondContact O-N 2.95Å; Q477-L480 PolarHBondContact O-N 3.47Å; Q477-G481 PolarHBondContact O-N 3.02Å; Q477-Y500 HydrophobicContact CB-CD1 4.34Å; Q477-Y500 HydrophobicContact CG-CD1 4.29Å; Q477-Y500 WeakPolarHBondContact O-CB 3.24Å; Q477-M503 HydrophobicContact CG-CB 4.41Å; Q477-M503 PolarHBondContact OE1-O 2.94Å; Q477-A504 HydrophobicContact CB-CB 3.93Å
478	L	94.6	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-57	-50.8	175.6	170.7	66.4	0	0	0	111.9	P474 E475 A476 L480 G481 R482 F501 A504 I511 A512	P474-L478 PolarHBondContact O-N 3.34Å; E475-L478 WeakPolarHBondContact O-CB 3.41Å; E475-L478 PolarHBondContact O-N 3.21Å; A476-L478 VanDerWaalsContact C-N 3.34Å; L478-L480 PolarHBondContact O-N 2.98Å; L478-G481 PolarHBondContact O-N 3.4Å; L478-G481 VanDerWaalsContact O-N 3.16Å; L478-R482 PolarHBondContact O-N 2.97Å; L478-F501 HydrophobicContact CD1-CD1 4.02Å; L478-F501 HydrophobicContact CD1-CE1 3.74Å; L478-A504 HydrophobicContact CB-CB 4.43Å; L478-I511 HydrophobicContact CD1-CB 4.09Å; L478-I511 HydrophobicContact CD1-CG2 3.64Å; L478-I511 HydrophobicContact CD2-CB 3.81Å; L478-I511 HydrophobicContact CD2-CD1 4.18Å; L478-I511 HydrophobicContact CD2-CG2 3.83Å; L478-I511 HydrophobicContact CG-CG2 4.33Å; L478-A512 HydrophobicContact CD1-CB 4.03Å
479	H	93.7	Very high	91.4	Very high	11 Å²	11	28 Å²	28	5%	0.051	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-38.5	-179.1	-73.6	-62.3	0	0	0	112.4	L445 F465 E475 A476 Q477 G481 R482 L483	L445-H479 WeakPolarHBondContact CD2-CE1 3.16Å; L445-H479 VanDerWaalsContact CD2-NE2 3.27Å; L445-H479 WeakPolarHBondContact CD2-NE2 3.43Å; F465-H479 HydrophobicContact CD1-CB 4.02Å; F465-H479 HydrophobicContact CD2-CB 4.17Å; F465-H479 HydrophobicContact CE1-CB 3.68Å; F465-H479 AromaticContact CE1-CD2 3.81Å; F465-H479 AromaticContact CE1-CG 3.91Å; F465-H479 HydrophobicContact CE2-CB 3.87Å; F465-H479 HydrophobicContact CG-CB 4.27Å; F465-H479 HydrophobicContact CZ-CB 3.61Å; F465-H479 AromaticContact CZ-CG 3.84Å; E475-H479 PolarHBondContact O-CD2 3.08Å; E475-H479 PolarHBondContact O-N 3.21Å; E475-H479 IonicContact OE1-CD2 2.67Å; E475-H479 IonicContact OE1-NE2 3.25Å; E475-H479 PolarHBondContact OE1-NE2 3.5Å; A476-H479 PolarHBondContact O-N 3.05Å; Q477-H479 PolarHBondContact O-N 2.95Å; H479-G481 VanDerWaalsContact C-N 3.31Å; H479-G481 PolarHBondContact O-N 2.85Å; H479-R482 PolarHBondContact O-N 3.21Å; H479-L483 VanDerWaalsContact O-CG 3.3Å; H479-L483 WeakPolarHBondContact O-CG 3.49Å; H479-L483 PolarHBondContact O-N 3.35Å
480	L	94.8	Very high	90.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.6	-44.7	170.8	-74.1	170.5	0	0	0	111.6	M462 F465 L466 A469 A476 Q477 L478 R482 L483 F484 Y500	M462-L480 HydrophobicContact CG-CD2 3.96Å; F465-L480 HydrophobicContact CB-CD1 4.21Å; F465-L480 HydrophobicContact CB-CD2 3.76Å; F465-L480 HydrophobicContact CB-CG 3.71Å; L466-L480 HydrophobicContact CD2-CD1 3.81Å; L466-L480 HydrophobicContact CD2-CD2 4.12Å; L466-L480 HydrophobicContact CG-CD1 4.19Å; L466-L480 HydrophobicContact CG-CD2 3.97Å; A469-L480 HydrophobicContact CB-CD1 3.49Å; A469-L480 VanDerWaalsContact CB-CD1 3.49Å; A476-L480 WeakPolarHBondContact O-CG 3.27Å; A476-L480 PolarHBondContact O-N 3.47Å; Q477-L480 PolarHBondContact O-N 3.47Å; L478-L480 PolarHBondContact O-N 2.98Å; L480-R482 VanDerWaalsContact C-N 3.3Å; L480-R482 PolarHBondContact O-N 3.38Å; L480-L483 PolarHBondContact O-N 3.35Å; L480-F484 HydrophobicContact CB-CD2 4.42Å; L480-F484 HydrophobicContact CB-CE2 4.23Å; L480-F484 HydrophobicContact CD2-CE2 4.35Å; L480-F484 WeakPolarHBondContact O-CD2 3.41Å; L480-F484 PolarHBondContact O-N 3.06Å; L480-Y500 HydrophobicContact CB-CD1 4.16Å; L480-Y500 HydrophobicContact CB-CD2 4.02Å; L480-Y500 HydrophobicContact CB-CE1 4.47Å; L480-Y500 HydrophobicContact CB-CE2 4.38Å; L480-Y500 HydrophobicContact CB-CG 3.93Å; L480-Y500 HydrophobicContact CD1-CD1 3.95Å; L480-Y500 HydrophobicContact CD1-CE1 3.59Å; L480-Y500 HydrophobicContact CD1-CE2 4.44Å
481	G	94.5	Very high	90.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-52.9	-48.4	174.6	0	0	0	0	0	112.1	Q477 L478 H479 F484 L485	Q477-G481 PolarHBondContact O-N 3.02Å; L478-G481 PolarHBondContact O-N 3.4Å; L478-G481 VanDerWaalsContact O-N 3.16Å; H479-G481 VanDerWaalsContact C-N 3.31Å; H479-G481 PolarHBondContact O-N 2.85Å; G481-F484 PolarHBondContact O-N 3.08Å; G481-L485 PolarHBondContact O-N 3.22Å
482	R	93	Very high	90.2	Very high	57 Å²	57	29.7 Å²	29.7	22%	0.215	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-37.2	177.8	-68.2	175.4	64.8	-177.7	2.3	113.3	L478 H479 L480 L485 T487 F501	L478-R482 PolarHBondContact O-N 2.97Å; H479-R482 PolarHBondContact O-N 3.21Å; L480-R482 VanDerWaalsContact C-N 3.3Å; L480-R482 PolarHBondContact O-N 3.38Å; R482-L485 PolarHBondContact O-N 2.94Å; R482-T487 WeakPolarHBondContact O-CG2 3.44Å; R482-T487 PolarHBondContact O-OG1 3.05Å; R482-F501 HydrophobicContact CG-CE1 4.1Å; R482-F501 HydrophobicContact CG-CZ 4.08Å
483	L	92.8	Very high	90.3	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-44.2	175.4	-69.6	173.6	0	0	0	110.8	L448 M462 F465 H479 L480 L485 G486 T487 I490	L448-L483 HydrophobicContact CD1-CD2 3.7Å; L448-L483 HydrophobicContact CD2-CD2 4.21Å; M462-L483 HydrophobicContact CB-CD1 4.15Å; M462-L483 HydrophobicContact CG-CD1 4.4Å; F465-L483 HydrophobicContact CD2-CD1 3.82Å; F465-L483 HydrophobicContact CE2-CD1 4.09Å; H479-L483 VanDerWaalsContact O-CG 3.3Å; H479-L483 WeakPolarHBondContact O-CG 3.49Å; H479-L483 PolarHBondContact O-N 3.35Å; L480-L483 PolarHBondContact O-N 3.35Å; L483-L485 PolarHBondContact O-N 2.92Å; L483-G486 PolarHBondContact O-N 3.21Å; L483-G486 VanDerWaalsContact O-N 3.11Å; L483-T487 PolarHBondContact O-N 3.21Å; L483-I490 HydrophobicContact CB-CD1 3.77Å; L483-I490 HydrophobicContact CD1-CD1 4.19Å; L483-I490 HydrophobicContact CD2-CD1 3.67Å; L483-I490 HydrophobicContact CG-CD1 4.05Å
484	F	93.4	Very high	90.3	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-69.3	-11.4	177.4	-71.9	-58.6	0	0	0	114.7	I56 Y59 L480 G481 G486 T492 D493 A497 Y500	I56-F484 HydrophobicContact CD1-CZ 3.83Å; I56-F484 HydrophobicContact CG1-CE1 4.35Å; I56-F484 HydrophobicContact CG1-CZ 3.94Å; Y59-F484 HydrophobicContact CD2-CE1 4.4Å; Y59-F484 HydrophobicContact CE2-CE1 4.21Å; L480-F484 HydrophobicContact CB-CD2 4.42Å; L480-F484 HydrophobicContact CB-CE2 4.23Å; L480-F484 HydrophobicContact CD2-CE2 4.35Å; L480-F484 WeakPolarHBondContact O-CD2 3.41Å; L480-F484 PolarHBondContact O-N 3.06Å; G481-F484 PolarHBondContact O-N 3.08Å; F484-G486 PolarHBondContact O-N 2.92Å; F484-T492 CarbonylContact O-C 3.52Å; F484-T492 WeakPolarHBondContact O-CA 3.46Å; F484-D493 HydrophobicContact CD1-CB 4.05Å; F484-D493 PolarHBondContact O-N 3.28Å; F484-A497 HydrophobicContact CB-CB 3.81Å; F484-Y500 AromaticContact CD2-CD2 3.73Å; F484-Y500 HydrophobicContact CD2-CD2 3.73Å; F484-Y500 AromaticContact CD2-CE2 3.95Å; F484-Y500 HydrophobicContact CD2-CE2 3.95Å; F484-Y500 AromaticContact CE2-CD2 3.62Å; F484-Y500 HydrophobicContact CE2-CD2 3.62Å; F484-Y500 AromaticContact CE2-CE2 3.35Å; F484-Y500 HydrophobicContact CE2-CE2 3.35Å; F484-Y500 HydrophobicContact CZ-CE2 4.26Å
485	L	91.6	Very high	90.4	Very high	50 Å²	50	37.4 Å²	37.4	26%	0.262	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-1.2	169.5	-70.2	179.9	0	0	0	113.8	G481 R482 L483 Y494 A497 F501 M519	G481-L485 PolarHBondContact O-N 3.22Å; R482-L485 PolarHBondContact O-N 2.94Å; L483-L485 PolarHBondContact O-N 2.92Å; L485-Y494 HydrophobicContact CD2-CD1 3.9Å; L485-Y494 HydrophobicContact CD2-CE1 4.1Å; L485-A497 HydrophobicContact CD2-CB 3.86Å; L485-A497 HydrophobicContact CG-CB 4.2Å; L485-F501 HydrophobicContact CD1-CE2 3.8Å; L485-F501 HydrophobicContact CD1-CZ 3.82Å; L485-F501 HydrophobicContact CD2-CE2 4.31Å; L485-F501 HydrophobicContact CG-CE2 3.99Å; L485-F501 HydrophobicContact CG-CZ 4.28Å; L485-M519 HydrophobicContact CD2-SD 4.34Å
486	G	84.8	Confident	90.5	Very high	30 Å²	30	37.4 Å²	37.4	31%	0.309	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.7	14.9	178.3	0	0	0	0	0	114.9	L483 F484 I490	L483-G486 PolarHBondContact O-N 3.21Å; L483-G486 VanDerWaalsContact O-N 3.11Å; F484-G486 PolarHBondContact O-N 2.92Å; G486-I490 CarbonylContact C-O 3.57Å; G486-I490 VanDerWaalsContact CA-O 3.25Å; G486-I490 WeakPolarHBondContact CA-O 3.46Å
487	T	83.4	Confident	90.5	Very high	54 Å²	54	37.4 Å²	37.4	33%	0.331	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-82.5	155.3	-178.2	65.9	0	0	0	0	111.3	R482 L483 G489 I490	R482-T487 WeakPolarHBondContact O-CG2 3.44Å; R482-T487 PolarHBondContact O-OG1 3.05Å; L483-T487 PolarHBondContact O-N 3.21Å; T487-G489 PolarHBondContact O-N 3.1Å; T487-G489 VanDerWaalsContact O-N 3.15Å; T487-I490 PolarHBondContact O-N 3.1Å
488	H	80.6	Confident	90.5	Very high	84 Å²	84	38.6 Å²	38.6	39%	0.389	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	56.9	29.5	176.4	-53.4	83.1	0	0	0	114.8	L448 Y449 P458 I490	L448-H488 HydrophobicContact CD1-CB 4.41Å; Y449-H488 AromaticContact CE1-NE2 3.95Å; P458-H488 HydrophobicContact CB-CB 4.1Å; H488-I490 VanDerWaalsContact C-N 3.26Å; H488-I490 PolarHBondContact O-N 2.93Å
489	G	76.7	Confident	90.6	Very high	18 Å²	18	40.9 Å²	40.9	19%	0.186	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	82.9	-11.1	178.2	0	0	0	0	0	115.3	F63 F72 T487	F63-G489 WeakPolarHBondContact CZ-O 3.45Å; F72-G489 VanDerWaalsContact CE1-CA 3.48Å; T487-G489 PolarHBondContact O-N 3.1Å; T487-G489 VanDerWaalsContact O-N 3.15Å
490	I	82.7	Confident	90.7	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.026	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-61.9	137.5	178.2	-63.5	169.7	0	0	0	109.8	M462 L483 G486 T487 H488 T492	M462-I490 HydrophobicContact SD-CD1 4.17Å; L483-I490 HydrophobicContact CB-CD1 3.77Å; L483-I490 HydrophobicContact CD1-CD1 4.19Å; L483-I490 HydrophobicContact CD2-CD1 3.67Å; L483-I490 HydrophobicContact CG-CD1 4.05Å; G486-I490 CarbonylContact C-O 3.57Å; G486-I490 VanDerWaalsContact CA-O 3.25Å; G486-I490 WeakPolarHBondContact CA-O 3.46Å; T487-I490 PolarHBondContact O-N 3.1Å; H488-I490 VanDerWaalsContact C-N 3.26Å; H488-I490 PolarHBondContact O-N 2.93Å; I490-T492 PolarHBondContact O-N 3.41Å
491	K	86.1	Confident	90.8	Very high	118 Å²	118	40.8 Å²	40.8	51%	0.513	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-63.5	135.1	178.4	177.6	164.7	166.8	-173.9	0	111.1	Y59 D493	Y59-K491 HydrophobicContact CD1-CB 3.92Å; Y59-K491 HydrophobicContact CD1-CD 4.46Å; Y59-K491 HydrophobicContact CE1-CB 3.77Å; Y59-K491 HydrophobicContact CE1-CD 3.87Å; Y59-K491 HydrophobicContact CE1-CG 3.96Å; K491-D493 PolarHBondContact O-N 3.1Å
492	T	90.9	Very high	90.9	Very high	68 Å²	68	43 Å²	43	42%	0.417	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-59.9	124.8	176.7	55.9	0	0	0	0	111.2	F484 I490	F484-T492 CarbonylContact O-C 3.52Å; F484-T492 WeakPolarHBondContact O-CA 3.46Å; I490-T492 PolarHBondContact O-N 3.41Å
493	D	93.2	Very high	91.1	Very high	18 Å²	18	42.7 Å²	42.7	10%	0.096	22%	0.22	C	C	.	.			trans	-136.3	85.7	169.7	-175.5	-9.9	0	0	0	108.9	K55 Y59 F484 K491 K495 S496 A497	K55-D493 IonicContact NZ-OD2 2.97Å; Y59-D493 PolarHBondContact OH-OD2 3.1Å; F484-D493 HydrophobicContact CD1-CB 4.05Å; F484-D493 PolarHBondContact O-N 3.28Å; K491-D493 PolarHBondContact O-N 3.1Å; D493-K495 PolarHBondContact O-N 3.27Å; D493-K495 VanDerWaalsContact O-N 3.16Å; D493-K495 WeakPolarHBondContact OD1-CB 3.44Å; D493-K495 PolarHBondContact OD1-N 2.75Å; D493-S496 PolarHBondContact O-N 3.4Å; D493-S496 VanDerWaalsContact O-N 3.11Å; D493-S496 PolarHBondContact OD1-N 3.4Å; D493-S496 PolarHBondContact OD2-OG 3.11Å; D493-A497 PolarHBondContact O-N 2.95Å
494	Y	94.9	Very high	91.2	Very high	97 Å²	97	42.6 Å²	42.6	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-59.9	-27.8	-177.9	-60.1	-66.1	0	0	0	113.3	L485 A497 L498 M519	L485-Y494 HydrophobicContact CD2-CD1 3.9Å; L485-Y494 HydrophobicContact CD2-CE1 4.1Å; Y494-A497 PolarHBondContact O-N 3.12Å; Y494-L498 VanDerWaalsContact O-CB 3.31Å; Y494-L498 WeakPolarHBondContact O-CB 3.4Å; Y494-L498 PolarHBondContact O-N 3.11Å; Y494-M519 WeakPolarHBondContact O-CE 3.35Å
495	K	94.5	Very high	91.3	Very high	156 Å²	156	43 Å²	43	68%	0.678	22%	0.222	S	C	*	.	H	α-helix	trans	-68.2	-43.7	177.4	-177.5	177.9	-179.2	175.1	0	110.8	D493 K499	D493-K495 PolarHBondContact O-N 3.27Å; D493-K495 VanDerWaalsContact O-N 3.16Å; D493-K495 WeakPolarHBondContact OD1-CB 3.44Å; D493-K495 PolarHBondContact OD1-N 2.75Å; K495-K499 PolarHBondContact O-N 3.22Å; K495-K499 VanDerWaalsContact O-N 3.14Å
496	S	93.6	Very high	91.4	Very high	6 Å²	6	47.8 Å²	47.8	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-67.8	-41.9	175	-61.3	0	0	0	0	110.9	D493 L498 K499 Y500	D493-S496 PolarHBondContact O-N 3.4Å; D493-S496 VanDerWaalsContact O-N 3.11Å; D493-S496 PolarHBondContact OD1-N 3.4Å; D493-S496 PolarHBondContact OD2-OG 3.11Å; S496-L498 PolarHBondContact O-N 2.9Å; S496-K499 WeakPolarHBondContact O-CB 3.48Å; S496-K499 PolarHBondContact O-N 3.46Å; S496-Y500 WeakPolarHBondContact O-CD2 3.27Å; S496-Y500 PolarHBondContact O-N 3.43Å
497	A	95.5	Very high	91.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-50.4	175.5	0	0	0	0	0	111.9	F484 L485 D493 Y494 K499 Y500 F501 M519	F484-A497 HydrophobicContact CB-CB 3.81Å; L485-A497 HydrophobicContact CD2-CB 3.86Å; L485-A497 HydrophobicContact CG-CB 4.2Å; D493-A497 PolarHBondContact O-N 2.95Å; Y494-A497 PolarHBondContact O-N 3.12Å; A497-K499 VanDerWaalsContact C-N 3.34Å; A497-K499 PolarHBondContact O-N 3.3Å; A497-Y500 PolarHBondContact O-N 2.95Å; A497-F501 HydrophobicContact CB-CD2 4.35Å; A497-F501 HydrophobicContact CB-CE2 4.1Å; A497-F501 WeakPolarHBondContact O-CD2 3.34Å; A497-F501 WeakPolarHBondContact O-CG 3.26Å; A497-F501 PolarHBondContact O-N 3.47Å; A497-M519 HydrophobicContact CB-CE 4.3Å
498	L	96.1	Very high	91.9	Very high	35 Å²	35	50.2 Å²	50.2	18%	0.183	25%	0.251	C	S	.	.	H	α-helix	trans	-55.1	-49.5	176.8	-174.6	79.3	0	0	0	111.3	Y494 S496 Y500 F501 T502 L516 M519 V526	Y494-L498 VanDerWaalsContact O-CB 3.31Å; Y494-L498 WeakPolarHBondContact O-CB 3.4Å; Y494-L498 PolarHBondContact O-N 3.11Å; S496-L498 PolarHBondContact O-N 2.9Å; L498-Y500 PolarHBondContact O-N 3.43Å; L498-F501 PolarHBondContact O-N 3.31Å; L498-T502 WeakPolarHBondContact O-CB 3.36Å; L498-T502 PolarHBondContact O-N 3.46Å; L498-T502 PolarHBondContact O-OG1 3.49Å; L498-L516 HydrophobicContact CD1-CD1 3.43Å; L498-L516 VanDerWaalsContact CD1-CD1 3.43Å; L498-L516 HydrophobicContact CG-CD1 4.44Å; L498-M519 HydrophobicContact CB-CE 3.83Å; L498-M519 HydrophobicContact CD1-CE 4.09Å; L498-M519 HydrophobicContact CD1-SD 4.43Å; L498-V526 HydrophobicContact CD1-CG1 3.45Å; L498-V526 VanDerWaalsContact CD1-CG1 3.45Å; L498-V526 HydrophobicContact CD1-CG2 4.36Å; L498-V526 HydrophobicContact CD2-CG1 3.15Å; L498-V526 HydrophobicContact CG-CG1 3.87Å
499	K	95.6	Very high	92.4	Very high	48 Å²	48	46.6 Å²	46.6	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-54.4	-50.7	179.6	177	-175.8	174.7	179.7	0	111.5	D52 K495 S496 A497 T502 M503	D52-K499 IonicContact OD2-NZ 3.53Å; D52-K499 PolarHBondContact OD2-NZ 3.03Å; K495-K499 PolarHBondContact O-N 3.22Å; K495-K499 VanDerWaalsContact O-N 3.14Å; S496-K499 WeakPolarHBondContact O-CB 3.48Å; S496-K499 PolarHBondContact O-N 3.46Å; A497-K499 VanDerWaalsContact C-N 3.34Å; A497-K499 PolarHBondContact O-N 3.3Å; K499-T502 PolarHBondContact O-N 3.25Å; K499-M503 HydrophobicContact CD-CE 4.29Å; K499-M503 HydrophobicContact CG-CE 3.9Å; K499-M503 HydrophobicContact CG-SD 4.31Å; K499-M503 WeakPolarHBondContact O-CG 3.21Å; K499-M503 PolarHBondContact O-N 3.49Å
500	Y	96.3	Very high	93.1	Very high	9 Å²	9	46.9 Å²	46.9	4%	0.035	23%	0.233	C	C	.	.	H	α-helix	trans	-71.7	-37.1	-177	-75.1	-68.5	0	0	0	112.8	L466 A469 Q477 L480 F484 S496 A497 L498 M503 A504	L466-Y500 WeakPolarHBondContact CD2-OH 3.43Å; A469-Y500 HydrophobicContact CB-CE1 4.23Å; Q477-Y500 HydrophobicContact CB-CD1 4.34Å; Q477-Y500 HydrophobicContact CG-CD1 4.29Å; Q477-Y500 WeakPolarHBondContact O-CB 3.24Å; L480-Y500 HydrophobicContact CB-CD1 4.16Å; L480-Y500 HydrophobicContact CB-CD2 4.02Å; L480-Y500 HydrophobicContact CB-CE1 4.47Å; L480-Y500 HydrophobicContact CB-CE2 4.38Å; L480-Y500 HydrophobicContact CB-CG 3.93Å; L480-Y500 HydrophobicContact CD1-CD1 3.95Å; L480-Y500 HydrophobicContact CD1-CE1 3.59Å; L480-Y500 HydrophobicContact CD1-CE2 4.44Å; F484-Y500 AromaticContact CD2-CD2 3.73Å; F484-Y500 HydrophobicContact CD2-CD2 3.73Å; F484-Y500 AromaticContact CD2-CE2 3.95Å; F484-Y500 HydrophobicContact CD2-CE2 3.95Å; F484-Y500 AromaticContact CE2-CD2 3.62Å; F484-Y500 HydrophobicContact CE2-CD2 3.62Å; F484-Y500 AromaticContact CE2-CE2 3.35Å; F484-Y500 HydrophobicContact CE2-CE2 3.35Å; F484-Y500 HydrophobicContact CZ-CE2 4.26Å; S496-Y500 WeakPolarHBondContact O-CD2 3.27Å; S496-Y500 PolarHBondContact O-N 3.43Å; A497-Y500 PolarHBondContact O-N 2.95Å; L498-Y500 PolarHBondContact O-N 3.43Å; Y500-M503 HydrophobicContact CD1-SD 4.5Å; Y500-M503 PolarHBondContact O-N 2.6Å; Y500-A504 WeakPolarHBondContact O-CB 3.45Å; Y500-A504 PolarHBondContact O-N 2.91Å
501	F	97	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-40.4	172.6	-69.1	-47.2	0	0	0	112.2	L478 R482 L485 A497 L498 M503 A504 S505 A512 H515 L516 M519	L478-F501 HydrophobicContact CD1-CD1 4.02Å; L478-F501 HydrophobicContact CD1-CE1 3.74Å; R482-F501 HydrophobicContact CG-CE1 4.1Å; R482-F501 HydrophobicContact CG-CZ 4.08Å; L485-F501 HydrophobicContact CD1-CE2 3.8Å; L485-F501 HydrophobicContact CD1-CZ 3.82Å; L485-F501 HydrophobicContact CD2-CE2 4.31Å; L485-F501 HydrophobicContact CG-CE2 3.99Å; L485-F501 HydrophobicContact CG-CZ 4.28Å; A497-F501 HydrophobicContact CB-CD2 4.35Å; A497-F501 HydrophobicContact CB-CE2 4.1Å; A497-F501 WeakPolarHBondContact O-CD2 3.34Å; A497-F501 WeakPolarHBondContact O-CG 3.26Å; A497-F501 PolarHBondContact O-N 3.47Å; L498-F501 PolarHBondContact O-N 3.31Å; F501-M503 PolarHBondContact O-N 3.41Å; F501-A504 PolarHBondContact O-N 2.97Å; F501-S505 VanDerWaalsContact O-CB 3.3Å; F501-S505 WeakPolarHBondContact O-CB 3.41Å; F501-S505 PolarHBondContact O-N 2.93Å; F501-S505 PolarHBondContact O-OG 3.31Å; F501-A512 HydrophobicContact CD1-CB 4.29Å; F501-H515 HydrophobicContact CD1-CB 4.07Å; F501-H515 HydrophobicContact CD2-CB 4.08Å; F501-H515 HydrophobicContact CE1-CB 3.77Å; F501-H515 AromaticContact CE1-CD2 3.73Å; F501-H515 HydrophobicContact CE2-CB 3.78Å; F501-H515 HydrophobicContact CG-CB 4.23Å; F501-H515 HydrophobicContact CZ-CB 3.61Å; F501-H515 AromaticContact CZ-CD2 3.87Å; F501-H515 AromaticContact CZ-CG 3.86Å; F501-L516 HydrophobicContact CB-CB 4.38Å; F501-M519 HydrophobicContact CD2-SD 3.66Å; F501-M519 HydrophobicContact CE2-SD 3.95Å
502	T	96.6	Very high	94.1	Very high	47 Å²	47	41.3 Å²	41.3	29%	0.288	21%	0.209	S	C	.	.	H	α-helix	trans	-61.8	-41.8	174.2	-58.1	0	0	0	0	111.9	L498 K499 S505 Q506	L498-T502 WeakPolarHBondContact O-CB 3.36Å; L498-T502 PolarHBondContact O-N 3.46Å; L498-T502 PolarHBondContact O-OG1 3.49Å; K499-T502 PolarHBondContact O-N 3.25Å; T502-S505 PolarHBondContact O-N 2.88Å; T502-S505 PolarHBondContact O-OG 2.94Å; T502-Q506 VanDerWaalsContact O-CG 3.25Å; T502-Q506 WeakPolarHBondContact O-CG 3.32Å; T502-Q506 PolarHBondContact O-N 3.47Å
503	M	96.3	Very high	94.3	Very high	50 Å²	50	39.3 Å²	39.3	25%	0.246	19%	0.194	C	C	.	.	H	α-helix	trans	-64.9	-42	176.8	-70.3	175.6	173.4	0	0	112.1	Q477 K499 Y500 F501	Q477-M503 HydrophobicContact CG-CB 4.41Å; Q477-M503 PolarHBondContact OE1-O 2.94Å; K499-M503 HydrophobicContact CD-CE 4.29Å; K499-M503 HydrophobicContact CG-CE 3.9Å; K499-M503 HydrophobicContact CG-SD 4.31Å; K499-M503 WeakPolarHBondContact O-CG 3.21Å; K499-M503 PolarHBondContact O-N 3.49Å; Y500-M503 HydrophobicContact CD1-SD 4.5Å; Y500-M503 PolarHBondContact O-N 2.6Å; F501-M503 PolarHBondContact O-N 3.41Å
504	A	95.4	Very high	94.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69	-38.8	177.8	0	0	0	0	0	112	Q477 L478 Y500 F501 Q507 N509 A512	Q477-A504 HydrophobicContact CB-CB 3.93Å; L478-A504 HydrophobicContact CB-CB 4.43Å; Y500-A504 WeakPolarHBondContact O-CB 3.45Å; Y500-A504 PolarHBondContact O-N 2.91Å; F501-A504 PolarHBondContact O-N 2.97Å; A504-Q507 PolarHBondContact O-N 3.4Å; A504-N509 HydrophobicContact CB-CB 4.18Å; A504-N509 VanDerWaalsContact O-CB 3.32Å; A504-N509 WeakPolarHBondContact O-CB 3.42Å; A504-N509 PolarHBondContact O-N 3.27Å; A504-A512 HydrophobicContact CB-CB 3.51Å
505	S	94.8	Very high	94.7	Very high	9 Å²	9	35 Å²	35	6%	0.063	18%	0.177	C	C	.	.	H	α-helix	trans	-68.9	-35.4	179.6	74.5	0	0	0	0	112.2	F501 T502 Q507 G508 F513	F501-S505 VanDerWaalsContact O-CB 3.3Å; F501-S505 WeakPolarHBondContact O-CB 3.41Å; F501-S505 PolarHBondContact O-N 2.93Å; F501-S505 PolarHBondContact O-OG 3.31Å; T502-S505 PolarHBondContact O-N 2.88Å; T502-S505 PolarHBondContact O-OG 2.94Å; S505-Q507 PolarHBondContact O-N 3.41Å; S505-Q507 VanDerWaalsContact O-N 3.13Å; S505-G508 PolarHBondContact O-N 3.21Å; S505-F513 WeakPolarHBondContact O-CE2 3.08Å; S505-F513 WeakPolarHBondContact O-CZ 3.41Å
506	Q	94	Very high	94.8	Very high	152 Å²	152	28.1 Å²	28.1	71%	0.71	15%	0.147	S	C	*	.	H	α-helix	trans	-57.7	-25.8	172.8	-77.9	173.1	-0.5	0	0	112.9	T502	T502-Q506 VanDerWaalsContact O-CG 3.25Å; T502-Q506 WeakPolarHBondContact O-CG 3.32Å; T502-Q506 PolarHBondContact O-N 3.47Å
507	Q	90.2	Very high	95	Very high	101 Å²	101	27.9 Å²	27.9	47%	0.472	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	7	177.2	-59.2	-175	72.8	0	0	113.2	G472 P474 A504 S505	G472-Q507 PolarHBondContact O-NE2 2.9Å; G472-Q507 PolarHBondContact O-OE1 3.4Å; G472-Q507 VanDerWaalsContact O-OE1 3.05Å; P474-Q507 HydrophobicContact CB-CB 4.08Å; P474-Q507 HydrophobicContact CG-CB 3.81Å; P474-Q507 HydrophobicContact CG-CG 4.35Å; A504-Q507 PolarHBondContact O-N 3.4Å; S505-Q507 PolarHBondContact O-N 3.41Å; S505-Q507 VanDerWaalsContact O-N 3.13Å
508	G	88.5	Confident	95	Very high	33 Å²	33	29.8 Å²	29.8	34%	0.34	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	9.3	175.3	0	0	0	0	0	115.6	S505 V510	S505-G508 PolarHBondContact O-N 3.21Å; G508-V510 PolarHBondContact O-N 2.85Å
509	N	91.1	Very high	95.1	Very high	9 Å²	9	28.3 Å²	28.3	5%	0.048	15%	0.146	C	C	.	.			trans	-68.2	114.4	-180	-172.2	-58.1	0	0	0	111.2	E475 A504 I511 A512 F513	E475-N509 PolarHBondContact OE2-ND2 2.97Å; A504-N509 HydrophobicContact CB-CB 4.18Å; A504-N509 VanDerWaalsContact O-CB 3.32Å; A504-N509 WeakPolarHBondContact O-CB 3.42Å; A504-N509 PolarHBondContact O-N 3.27Å; N509-I511 PolarHBondContact OD1-N 3.33Å; N509-A512 HydrophobicContact CB-CB 3.9Å; N509-A512 WeakPolarHBondContact O-CB 3.44Å; N509-A512 PolarHBondContact O-N 2.89Å; N509-A512 PolarHBondContact OD1-N 2.92Å; N509-F513 WeakPolarHBondContact O-CD2 3.28Å; N509-F513 PolarHBondContact O-N 3.44Å; N509-F513 VanDerWaalsContact O-N 3.08Å
510	V	92	Very high	95.2	Very high	23 Å²	23	27.6 Å²	27.6	14%	0.139	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-40.1	-174.1	-168.4	0	0	0	0	112.3	V304 V308 G508 A512 F513 Y514 V540 R543	V304-V510 HydrophobicContact CG1-CG1 4.44Å; V308-V510 HydrophobicContact CG1-CB 4.31Å; V308-V510 HydrophobicContact CG2-CG1 4.43Å; G508-V510 PolarHBondContact O-N 2.85Å; V510-A512 VanDerWaalsContact C-N 3.29Å; V510-A512 PolarHBondContact O-N 3.33Å; V510-F513 WeakPolarHBondContact O-CB 3.3Å; V510-F513 PolarHBondContact O-N 3.25Å; V510-Y514 PolarHBondContact O-N 3.08Å; V510-V540 HydrophobicContact CG1-CG1 3.99Å; V510-V540 HydrophobicContact CG1-CG2 4.48Å; V510-R543 HydrophobicContact CG1-CB 4.43Å; V510-R543 VanDerWaalsContact CG2-CD 3.41Å
511	I	93.5	Very high	95.2	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.036	15%	0.147	C	C	.	.	H	α-helix	trans	-67.6	-36.2	179.1	-62.7	168.4	0	0	0	110.1	Y305 V308 L478 N509 Y514 H515	Y305-I511 HydrophobicContact CD2-CG1 4.27Å; Y305-I511 HydrophobicContact CD2-CG2 4.17Å; Y305-I511 HydrophobicContact CE2-CB 4.46Å; Y305-I511 HydrophobicContact CE2-CG1 4.34Å; Y305-I511 HydrophobicContact CE2-CG2 3.66Å; V308-I511 HydrophobicContact CG1-CD1 4.21Å; V308-I511 HydrophobicContact CG1-CG1 4.01Å; L478-I511 HydrophobicContact CD1-CB 4.09Å; L478-I511 HydrophobicContact CD1-CG2 3.64Å; L478-I511 HydrophobicContact CD2-CB 3.81Å; L478-I511 HydrophobicContact CD2-CD1 4.18Å; L478-I511 HydrophobicContact CD2-CG2 3.83Å; L478-I511 HydrophobicContact CG-CG2 4.33Å; N509-I511 PolarHBondContact OD1-N 3.33Å; I511-Y514 WeakPolarHBondContact O-CB 3.49Å; I511-Y514 PolarHBondContact O-N 3.13Å; I511-H515 PolarHBondContact O-CD2 3.39Å; I511-H515 PolarHBondContact O-N 3.34Å
512	A	95.5	Very high	95.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-40.7	174.6	0	0	0	0	0	112	L478 F501 A504 N509 V510 Y514 H515 L516	L478-A512 HydrophobicContact CD1-CB 4.03Å; F501-A512 HydrophobicContact CD1-CB 4.29Å; A504-A512 HydrophobicContact CB-CB 3.51Å; N509-A512 HydrophobicContact CB-CB 3.9Å; N509-A512 WeakPolarHBondContact O-CB 3.44Å; N509-A512 PolarHBondContact O-N 2.89Å; N509-A512 PolarHBondContact OD1-N 2.92Å; V510-A512 VanDerWaalsContact C-N 3.29Å; V510-A512 PolarHBondContact O-N 3.33Å; A512-Y514 VanDerWaalsContact C-N 3.3Å; A512-Y514 PolarHBondContact O-N 3.48Å; A512-H515 PolarHBondContact O-N 3Å; A512-L516 WeakPolarHBondContact O-CB 3.49Å; A512-L516 PolarHBondContact O-N 3.25Å
513	F	96.6	Very high	95.1	Very high	25 Å²	25	33.8 Å²	33.8	11%	0.11	18%	0.177	C	C	.	.	H	α-helix	trans	-57.7	-43.3	171.2	-81.7	-70.4	0	0	0	111.9	S505 N509 V510 L516 A517 L536 V540	S505-F513 WeakPolarHBondContact O-CE2 3.08Å; S505-F513 WeakPolarHBondContact O-CZ 3.41Å; N509-F513 WeakPolarHBondContact O-CD2 3.28Å; N509-F513 PolarHBondContact O-N 3.44Å; N509-F513 VanDerWaalsContact O-N 3.08Å; V510-F513 WeakPolarHBondContact O-CB 3.3Å; V510-F513 PolarHBondContact O-N 3.25Å; F513-L516 PolarHBondContact O-N 3.49Å; F513-A517 VanDerWaalsContact O-CB 3.31Å; F513-A517 WeakPolarHBondContact O-CB 3.37Å; F513-A517 PolarHBondContact O-N 2.94Å; F513-L536 HydrophobicContact CD1-CD2 3.68Å; F513-L536 HydrophobicContact CE1-CD2 4.08Å; F513-V540 HydrophobicContact CB-CG2 3.54Å
514	Y	97.5	Very high	94.9	Very high	10 Å²	10	33.3 Å²	33.3	4%	0.039	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-51.7	179	178	-92.1	0	0	0	112	A301 Q302 Y305 V510 I511 A512 L516 A517 E518 F537	A301-Y514 HydrophobicContact CB-CD2 4.25Å; Q302-Y514 HydrophobicContact CG-CE2 4Å; Y305-Y514 HydrophobicContact CD1-CD1 4.2Å; Y305-Y514 AromaticContact CD1-CE1 3.95Å; Y305-Y514 HydrophobicContact CD1-CE1 3.95Å; Y305-Y514 HydrophobicContact CD1-CE2 4.48Å; Y305-Y514 AromaticContact CD2-CD1 3.54Å; Y305-Y514 HydrophobicContact CD2-CD1 3.54Å; Y305-Y514 HydrophobicContact CD2-CD2 4.4Å; Y305-Y514 HydrophobicContact CD2-CE1 4.13Å; Y305-Y514 AromaticContact CD2-CG 3.72Å; Y305-Y514 HydrophobicContact CD2-CG 3.72Å; Y305-Y514 HydrophobicContact CE1-CD1 4.46Å; Y305-Y514 HydrophobicContact CE1-CE1 4.14Å; Y305-Y514 AromaticContact CE2-CD1 3.85Å; Y305-Y514 HydrophobicContact CE2-CD1 3.85Å; Y305-Y514 HydrophobicContact CE2-CE1 4.31Å; Y305-Y514 HydrophobicContact CE2-CG 4.46Å; Y305-Y514 AromaticContact CG-CD1 3.72Å; Y305-Y514 HydrophobicContact CG-CD1 3.72Å; Y305-Y514 HydrophobicContact CG-CD2 4.02Å; Y305-Y514 AromaticContact CG-CE1 3.93Å; Y305-Y514 HydrophobicContact CG-CE1 3.93Å; Y305-Y514 HydrophobicContact CG-CE2 4.21Å; Y305-Y514 AromaticContact CG-CG 3.79Å; Y305-Y514 HydrophobicContact CG-CG 3.79Å; V510-Y514 PolarHBondContact O-N 3.08Å; I511-Y514 WeakPolarHBondContact O-CB 3.49Å; I511-Y514 PolarHBondContact O-N 3.13Å; A512-Y514 VanDerWaalsContact C-N 3.3Å; A512-Y514 PolarHBondContact O-N 3.48Å; Y514-L516 VanDerWaalsContact C-N 3.34Å; Y514-L516 PolarHBondContact O-N 2.85Å; Y514-A517 WeakPolarHBondContact O-CB 3.17Å; Y514-A517 PolarHBondContact O-N 2.8Å; Y514-E518 HydrophobicContact CD1-CG 4.32Å; Y514-E518 HydrophobicContact CE1-CG 3.81Å; Y514-E518 VanDerWaalsContact CE1-OE1 3.22Å; Y514-E518 WeakPolarHBondContact CE1-OE1 3.31Å; Y514-E518 WeakPolarHBondContact CE1-OE2 3.25Å; Y514-E518 VanDerWaalsContact CZ-OE1 3.28Å; Y514-E518 PolarHBondContact O-N 3.12Å; Y514-E518 PolarHBondContact OH-OE1 2.8Å; Y514-F537 HydrophobicContact CD2-CD1 4.3Å; Y514-F537 AromaticContact CD2-CE1 3.89Å; Y514-F537 HydrophobicContact CD2-CE1 3.89Å; Y514-F537 AromaticContact CE2-CE1 3.93Å; Y514-F537 HydrophobicContact CE2-CE1 3.93Å
515	H	97.1	Very high	94.6	Very high	16 Å²	16	35.5 Å²	35.5	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-65.2	-37.3	178.2	-71.5	-48.7	0	0	0	112.7	F501 I511 A512 A517 E518 M519	F501-H515 HydrophobicContact CD1-CB 4.07Å; F501-H515 HydrophobicContact CD2-CB 4.08Å; F501-H515 HydrophobicContact CE1-CB 3.77Å; F501-H515 AromaticContact CE1-CD2 3.73Å; F501-H515 HydrophobicContact CE2-CB 3.78Å; F501-H515 HydrophobicContact CG-CB 4.23Å; F501-H515 HydrophobicContact CZ-CB 3.61Å; F501-H515 AromaticContact CZ-CD2 3.87Å; F501-H515 AromaticContact CZ-CG 3.86Å; I511-H515 PolarHBondContact O-CD2 3.39Å; I511-H515 PolarHBondContact O-N 3.34Å; A512-H515 PolarHBondContact O-N 3Å; H515-A517 VanDerWaalsContact C-N 3.31Å; H515-A517 PolarHBondContact O-N 3.07Å; H515-E518 IonicContact ND1-OE2 2.85Å; H515-E518 PolarHBondContact ND1-OE2 3.25Å; H515-E518 PolarHBondContact O-N 3.14Å; H515-M519 VanDerWaalsContact O-CG 3.27Å; H515-M519 WeakPolarHBondContact O-CG 3.29Å; H515-M519 PolarHBondContact O-N 3.14Å
516	L	96.8	Very high	94.6	Very high	11 Å²	11	36.5 Å²	36.5	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-42.1	174	-174.6	60.7	0	0	0	111.1	L498 F501 A512 F513 Y514 M519 H520 L536	L498-L516 HydrophobicContact CD1-CD1 3.43Å; L498-L516 VanDerWaalsContact CD1-CD1 3.43Å; L498-L516 HydrophobicContact CG-CD1 4.44Å; F501-L516 HydrophobicContact CB-CB 4.38Å; A512-L516 WeakPolarHBondContact O-CB 3.49Å; A512-L516 PolarHBondContact O-N 3.25Å; F513-L516 PolarHBondContact O-N 3.49Å; Y514-L516 VanDerWaalsContact C-N 3.34Å; Y514-L516 PolarHBondContact O-N 2.85Å; L516-M519 PolarHBondContact O-N 3.29Å; L516-H520 PolarHBondContact O-CD2 3.4Å; L516-H520 VanDerWaalsContact O-CD2 3.25Å; L516-H520 PolarHBondContact O-N 2.78Å; L516-L536 HydrophobicContact CB-CD1 4.41Å; L516-L536 HydrophobicContact CD2-CD1 4.18Å; L516-L536 HydrophobicContact CD2-CD2 4.04Å; L516-L536 HydrophobicContact CG-CD1 3.83Å
517	A	97.8	Very high	94.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-44.2	175.9	0	0	0	0	0	112.1	F513 Y514 H515 M519 H520 A521 L536 F537	F513-A517 VanDerWaalsContact O-CB 3.31Å; F513-A517 WeakPolarHBondContact O-CB 3.37Å; F513-A517 PolarHBondContact O-N 2.94Å; Y514-A517 WeakPolarHBondContact O-CB 3.17Å; Y514-A517 PolarHBondContact O-N 2.8Å; H515-A517 VanDerWaalsContact C-N 3.31Å; H515-A517 PolarHBondContact O-N 3.07Å; A517-M519 VanDerWaalsContact C-N 3.28Å; A517-M519 PolarHBondContact O-N 3.35Å; A517-H520 PolarHBondContact O-N 3.22Å; A517-A521 WeakPolarHBondContact O-CB 3.39Å; A517-A521 PolarHBondContact O-N 3.34Å; A517-L536 HydrophobicContact CB-CB 3.53Å; A517-L536 HydrophobicContact CB-CD1 4.32Å; A517-F537 HydrophobicContact CB-CD1 3.47Å; A517-F537 VanDerWaalsContact CB-CD1 3.47Å; A517-F537 HydrophobicContact CB-CD2 3.87Å; A517-F537 HydrophobicContact CB-CE1 3.32Å; A517-F537 HydrophobicContact CB-CE2 3.74Å; A517-F537 HydrophobicContact CB-CG 3.72Å; A517-F537 HydrophobicContact CB-CZ 3.44Å; A517-F537 VanDerWaalsContact CB-CZ 3.44Å
518	E	97.3	Very high	94.9	Very high	40 Å²	40	38.8 Å²	38.8	19%	0.187	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-40	174.6	-72	-173.2	132.8	0	0	111.9	Y514 H515 A521 K522 F537	Y514-E518 HydrophobicContact CD1-CG 4.32Å; Y514-E518 HydrophobicContact CE1-CG 3.81Å; Y514-E518 VanDerWaalsContact CE1-OE1 3.22Å; Y514-E518 WeakPolarHBondContact CE1-OE1 3.31Å; Y514-E518 WeakPolarHBondContact CE1-OE2 3.25Å; Y514-E518 VanDerWaalsContact CZ-OE1 3.28Å; Y514-E518 PolarHBondContact O-N 3.12Å; Y514-E518 PolarHBondContact OH-OE1 2.8Å; H515-E518 IonicContact ND1-OE2 2.85Å; H515-E518 PolarHBondContact ND1-OE2 3.25Å; H515-E518 PolarHBondContact O-N 3.14Å; E518-A521 PolarHBondContact O-N 3.08Å; E518-K522 WeakPolarHBondContact O-CB 3.46Å; E518-K522 WeakPolarHBondContact O-CG 3.32Å; E518-K522 PolarHBondContact O-N 2.93Å; E518-F537 HydrophobicContact CG-CE1 4.28Å; E518-F537 HydrophobicContact CG-CZ 3.98Å
519	M	96.9	Very high	95.4	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.02	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-42	177.2	-69.4	179	73.7	0	0	112.1	L485 Y494 A497 L498 F501 H515 L516 A517 G523 T524 V526	L485-M519 HydrophobicContact CD2-SD 4.34Å; Y494-M519 WeakPolarHBondContact O-CE 3.35Å; A497-M519 HydrophobicContact CB-CE 4.3Å; L498-M519 HydrophobicContact CB-CE 3.83Å; L498-M519 HydrophobicContact CD1-CE 4.09Å; L498-M519 HydrophobicContact CD1-SD 4.43Å; F501-M519 HydrophobicContact CD2-SD 3.66Å; F501-M519 HydrophobicContact CE2-SD 3.95Å; H515-M519 VanDerWaalsContact O-CG 3.27Å; H515-M519 WeakPolarHBondContact O-CG 3.29Å; H515-M519 PolarHBondContact O-N 3.14Å; L516-M519 PolarHBondContact O-N 3.29Å; A517-M519 VanDerWaalsContact C-N 3.28Å; A517-M519 PolarHBondContact O-N 3.35Å; M519-G523 VanDerWaalsContact O-CA 3.32Å; M519-G523 WeakPolarHBondContact O-CA 3.5Å; M519-G523 PolarHBondContact O-N 3.07Å; M519-T524 WeakPolarHBondContact CA-OG1 3.32Å; M519-T524 WeakPolarHBondContact CE-O 3.24Å; M519-T524 WeakPolarHBondContact CG-OG1 3.14Å; M519-T524 PolarHBondContact O-N 3.43Å; M519-V526 HydrophobicContact CB-CG2 4.46Å
520	H	97.5	Very high	95.7	Very high	34 Å²	34	39.4 Å²	39.4	16%	0.157	21%	0.214	C	C	.	.	H	α-helix	trans	-70.8	-32.8	175.1	-81.2	-72.7	0	0	0	113.4	L516 A517 R528 S529 A533	L516-H520 PolarHBondContact O-CD2 3.4Å; L516-H520 VanDerWaalsContact O-CD2 3.25Å; L516-H520 PolarHBondContact O-N 2.78Å; A517-H520 PolarHBondContact O-N 3.22Å; H520-R528 VanDerWaalsContact O-CA 3.3Å; H520-R528 WeakPolarHBondContact O-CA 3.29Å; H520-S529 PolarHBondContact O-N 3.38Å; H520-A533 HydrophobicContact CB-CB 3.99Å
521	A	97.4	Very high	95.9	Very high	12 Å²	12	41 Å²	41	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-69.2	-44.9	176	0	0	0	0	0	110.9	L294 A517 E518 R528 A533 F537	L294-A521 HydrophobicContact CD1-CB 4.1Å; A517-A521 WeakPolarHBondContact O-CB 3.39Å; A517-A521 PolarHBondContact O-N 3.34Å; E518-A521 PolarHBondContact O-N 3.08Å; A521-R528 WeakPolarHBondContact O-CD 3.43Å; A521-R528 WeakPolarHBondContact O-CG 3.32Å; A521-R528 PolarHBondContact O-NH1 3.12Å; A521-A533 HydrophobicContact CB-CB 3.9Å; A521-F537 HydrophobicContact CB-CE2 4.09Å
522	K	95.8	Very high	96.1	Very high	145 Å²	145	42.9 Å²	42.9	63%	0.63	24%	0.238	S	C	*	.	H	α-helix	trans	-83.7	-22.4	-178.4	-66	174	-177.2	169.3	0	113.3	E518 T524	E518-K522 WeakPolarHBondContact O-CB 3.46Å; E518-K522 WeakPolarHBondContact O-CG 3.32Å; E518-K522 PolarHBondContact O-N 2.93Å; K522-T524 HydrophobicContact CB-CG2 3.89Å
523	G	94.8	Very high	96.2	Very high	28 Å²	28	42.9 Å²	42.9	29%	0.289	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	31.3	-171.3	0	0	0	0	0	113.3	M519 G525 V526	M519-G523 VanDerWaalsContact O-CA 3.32Å; M519-G523 WeakPolarHBondContact O-CA 3.5Å; M519-G523 PolarHBondContact O-N 3.07Å; G523-G525 PolarHBondContact O-N 2.98Å; G523-V526 CarbonylContact C-O 3.14Å; G523-V526 WeakPolarHBondContact CA-O 3.38Å
524	T	92.2	Very high	96.3	Very high	41 Å²	41	41.7 Å²	41.7	25%	0.252	23%	0.233	S	C	.	.	S	Bend	trans	-87.7	106.3	-179.4	55	0	0	0	0	110.6	M519 K522 V526	M519-T524 WeakPolarHBondContact CA-OG1 3.32Å; M519-T524 WeakPolarHBondContact CE-O 3.24Å; M519-T524 WeakPolarHBondContact CG-OG1 3.14Å; M519-T524 PolarHBondContact O-N 3.43Å; K522-T524 HydrophobicContact CB-CG2 3.89Å; T524-V526 PolarHBondContact O-N 3.09Å
525	G	89.4	Confident	96.3	Very high	46 Å²	46	47 Å²	47	47%	0.474	26%	0.258	S	S	.	.	S	Bend	trans	80.6	-8.4	-178.1	0	0	0	0	0	115.3	G523	G523-G525 PolarHBondContact O-N 2.98Å
526	V	95	Very high	96.3	Very high	29 Å²	29	47.3 Å²	47.3	18%	0.176	26%	0.26	C	S	.	.	S	Bend	trans	-138.2	159.5	174.9	-72.4	0	0	0	0	109.6	L498 M519 G523 T524 R528	L498-V526 HydrophobicContact CD1-CG1 3.45Å; L498-V526 VanDerWaalsContact CD1-CG1 3.45Å; L498-V526 HydrophobicContact CD1-CG2 4.36Å; L498-V526 HydrophobicContact CD2-CG1 3.15Å; L498-V526 HydrophobicContact CG-CG1 3.87Å; M519-V526 HydrophobicContact CB-CG2 4.46Å; G523-V526 CarbonylContact C-O 3.14Å; G523-V526 WeakPolarHBondContact CA-O 3.38Å; T524-V526 PolarHBondContact O-N 3.09Å; V526-R528 PolarHBondContact O-N 2.87Å
527	L	94.5	Very high	96.4	Very high	161 Å²	161	46.8 Å²	46.8	84%	0.843	26%	0.257	S	S	*	.			trans	-61.9	135	169.2	-66.1	173.4	0	0	0	109.6	S529	L527-S529 PolarHBondContact O-N 3.2Å
528	R	96.8	Very high	96.4	Very high	140 Å²	140	47.7 Å²	47.7	53%	0.528	26%	0.261	S	S	.	.			trans	-58.8	132.7	173.9	174.1	175.6	166.3	116.5	-6.3	109.3	E291 H520 A521 V526	E291-R528 IonicContact OE1-CZ 2.58Å; E291-R528 IonicContact OE1-NE 2.81Å; E291-R528 IonicContact OE1-NH2 3.61Å; E291-R528 PolarHBondContact OE1-NH2 3.43Å; E291-R528 IonicContact OE2-CZ 2.82Å; E291-R528 IonicContact OE2-NH2 3.97Å; E291-R528 PolarHBondContact OE2-NH2 3.18Å; H520-R528 VanDerWaalsContact O-CA 3.3Å; H520-R528 WeakPolarHBondContact O-CA 3.29Å; A521-R528 WeakPolarHBondContact O-CD 3.43Å; A521-R528 WeakPolarHBondContact O-CG 3.32Å; A521-R528 PolarHBondContact O-NH1 3.12Å; V526-R528 PolarHBondContact O-N 2.87Å
529	S	97.5	Very high	96.3	Very high	29 Å²	29	48 Å²	48	20%	0.203	26%	0.264	C	S	.	.			trans	-143	107	176.9	176.1	0	0	0	0	108.8	H520 L527 S531 T532 A533	H520-S529 PolarHBondContact O-N 3.38Å; L527-S529 PolarHBondContact O-N 3.2Å; S529-S531 VanDerWaalsContact C-N 3.3Å; S529-S531 PolarHBondContact O-N 2.95Å; S529-S531 PolarHBondContact OG-OG 3.36Å; S529-T532 WeakPolarHBondContact OG-CB 3.47Å; S529-T532 PolarHBondContact OG-N 3.47Å; S529-T532 PolarHBondContact OG-OG1 2.98Å; S529-A533 VanDerWaalsContact O-CB 3.24Å; S529-A533 WeakPolarHBondContact O-CB 3.32Å; S529-A533 PolarHBondContact O-N 3.4Å
530	C	97.6	Very high	96.3	Very high	26 Å²	26	47.8 Å²	47.8	18%	0.176	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-41.9	178.1	61.2	0	0	0	0	111	C290 E291 L294 A533 A534	C290-C530 HydrophobicContact CB-CB 3.77Å; C290-C530 WeakPolarHBondContact CB-SG 3.42Å; C290-C530 WeakPolarHBondContact SG-CB 3.39Å; C290-C530 CovalentContact SG-SG 2.04Å; C290-C530 PolarHBondContact SG-SG 3.41Å; E291-C530 HydrophobicContact CG-CB 4.48Å; E291-C530 WeakPolarHBondContact OE1-CB 3.39Å; L294-C530 HydrophobicContact CD1-CB 4.4Å; C530-A533 PolarHBondContact O-N 3.28Å; C530-A534 WeakPolarHBondContact O-CB 3.43Å; C530-A534 PolarHBondContact O-N 3.32Å
531	S	96.5	Very high	96.2	Very high	56 Å²	56	46.2 Å²	46.2	39%	0.392	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-55	-179.4	55.3	0	0	0	0	110.9	W281 S529 A533 A534 E535	W281-S531 WeakPolarHBondContact CH2-O 3.5Å; W281-S531 VanDerWaalsContact CZ3-O 3.24Å; W281-S531 WeakPolarHBondContact CZ3-O 3.45Å; S529-S531 VanDerWaalsContact C-N 3.3Å; S529-S531 PolarHBondContact O-N 2.95Å; S529-S531 PolarHBondContact OG-OG 3.36Å; S531-A533 VanDerWaalsContact C-N 3.28Å; S531-A533 PolarHBondContact O-N 3.35Å; S531-A534 PolarHBondContact O-N 2.85Å; S531-E535 PolarHBondContact O-N 3.16Å
532	T	97.1	Very high	96.1	Very high	48 Å²	48	46.5 Å²	46.5	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-59	-41	178.4	-49.4	0	0	0	0	111.7	S529 L536	S529-T532 WeakPolarHBondContact OG-CB 3.47Å; S529-T532 PolarHBondContact OG-N 3.47Å; S529-T532 PolarHBondContact OG-OG1 2.98Å; T532-L536 HydrophobicContact CG2-CD1 4.02Å; T532-L536 WeakPolarHBondContact O-CB 3.42Å; T532-L536 WeakPolarHBondContact O-CD1 3.19Å; T532-L536 WeakPolarHBondContact O-CG 3.22Å; T532-L536 PolarHBondContact O-N 2.85Å
533	A	98.1	Very high	95.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-46	178	0	0	0	0	0	112.6	L294 H520 A521 S529 C530 S531 L536 F537	L294-A533 HydrophobicContact CD1-CB 3.69Å; L294-A533 HydrophobicContact CG-CB 4.44Å; H520-A533 HydrophobicContact CB-CB 3.99Å; A521-A533 HydrophobicContact CB-CB 3.9Å; S529-A533 VanDerWaalsContact O-CB 3.24Å; S529-A533 WeakPolarHBondContact O-CB 3.32Å; S529-A533 PolarHBondContact O-N 3.4Å; C530-A533 PolarHBondContact O-N 3.28Å; S531-A533 VanDerWaalsContact C-N 3.28Å; S531-A533 PolarHBondContact O-N 3.35Å; A533-L536 PolarHBondContact O-N 2.89Å; A533-F537 HydrophobicContact CB-CE2 4.45Å; A533-F537 WeakPolarHBondContact O-CB 3.4Å; A533-F537 WeakPolarHBondContact O-CD2 3.25Å; A533-F537 PolarHBondContact O-N 3.39Å
534	A	98.2	Very high	95.7	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-35.6	178	0	0	0	0	0	112.5	W281 L294 C530 S531 F537 K538	W281-A534 HydrophobicContact CE3-CB 3.62Å; W281-A534 HydrophobicContact CH2-CB 4.42Å; W281-A534 HydrophobicContact CZ3-CB 3.34Å; L294-A534 HydrophobicContact CB-CB 3.97Å; C530-A534 WeakPolarHBondContact O-CB 3.43Å; C530-A534 PolarHBondContact O-N 3.32Å; S531-A534 PolarHBondContact O-N 2.85Å; A534-F537 PolarHBondContact O-N 2.61Å; A534-K538 WeakPolarHBondContact O-CB 3.43Å; A534-K538 PolarHBondContact O-N 3.46Å
535	E	96.9	Very high	95.4	Very high	121 Å²	121	45.4 Å²	45.4	57%	0.565	23%	0.234	S	C	*	.	H	α-helix	trans	-62.5	-44.5	172.3	-172.5	-178	172	0	0	111.7	W281 S531 K538 N539	W281-E535 HydrophobicContact CH2-CB 3.94Å; W281-E535 HydrophobicContact CZ2-CB 4.25Å; S531-E535 PolarHBondContact O-N 3.16Å; E535-K538 PolarHBondContact O-N 3.46Å; E535-N539 WeakPolarHBondContact O-CB 3.22Å; E535-N539 PolarHBondContact O-N 2.7Å
536	L	98.1	Very high	95.3	Very high	22 Å²	22	44.3 Å²	44.3	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-41.7	177.2	-66.7	166	0	0	0	111.9	F513 L516 A517 T532 A533 N539 V540	F513-L536 HydrophobicContact CD1-CD2 3.68Å; F513-L536 HydrophobicContact CE1-CD2 4.08Å; L516-L536 HydrophobicContact CB-CD1 4.41Å; L516-L536 HydrophobicContact CD2-CD1 4.18Å; L516-L536 HydrophobicContact CD2-CD2 4.04Å; L516-L536 HydrophobicContact CG-CD1 3.83Å; A517-L536 HydrophobicContact CB-CB 3.53Å; A517-L536 HydrophobicContact CB-CD1 4.32Å; T532-L536 HydrophobicContact CG2-CD1 4.02Å; T532-L536 WeakPolarHBondContact O-CB 3.42Å; T532-L536 WeakPolarHBondContact O-CD1 3.19Å; T532-L536 WeakPolarHBondContact O-CG 3.22Å; T532-L536 PolarHBondContact O-N 2.85Å; A533-L536 PolarHBondContact O-N 2.89Å; L536-N539 VanDerWaalsContact O-CB 3.29Å; L536-N539 WeakPolarHBondContact O-CB 3.33Å; L536-N539 PolarHBondContact O-N 3.36Å; L536-V540 WeakPolarHBondContact O-CG2 3.2Å; L536-V540 PolarHBondContact O-N 2.95Å; L536-V540 VanDerWaalsContact O-N 3.07Å
537	F	98.6	Very high	94.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-39.4	175.3	-76.4	-51.2	0	0	0	112.2	L294 H298 A301 Y514 A517 E518 A521 A533 A534 N539 V540 A541	L294-F537 HydrophobicContact CG-CD2 4.32Å; L294-F537 HydrophobicContact CG-CE2 4.5Å; H298-F537 HydrophobicContact CB-CD2 4.15Å; H298-F537 HydrophobicContact CB-CE2 4.25Å; H298-F537 HydrophobicContact CB-CG 4.41Å; H298-F537 AromaticContact CD2-CE1 3.67Å; H298-F537 AromaticContact CD2-CE2 3.8Å; H298-F537 AromaticContact CD2-CZ 3.4Å; H298-F537 VanDerWaalsContact CD2-CZ 3.4Å; H298-F537 WeakPolarHBondContact CD2-CZ 3.49Å; A301-F537 HydrophobicContact CB-CB 4.14Å; A301-F537 HydrophobicContact CB-CD1 3.56Å; A301-F537 HydrophobicContact CB-CE1 4.43Å; A301-F537 HydrophobicContact CB-CG 4.24Å; Y514-F537 HydrophobicContact CD2-CD1 4.3Å; Y514-F537 AromaticContact CD2-CE1 3.89Å; Y514-F537 HydrophobicContact CD2-CE1 3.89Å; Y514-F537 AromaticContact CE2-CE1 3.93Å; Y514-F537 HydrophobicContact CE2-CE1 3.93Å; A517-F537 HydrophobicContact CB-CD1 3.47Å; A517-F537 VanDerWaalsContact CB-CD1 3.47Å; A517-F537 HydrophobicContact CB-CD2 3.87Å; A517-F537 HydrophobicContact CB-CE1 3.32Å; A517-F537 HydrophobicContact CB-CE2 3.74Å; A517-F537 HydrophobicContact CB-CG 3.72Å; A517-F537 HydrophobicContact CB-CZ 3.44Å; A517-F537 VanDerWaalsContact CB-CZ 3.44Å; E518-F537 HydrophobicContact CG-CE1 4.28Å; E518-F537 HydrophobicContact CG-CZ 3.98Å; A521-F537 HydrophobicContact CB-CE2 4.09Å; A533-F537 HydrophobicContact CB-CE2 4.45Å; A533-F537 WeakPolarHBondContact O-CB 3.4Å; A533-F537 WeakPolarHBondContact O-CD2 3.25Å; A533-F537 PolarHBondContact O-N 3.39Å; A534-F537 PolarHBondContact O-N 2.61Å; F537-N539 VanDerWaalsContact C-N 3.28Å; F537-N539 PolarHBondContact O-N 2.95Å; F537-V540 WeakPolarHBondContact O-CB 3.33Å; F537-V540 PolarHBondContact O-N 3.32Å; F537-V540 VanDerWaalsContact O-N 3.17Å; F537-A541 VanDerWaalsContact O-CB 3.29Å; F537-A541 WeakPolarHBondContact O-CB 3.38Å; F537-A541 PolarHBondContact O-N 3.03Å
538	K	97.9	Very high	94.4	Very high	20 Å²	20	39.1 Å²	39.1	9%	0.087	19%	0.185	C	C	.	.	H	α-helix	trans	-56.2	-45.9	170.4	177.3	-177.2	176.3	-175	0	110.6	Y297 A534 E535 V540 A541 E542	Y297-K538 HydrophobicContact CD1-CB 3.94Å; Y297-K538 HydrophobicContact CD1-CG 4.26Å; Y297-K538 HydrophobicContact CD2-CB 3.93Å; Y297-K538 HydrophobicContact CE1-CB 3.91Å; Y297-K538 HydrophobicContact CE1-CD 4.36Å; Y297-K538 HydrophobicContact CE1-CG 3.75Å; Y297-K538 HydrophobicContact CE2-CB 3.87Å; Y297-K538 HydrophobicContact CE2-CD 4.1Å; Y297-K538 HydrophobicContact CE2-CG 4.13Å; Y297-K538 HydrophobicContact CG-CB 3.96Å; A534-K538 WeakPolarHBondContact O-CB 3.43Å; A534-K538 PolarHBondContact O-N 3.46Å; E535-K538 PolarHBondContact O-N 3.46Å; K538-V540 VanDerWaalsContact C-N 3.29Å; K538-V540 PolarHBondContact O-N 2.89Å; K538-A541 PolarHBondContact O-N 3.11Å; K538-E542 WeakPolarHBondContact CE-OE1 3.19Å; K538-E542 HydrophobicContact CG-CG 4.14Å; K538-E542 VanDerWaalsContact O-CB 3.3Å; K538-E542 WeakPolarHBondContact O-CB 3.42Å; K538-E542 VanDerWaalsContact O-CG 3.24Å; K538-E542 WeakPolarHBondContact O-CG 3.47Å; K538-E542 PolarHBondContact O-N 2.8Å
539	N	95.3	Very high	94	Very high	46 Å²	46	34.3 Å²	34.3	25%	0.246	17%	0.169	C	C	.	.	H	α-helix	trans	-57.8	-39.8	177.7	-170.3	-71.5	0	0	0	112.4	E535 L536 F537 R543	E535-N539 WeakPolarHBondContact O-CB 3.22Å; E535-N539 PolarHBondContact O-N 2.7Å; L536-N539 VanDerWaalsContact O-CB 3.29Å; L536-N539 WeakPolarHBondContact O-CB 3.33Å; L536-N539 PolarHBondContact O-N 3.36Å; F537-N539 VanDerWaalsContact C-N 3.28Å; F537-N539 PolarHBondContact O-N 2.95Å; N539-R543 VanDerWaalsContact CG-NH1 3.3Å; N539-R543 PolarHBondContact O-NH1 3.08Å; N539-R543 VanDerWaalsContact OD1-CZ 3.24Å; N539-R543 PolarHBondContact OD1-NH1 3.43Å; N539-R543 PolarHBondContact OD1-NH2 3.42Å
540	V	96.4	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.9	-52.6	172.8	176.5	0	0	0	0	111	A301 V304 V510 F513 L536 F537 K538 E542 R543	A301-V540 HydrophobicContact CB-CB 3.91Å; A301-V540 HydrophobicContact CB-CG1 3.76Å; V304-V540 HydrophobicContact CB-CG1 4.18Å; V304-V540 HydrophobicContact CG1-CG1 4.18Å; V304-V540 WeakPolarHBondContact CG1-O 3.3Å; V510-V540 HydrophobicContact CG1-CG1 3.99Å; V510-V540 HydrophobicContact CG1-CG2 4.48Å; F513-V540 HydrophobicContact CB-CG2 3.54Å; L536-V540 WeakPolarHBondContact O-CG2 3.2Å; L536-V540 PolarHBondContact O-N 2.95Å; L536-V540 VanDerWaalsContact O-N 3.07Å; F537-V540 WeakPolarHBondContact O-CB 3.33Å; F537-V540 PolarHBondContact O-N 3.32Å; F537-V540 VanDerWaalsContact O-N 3.17Å; K538-V540 VanDerWaalsContact C-N 3.29Å; K538-V540 PolarHBondContact O-N 2.89Å; V540-E542 PolarHBondContact O-N 3.48Å; V540-R543 WeakPolarHBondContact O-CB 3.45Å; V540-R543 PolarHBondContact O-N 3.5Å
541	A	96.9	Very high	92.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.6	-37.2	-177.2	0	0	0	0	0	112	M274 Y297 V300 F537 K538 R543 G544 W546	M274-A541 HydrophobicContact CE-CB 4.3Å; M274-A541 HydrophobicContact SD-CB 3.39Å; M274-A541 WeakPolarHBondContact SD-CB 3.38Å; Y297-A541 HydrophobicContact CD1-CB 4.3Å; V300-A541 HydrophobicContact CB-CB 3.83Å; V300-A541 HydrophobicContact CG1-CB 3.65Å; F537-A541 VanDerWaalsContact O-CB 3.29Å; F537-A541 WeakPolarHBondContact O-CB 3.38Å; F537-A541 PolarHBondContact O-N 3.03Å; K538-A541 PolarHBondContact O-N 3.11Å; A541-R543 PolarHBondContact O-N 3.41Å; A541-G544 PolarHBondContact O-N 3.23Å; A541-G544 VanDerWaalsContact O-N 3.15Å; A541-W546 WeakPolarHBondContact O-CZ2 3.33Å; A541-W546 PolarHBondContact O-NE1 3.39Å
542	E	95.1	Very high	92.2	Very high	18 Å²	18	33.5 Å²	33.5	8%	0.084	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-9.4	176.2	-77.1	-173	169.7	0	0	114.5	M274 R326 K538 V540 S547 Y577	M274-E542 HydrophobicContact CE-CG 3.88Å; R326-E542 IonicContact CZ-OE2 3.88Å; R326-E542 IonicContact NH1-OE2 3.95Å; R326-E542 PolarHBondContact NH1-OE2 3.46Å; R326-E542 VanDerWaalsContact NH2-CB 3.31Å; R326-E542 PolarHBondContact NH2-O 2.86Å; R326-E542 IonicContact NH2-OE2 2.8Å; K538-E542 WeakPolarHBondContact CE-OE1 3.19Å; K538-E542 HydrophobicContact CG-CG 4.14Å; K538-E542 VanDerWaalsContact O-CB 3.3Å; K538-E542 WeakPolarHBondContact O-CB 3.42Å; K538-E542 VanDerWaalsContact O-CG 3.24Å; K538-E542 WeakPolarHBondContact O-CG 3.47Å; K538-E542 PolarHBondContact O-N 2.8Å; V540-E542 PolarHBondContact O-N 3.48Å; E542-S547 WeakPolarHBondContact O-CB 3.48Å; E542-Y577 WeakPolarHBondContact CA-OH 3.48Å; E542-Y577 HydrophobicContact CB-CD1 4.26Å; E542-Y577 HydrophobicContact CB-CE1 3.48Å; E542-Y577 VanDerWaalsContact CB-CE1 3.48Å; E542-Y577 HydrophobicContact CG-CD1 3.9Å; E542-Y577 HydrophobicContact CG-CE1 3.54Å; E542-Y577 HydrophobicContact CG-CE2 4.48Å; E542-Y577 WeakPolarHBondContact O-CE1 3.41Å; E542-Y577 PolarHBondContact O-OH 3.35Å
543	R	91.1	Very high	91.9	Very high	78 Å²	78	31.2 Å²	31.2	29%	0.294	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	9.2	176.6	-67.6	173	165.8	69.3	-10.6	113.6	V304 V510 N539 V540 A541	V304-R543 HydrophobicContact CG1-CB 4.47Å; V510-R543 HydrophobicContact CG1-CB 4.43Å; V510-R543 VanDerWaalsContact CG2-CD 3.41Å; N539-R543 VanDerWaalsContact CG-NH1 3.3Å; N539-R543 PolarHBondContact O-NH1 3.08Å; N539-R543 VanDerWaalsContact OD1-CZ 3.24Å; N539-R543 PolarHBondContact OD1-NH1 3.43Å; N539-R543 PolarHBondContact OD1-NH2 3.42Å; V540-R543 WeakPolarHBondContact O-CB 3.45Å; V540-R543 PolarHBondContact O-N 3.5Å; A541-R543 PolarHBondContact O-N 3.41Å
544	G	89.7	Confident	91.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.01	15%	0.147	C	C	.	.	S	Bend	trans	-61.1	168.9	171.4	0	0	0	0	0	113.1	V304 A541 W546 S547	V304-G544 VanDerWaalsContact CG2-CA 3.47Å; A541-G544 PolarHBondContact O-N 3.23Å; A541-G544 VanDerWaalsContact O-N 3.15Å; G544-W546 PolarHBondContact O-N 3.26Å; G544-W546 VanDerWaalsContact O-N 3.12Å; G544-S547 VanDerWaalsContact O-CB 3.24Å; G544-S547 WeakPolarHBondContact O-CB 3.29Å; G544-S547 PolarHBondContact O-N 3.15Å; G544-S547 PolarHBondContact O-OG 3.27Å
545	R	85.7	Confident	90.6	Very high	113 Å²	113	33.9 Å²	33.9	43%	0.426	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-55.7	-32.4	-176.1	-70	174.5	-175.8	-141.6	2	113.8	E173 E307 S547 K548	E173-R545 IonicContact OE1-NH1 2.71Å; E173-R545 PolarHBondContact OE1-NH1 3.48Å; E307-R545 IonicContact OE1-NE 2.8Å; E307-R545 WeakPolarHBondContact OE2-CD 3.47Å; E307-R545 VanDerWaalsContact OE2-CG 3.27Å; E307-R545 WeakPolarHBondContact OE2-CG 3.34Å; E307-R545 IonicContact OE2-NE 3.63Å; E307-R545 PolarHBondContact OE2-NE 3.16Å; R545-S547 PolarHBondContact O-N 3.42Å; R545-S547 VanDerWaalsContact O-N 3.17Å; R545-K548 WeakPolarHBondContact O-CB 3.39Å; R545-K548 WeakPolarHBondContact O-CG 3.22Å; R545-K548 PolarHBondContact O-N 3.25Å; R545-K548 VanDerWaalsContact O-N 3.12Å
546	W	88.8	Confident	90.1	Very high	23 Å²	23	28.1 Å²	28.1	9%	0.087	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-60.8	-20	175.9	51.4	86	0	0	0	113.8	N270 F271 V300 V304 A541 G544 K548 M549 Y577	N270-W546 HydrophobicContact CB-CH2 4.14Å; N270-W546 HydrophobicContact CB-CZ3 4.17Å; F271-W546 HydrophobicContact CD1-CD2 4.43Å; F271-W546 HydrophobicContact CD1-CG 4.44Å; F271-W546 HydrophobicContact CE1-CB 3.44Å; F271-W546 VanDerWaalsContact CE1-CB 3.44Å; F271-W546 AromaticContact CE1-CD2 3.74Å; F271-W546 HydrophobicContact CE1-CD2 3.74Å; F271-W546 AromaticContact CE1-CE3 3.92Å; F271-W546 HydrophobicContact CE1-CE3 3.92Å; F271-W546 AromaticContact CE1-CG 3.56Å; F271-W546 HydrophobicContact CE1-CG 3.56Å; F271-W546 HydrophobicContact CZ-CB 3.64Å; F271-W546 HydrophobicContact CZ-CG 4.28Å; V300-W546 HydrophobicContact CG1-CH2 3.5Å; V300-W546 VanDerWaalsContact CG1-CH2 3.5Å; V300-W546 HydrophobicContact CG1-CZ2 3.38Å; V304-W546 HydrophobicContact CG2-CH2 3.72Å; V304-W546 HydrophobicContact CG2-CZ2 3.92Å; A541-W546 WeakPolarHBondContact O-CZ2 3.33Å; A541-W546 PolarHBondContact O-NE1 3.39Å; G544-W546 PolarHBondContact O-N 3.26Å; G544-W546 VanDerWaalsContact O-N 3.12Å; W546-K548 PolarHBondContact O-N 2.69Å; W546-K548 VanDerWaalsContact O-N 3.11Å; W546-M549 HydrophobicContact CB-SD 4.39Å; W546-M549 WeakPolarHBondContact O-CB 3.29Å; W546-M549 VanDerWaalsContact O-CG 3.22Å; W546-M549 WeakPolarHBondContact O-CG 3.14Å; W546-M549 PolarHBondContact O-N 3.23Å; W546-Y577 VanDerWaalsContact CD1-OH 3.24Å; W546-Y577 PolarHBondContact NE1-OH 3.38Å
547	S	86.4	Confident	89.6	Confident	9 Å²	9	27.9 Å²	27.9	6%	0.063	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-56.7	-26.4	172.8	63.4	0	0	0	0	112.6	V324 E542 G544 R545 M549 F550	V324-S547 WeakPolarHBondContact CG1-O 3.36Å; V324-S547 WeakPolarHBondContact CG2-OG 3.41Å; E542-S547 WeakPolarHBondContact O-CB 3.48Å; G544-S547 VanDerWaalsContact O-CB 3.24Å; G544-S547 WeakPolarHBondContact O-CB 3.29Å; G544-S547 PolarHBondContact O-N 3.15Å; G544-S547 PolarHBondContact O-OG 3.27Å; R545-S547 PolarHBondContact O-N 3.42Å; R545-S547 VanDerWaalsContact O-N 3.17Å; S547-M549 PolarHBondContact O-N 3.32Å; S547-F550 WeakPolarHBondContact O-CB 3.48Å; S547-F550 PolarHBondContact O-N 3.23Å
548	K	83.9	Confident	88.9	Confident	71 Å²	71	32.9 Å²	32.9	31%	0.309	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-54.6	-25.3	171.8	-69.2	-178	176.3	-172.9	0	113.5	V324 R545 W546 F550 M551 S552	V324-K548 HydrophobicContact CG2-CG 4.36Å; R545-K548 WeakPolarHBondContact O-CB 3.39Å; R545-K548 WeakPolarHBondContact O-CG 3.22Å; R545-K548 PolarHBondContact O-N 3.25Å; R545-K548 VanDerWaalsContact O-N 3.12Å; W546-K548 PolarHBondContact O-N 2.69Å; W546-K548 VanDerWaalsContact O-N 3.11Å; K548-F550 PolarHBondContact O-N 2.86Å; K548-F550 VanDerWaalsContact O-N 3.16Å; K548-M551 WeakPolarHBondContact O-CB 3.49Å; K548-M551 PolarHBondContact O-N 3.01Å; K548-S552 PolarHBondContact O-N 3.45Å
549	M	88.8	Confident	88.3	Confident	39 Å²	39	36.7 Å²	36.7	19%	0.192	17%	0.174	C	C	.	.	H	α-helix	trans	-57.2	-27.4	175	-68.4	175.3	173.4	0	0	112.7	L210 F271 W546 S547 M551 S552 A553 T568 L571 L572	L210-M549 HydrophobicContact CD1-CE 4.06Å; F271-M549 HydrophobicContact CE2-CE 4.1Å; F271-M549 HydrophobicContact CZ-CE 3.91Å; W546-M549 HydrophobicContact CB-SD 4.39Å; W546-M549 WeakPolarHBondContact O-CB 3.29Å; W546-M549 VanDerWaalsContact O-CG 3.22Å; W546-M549 WeakPolarHBondContact O-CG 3.14Å; W546-M549 PolarHBondContact O-N 3.23Å; S547-M549 PolarHBondContact O-N 3.32Å; M549-M551 VanDerWaalsContact C-N 3.34Å; M549-M551 PolarHBondContact O-N 3.48Å; M549-S552 PolarHBondContact O-N 3.23Å; M549-A553 VanDerWaalsContact O-CB 3.25Å; M549-A553 WeakPolarHBondContact O-CB 3.22Å; M549-A553 PolarHBondContact O-N 3.39Å; M549-T568 HydrophobicContact CB-CG2 3.82Å; M549-T568 HydrophobicContact CG-CG2 4.44Å; M549-L571 HydrophobicContact CE-CD2 4.23Å; M549-L571 HydrophobicContact SD-CD2 3.93Å; M549-L572 HydrophobicContact CB-CD1 3.94Å; M549-L572 HydrophobicContact CB-CD2 4.2Å; M549-L572 HydrophobicContact CB-CG 4.31Å; M549-L572 HydrophobicContact SD-CD2 4.47Å
550	F	88.9	Confident	88	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-43	172.3	-86.8	-81.1	0	0	0	112.5	V324 R326 S547 K548 Y554 Y569 L572 Y577 V579 A580	V324-F550 HydrophobicContact CG1-CB 4.1Å; R326-F550 HydrophobicContact CB-CD1 3.99Å; R326-F550 HydrophobicContact CB-CE1 4.08Å; R326-F550 HydrophobicContact CB-CG 4.26Å; R326-F550 HydrophobicContact CB-CZ 4.42Å; R326-F550 HydrophobicContact CG-CD1 4.18Å; R326-F550 HydrophobicContact CG-CD2 3.9Å; R326-F550 HydrophobicContact CG-CE1 4.32Å; R326-F550 HydrophobicContact CG-CE2 4.04Å; R326-F550 HydrophobicContact CG-CG 3.97Å; R326-F550 HydrophobicContact CG-CZ 4.25Å; S547-F550 WeakPolarHBondContact O-CB 3.48Å; S547-F550 PolarHBondContact O-N 3.23Å; K548-F550 PolarHBondContact O-N 2.86Å; K548-F550 VanDerWaalsContact O-N 3.16Å; F550-Y554 WeakPolarHBondContact O-CB 3.48Å; F550-Y554 PolarHBondContact O-N 3.29Å; F550-Y569 AromaticContact CD1-CE1 3.92Å; F550-Y569 HydrophobicContact CD1-CE1 3.92Å; F550-Y569 HydrophobicContact CE1-CD1 4.46Å; F550-Y569 HydrophobicContact CE1-CE1 4.19Å; F550-L572 HydrophobicContact CD1-CD1 4.25Å; F550-L572 HydrophobicContact CD2-CD1 3.81Å; F550-L572 HydrophobicContact CD2-CD2 4.31Å; F550-L572 HydrophobicContact CE1-CD1 4.28Å; F550-L572 HydrophobicContact CE2-CD1 3.85Å; F550-L572 HydrophobicContact CE2-CD2 4.02Å; F550-L572 HydrophobicContact CE2-CG 4.36Å; F550-L572 HydrophobicContact CG-CD1 4.01Å; F550-L572 HydrophobicContact CZ-CB 4.41Å; F550-L572 HydrophobicContact CZ-CD1 4.08Å; F550-Y577 AromaticContact CE2-CD1 3.45Å; F550-Y577 HydrophobicContact CE2-CD1 3.45Å; F550-Y577 VanDerWaalsContact CE2-CD1 3.45Å; F550-Y577 HydrophobicContact CE2-CD2 4.28Å; F550-Y577 AromaticContact CE2-CE1 3.69Å; F550-Y577 HydrophobicContact CE2-CE1 3.69Å; F550-Y577 AromaticContact CE2-CG 3.75Å; F550-Y577 HydrophobicContact CE2-CG 3.75Å; F550-Y577 AromaticContact CZ-CD1 3.76Å; F550-Y577 HydrophobicContact CZ-CD1 3.76Å; F550-Y577 HydrophobicContact CZ-CE1 4.45Å; F550-Y577 AromaticContact CZ-CG 3.83Å; F550-Y577 HydrophobicContact CZ-CG 3.83Å; F550-V579 HydrophobicContact CE1-CB 4.05Å; F550-V579 HydrophobicContact CE1-CG1 4.04Å; F550-V579 HydrophobicContact CZ-CB 4.46Å; F550-A580 HydrophobicContact CE1-CB 3.98Å; F550-A580 HydrophobicContact CZ-CB 3.84Å
551	M	82.5	Confident	87.6	Confident	44 Å²	44	47 Å²	47	22%	0.217	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-41.4	-180	-63.9	177.3	67.4	0	0	110.8	V324 K548 M549 Y554 S555	V324-M551 HydrophobicContact CG1-CG 4.47Å; V324-M551 HydrophobicContact CG2-SD 4.47Å; K548-M551 WeakPolarHBondContact O-CB 3.49Å; K548-M551 PolarHBondContact O-N 3.01Å; M549-M551 VanDerWaalsContact C-N 3.34Å; M549-M551 PolarHBondContact O-N 3.48Å; M551-Y554 PolarHBondContact O-N 3.19Å; M551-S555 WeakPolarHBondContact O-CB 3.4Å; M551-S555 PolarHBondContact O-N 2.99Å
552	S	82.6	Confident	87.3	Confident	50 Å²	50	49.5 Å²	49.5	35%	0.35	22%	0.219	S	C	.	.	H	α-helix	trans	-61.7	-49.5	174.7	-174.5	0	0	0	0	111.5	K548 M549 Y554 S555 A556	K548-S552 PolarHBondContact O-N 3.45Å; M549-S552 PolarHBondContact O-N 3.23Å; S552-Y554 VanDerWaalsContact C-N 3.35Å; S552-Y554 PolarHBondContact O-N 3.04Å; S552-S555 PolarHBondContact O-N 3.02Å; S552-A556 WeakPolarHBondContact O-CB 3.24Å; S552-A556 PolarHBondContact O-N 2.96Å
553	A	89.7	Confident	87.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-40.8	178.7	0	0	0	0	0	112.6	M549 A556 F557 A565 T568 Y569	M549-A553 VanDerWaalsContact O-CB 3.25Å; M549-A553 WeakPolarHBondContact O-CB 3.22Å; M549-A553 PolarHBondContact O-N 3.39Å; A553-A556 PolarHBondContact O-N 3.25Å; A553-F557 WeakPolarHBondContact O-CB 3.49Å; A553-F557 PolarHBondContact O-N 3.49Å; A553-A565 WeakPolarHBondContact O-CB 3.2Å; A553-T568 HydrophobicContact CB-CG2 3.79Å; A553-Y569 HydrophobicContact CB-CD1 4.06Å; A553-Y569 HydrophobicContact CB-CD2 3.97Å; A553-Y569 HydrophobicContact CB-CE1 3.78Å; A553-Y569 HydrophobicContact CB-CE2 3.69Å; A553-Y569 HydrophobicContact CB-CG 4.14Å
554	Y	87.2	Confident	87	Confident	9 Å²	9	47.9 Å²	47.9	4%	0.035	22%	0.215	C	C	.	.	H	α-helix	trans	-65.9	-45.2	175.4	-177	-96.9	0	0	0	112	A327 L329 E332 G342 L344 F550 M551 S552 A556 F557 R558 Y569	A327-Y554 HydrophobicContact CB-CD2 3.79Å; A327-Y554 HydrophobicContact CB-CE2 3.91Å; A327-Y554 HydrophobicContact CB-CG 4.45Å; L329-Y554 HydrophobicContact CD2-CD2 3.86Å; L329-Y554 HydrophobicContact CD2-CE2 4.07Å; E332-Y554 HydrophobicContact CG-CE2 4.33Å; G342-Y554 PolarHBondContact O-OH 3.46Å; L344-Y554 HydrophobicContact CD1-CD1 3.17Å; L344-Y554 HydrophobicContact CD1-CE1 3.57Å; L344-Y554 HydrophobicContact CD1-CG 3.91Å; L344-Y554 HydrophobicContact CG-CD1 3.94Å; L344-Y554 HydrophobicContact CG-CE1 3.8Å; F550-Y554 WeakPolarHBondContact O-CB 3.48Å; F550-Y554 PolarHBondContact O-N 3.29Å; M551-Y554 PolarHBondContact O-N 3.19Å; S552-Y554 VanDerWaalsContact C-N 3.35Å; S552-Y554 PolarHBondContact O-N 3.04Å; Y554-A556 VanDerWaalsContact C-N 3.34Å; Y554-A556 PolarHBondContact O-N 3.26Å; Y554-F557 PolarHBondContact O-N 3.5Å; Y554-R558 HydrophobicContact CD1-CG 4.07Å; Y554-R558 HydrophobicContact CE1-CG 3.7Å; Y554-R558 HydrophobicContact CE2-CG 4.36Å; Y554-R558 WeakPolarHBondContact O-CG 3.37Å; Y554-R558 PolarHBondContact O-N 2.95Å; Y554-Y569 WeakPolarHBondContact CA-OH 3.15Å; Y554-Y569 PolarHBondContact N-OH 3.02Å
555	S	81.7	Confident	87.1	Confident	46 Å²	46	47.8 Å²	47.8	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-59.7	-44.6	174.7	177.3	0	0	0	0	111.5	M551 S552 F557 R558 N559	M551-S555 WeakPolarHBondContact O-CB 3.4Å; M551-S555 PolarHBondContact O-N 2.99Å; S552-S555 PolarHBondContact O-N 3.02Å; S555-F557 PolarHBondContact O-N 2.91Å; S555-R558 PolarHBondContact O-N 3.06Å; S555-N559 VanDerWaalsContact O-CB 3.28Å; S555-N559 WeakPolarHBondContact O-CB 3.47Å; S555-N559 VanDerWaalsContact O-CG 3.3Å; S555-N559 PolarHBondContact O-N 2.88Å; S555-N559 PolarHBondContact O-ND2 3.3Å; S555-N559 PolarHBondContact OG-ND2 3.45Å
556	A	86	Confident	87.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.1	-46.1	175	0	0	0	0	0	111.4	S552 A553 Y554 N559 R560 R561 E564 A565	S552-A556 WeakPolarHBondContact O-CB 3.24Å; S552-A556 PolarHBondContact O-N 2.96Å; A553-A556 PolarHBondContact O-N 3.25Å; Y554-A556 VanDerWaalsContact C-N 3.34Å; Y554-A556 PolarHBondContact O-N 3.26Å; A556-N559 CarbonylContact O-C 3.52Å; A556-N559 PolarHBondContact O-N 2.95Å; A556-R560 PolarHBondContact O-N 2.83Å; A556-R561 HydrophobicContact CB-CB 4.09Å; A556-R561 WeakPolarHBondContact O-CA 3.48Å; A556-R561 WeakPolarHBondContact O-CB 3.45Å; A556-R561 PolarHBondContact O-N 3.04Å; A556-E564 HydrophobicContact CB-CB 4.29Å; A556-E564 HydrophobicContact CB-CG 3.85Å; A556-A565 HydrophobicContact CB-CB 4.05Å
557	F	88.8	Confident	87.8	Confident	18 Å²	18	41.4 Å²	41.4	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-48.1	177.7	-177.9	-94.9	0	0	0	112.4	L329 A553 Y554 S555 N559 R560 Y562 A565 F586 I587 K592	L329-F557 HydrophobicContact CD1-CD1 4.23Å; L329-F557 HydrophobicContact CD1-CD2 3.85Å; L329-F557 HydrophobicContact CD1-CE1 4.25Å; L329-F557 HydrophobicContact CD1-CE2 3.89Å; L329-F557 HydrophobicContact CD1-CG 4.03Å; L329-F557 HydrophobicContact CD1-CZ 4.09Å; L329-F557 HydrophobicContact CD2-CD1 3.59Å; L329-F557 HydrophobicContact CD2-CE1 3.85Å; L329-F557 HydrophobicContact CD2-CG 4.04Å; L329-F557 HydrophobicContact CD2-CZ 4.49Å; A553-F557 WeakPolarHBondContact O-CB 3.49Å; A553-F557 PolarHBondContact O-N 3.49Å; Y554-F557 PolarHBondContact O-N 3.5Å; S555-F557 PolarHBondContact O-N 2.91Å; F557-N559 VanDerWaalsContact C-N 3.29Å; F557-N559 PolarHBondContact O-N 2.93Å; F557-R560 PolarHBondContact O-N 3.4Å; F557-Y562 AromaticContact CD2-CD1 3.8Å; F557-Y562 HydrophobicContact CD2-CD1 3.8Å; F557-Y562 HydrophobicContact CD2-CE1 4.1Å; F557-Y562 AromaticContact CE2-CD1 3.93Å; F557-Y562 HydrophobicContact CE2-CD1 3.93Å; F557-Y562 AromaticContact CE2-CE1 3.96Å; F557-Y562 HydrophobicContact CE2-CE1 3.96Å; F557-Y562 HydrophobicContact CZ-CE1 4.44Å; F557-A565 HydrophobicContact CB-CB 3.81Å; F557-F586 HydrophobicContact CE2-CE1 4.45Å; F557-F586 AromaticContact CZ-CE1 3.94Å; F557-F586 HydrophobicContact CZ-CE1 3.94Å; F557-I587 HydrophobicContact CD2-CD1 4.08Å; F557-I587 HydrophobicContact CD2-CG1 4.07Å; F557-I587 HydrophobicContact CE2-CD1 4.4Å; F557-I587 HydrophobicContact CE2-CG1 3.88Å; F557-K592 HydrophobicContact CE2-CD 4.2Å
558	R	84.1	Confident	88.2	Confident	104 Å²	104	41.2 Å²	41.2	39%	0.392	19%	0.188	S	C	.	.	H	α-helix	trans	-61.8	-37.4	177.1	-71.6	-69.2	-65.3	-135.7	-2.2	112.2	M336 Y554 S555 R560	M336-R558 PolarHBondContact SD-NH1 3.35Å; M336-R558 VanDerWaalsContact SD-NH1 3.35Å; Y554-R558 HydrophobicContact CD1-CG 4.07Å; Y554-R558 HydrophobicContact CE1-CG 3.7Å; Y554-R558 HydrophobicContact CE2-CG 4.36Å; Y554-R558 WeakPolarHBondContact O-CG 3.37Å; Y554-R558 PolarHBondContact O-N 2.95Å; S555-R558 PolarHBondContact O-N 3.06Å; R558-R560 PolarHBondContact O-N 3.33Å
559	N	85	Confident	88.9	Confident	101 Å²	101	37.8 Å²	37.8	54%	0.54	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	12.6	175.4	-69.5	-50	0	0	0	113.5	S555 A556 F557 R561	S555-N559 VanDerWaalsContact O-CB 3.28Å; S555-N559 WeakPolarHBondContact O-CB 3.47Å; S555-N559 VanDerWaalsContact O-CG 3.3Å; S555-N559 PolarHBondContact O-N 2.88Å; S555-N559 PolarHBondContact O-ND2 3.3Å; S555-N559 PolarHBondContact OG-ND2 3.45Å; A556-N559 CarbonylContact O-C 3.52Å; A556-N559 PolarHBondContact O-N 2.95Å; F557-N559 VanDerWaalsContact C-N 3.29Å; F557-N559 PolarHBondContact O-N 2.93Å; N559-R561 PolarHBondContact O-N 2.88Å; N559-R561 VanDerWaalsContact O-N 3.1Å
560	R	89	Confident	89.2	Confident	189 Å²	189	36.3 Å²	36.3	71%	0.713	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	17.2	179.7	-51.7	-178.4	-177.8	-80.9	3.5	114.5	A556 F557 R558 Y562	A556-R560 PolarHBondContact O-N 2.83Å; F557-R560 PolarHBondContact O-N 3.4Å; R558-R560 PolarHBondContact O-N 3.33Å; R560-Y562 HydrophobicContact CB-CE1 4.45Å; R560-Y562 HydrophobicContact CB-CE2 4.2Å; R560-Y562 PolarHBondContact NH1-OH 2.97Å; R560-Y562 PolarHBondContact O-N 3.32Å
561	R	88.3	Confident	89.6	Confident	74 Å²	74	36.3 Å²	36.3	28%	0.279	17%	0.166	S	C	.	.			trans	-82	65	169	-65	-178.9	-72	139.5	0.4	108.8	A556 N559 H563 E564 A565	A556-R561 HydrophobicContact CB-CB 4.09Å; A556-R561 WeakPolarHBondContact O-CA 3.48Å; A556-R561 WeakPolarHBondContact O-CB 3.45Å; A556-R561 PolarHBondContact O-N 3.04Å; N559-R561 PolarHBondContact O-N 2.88Å; N559-R561 VanDerWaalsContact O-N 3.1Å; R561-H563 VanDerWaalsContact C-N 3.33Å; R561-H563 PolarHBondContact O-N 3.45Å; R561-E564 HydrophobicContact CB-CB 4.47Å; R561-E564 IonicContact CZ-OE1 3.75Å; R561-E564 IonicContact CZ-OE2 3.23Å; R561-E564 IonicContact NE-OE2 3.94Å; R561-E564 IonicContact NH1-OE1 2.74Å; R561-E564 PolarHBondContact NH1-OE1 2.98Å; R561-E564 IonicContact NH1-OE2 2.61Å; R561-E564 PolarHBondContact NH1-OE2 3.21Å; R561-E564 PolarHBondContact O-N 3.3Å; R561-A565 PolarHBondContact O-N 3.49Å; R561-A565 VanDerWaalsContact O-N 3.12Å
562	Y	90.8	Very high	90.4	Very high	52 Å²	52	34.2 Å²	34.2	20%	0.204	16%	0.156	C	C	.	.	H	α-helix	trans	-65.6	-33.2	-171.1	-57.4	-53.3	0	0	0	113.4	F557 R560 A565 F566 K592	F557-Y562 AromaticContact CD2-CD1 3.8Å; F557-Y562 HydrophobicContact CD2-CD1 3.8Å; F557-Y562 HydrophobicContact CD2-CE1 4.1Å; F557-Y562 AromaticContact CE2-CD1 3.93Å; F557-Y562 HydrophobicContact CE2-CD1 3.93Å; F557-Y562 AromaticContact CE2-CE1 3.96Å; F557-Y562 HydrophobicContact CE2-CE1 3.96Å; F557-Y562 HydrophobicContact CZ-CE1 4.44Å; R560-Y562 HydrophobicContact CB-CE1 4.45Å; R560-Y562 HydrophobicContact CB-CE2 4.2Å; R560-Y562 PolarHBondContact NH1-OH 2.97Å; R560-Y562 PolarHBondContact O-N 3.32Å; Y562-A565 PolarHBondContact O-N 3.26Å; Y562-F566 WeakPolarHBondContact O-CB 3.3Å; Y562-F566 PolarHBondContact O-N 3.21Å; Y562-K592 WeakPolarHBondContact CB-O 3.42Å; Y562-K592 HydrophobicContact CD1-CB 4.32Å; Y562-K592 HydrophobicContact CD1-CD 4.08Å; Y562-K592 HydrophobicContact CD1-CG 4.42Å; Y562-K592 HydrophobicContact CD2-CB 4.12Å; Y562-K592 HydrophobicContact CD2-CG 4.1Å; Y562-K592 HydrophobicContact CE1-CD 3.79Å; Y562-K592 HydrophobicContact CE1-CG 4.4Å; Y562-K592 HydrophobicContact CE2-CD 4.23Å; Y562-K592 HydrophobicContact CE2-CG 4.06Å; Y562-K592 HydrophobicContact CG-CB 3.97Å; Y562-K592 HydrophobicContact CG-CD 4.43Å; Y562-K592 HydrophobicContact CG-CG 4.28Å
563	H	89.4	Confident	91.1	Very high	41 Å²	41	31.8 Å²	31.8	19%	0.19	14%	0.139	C	C	.	.	H	α-helix	trans	-61.3	-53.7	177.2	177.9	-88.3	0	0	0	111.7	F218 R561 A565 F566 V567 T594	F218-H563 AromaticContact CE2-NE2 3.26Å; F218-H563 VanDerWaalsContact CE2-NE2 3.26Å; F218-H563 WeakPolarHBondContact CE2-NE2 3.36Å; F218-H563 AromaticContact CZ-CE1 3.87Å; F218-H563 AromaticContact CZ-NE2 3.22Å; F218-H563 WeakPolarHBondContact CZ-NE2 3.44Å; R561-H563 VanDerWaalsContact C-N 3.33Å; R561-H563 PolarHBondContact O-N 3.45Å; H563-A565 VanDerWaalsContact C-N 3.34Å; H563-A565 PolarHBondContact O-N 2.9Å; H563-F566 PolarHBondContact O-N 3.48Å; H563-V567 WeakPolarHBondContact O-CG2 3.43Å; H563-V567 PolarHBondContact O-N 3.24Å; H563-T594 PolarHBondContact CD2-OG1 3Å; H563-T594 VanDerWaalsContact CD2-OG1 3.24Å
564	E	89.8	Confident	91.5	Very high	20 Å²	20	32.1 Å²	32.1	9%	0.093	14%	0.141	C	C	.	.	H	α-helix	trans	-58.6	-44.9	176.7	169.6	-179.9	166.4	0	0	111.8	L210 A556 R561 F566 T568	L210-E564 WeakPolarHBondContact O-CA 3.31Å; L210-E564 WeakPolarHBondContact O-CB 3.49Å; L210-E564 VanDerWaalsContact O-CG 3.31Å; L210-E564 WeakPolarHBondContact O-CG 3.26Å; A556-E564 HydrophobicContact CB-CB 4.29Å; A556-E564 HydrophobicContact CB-CG 3.85Å; R561-E564 HydrophobicContact CB-CB 4.47Å; R561-E564 IonicContact CZ-OE1 3.75Å; R561-E564 IonicContact CZ-OE2 3.23Å; R561-E564 IonicContact NE-OE2 3.94Å; R561-E564 IonicContact NH1-OE1 2.74Å; R561-E564 PolarHBondContact NH1-OE1 2.98Å; R561-E564 IonicContact NH1-OE2 2.61Å; R561-E564 PolarHBondContact NH1-OE2 3.21Å; R561-E564 PolarHBondContact O-N 3.3Å; E564-F566 PolarHBondContact O-N 2.91Å; E564-T568 VanDerWaalsContact O-CB 3.29Å; E564-T568 WeakPolarHBondContact O-CB 3.17Å; E564-T568 PolarHBondContact O-N 3.35Å; E564-T568 PolarHBondContact O-OG1 2.94Å
565	A	92.3	Very high	92	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-46.7	175.8	0	0	0	0	0	111.8	A553 A556 F557 R561 Y562 H563 T568 Y569	A553-A565 WeakPolarHBondContact O-CB 3.2Å; A556-A565 HydrophobicContact CB-CB 4.05Å; F557-A565 HydrophobicContact CB-CB 3.81Å; R561-A565 PolarHBondContact O-N 3.49Å; R561-A565 VanDerWaalsContact O-N 3.12Å; Y562-A565 PolarHBondContact O-N 3.26Å; H563-A565 VanDerWaalsContact C-N 3.34Å; H563-A565 PolarHBondContact O-N 2.9Å; A565-T568 PolarHBondContact O-N 3.44Å; A565-Y569 HydrophobicContact CB-CD2 4.46Å; A565-Y569 HydrophobicContact CB-CE2 4.47Å; A565-Y569 WeakPolarHBondContact O-CB 3.37Å; A565-Y569 WeakPolarHBondContact O-CD2 3.46Å; A565-Y569 PolarHBondContact O-N 2.89Å
566	F	95	Very high	92.7	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.009	12%	0.124	C	C	.	.	H	α-helix	trans	-61.1	-50.7	-179.7	174.8	-108.9	0	0	0	111.7	L248 Y562 H563 E564 T568 Y569 Q570 V584 I587 L588 A593 I596	L248-F566 HydrophobicContact CD2-CE1 4.02Å; Y562-F566 WeakPolarHBondContact O-CB 3.3Å; Y562-F566 PolarHBondContact O-N 3.21Å; H563-F566 PolarHBondContact O-N 3.48Å; E564-F566 PolarHBondContact O-N 2.91Å; F566-T568 VanDerWaalsContact C-N 3.35Å; F566-T568 PolarHBondContact O-N 3.46Å; F566-Y569 PolarHBondContact O-N 3.27Å; F566-Q570 VanDerWaalsContact O-CB 3.24Å; F566-Q570 WeakPolarHBondContact O-CB 3.49Å; F566-Q570 PolarHBondContact O-N 2.86Å; F566-V584 HydrophobicContact CE2-CG1 3.91Å; F566-I587 HydrophobicContact CB-CG2 4.14Å; F566-I587 HydrophobicContact CD2-CB 4.34Å; F566-I587 HydrophobicContact CD2-CG2 3.91Å; F566-I587 HydrophobicContact CG-CG2 4.39Å; F566-L588 HydrophobicContact CE2-CD1 4.42Å; F566-L588 HydrophobicContact CE2-CD2 3.81Å; F566-L588 HydrophobicContact CE2-CG 3.89Å; F566-L588 HydrophobicContact CZ-CD2 4.04Å; F566-A593 HydrophobicContact CD1-CB 4.09Å; F566-A593 HydrophobicContact CD2-CB 3.76Å; F566-A593 HydrophobicContact CE1-CB 4.14Å; F566-A593 HydrophobicContact CE2-CB 3.83Å; F566-A593 HydrophobicContact CG-CB 3.9Å; F566-A593 HydrophobicContact CZ-CB 4.02Å; F566-I596 HydrophobicContact CE1-CD1 4.33Å; F566-I596 HydrophobicContact CE1-CG1 4.25Å; F566-I596 HydrophobicContact CZ-CD1 4.36Å; F566-I596 HydrophobicContact CZ-CG1 4.17Å
567	V	94.1	Very high	93.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65	-40.5	-179.5	-178.5	0	0	0	0	111	L209 L210 F218 H563 Q570 L571	L209-V567 HydrophobicContact CD1-CG1 4.18Å; L209-V567 HydrophobicContact CG-CG1 4.05Å; L210-V567 HydrophobicContact CD2-CG1 4.18Å; F218-V567 HydrophobicContact CE1-CG1 4.36Å; F218-V567 HydrophobicContact CE1-CG2 3.75Å; F218-V567 HydrophobicContact CZ-CG2 3.65Å; H563-V567 WeakPolarHBondContact O-CG2 3.43Å; H563-V567 PolarHBondContact O-N 3.24Å; V567-Q570 PolarHBondContact O-N 3.47Å; V567-L571 PolarHBondContact O-N 3.38Å
568	T	94.7	Very high	93.6	Very high	4 Å²	4	30 Å²	30	3%	0.025	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-43.5	177.3	-52.7	0	0	0	0	111.9	M549 A553 E564 A565 F566 Q570 L571 L572	M549-T568 HydrophobicContact CB-CG2 3.82Å; M549-T568 HydrophobicContact CG-CG2 4.44Å; A553-T568 HydrophobicContact CB-CG2 3.79Å; E564-T568 VanDerWaalsContact O-CB 3.29Å; E564-T568 WeakPolarHBondContact O-CB 3.17Å; E564-T568 PolarHBondContact O-N 3.35Å; E564-T568 PolarHBondContact O-OG1 2.94Å; A565-T568 PolarHBondContact O-N 3.44Å; F566-T568 VanDerWaalsContact C-N 3.35Å; F566-T568 PolarHBondContact O-N 3.46Å; T568-Q570 VanDerWaalsContact C-N 3.34Å; T568-L571 PolarHBondContact O-N 3.45Å; T568-L572 HydrophobicContact CG2-CD1 4.42Å; T568-L572 WeakPolarHBondContact O-CG 3.46Å; T568-L572 PolarHBondContact O-N 3.19Å; T568-L572 VanDerWaalsContact O-N 3.08Å
569	Y	97.4	Very high	94.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.3	-36.1	173.2	-76.7	-54.5	0	0	0	112	L329 F550 A553 Y554 A565 F566 L571 L572 A573 A580 N583 V584 I587	L329-Y569 HydrophobicContact CD1-CE2 3.99Å; F550-Y569 AromaticContact CD1-CE1 3.92Å; F550-Y569 HydrophobicContact CD1-CE1 3.92Å; F550-Y569 HydrophobicContact CE1-CD1 4.46Å; F550-Y569 HydrophobicContact CE1-CE1 4.19Å; A553-Y569 HydrophobicContact CB-CD1 4.06Å; A553-Y569 HydrophobicContact CB-CD2 3.97Å; A553-Y569 HydrophobicContact CB-CE1 3.78Å; A553-Y569 HydrophobicContact CB-CE2 3.69Å; A553-Y569 HydrophobicContact CB-CG 4.14Å; Y554-Y569 WeakPolarHBondContact CA-OH 3.15Å; Y554-Y569 PolarHBondContact N-OH 3.02Å; A565-Y569 HydrophobicContact CB-CD2 4.46Å; A565-Y569 HydrophobicContact CB-CE2 4.47Å; A565-Y569 WeakPolarHBondContact O-CB 3.37Å; A565-Y569 WeakPolarHBondContact O-CD2 3.46Å; A565-Y569 PolarHBondContact O-N 2.89Å; F566-Y569 PolarHBondContact O-N 3.27Å; Y569-L571 VanDerWaalsContact C-N 3.35Å; Y569-L572 HydrophobicContact CD1-CD1 4.46Å; Y569-L572 PolarHBondContact O-N 3.24Å; Y569-A573 WeakPolarHBondContact O-CB 3.35Å; Y569-A573 PolarHBondContact O-N 2.81Å; Y569-A580 HydrophobicContact CD1-CB 4.22Å; Y569-N583 HydrophobicContact CD1-CB 3.9Å; Y569-N583 HydrophobicContact CD2-CB 4.01Å; Y569-N583 HydrophobicContact CE1-CB 4.06Å; Y569-N583 WeakPolarHBondContact CE1-ND2 3.47Å; Y569-N583 HydrophobicContact CE2-CB 4.17Å; Y569-N583 HydrophobicContact CG-CB 3.89Å; Y569-N583 VanDerWaalsContact CZ-ND2 3.3Å; Y569-N583 PolarHBondContact OH-ND2 2.85Å; Y569-V584 VanDerWaalsContact C-CG2 3.45Å; Y569-I587 HydrophobicContact CD2-CD1 3.72Å; Y569-I587 HydrophobicContact CE2-CD1 4.25Å
570	Q	96.5	Very high	94.9	Very high	8 Å²	8	21.1 Å²	21.1	4%	0.037	9%	0.087	C	C	.	.	H	α-helix	trans	-63.4	-41.8	176.2	-174.7	61.1	61.4	0	0	111.3	F242 L248 F566 V567 T568 A573 E574 V584	F242-Q570 HydrophobicContact CE2-CB 4.49Å; F242-Q570 HydrophobicContact CE2-CG 3.98Å; F242-Q570 HydrophobicContact CZ-CB 4.26Å; F242-Q570 HydrophobicContact CZ-CG 3.93Å; L248-Q570 HydrophobicContact CD1-CG 4.23Å; F566-Q570 VanDerWaalsContact O-CB 3.24Å; F566-Q570 WeakPolarHBondContact O-CB 3.49Å; F566-Q570 PolarHBondContact O-N 2.86Å; V567-Q570 PolarHBondContact O-N 3.47Å; T568-Q570 VanDerWaalsContact C-N 3.34Å; Q570-A573 PolarHBondContact O-N 3.3Å; Q570-E574 PolarHBondContact NE2-OE1 3.36Å; Q570-E574 WeakPolarHBondContact O-CG 3.38Å; Q570-E574 PolarHBondContact O-N 2.9Å; Q570-E574 VanDerWaalsContact O-N 3.07Å; Q570-V584 HydrophobicContact CB-CG2 4.26Å
571	L	97.2	Very high	95.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-57.2	-55.5	171.9	177.7	66.8	0	0	0	110.8	M206 L210 F238 F242 F271 M549 V567 T568 Y569 A573 E574 L575	M206-L571 HydrophobicContact CE-CD2 3.8Å; L210-L571 HydrophobicContact CD1-CD2 4.25Å; L210-L571 HydrophobicContact CD2-CD2 3.97Å; F238-L571 HydrophobicContact CE1-CD1 3.6Å; F238-L571 HydrophobicContact CZ-CD1 3.43Å; F238-L571 VanDerWaalsContact CZ-CD1 3.43Å; F242-L571 HydrophobicContact CD2-CD1 3.97Å; F242-L571 VanDerWaalsContact CE2-CA 3.4Å; F242-L571 HydrophobicContact CE2-CB 4.09Å; F242-L571 HydrophobicContact CE2-CD1 4.21Å; F242-L571 HydrophobicContact CG-CD1 4.18Å; F242-L571 HydrophobicContact CZ-CB 4.17Å; F271-L571 HydrophobicContact CE2-CD2 4.41Å; M549-L571 HydrophobicContact CE-CD2 4.23Å; M549-L571 HydrophobicContact SD-CD2 3.93Å; V567-L571 PolarHBondContact O-N 3.38Å; T568-L571 PolarHBondContact O-N 3.45Å; Y569-L571 VanDerWaalsContact C-N 3.35Å; L571-A573 VanDerWaalsContact C-N 3.26Å; L571-A573 PolarHBondContact O-N 3.35Å; L571-E574 PolarHBondContact O-N 3.12Å; L571-E574 VanDerWaalsContact O-N 3.12Å; L571-L575 WeakPolarHBondContact O-CG 3.25Å; L571-L575 PolarHBondContact O-N 2.83Å; L571-L575 VanDerWaalsContact O-N 3.14Å
572	L	98	Very high	95.8	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-60.8	-33.9	179.1	-69.5	166.5	0	0	0	112.7	M549 F550 T568 Y569 L575 G576 Y577 A580	M549-L572 HydrophobicContact CB-CD1 3.94Å; M549-L572 HydrophobicContact CB-CD2 4.2Å; M549-L572 HydrophobicContact CB-CG 4.31Å; M549-L572 HydrophobicContact SD-CD2 4.47Å; F550-L572 HydrophobicContact CD1-CD1 4.25Å; F550-L572 HydrophobicContact CD2-CD1 3.81Å; F550-L572 HydrophobicContact CD2-CD2 4.31Å; F550-L572 HydrophobicContact CE1-CD1 4.28Å; F550-L572 HydrophobicContact CE2-CD1 3.85Å; F550-L572 HydrophobicContact CE2-CD2 4.02Å; F550-L572 HydrophobicContact CE2-CG 4.36Å; F550-L572 HydrophobicContact CG-CD1 4.01Å; F550-L572 HydrophobicContact CZ-CB 4.41Å; F550-L572 HydrophobicContact CZ-CD1 4.08Å; T568-L572 HydrophobicContact CG2-CD1 4.42Å; T568-L572 WeakPolarHBondContact O-CG 3.46Å; T568-L572 PolarHBondContact O-N 3.19Å; T568-L572 VanDerWaalsContact O-N 3.08Å; Y569-L572 HydrophobicContact CD1-CD1 4.46Å; Y569-L572 PolarHBondContact O-N 3.24Å; L572-L575 HydrophobicContact CD2-CD1 4.44Å; L572-L575 PolarHBondContact O-N 3.35Å; L572-G576 PolarHBondContact O-N 3.48Å; L572-Y577 HydrophobicContact CB-CD2 4.28Å; L572-Y577 HydrophobicContact CD2-CD2 4.04Å; L572-Y577 HydrophobicContact CD2-CE2 3.91Å; L572-Y577 WeakPolarHBondContact O-CD2 3.23Å; L572-Y577 PolarHBondContact O-N 3.28Å; L572-A580 HydrophobicContact CB-CB 3.45Å; L572-A580 VanDerWaalsContact CB-CB 3.45Å
573	A	98.1	Very high	96.1	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-66	-38	176.7	0	0	0	0	0	112.1	Y569 Q570 L571 L575 G576 A580 Q581 V584	Y569-A573 WeakPolarHBondContact O-CB 3.35Å; Y569-A573 PolarHBondContact O-N 2.81Å; Q570-A573 PolarHBondContact O-N 3.3Å; L571-A573 VanDerWaalsContact C-N 3.26Å; L571-A573 PolarHBondContact O-N 3.35Å; A573-L575 VanDerWaalsContact C-N 3.32Å; A573-G576 PolarHBondContact O-N 3.32Å; A573-G576 VanDerWaalsContact O-N 3.11Å; A573-A580 HydrophobicContact CB-CB 4.21Å; A573-Q581 HydrophobicContact CB-CB 4.35Å; A573-Q581 HydrophobicContact CB-CG 3.65Å; A573-Q581 PolarHBondContact O-NE2 2.78Å; A573-Q581 VanDerWaalsContact O-NE2 3.14Å; A573-V584 HydrophobicContact CB-CG2 3.95Å
574	E	97.2	Very high	96.5	Very high	7 Å²	7	4.1 Å²	4.1	3%	0.033	2%	0.021	C	C	.	.	H	α-helix	trans	-70.6	-26.1	173.7	-71.5	-57.2	131.8	0	0	112.8	F242 A245 A275 R279 Q570 L571 G576 R611	F242-E574 HydrophobicContact CD2-CB 4.13Å; F242-E574 HydrophobicContact CD2-CG 3.92Å; F242-E574 HydrophobicContact CE2-CB 4.38Å; F242-E574 HydrophobicContact CE2-CG 3.95Å; A245-E574 HydrophobicContact CB-CG 4.46Å; A275-E574 WeakPolarHBondContact CA-O 3.4Å; A275-E574 WeakPolarHBondContact CB-O 3.49Å; R279-E574 IonicContact CZ-OE2 3.61Å; R279-E574 IonicContact NH2-OE2 2.69Å; R279-E574 PolarHBondContact NH2-OE2 3.28Å; Q570-E574 PolarHBondContact NE2-OE1 3.36Å; Q570-E574 WeakPolarHBondContact O-CG 3.38Å; Q570-E574 PolarHBondContact O-N 2.9Å; Q570-E574 VanDerWaalsContact O-N 3.07Å; L571-E574 PolarHBondContact O-N 3.12Å; L571-E574 VanDerWaalsContact O-N 3.12Å; E574-G576 PolarHBondContact O-N 3.05Å; E574-R611 IonicContact OE1-CZ 2.61Å; E574-R611 IonicContact OE1-NH1 3.55Å; E574-R611 PolarHBondContact OE1-NH1 2.74Å; E574-R611 IonicContact OE2-NH1 3.77Å
575	L	97.7	Very high	96.9	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.016	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-3	169.1	-53.5	-172.8	0	0	0	113.2	F238 F271 M274 A275 L571 L572 A573 Y577	F238-L575 HydrophobicContact CE2-CD2 4.12Å; F238-L575 HydrophobicContact CZ-CD2 4.12Å; F271-L575 HydrophobicContact CB-CD2 3.67Å; F271-L575 HydrophobicContact CD1-CD1 3.98Å; F271-L575 HydrophobicContact CE1-CD1 4.34Å; F271-L575 HydrophobicContact CG-CD1 4.18Å; F271-L575 HydrophobicContact CG-CD2 4.11Å; F271-L575 VanDerWaalsContact O-CD2 3.28Å; F271-L575 WeakPolarHBondContact O-CD2 3.49Å; M274-L575 HydrophobicContact CB-CB 4.07Å; M274-L575 HydrophobicContact CB-CD2 4.14Å; A275-L575 HydrophobicContact CB-CD2 4.45Å; L571-L575 WeakPolarHBondContact O-CG 3.25Å; L571-L575 PolarHBondContact O-N 2.83Å; L571-L575 VanDerWaalsContact O-N 3.14Å; L572-L575 HydrophobicContact CD2-CD1 4.44Å; L572-L575 PolarHBondContact O-N 3.35Å; A573-L575 VanDerWaalsContact C-N 3.32Å; L575-Y577 HydrophobicContact CB-CD2 3.98Å; L575-Y577 HydrophobicContact CB-CE2 4.12Å; L575-Y577 HydrophobicContact CD1-CE2 4.34Å
576	G	97.1	Very high	97.1	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.017	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	8.6	175.8	0	0	0	0	0	115.8	Y278 L572 A573 E574 E578 Q615	Y278-G576 VanDerWaalsContact CD2-CA 3.46Å; L572-G576 PolarHBondContact O-N 3.48Å; A573-G576 PolarHBondContact O-N 3.32Å; A573-G576 VanDerWaalsContact O-N 3.11Å; E574-G576 PolarHBondContact O-N 3.05Å; G576-E578 PolarHBondContact O-N 2.81Å; G576-Q615 PolarHBondContact O-NE2 3.39Å; G576-Q615 VanDerWaalsContact O-NE2 3.14Å; G576-Q615 PolarHBondContact O-OE1 3.14Å; G576-Q615 VanDerWaalsContact O-OE1 3.05Å
577	Y	97.8	Very high	97.1	Very high	1 Å²	1	3.3 Å²	3.3	0%	0.004	2%	0.017	C	C	.	.			trans	-70.8	116.5	176.6	-73	-93.9	0	0	0	111.4	M274 E542 W546 F550 L572 L575 V579 A580 Q581	M274-Y577 HydrophobicContact CE-CE2 4.24Å; E542-Y577 WeakPolarHBondContact CA-OH 3.48Å; E542-Y577 HydrophobicContact CB-CD1 4.26Å; E542-Y577 HydrophobicContact CB-CE1 3.48Å; E542-Y577 VanDerWaalsContact CB-CE1 3.48Å; E542-Y577 HydrophobicContact CG-CD1 3.9Å; E542-Y577 HydrophobicContact CG-CE1 3.54Å; E542-Y577 HydrophobicContact CG-CE2 4.48Å; E542-Y577 WeakPolarHBondContact O-CE1 3.41Å; E542-Y577 PolarHBondContact O-OH 3.35Å; W546-Y577 VanDerWaalsContact CD1-OH 3.24Å; W546-Y577 PolarHBondContact NE1-OH 3.38Å; F550-Y577 AromaticContact CE2-CD1 3.45Å; F550-Y577 HydrophobicContact CE2-CD1 3.45Å; F550-Y577 VanDerWaalsContact CE2-CD1 3.45Å; F550-Y577 HydrophobicContact CE2-CD2 4.28Å; F550-Y577 AromaticContact CE2-CE1 3.69Å; F550-Y577 HydrophobicContact CE2-CE1 3.69Å; F550-Y577 AromaticContact CE2-CG 3.75Å; F550-Y577 HydrophobicContact CE2-CG 3.75Å; F550-Y577 AromaticContact CZ-CD1 3.76Å; F550-Y577 HydrophobicContact CZ-CD1 3.76Å; F550-Y577 HydrophobicContact CZ-CE1 4.45Å; F550-Y577 AromaticContact CZ-CG 3.83Å; F550-Y577 HydrophobicContact CZ-CG 3.83Å; L572-Y577 HydrophobicContact CB-CD2 4.28Å; L572-Y577 HydrophobicContact CD2-CD2 4.04Å; L572-Y577 HydrophobicContact CD2-CE2 3.91Å; L572-Y577 WeakPolarHBondContact O-CD2 3.23Å; L572-Y577 PolarHBondContact O-N 3.28Å; L575-Y577 HydrophobicContact CB-CD2 3.98Å; L575-Y577 HydrophobicContact CB-CE2 4.12Å; L575-Y577 HydrophobicContact CD1-CE2 4.34Å; Y577-V579 PolarHBondContact O-N 3.24Å; Y577-A580 PolarHBondContact O-N 3.42Å; Y577-Q581 WeakPolarHBondContact O-CG 3.43Å; Y577-Q581 PolarHBondContact O-N 3.13Å; Y577-Q581 VanDerWaalsContact O-N 3.09Å
578	E	97.1	Very high	97.3	Very high	28 Å²	28	3.4 Å²	3.4	13%	0.131	2%	0.017	C	C	.	.	H	α-helix	trans	-54.6	-47.3	178.8	177	-77.9	134.8	0	0	113.1	R328 G576 A580 Q581 S582 S612 Q615 S617	R328-E578 IonicContact CZ-OE1 3.41Å; R328-E578 IonicContact CZ-OE2 2.71Å; R328-E578 IonicContact NE-OE1 3.74Å; R328-E578 VanDerWaalsContact NH2-CD 3.31Å; R328-E578 IonicContact NH2-OE1 3.12Å; R328-E578 PolarHBondContact NH2-OE1 3.14Å; R328-E578 VanDerWaalsContact NH2-OE1 3.14Å; R328-E578 IonicContact NH2-OE2 3.11Å; R328-E578 PolarHBondContact NH2-OE2 2.91Å; G576-E578 PolarHBondContact O-N 2.81Å; E578-A580 VanDerWaalsContact C-N 3.3Å; E578-A580 PolarHBondContact O-N 2.91Å; E578-Q581 WeakPolarHBondContact O-CB 3.39Å; E578-Q581 PolarHBondContact O-N 3.42Å; E578-S582 PolarHBondContact O-N 3.31Å; E578-S612 PolarHBondContact OE1-OG 3.47Å; E578-Q615 HydrophobicContact CB-CB 3.97Å; E578-Q615 HydrophobicContact CB-CG 4.5Å; E578-Q615 HydrophobicContact CG-CB 3.92Å; E578-S617 VanDerWaalsContact CD-CB 3.5Å; E578-S617 WeakPolarHBondContact OE1-CB 3.45Å; E578-S617 PolarHBondContact OE1-OG 3.41Å
579	V	96.7	Very high	97.2	Very high	17 Å²	17	5.3 Å²	5.3	10%	0.103	3%	0.026	C	C	.	.	H	α-helix	trans	-62	-40.8	-178.9	178.8	0	0	0	0	110.8	R326 A327 R328 F550 Y577 S582 N583	R326-V579 HydrophobicContact CB-CB 4.27Å; R326-V579 HydrophobicContact CB-CG1 4.19Å; R326-V579 HydrophobicContact CB-CG2 4.14Å; A327-V579 WeakPolarHBondContact O-CG1 3.49Å; R328-V579 HydrophobicContact CB-CG1 4.19Å; F550-V579 HydrophobicContact CE1-CB 4.05Å; F550-V579 HydrophobicContact CE1-CG1 4.04Å; F550-V579 HydrophobicContact CZ-CB 4.46Å; Y577-V579 PolarHBondContact O-N 3.24Å; V579-S582 PolarHBondContact O-N 3.46Å; V579-S582 PolarHBondContact O-OG 2.91Å; V579-N583 WeakPolarHBondContact O-CB 3.47Å; V579-N583 PolarHBondContact O-N 3.48Å; V579-N583 PolarHBondContact O-OD1 3.4Å
580	A	98.2	Very high	97	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-64.9	-41.7	177.9	0	0	0	0	0	111.5	F550 Y569 L572 A573 Y577 E578 S582 N583 V584	F550-A580 HydrophobicContact CE1-CB 3.98Å; F550-A580 HydrophobicContact CZ-CB 3.84Å; Y569-A580 HydrophobicContact CD1-CB 4.22Å; L572-A580 HydrophobicContact CB-CB 3.45Å; L572-A580 VanDerWaalsContact CB-CB 3.45Å; A573-A580 HydrophobicContact CB-CB 4.21Å; Y577-A580 PolarHBondContact O-N 3.42Å; E578-A580 VanDerWaalsContact C-N 3.3Å; E578-A580 PolarHBondContact O-N 2.91Å; A580-S582 VanDerWaalsContact C-N 3.34Å; A580-S582 PolarHBondContact O-N 3.19Å; A580-N583 PolarHBondContact O-N 3.46Å; A580-N583 VanDerWaalsContact O-N 3.12Å; A580-V584 WeakPolarHBondContact O-CG2 3.28Å; A580-V584 PolarHBondContact O-N 2.91Å
581	Q	98.3	Very high	96.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.2	-45.8	174.7	-66.1	167.5	-2.2	0	0	111.4	Y278 A573 Y577 E578 N583 V584 A585 R611 S612 Q615	Y278-Q581 PolarHBondContact OH-NE2 3.01Å; Y278-Q581 VanDerWaalsContact OH-NE2 3.14Å; A573-Q581 HydrophobicContact CB-CB 4.35Å; A573-Q581 HydrophobicContact CB-CG 3.65Å; A573-Q581 PolarHBondContact O-NE2 2.78Å; A573-Q581 VanDerWaalsContact O-NE2 3.14Å; Y577-Q581 WeakPolarHBondContact O-CG 3.43Å; Y577-Q581 PolarHBondContact O-N 3.13Å; Y577-Q581 VanDerWaalsContact O-N 3.09Å; E578-Q581 WeakPolarHBondContact O-CB 3.39Å; E578-Q581 PolarHBondContact O-N 3.42Å; Q581-N583 VanDerWaalsContact C-N 3.32Å; Q581-N583 PolarHBondContact O-N 2.73Å; Q581-V584 PolarHBondContact O-N 2.84Å; Q581-A585 PolarHBondContact O-N 2.95Å; Q581-R611 HydrophobicContact CG-CB 4.41Å; Q581-R611 PolarHBondContact OE1-O 2.86Å; Q581-S612 VanDerWaalsContact OE1-N 3.15Å; Q581-Q615 VanDerWaalsContact CD-NE2 3.3Å
582	S	98	Very high	96.5	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.5	-37.4	175.3	67.9	0	0	0	0	112.9	R328 E578 V579 A580 A585 F586	R328-S582 WeakPolarHBondContact CG-OG 3.44Å; R328-S582 PolarHBondContact NE-OG 3.46Å; E578-S582 PolarHBondContact O-N 3.31Å; V579-S582 PolarHBondContact O-N 3.46Å; V579-S582 PolarHBondContact O-OG 2.91Å; A580-S582 VanDerWaalsContact C-N 3.34Å; A580-S582 PolarHBondContact O-N 3.19Å; S582-A585 PolarHBondContact O-N 3.43Å; S582-F586 WeakPolarHBondContact O-CB 3.36Å; S582-F586 PolarHBondContact O-N 3.33Å
583	N	97.6	Very high	95.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-71.1	-38.3	179	-70.8	-9.7	0	0	0	112.4	A327 R328 L329 Y569 V579 A580 Q581 F586 I587	A327-N583 PolarHBondContact O-ND2 2.75Å; R328-N583 WeakPolarHBondContact CA-OD1 3.46Å; L329-N583 HydrophobicContact CD1-CB 3.96Å; L329-N583 HydrophobicContact CG-CB 4.15Å; L329-N583 PolarHBondContact N-OD1 2.84Å; Y569-N583 HydrophobicContact CD1-CB 3.9Å; Y569-N583 HydrophobicContact CD2-CB 4.01Å; Y569-N583 HydrophobicContact CE1-CB 4.06Å; Y569-N583 WeakPolarHBondContact CE1-ND2 3.47Å; Y569-N583 HydrophobicContact CE2-CB 4.17Å; Y569-N583 HydrophobicContact CG-CB 3.89Å; Y569-N583 VanDerWaalsContact CZ-ND2 3.3Å; Y569-N583 PolarHBondContact OH-ND2 2.85Å; V579-N583 WeakPolarHBondContact O-CB 3.47Å; V579-N583 PolarHBondContact O-N 3.48Å; V579-N583 PolarHBondContact O-OD1 3.4Å; A580-N583 PolarHBondContact O-N 3.46Å; A580-N583 VanDerWaalsContact O-N 3.12Å; Q581-N583 VanDerWaalsContact C-N 3.32Å; Q581-N583 PolarHBondContact O-N 2.73Å; N583-F586 PolarHBondContact O-N 3.36Å; N583-I587 VanDerWaalsContact O-CG1 3.26Å; N583-I587 WeakPolarHBondContact O-CG1 3.32Å; N583-I587 PolarHBondContact O-N 2.92Å
584	V	97.9	Very high	95.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-59.6	-50.2	171.9	172.1	0	0	0	0	109.9	F566 Y569 Q570 A573 A580 Q581 F586 I587 L588 Q608	F566-V584 HydrophobicContact CE2-CG1 3.91Å; Y569-V584 VanDerWaalsContact C-CG2 3.45Å; Q570-V584 HydrophobicContact CB-CG2 4.26Å; A573-V584 HydrophobicContact CB-CG2 3.95Å; A580-V584 WeakPolarHBondContact O-CG2 3.28Å; A580-V584 PolarHBondContact O-N 2.91Å; Q581-V584 PolarHBondContact O-N 2.84Å; V584-F586 VanDerWaalsContact C-N 3.28Å; V584-F586 PolarHBondContact O-N 3.18Å; V584-I587 PolarHBondContact O-N 2.77Å; V584-L588 HydrophobicContact CG1-CD1 3.91Å; V584-L588 WeakPolarHBondContact O-CG 3.5Å; V584-L588 PolarHBondContact O-N 3.13Å; V584-Q608 HydrophobicContact CB-CG 4.31Å; V584-Q608 HydrophobicContact CG1-CG 3.82Å
585	A	97.9	Very high	94.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.9	-43.9	179.3	0	0	0	0	0	111.5	Q581 S582 L588 E589 A605 Q608 W609	Q581-A585 PolarHBondContact O-N 2.95Å; S582-A585 PolarHBondContact O-N 3.43Å; A585-L588 WeakPolarHBondContact O-CB 2.95Å; A585-L588 PolarHBondContact O-N 3.45Å; A585-E589 WeakPolarHBondContact O-CG 3.28Å; A585-E589 PolarHBondContact O-N 3.29Å; A585-A605 HydrophobicContact CB-CB 4.42Å; A585-Q608 HydrophobicContact CB-CB 3.78Å; A585-W609 HydrophobicContact CB-CD2 3.5Å; A585-W609 HydrophobicContact CB-CE3 4.05Å; A585-W609 HydrophobicContact CB-CG 3.85Å; A585-W609 HydrophobicContact CB-CH2 4.26Å; A585-W609 HydrophobicContact CB-CZ2 3.75Å; A585-W609 HydrophobicContact CB-CZ3 4.42Å
586	F	96.4	Very high	94	Very high	5 Å²	5	25.8 Å²	25.8	2%	0.022	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-47.4	176.5	178	-93.1	0	0	0	113.1	L329 L330 I333 F557 S582 N583 V584 L588 E589 E590 W609	L329-F586 HydrophobicContact CB-CD1 3.6Å; L329-F586 HydrophobicContact CB-CE1 4.11Å; L329-F586 HydrophobicContact CB-CG 4.13Å; L329-F586 HydrophobicContact CD1-CD1 3.97Å; L329-F586 HydrophobicContact CG-CD1 4.46Å; L330-F586 HydrophobicContact CB-CD2 4.28Å; L330-F586 HydrophobicContact CD1-CD2 4.07Å; L330-F586 HydrophobicContact CD1-CE2 4.35Å; I333-F586 HydrophobicContact CD1-CE1 3.81Å; I333-F586 HydrophobicContact CD1-CE2 3.5Å; I333-F586 HydrophobicContact CD1-CZ 3Å; I333-F586 HydrophobicContact CG1-CZ 4.43Å; F557-F586 HydrophobicContact CE2-CE1 4.45Å; F557-F586 AromaticContact CZ-CE1 3.94Å; F557-F586 HydrophobicContact CZ-CE1 3.94Å; S582-F586 WeakPolarHBondContact O-CB 3.36Å; S582-F586 PolarHBondContact O-N 3.33Å; N583-F586 PolarHBondContact O-N 3.36Å; V584-F586 VanDerWaalsContact C-N 3.28Å; V584-F586 PolarHBondContact O-N 3.18Å; F586-L588 VanDerWaalsContact C-N 3.27Å; F586-L588 PolarHBondContact O-N 3.36Å; F586-E589 PolarHBondContact O-N 2.79Å; F586-E590 HydrophobicContact CD1-CG 4.45Å; F586-E590 HydrophobicContact CE1-CG 3.75Å; F586-E590 HydrophobicContact CE2-CG 3.94Å; F586-E590 HydrophobicContact CZ-CG 3.39Å; F586-E590 WeakPolarHBondContact O-CG 3.24Å; F586-E590 PolarHBondContact O-N 3.25Å; F586-W609 HydrophobicContact CB-CH2 4.45Å; F586-W609 HydrophobicContact CB-CZ2 4.45Å
587	I	96.2	Very high	93.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-35.7	179.3	-68.2	167.8	0	0	0	111.4	L329 F557 F566 Y569 N583 V584 K592 A593	L329-I587 HydrophobicContact CD1-CD1 3.91Å; L329-I587 HydrophobicContact CD1-CG1 3.86Å; F557-I587 HydrophobicContact CD2-CD1 4.08Å; F557-I587 HydrophobicContact CD2-CG1 4.07Å; F557-I587 HydrophobicContact CE2-CD1 4.4Å; F557-I587 HydrophobicContact CE2-CG1 3.88Å; F566-I587 HydrophobicContact CB-CG2 4.14Å; F566-I587 HydrophobicContact CD2-CB 4.34Å; F566-I587 HydrophobicContact CD2-CG2 3.91Å; F566-I587 HydrophobicContact CG-CG2 4.39Å; Y569-I587 HydrophobicContact CD2-CD1 3.72Å; Y569-I587 HydrophobicContact CE2-CD1 4.25Å; N583-I587 VanDerWaalsContact O-CG1 3.26Å; N583-I587 WeakPolarHBondContact O-CG1 3.32Å; N583-I587 PolarHBondContact O-N 2.92Å; V584-I587 PolarHBondContact O-N 2.77Å; I587-K592 HydrophobicContact CG2-CB 3.98Å; I587-K592 PolarHBondContact O-N 2.71Å; I587-K592 VanDerWaalsContact O-N 3.15Å; I587-A593 HydrophobicContact CG2-CB 4.14Å
588	L	96.5	Very high	93.2	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-64.2	-48.9	174.5	-72.7	168.2	0	0	0	111.3	F566 V584 A585 F586 E590 E591 A593 I596 I601 R604 A605	F566-L588 HydrophobicContact CE2-CD1 4.42Å; F566-L588 HydrophobicContact CE2-CD2 3.81Å; F566-L588 HydrophobicContact CE2-CG 3.89Å; F566-L588 HydrophobicContact CZ-CD2 4.04Å; V584-L588 HydrophobicContact CG1-CD1 3.91Å; V584-L588 WeakPolarHBondContact O-CG 3.5Å; V584-L588 PolarHBondContact O-N 3.13Å; A585-L588 WeakPolarHBondContact O-CB 2.95Å; A585-L588 PolarHBondContact O-N 3.45Å; F586-L588 VanDerWaalsContact C-N 3.27Å; F586-L588 PolarHBondContact O-N 3.36Å; L588-E590 PolarHBondContact O-N 2.93Å; L588-E591 PolarHBondContact O-N 3.46Å; L588-A593 HydrophobicContact CD2-CB 3.94Å; L588-I596 HydrophobicContact CD2-CG1 4.28Å; L588-I596 HydrophobicContact CD2-CG2 4.34Å; L588-I601 HydrophobicContact CB-CG2 4.16Å; L588-I601 WeakPolarHBondContact O-CG2 3.49Å; L588-R604 HydrophobicContact CD1-CB 3.75Å; L588-A605 HydrophobicContact CB-CB 4.03Å; L588-A605 HydrophobicContact CD1-CB 4.28Å
589	E	94.2	Very high	93	Very high	44 Å²	44	39.6 Å²	39.6	21%	0.206	22%	0.221	C	C	.	.	H	α-helix	trans	-55.7	-39.5	178	-77.8	-177.7	177.7	0	0	113.3	A585 F586 E591 A605 W609 K623 Y627	A585-E589 WeakPolarHBondContact O-CG 3.28Å; A585-E589 PolarHBondContact O-N 3.29Å; F586-E589 PolarHBondContact O-N 2.79Å; E589-E591 PolarHBondContact O-N 3.04Å; E589-A605 HydrophobicContact CG-CB 4.39Å; E589-W609 PolarHBondContact OE1-NE1 2.8Å; E589-K623 IonicContact OE2-NZ 2.69Å; E589-K623 PolarHBondContact OE2-NZ 3.14Å; E589-Y627 VanDerWaalsContact CG-OH 3.22Å; E589-Y627 WeakPolarHBondContact CG-OH 3.48Å; E589-Y627 WeakPolarHBondContact OE1-CE2 3.45Å; E589-Y627 VanDerWaalsContact OE1-CZ 3.23Å; E589-Y627 PolarHBondContact OE1-OH 3Å
590	E	93	Very high	92.8	Very high	92 Å²	92	41.9 Å²	41.9	43%	0.43	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	3.2	-179.9	-68.5	-76.9	124	0	0	113.4	F586 L588 K592	F586-E590 HydrophobicContact CD1-CG 4.45Å; F586-E590 HydrophobicContact CE1-CG 3.75Å; F586-E590 HydrophobicContact CE2-CG 3.94Å; F586-E590 HydrophobicContact CZ-CG 3.39Å; F586-E590 WeakPolarHBondContact O-CG 3.24Å; F586-E590 PolarHBondContact O-N 3.25Å; L588-E590 PolarHBondContact O-N 2.93Å; E590-K592 HydrophobicContact CB-CB 4.39Å; E590-K592 HydrophobicContact CB-CD 3.69Å; E590-K592 HydrophobicContact CB-CG 3.91Å; E590-K592 HydrophobicContact CG-CD 4.43Å; E590-K592 PolarHBondContact O-N 3.11Å; E590-K592 VanDerWaalsContact O-N 3.08Å; E590-K592 IonicContact OE2-NZ 2.74Å; E590-K592 PolarHBondContact OE2-NZ 3.05Å
591	E	91.8	Very high	92.6	Very high	112 Å²	112	42.3 Å²	42.3	52%	0.523	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	29	-172.9	-58.6	-168.8	-173.5	0	0	113.2	L588 E589 K598 I601	L588-E591 PolarHBondContact O-N 3.46Å; E589-E591 PolarHBondContact O-N 3.04Å; E591-K598 IonicContact OE2-NZ 3.62Å; E591-K598 PolarHBondContact OE2-NZ 3.1Å; E591-I601 HydrophobicContact CG-CD1 4.1Å
592	K	90.4	Very high	92.5	Very high	48 Å²	48	45.9 Å²	45.9	21%	0.209	25%	0.249	C	C	.	.			trans	-87.8	-17.7	-178.4	-76.8	169.2	-174.6	149.1	0	113.1	F557 Y562 I587 E590	F557-K592 HydrophobicContact CE2-CD 4.2Å; Y562-K592 WeakPolarHBondContact CB-O 3.42Å; Y562-K592 HydrophobicContact CD1-CB 4.32Å; Y562-K592 HydrophobicContact CD1-CD 4.08Å; Y562-K592 HydrophobicContact CD1-CG 4.42Å; Y562-K592 HydrophobicContact CD2-CB 4.12Å; Y562-K592 HydrophobicContact CD2-CG 4.1Å; Y562-K592 HydrophobicContact CE1-CD 3.79Å; Y562-K592 HydrophobicContact CE1-CG 4.4Å; Y562-K592 HydrophobicContact CE2-CD 4.23Å; Y562-K592 HydrophobicContact CE2-CG 4.06Å; Y562-K592 HydrophobicContact CG-CB 3.97Å; Y562-K592 HydrophobicContact CG-CD 4.43Å; Y562-K592 HydrophobicContact CG-CG 4.28Å; I587-K592 HydrophobicContact CG2-CB 3.98Å; I587-K592 PolarHBondContact O-N 2.71Å; I587-K592 VanDerWaalsContact O-N 3.15Å; E590-K592 HydrophobicContact CB-CB 4.39Å; E590-K592 HydrophobicContact CB-CD 3.69Å; E590-K592 HydrophobicContact CB-CG 3.91Å; E590-K592 HydrophobicContact CG-CD 4.43Å; E590-K592 PolarHBondContact O-N 3.11Å; E590-K592 VanDerWaalsContact O-N 3.08Å; E590-K592 IonicContact OE2-NZ 2.74Å; E590-K592 PolarHBondContact OE2-NZ 3.05Å
593	A	86.9	Confident	92.5	Very high	14 Å²	14	51.7 Å²	51.7	12%	0.116	27%	0.274	C	S	.	.			trans	-73.3	124.2	174.5	0	0	0	0	0	110.5	F566 I587 L588 I596	F566-A593 HydrophobicContact CD1-CB 4.09Å; F566-A593 HydrophobicContact CD2-CB 3.76Å; F566-A593 HydrophobicContact CE1-CB 4.14Å; F566-A593 HydrophobicContact CE2-CB 3.83Å; F566-A593 HydrophobicContact CG-CB 3.9Å; F566-A593 HydrophobicContact CZ-CB 4.02Å; I587-A593 HydrophobicContact CG2-CB 4.14Å; L588-A593 HydrophobicContact CD2-CB 3.94Å; A593-I596 HydrophobicContact CB-CG1 4.3Å
594	T	82	Confident	92.4	Very high	81 Å²	81	54.2 Å²	54.2	50%	0.497	28%	0.284	S	S	.	.	S	Bend	trans	-88.4	148.6	175.2	51.6	0	0	0	0	111.1	H563 I596	H563-T594 PolarHBondContact CD2-OG1 3Å; H563-T594 VanDerWaalsContact CD2-OG1 3.24Å; T594-I596 PolarHBondContact O-N 3.18Å
595	G	82.1	Confident	92.4	Very high	77 Å²	77	54.2 Å²	54.2	79%	0.794	28%	0.284	S	S	*	.	S	Bend	trans	84	0.6	175.6	0	0	0	0	0	116
596	I	87.9	Confident	92.4	Very high	20 Å²	20	55.8 Å²	55.8	10%	0.103	29%	0.291	C	S	.	.			trans	-97.3	129.7	176.4	-55.9	-58.4	0	0	0	110.1	L248 F566 L588 A593 T594 E600 I601	L248-I596 HydrophobicContact CD2-CD1 3.95Å; F566-I596 HydrophobicContact CE1-CD1 4.33Å; F566-I596 HydrophobicContact CE1-CG1 4.25Å; F566-I596 HydrophobicContact CZ-CD1 4.36Å; F566-I596 HydrophobicContact CZ-CG1 4.17Å; L588-I596 HydrophobicContact CD2-CG1 4.28Å; L588-I596 HydrophobicContact CD2-CG2 4.34Å; A593-I596 HydrophobicContact CB-CG1 4.3Å; T594-I596 PolarHBondContact O-N 3.18Å; I596-E600 HydrophobicContact CG2-CB 4.44Å; I596-I601 HydrophobicContact CG2-CG1 4.12Å
597	P	89.4	Confident	92.4	Very high	54 Å²	54	58.4 Å²	58.4	35%	0.351	31%	0.307	S	S	.	.			trans	-58.9	136.1	173.3	-23	33.6	0	0	0	111.9	D599 E600 I601	P597-D599 VanDerWaalsContact CB-OD1 3.22Å; P597-D599 WeakPolarHBondContact CB-OD1 3.44Å; P597-D599 PolarHBondContact O-N 3.07Å; P597-E600 HydrophobicContact CB-CB 4.49Å; P597-E600 HydrophobicContact CB-CG 4.16Å; P597-E600 HydrophobicContact CG-CG 4.41Å; P597-E600 PolarHBondContact O-N 2.89Å; P597-I601 PolarHBondContact O-N 3.21Å
598	K	89.5	Confident	92.5	Very high	146 Å²	146	59 Å²	59	64%	0.635	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-33.8	-175	-71.7	-164	171.9	-133.6	0	113.5	E591 E600 I601	E591-K598 IonicContact OE2-NZ 3.62Å; E591-K598 PolarHBondContact OE2-NZ 3.1Å; K598-E600 PolarHBondContact O-N 3.36Å; K598-I601 HydrophobicContact CG-CD1 4.4Å; K598-I601 PolarHBondContact O-N 2.92Å
599	D	91.2	Very high	92.5	Very high	120 Å²	120	58.9 Å²	58.9	64%	0.642	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-17.5	178.2	60.6	-60.2	0	0	0	113.6	P597	P597-D599 VanDerWaalsContact CB-OD1 3.22Å; P597-D599 WeakPolarHBondContact CB-OD1 3.44Å; P597-D599 PolarHBondContact O-N 3.07Å
600	E	92.2	Very high	92.7	Very high	64 Å²	64	59.6 Å²	59.6	30%	0.299	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-19.5	177.2	-65.6	-174.5	-173	0	0	113.6	I596 P597 K598 H602 K603 R604	I596-E600 HydrophobicContact CG2-CB 4.44Å; P597-E600 HydrophobicContact CB-CB 4.49Å; P597-E600 HydrophobicContact CB-CG 4.16Å; P597-E600 HydrophobicContact CG-CG 4.41Å; P597-E600 PolarHBondContact O-N 2.89Å; K598-E600 PolarHBondContact O-N 3.36Å; E600-H602 PolarHBondContact O-N 3.39Å; E600-K603 PolarHBondContact O-N 3.15Å; E600-K603 VanDerWaalsContact O-N 3.08Å; E600-R604 HydrophobicContact CB-CG 4.43Å; E600-R604 WeakPolarHBondContact O-CG 3.29Å; E600-R604 PolarHBondContact O-N 3.39Å; E600-R604 IonicContact OE2-CZ 2.73Å; E600-R604 IonicContact OE2-NE 3.77Å; E600-R604 PolarHBondContact OE2-NE 3.05Å; E600-R604 IonicContact OE2-NH2 3.51Å; E600-R604 PolarHBondContact OE2-NH2 3.34Å
601	I	95.3	Very high	92.9	Very high	9 Å²	9	56.9 Å²	56.9	5%	0.046	30%	0.299	C	S	.	.	H	α-helix	trans	-51.5	-54.5	-171.7	-71	178.8	0	0	0	111.5	L588 E591 I596 P597 K598 K603 R604 A605	L588-I601 HydrophobicContact CB-CG2 4.16Å; L588-I601 WeakPolarHBondContact O-CG2 3.49Å; E591-I601 HydrophobicContact CG-CD1 4.1Å; I596-I601 HydrophobicContact CG2-CG1 4.12Å; P597-I601 PolarHBondContact O-N 3.21Å; K598-I601 HydrophobicContact CG-CD1 4.4Å; K598-I601 PolarHBondContact O-N 2.92Å; I601-K603 PolarHBondContact O-N 3.13Å; I601-R604 PolarHBondContact O-N 2.95Å; I601-A605 WeakPolarHBondContact O-CB 3.21Å; I601-A605 PolarHBondContact O-N 3.02Å
602	H	96.6	Very high	93.2	Very high	75 Å²	75	51.5 Å²	51.5	35%	0.347	27%	0.274	S	S	.	.	H	α-helix	trans	-66.4	-35.8	-178.6	-65.1	-59.5	0	0	0	112.7	E600 F606 Y627 L632	E600-H602 PolarHBondContact O-N 3.39Å; H602-F606 WeakPolarHBondContact O-CB 3.14Å; H602-F606 PolarHBondContact O-N 3.34Å; H602-Y627 WeakPolarHBondContact O-CE1 3.24Å; H602-L632 HydrophobicContact CB-CB 4.36Å
603	K	96.3	Very high	93.5	Very high	122 Å²	122	49.2 Å²	49.2	53%	0.53	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-41.2	177.6	-67	177.2	-180	171.2	0	111.6	E600 I601 T607	E600-K603 PolarHBondContact O-N 3.15Å; E600-K603 VanDerWaalsContact O-N 3.08Å; I601-K603 PolarHBondContact O-N 3.13Å; K603-T607 PolarHBondContact O-N 3.17Å; K603-T607 VanDerWaalsContact O-N 3.15Å; K603-T607 PolarHBondContact O-OG1 3.15Å
604	R	95.9	Very high	93.8	Very high	54 Å²	54	52.6 Å²	52.6	20%	0.204	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-47.2	176.3	-70.2	176.3	176.9	-113.2	7.3	110.8	S246 G247 L588 E600 I601 F606 T607 Q608	S246-R604 PolarHBondContact O-NH1 2.76Å; G247-R604 PolarHBondContact O-NH2 3.4Å; L588-R604 HydrophobicContact CD1-CB 3.75Å; E600-R604 HydrophobicContact CB-CG 4.43Å; E600-R604 WeakPolarHBondContact O-CG 3.29Å; E600-R604 PolarHBondContact O-N 3.39Å; E600-R604 IonicContact OE2-CZ 2.73Å; E600-R604 IonicContact OE2-NE 3.77Å; E600-R604 PolarHBondContact OE2-NE 3.05Å; E600-R604 IonicContact OE2-NH2 3.51Å; E600-R604 PolarHBondContact OE2-NH2 3.34Å; I601-R604 PolarHBondContact O-N 2.95Å; R604-F606 PolarHBondContact O-N 3.39Å; R604-T607 PolarHBondContact O-N 2.86Å; R604-Q608 WeakPolarHBondContact O-CG 3.35Å; R604-Q608 PolarHBondContact O-N 2.97Å; R604-Q608 VanDerWaalsContact O-N 3.11Å
605	A	97.7	Very high	94.4	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-44.1	177.1	0	0	0	0	0	112	A585 L588 E589 I601 T607 Q608 W609 Y627	A585-A605 HydrophobicContact CB-CB 4.42Å; L588-A605 HydrophobicContact CB-CB 4.03Å; L588-A605 HydrophobicContact CD1-CB 4.28Å; E589-A605 HydrophobicContact CG-CB 4.39Å; I601-A605 WeakPolarHBondContact O-CB 3.21Å; I601-A605 PolarHBondContact O-N 3.02Å; A605-T607 VanDerWaalsContact C-N 3.33Å; A605-T607 PolarHBondContact O-N 3.39Å; A605-Q608 PolarHBondContact O-N 3.17Å; A605-Q608 VanDerWaalsContact O-N 3.14Å; A605-W609 VanDerWaalsContact O-CD1 3.25Å; A605-W609 PolarHBondContact O-N 3.05Å; A605-Y627 HydrophobicContact CB-CE1 4.29Å; A605-Y627 VanDerWaalsContact CB-OH 3.23Å; A605-Y627 WeakPolarHBondContact CB-OH 3.36Å
606	F	98.1	Very high	94.9	Very high	32 Å²	32	49 Å²	49	14%	0.14	25%	0.25	C	C	.	.	H	α-helix	trans	-52.9	-49.3	173.7	174.9	-105.5	0	0	0	112	H602 R604 Q608 W609 Q610 L624 Y627 Y628 T634	H602-F606 WeakPolarHBondContact O-CB 3.14Å; H602-F606 PolarHBondContact O-N 3.34Å; R604-F606 PolarHBondContact O-N 3.39Å; F606-Q608 VanDerWaalsContact C-N 3.31Å; F606-Q608 PolarHBondContact O-N 3.45Å; F606-W609 PolarHBondContact O-N 3.32Å; F606-Q610 WeakPolarHBondContact O-CB 3.13Å; F606-Q610 PolarHBondContact O-N 3.48Å; F606-L624 HydrophobicContact CD2-CD1 3.89Å; F606-L624 HydrophobicContact CE2-CD1 3.47Å; F606-L624 VanDerWaalsContact CE2-CD1 3.47Å; F606-L624 HydrophobicContact CZ-CD1 4.21Å; F606-Y627 HydrophobicContact CB-CD1 3.57Å; F606-Y627 HydrophobicContact CB-CE1 3.8Å; F606-Y627 AromaticContact CD2-CD1 3.7Å; F606-Y627 HydrophobicContact CD2-CD1 3.7Å; F606-Y627 HydrophobicContact CD2-CG 4.12Å; F606-Y627 HydrophobicContact CG-CD1 4.11Å; F606-Y628 HydrophobicContact CE2-CE1 4.08Å; F606-Y628 HydrophobicContact CE2-CE2 4.09Å; F606-Y628 AromaticContact CE2-CZ 3.81Å; F606-Y628 HydrophobicContact CZ-CE1 4.03Å; F606-Y628 HydrophobicContact CZ-CE2 4.38Å; F606-Y628 AromaticContact CZ-CZ 3.72Å; F606-T634 HydrophobicContact CD2-CG2 4.09Å; F606-T634 HydrophobicContact CE2-CG2 3.78Å; F606-T634 HydrophobicContact CZ-CG2 4.31Å
607	T	96.6	Very high	95.2	Very high	61 Å²	61	48.4 Å²	48.4	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-60.5	-42.1	179.5	-57.8	0	0	0	0	111.3	K603 R604 A605 Q610 R611	K603-T607 PolarHBondContact O-N 3.17Å; K603-T607 VanDerWaalsContact O-N 3.15Å; K603-T607 PolarHBondContact O-OG1 3.15Å; R604-T607 PolarHBondContact O-N 2.86Å; A605-T607 VanDerWaalsContact C-N 3.33Å; A605-T607 PolarHBondContact O-N 3.39Å; T607-Q610 PolarHBondContact O-N 2.81Å; T607-R611 VanDerWaalsContact O-CG 3.32Å; T607-R611 WeakPolarHBondContact O-CG 3.46Å; T607-R611 PolarHBondContact O-N 2.92Å
608	Q	98	Very high	95.4	Very high	11 Å²	11	47.3 Å²	47.3	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-71.2	-38.5	179.4	-66	-63.2	-12.2	0	0	112.6	V584 A585 R604 A605 F606 R611 S612	V584-Q608 HydrophobicContact CB-CG 4.31Å; V584-Q608 HydrophobicContact CG1-CG 3.82Å; A585-Q608 HydrophobicContact CB-CB 3.78Å; R604-Q608 WeakPolarHBondContact O-CG 3.35Å; R604-Q608 PolarHBondContact O-N 2.97Å; R604-Q608 VanDerWaalsContact O-N 3.11Å; A605-Q608 PolarHBondContact O-N 3.17Å; A605-Q608 VanDerWaalsContact O-N 3.14Å; F606-Q608 VanDerWaalsContact C-N 3.31Å; F606-Q608 PolarHBondContact O-N 3.45Å; Q608-R611 PolarHBondContact O-N 3.26Å; Q608-S612 WeakPolarHBondContact O-CB 3.43Å; Q608-S612 PolarHBondContact O-N 3.48Å
609	W	98.1	Very high	95.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-43	171.2	-73.2	132.5	0	0	0	112	L330 A585 F586 E589 A605 F606 S612 A613 S620 K623 Y627	L330-W609 HydrophobicContact CD2-CH2 3.89Å; L330-W609 HydrophobicContact CD2-CZ3 4.41Å; A585-W609 HydrophobicContact CB-CD2 3.5Å; A585-W609 HydrophobicContact CB-CE3 4.05Å; A585-W609 HydrophobicContact CB-CG 3.85Å; A585-W609 HydrophobicContact CB-CH2 4.26Å; A585-W609 HydrophobicContact CB-CZ2 3.75Å; A585-W609 HydrophobicContact CB-CZ3 4.42Å; F586-W609 HydrophobicContact CB-CH2 4.45Å; F586-W609 HydrophobicContact CB-CZ2 4.45Å; E589-W609 PolarHBondContact OE1-NE1 2.8Å; A605-W609 VanDerWaalsContact O-CD1 3.25Å; A605-W609 PolarHBondContact O-N 3.05Å; F606-W609 PolarHBondContact O-N 3.32Å; W609-S612 PolarHBondContact O-N 3.03Å; W609-A613 WeakPolarHBondContact O-CB 3.28Å; W609-A613 PolarHBondContact O-N 2.79Å; W609-S620 VanDerWaalsContact CE3-OG 3.31Å; W609-S620 VanDerWaalsContact CZ3-OG 3.29Å; W609-S620 WeakPolarHBondContact CZ3-OG 3.13Å; W609-K623 HydrophobicContact CD2-CB 3.74Å; W609-K623 HydrophobicContact CD2-CG 4.21Å; W609-K623 HydrophobicContact CE3-CB 4.09Å; W609-K623 HydrophobicContact CE3-CG 4.37Å; W609-K623 HydrophobicContact CG-CB 4.05Å; W609-K623 HydrophobicContact CH2-CG 4.02Å; W609-K623 HydrophobicContact CZ2-CB 4.25Å; W609-K623 HydrophobicContact CZ2-CD 4.07Å; W609-K623 HydrophobicContact CZ2-CG 3.82Å; W609-K623 HydrophobicContact CZ3-CB 4.47Å; W609-K623 HydrophobicContact CZ3-CG 4.26Å; W609-Y627 AromaticContact CD1-CE2 3.63Å; W609-Y627 AromaticContact CD1-CZ 3.7Å; W609-Y627 AromaticContact NE1-CE2 3.74Å; W609-Y627 AromaticContact NE1-CZ 3.9Å
610	Q	97.5	Very high	95.7	Very high	59 Å²	59	36.1 Å²	36.1	28%	0.276	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-47.4	175.3	-179.3	65.1	61.9	0	0	111.4	F606 T607 S612 A613 T614 L624	F606-Q610 WeakPolarHBondContact O-CB 3.13Å; F606-Q610 PolarHBondContact O-N 3.48Å; T607-Q610 PolarHBondContact O-N 2.81Å; Q610-S612 PolarHBondContact O-N 3.42Å; Q610-A613 PolarHBondContact O-N 2.73Å; Q610-T614 PolarHBondContact NE2-OG1 3.04Å; Q610-T614 WeakPolarHBondContact O-CB 3.37Å; Q610-T614 PolarHBondContact O-N 3.46Å; Q610-T614 PolarHBondContact O-OG1 2.69Å; Q610-L624 HydrophobicContact CB-CD1 4.19Å; Q610-L624 VanDerWaalsContact OE1-CD2 3.23Å
611	R	97.3	Very high	95.9	Very high	35 Å²	35	34.7 Å²	34.7	13%	0.132	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-47.4	177.1	-75.6	-179.1	179.9	-177.8	3.2	111.8	Y278 E574 Q581 T607 Q608 T614 Q615	Y278-R611 WeakPolarHBondContact OH-CB 3.12Å; Y278-R611 WeakPolarHBondContact OH-CG 3.19Å; E574-R611 IonicContact OE1-CZ 2.61Å; E574-R611 IonicContact OE1-NH1 3.55Å; E574-R611 PolarHBondContact OE1-NH1 2.74Å; E574-R611 IonicContact OE2-NH1 3.77Å; Q581-R611 HydrophobicContact CG-CB 4.41Å; Q581-R611 PolarHBondContact OE1-O 2.86Å; T607-R611 VanDerWaalsContact O-CG 3.32Å; T607-R611 WeakPolarHBondContact O-CG 3.46Å; T607-R611 PolarHBondContact O-N 2.92Å; Q608-R611 PolarHBondContact O-N 3.26Å; R611-T614 PolarHBondContact O-N 2.89Å; R611-Q615 WeakPolarHBondContact O-CG 3.06Å; R611-Q615 PolarHBondContact O-N 3.25Å
612	S	97.7	Very high	96	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.7	-42.6	179.3	166.1	0	0	0	0	112.5	E578 Q581 Q608 W609 Q610 T614 Q615 S617 S620	E578-S612 PolarHBondContact OE1-OG 3.47Å; Q581-S612 VanDerWaalsContact OE1-N 3.15Å; Q608-S612 WeakPolarHBondContact O-CB 3.43Å; Q608-S612 PolarHBondContact O-N 3.48Å; W609-S612 PolarHBondContact O-N 3.03Å; Q610-S612 PolarHBondContact O-N 3.42Å; S612-T614 VanDerWaalsContact C-N 3.32Å; S612-T614 PolarHBondContact O-N 3.46Å; S612-Q615 PolarHBondContact O-N 2.9Å; S612-Q615 VanDerWaalsContact O-N 3.14Å; S612-S617 VanDerWaalsContact O-CB 3.27Å; S612-S617 WeakPolarHBondContact O-CB 3.39Å; S612-S617 PolarHBondContact O-N 2.89Å; S612-S617 VanDerWaalsContact OG-CB 3.3Å; S612-S617 WeakPolarHBondContact OG-CB 3.16Å; S612-S617 PolarHBondContact OG-OG 3.42Å; S612-S620 VanDerWaalsContact OG-CB 3.22Å; S612-S620 WeakPolarHBondContact OG-CB 3.48Å; S612-S620 PolarHBondContact OG-OG 3.26Å
613	A	96.3	Very high	96	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-36.9	177.3	0	0	0	0	0	112.2	W609 Q610 Q615 G616 R621 L624	W609-A613 WeakPolarHBondContact O-CB 3.28Å; W609-A613 PolarHBondContact O-N 2.79Å; Q610-A613 PolarHBondContact O-N 2.73Å; A613-Q615 PolarHBondContact O-N 3.11Å; A613-G616 PolarHBondContact O-N 3.28Å; A613-R621 HydrophobicContact CB-CB 4.09Å; A613-R621 PolarHBondContact O-NH2 2.99Å; A613-L624 HydrophobicContact CB-CD2 3.96Å
614	T	94.6	Very high	96	Very high	84 Å²	84	27.6 Å²	27.6	52%	0.515	15%	0.149	S	C	.	.	H	α-helix	trans	-62.4	-27.7	177	-55	0	0	0	0	111.7	Q610 R611 S612 G616	Q610-T614 PolarHBondContact NE2-OG1 3.04Å; Q610-T614 WeakPolarHBondContact O-CB 3.37Å; Q610-T614 PolarHBondContact O-N 3.46Å; Q610-T614 PolarHBondContact O-OG1 2.69Å; R611-T614 PolarHBondContact O-N 2.89Å; S612-T614 VanDerWaalsContact C-N 3.32Å; S612-T614 PolarHBondContact O-N 3.46Å; T614-G616 VanDerWaalsContact C-N 3.26Å; T614-G616 PolarHBondContact O-N 3.11Å
615	Q	94.5	Very high	96.1	Very high	48 Å²	48	25 Å²	25	22%	0.224	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	11.3	175.2	-59.7	-171.6	69.3	0	0	114.2	Y278 G576 E578 Q581 R611 S612 A613	Y278-Q615 HydrophobicContact CE2-CG 4.49Å; G576-Q615 PolarHBondContact O-NE2 3.39Å; G576-Q615 VanDerWaalsContact O-NE2 3.14Å; G576-Q615 PolarHBondContact O-OE1 3.14Å; G576-Q615 VanDerWaalsContact O-OE1 3.05Å; E578-Q615 HydrophobicContact CB-CB 3.97Å; E578-Q615 HydrophobicContact CB-CG 4.5Å; E578-Q615 HydrophobicContact CG-CB 3.92Å; Q581-Q615 VanDerWaalsContact CD-NE2 3.3Å; R611-Q615 WeakPolarHBondContact O-CG 3.06Å; R611-Q615 PolarHBondContact O-N 3.25Å; S612-Q615 PolarHBondContact O-N 2.9Å; S612-Q615 VanDerWaalsContact O-N 3.14Å; A613-Q615 PolarHBondContact O-N 3.11Å
616	G	92.5	Very high	96.1	Very high	36 Å²	36	26.8 Å²	26.8	37%	0.371	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	8.3	175	0	0	0	0	0	115.2	A613 T614 T618	A613-G616 PolarHBondContact O-N 3.28Å; T614-G616 VanDerWaalsContact C-N 3.26Å; T614-G616 PolarHBondContact O-N 3.11Å; G616-T618 PolarHBondContact O-N 3.5Å
617	S	93.9	Very high	96.1	Very high	7 Å²	7	25.4 Å²	25.4	5%	0.049	14%	0.143	C	C	.	.			trans	-72.8	115	178.8	-170.2	0	0	0	0	112.7	E578 S612 S620 R621	E578-S617 VanDerWaalsContact CD-CB 3.5Å; E578-S617 WeakPolarHBondContact OE1-CB 3.45Å; E578-S617 PolarHBondContact OE1-OG 3.41Å; S612-S617 VanDerWaalsContact O-CB 3.27Å; S612-S617 WeakPolarHBondContact O-CB 3.39Å; S612-S617 PolarHBondContact O-N 2.89Å; S612-S617 VanDerWaalsContact OG-CB 3.3Å; S612-S617 WeakPolarHBondContact OG-CB 3.16Å; S612-S617 PolarHBondContact OG-OG 3.42Å; S617-S620 PolarHBondContact OG-OG 3.37Å; S617-S620 VanDerWaalsContact OG-OG 3.04Å; S617-R621 WeakPolarHBondContact O-CB 3.37Å; S617-R621 PolarHBondContact O-N 2.87Å
618	T	93.4	Very high	96.2	Very high	30 Å²	30	23.5 Å²	23.5	18%	0.184	13%	0.129	C	C	.	.	H	α-helix	trans	-67.7	-48.1	-177.5	-49.3	0	0	0	0	112.5	G616 S620 R621 V622 A648 H652 N654	G616-T618 PolarHBondContact O-N 3.5Å; T618-S620 VanDerWaalsContact C-N 3.31Å; T618-S620 PolarHBondContact O-N 2.81Å; T618-R621 WeakPolarHBondContact O-CB 3.47Å; T618-R621 PolarHBondContact O-N 3.38Å; T618-R621 VanDerWaalsContact O-N 3.08Å; T618-V622 PolarHBondContact O-N 3.47Å; T618-A648 HydrophobicContact CG2-CB 4.15Å; T618-H652 HydrophobicContact CG2-CB 3.51Å; T618-H652 WeakPolarHBondContact OG1-CB 3.26Å; T618-H652 PolarHBondContact OG1-CD2 3.3Å; T618-H652 VanDerWaalsContact OG1-CD2 3.25Å; T618-H652 PolarHBondContact OG1-ND1 3.49Å; T618-N654 HydrophobicContact CG2-CB 3.7Å
619	S	91.7	Very high	96.2	Very high	31 Å²	31	24.7 Å²	24.7	22%	0.217	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-43.4	180	-48.8	0	0	0	0	110.8	D331 R621 V622 K623	D331-S619 PolarHBondContact OD1-OG 2.92Å; S619-R621 VanDerWaalsContact C-N 3.3Å; S619-R621 PolarHBondContact O-N 2.94Å; S619-V622 PolarHBondContact O-N 3.49Å; S619-K623 PolarHBondContact O-N 2.84Å
620	S	96.2	Very high	96.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-34.2	174.5	-57.7	0	0	0	0	113	W609 S612 S617 T618 K623 L624	W609-S620 VanDerWaalsContact CE3-OG 3.31Å; W609-S620 VanDerWaalsContact CZ3-OG 3.29Å; W609-S620 WeakPolarHBondContact CZ3-OG 3.13Å; S612-S620 VanDerWaalsContact OG-CB 3.22Å; S612-S620 WeakPolarHBondContact OG-CB 3.48Å; S612-S620 PolarHBondContact OG-OG 3.26Å; S617-S620 PolarHBondContact OG-OG 3.37Å; S617-S620 VanDerWaalsContact OG-OG 3.04Å; T618-S620 VanDerWaalsContact C-N 3.31Å; T618-S620 PolarHBondContact O-N 2.81Å; S620-K623 PolarHBondContact O-N 3.21Å; S620-L624 WeakPolarHBondContact O-CB 3.42Å; S620-L624 PolarHBondContact O-N 2.95Å
621	R	96.2	Very high	96.1	Very high	34 Å²	34	30.3 Å²	30.3	13%	0.128	16%	0.16	C	C	.	.	H	α-helix	trans	-68.6	-37.5	176	-168.7	179.8	-59.2	-79.9	-2.1	112.1	A613 S617 T618 S619 L624 G625 H644 I647 A648	A613-R621 HydrophobicContact CB-CB 4.09Å; A613-R621 PolarHBondContact O-NH2 2.99Å; S617-R621 WeakPolarHBondContact O-CB 3.37Å; S617-R621 PolarHBondContact O-N 2.87Å; T618-R621 WeakPolarHBondContact O-CB 3.47Å; T618-R621 PolarHBondContact O-N 3.38Å; T618-R621 VanDerWaalsContact O-N 3.08Å; S619-R621 VanDerWaalsContact C-N 3.3Å; S619-R621 PolarHBondContact O-N 2.94Å; R621-L624 PolarHBondContact O-N 3.06Å; R621-G625 PolarHBondContact O-N 2.94Å; R621-H644 WeakPolarHBondContact CD-O 3.39Å; R621-H644 HydrophobicContact CG-CB 4.1Å; R621-I647 VanDerWaalsContact CD-CG2 3.44Å; R621-A648 HydrophobicContact CG-CB 4.45Å
622	V	96.7	Very high	96	Very high	10 Å²	10	31.4 Å²	31.4	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-48.4	172.3	177	0	0	0	0	110.1	T618 S619 L624 G625 D626 Y645 A648 Q656 A657	T618-V622 PolarHBondContact O-N 3.47Å; S619-V622 PolarHBondContact O-N 3.49Å; V622-L624 VanDerWaalsContact C-N 3.31Å; V622-L624 PolarHBondContact O-N 3.43Å; V622-G625 WeakPolarHBondContact O-CA 3.21Å; V622-G625 PolarHBondContact O-N 3.38Å; V622-D626 PolarHBondContact O-N 3.37Å; V622-Y645 HydrophobicContact CG1-CE1 4.22Å; V622-Y645 WeakPolarHBondContact O-CE1 3.29Å; V622-A648 HydrophobicContact CG2-CB 3.97Å; V622-Q656 HydrophobicContact CG1-CB 4.44Å; V622-Q656 HydrophobicContact CG1-CG 3.92Å; V622-A657 HydrophobicContact CG2-CB 4.08Å
623	K	97	Very high	95.8	Very high	47 Å²	47	32.9 Å²	32.9	20%	0.204	18%	0.184	C	C	.	.	H	α-helix	trans	-55.4	-45.1	174.7	-74.9	-75.1	-172.8	162.8	0	112.3	L330 E589 W609 S619 S620 G625 D626 Y627	L330-K623 HydrophobicContact CD2-CG 4.1Å; E589-K623 IonicContact OE2-NZ 2.69Å; E589-K623 PolarHBondContact OE2-NZ 3.14Å; W609-K623 HydrophobicContact CD2-CB 3.74Å; W609-K623 HydrophobicContact CD2-CG 4.21Å; W609-K623 HydrophobicContact CE3-CB 4.09Å; W609-K623 HydrophobicContact CE3-CG 4.37Å; W609-K623 HydrophobicContact CG-CB 4.05Å; W609-K623 HydrophobicContact CH2-CG 4.02Å; W609-K623 HydrophobicContact CZ2-CB 4.25Å; W609-K623 HydrophobicContact CZ2-CD 4.07Å; W609-K623 HydrophobicContact CZ2-CG 3.82Å; W609-K623 HydrophobicContact CZ3-CB 4.47Å; W609-K623 HydrophobicContact CZ3-CG 4.26Å; S619-K623 PolarHBondContact O-N 2.84Å; S620-K623 PolarHBondContact O-N 3.21Å; K623-G625 VanDerWaalsContact C-N 3.28Å; K623-G625 PolarHBondContact O-N 3.37Å; K623-D626 WeakPolarHBondContact O-CB 3.42Å; K623-D626 PolarHBondContact O-N 3.41Å; K623-Y627 WeakPolarHBondContact O-CD2 3.41Å; K623-Y627 PolarHBondContact O-N 3.24Å
624	L	96.9	Very high	95.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60	-38.5	175.5	-177.4	62.7	0	0	0	112.3	F606 Q610 A613 S620 R621 V622 Y627 Y628 H644	F606-L624 HydrophobicContact CD2-CD1 3.89Å; F606-L624 HydrophobicContact CE2-CD1 3.47Å; F606-L624 VanDerWaalsContact CE2-CD1 3.47Å; F606-L624 HydrophobicContact CZ-CD1 4.21Å; Q610-L624 HydrophobicContact CB-CD1 4.19Å; Q610-L624 VanDerWaalsContact OE1-CD2 3.23Å; A613-L624 HydrophobicContact CB-CD2 3.96Å; S620-L624 WeakPolarHBondContact O-CB 3.42Å; S620-L624 PolarHBondContact O-N 2.95Å; R621-L624 PolarHBondContact O-N 3.06Å; V622-L624 VanDerWaalsContact C-N 3.31Å; V622-L624 PolarHBondContact O-N 3.43Å; L624-Y627 PolarHBondContact O-N 3.39Å; L624-Y628 HydrophobicContact CD1-CD2 4.38Å; L624-Y628 HydrophobicContact CD1-CE2 3.86Å; L624-Y628 HydrophobicContact CG-CD2 4.32Å; L624-Y628 HydrophobicContact CG-CE2 3.98Å; L624-Y628 WeakPolarHBondContact O-CD2 3.43Å; L624-Y628 PolarHBondContact O-N 3.41Å; L624-H644 WeakPolarHBondContact CD2-CE1 3.33Å
625	G	97.4	Very high	95.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-44.9	170.8	0	0	0	0	0	112.5	R621 V622 K623 Y627 Y628 Y629 A641	R621-G625 PolarHBondContact O-N 2.94Å; V622-G625 WeakPolarHBondContact O-CA 3.21Å; V622-G625 PolarHBondContact O-N 3.38Å; K623-G625 VanDerWaalsContact C-N 3.28Å; K623-G625 PolarHBondContact O-N 3.37Å; G625-Y627 VanDerWaalsContact C-N 3.31Å; G625-Y627 PolarHBondContact O-N 3.27Å; G625-Y628 PolarHBondContact O-N 3.04Å; G625-Y629 WeakPolarHBondContact O-CB 3.36Å; G625-Y629 PolarHBondContact O-N 3.41Å; G625-A641 VanDerWaalsContact O-CB 3.29Å; G625-A641 WeakPolarHBondContact O-CB 3.34Å
626	D	97.5	Very high	96.1	Very high	37 Å²	37	38.8 Å²	38.8	20%	0.198	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-37.8	177.8	-57.8	-21.1	0	0	0	111.6	V622 K623 Y628 Y629 Y630 Y645 N660	V622-D626 PolarHBondContact O-N 3.37Å; K623-D626 WeakPolarHBondContact O-CB 3.42Å; K623-D626 PolarHBondContact O-N 3.41Å; D626-Y628 PolarHBondContact O-N 2.84Å; D626-Y629 WeakPolarHBondContact O-CB 3.32Å; D626-Y629 PolarHBondContact O-N 2.94Å; D626-Y629 VanDerWaalsContact O-N 3.15Å; D626-Y630 HydrophobicContact CB-CD2 4.32Å; D626-Y630 HydrophobicContact CB-CE2 4.46Å; D626-Y630 VanDerWaalsContact O-CD2 3.25Å; D626-Y630 WeakPolarHBondContact O-CD2 3.48Å; D626-Y630 PolarHBondContact O-N 2.93Å; D626-Y645 WeakPolarHBondContact CA-OH 3.41Å; D626-Y645 PolarHBondContact N-OH 3.28Å; D626-Y645 WeakPolarHBondContact OD1-CE1 3.36Å; D626-Y645 PolarHBondContact OD1-OH 2.84Å; D626-N660 PolarHBondContact OD1-ND2 3.24Å
627	Y	98.2	Very high	96.4	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-43.7	176.8	-88.4	-120.2	0	0	0	112.1	E589 H602 A605 F606 W609 K623 L624 G625 Y629 G631 L632	E589-Y627 VanDerWaalsContact CG-OH 3.22Å; E589-Y627 WeakPolarHBondContact CG-OH 3.48Å; E589-Y627 WeakPolarHBondContact OE1-CE2 3.45Å; E589-Y627 VanDerWaalsContact OE1-CZ 3.23Å; E589-Y627 PolarHBondContact OE1-OH 3Å; H602-Y627 WeakPolarHBondContact O-CE1 3.24Å; A605-Y627 HydrophobicContact CB-CE1 4.29Å; A605-Y627 VanDerWaalsContact CB-OH 3.23Å; A605-Y627 WeakPolarHBondContact CB-OH 3.36Å; F606-Y627 HydrophobicContact CB-CD1 3.57Å; F606-Y627 HydrophobicContact CB-CE1 3.8Å; F606-Y627 AromaticContact CD2-CD1 3.7Å; F606-Y627 HydrophobicContact CD2-CD1 3.7Å; F606-Y627 HydrophobicContact CD2-CG 4.12Å; F606-Y627 HydrophobicContact CG-CD1 4.11Å; W609-Y627 AromaticContact CD1-CE2 3.63Å; W609-Y627 AromaticContact CD1-CZ 3.7Å; W609-Y627 AromaticContact NE1-CE2 3.74Å; W609-Y627 AromaticContact NE1-CZ 3.9Å; K623-Y627 WeakPolarHBondContact O-CD2 3.41Å; K623-Y627 PolarHBondContact O-N 3.24Å; L624-Y627 PolarHBondContact O-N 3.39Å; G625-Y627 VanDerWaalsContact C-N 3.31Å; G625-Y627 PolarHBondContact O-N 3.27Å; Y627-Y629 VanDerWaalsContact C-N 3.34Å; Y627-G631 VanDerWaalsContact O-CA 3.29Å; Y627-G631 WeakPolarHBondContact O-CA 3.32Å; Y627-G631 PolarHBondContact O-N 3.5Å; Y627-L632 HydrophobicContact CD1-CB 3.77Å; Y627-L632 WeakPolarHBondContact CD1-O 3.17Å; Y627-L632 HydrophobicContact CD2-CD1 4.46Å; Y627-L632 HydrophobicContact CE1-CB 3.97Å; Y627-L632 HydrophobicContact CE2-CD1 4.4Å; Y627-L632 HydrophobicContact CG-CB 4.09Å; Y627-L632 PolarHBondContact O-N 3.27Å
628	Y	98.5	Very high	96.5	Very high	21 Å²	21	42.2 Å²	42.2	8%	0.082	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-32.1	172.8	-74.1	-60.6	0	0	0	112.7	F606 L624 G625 D626 T634 V636 S637 K640 H644	F606-Y628 HydrophobicContact CE2-CE1 4.08Å; F606-Y628 HydrophobicContact CE2-CE2 4.09Å; F606-Y628 AromaticContact CE2-CZ 3.81Å; F606-Y628 HydrophobicContact CZ-CE1 4.03Å; F606-Y628 HydrophobicContact CZ-CE2 4.38Å; F606-Y628 AromaticContact CZ-CZ 3.72Å; L624-Y628 HydrophobicContact CD1-CD2 4.38Å; L624-Y628 HydrophobicContact CD1-CE2 3.86Å; L624-Y628 HydrophobicContact CG-CD2 4.32Å; L624-Y628 HydrophobicContact CG-CE2 3.98Å; L624-Y628 WeakPolarHBondContact O-CD2 3.43Å; L624-Y628 PolarHBondContact O-N 3.41Å; G625-Y628 PolarHBondContact O-N 3.04Å; D626-Y628 PolarHBondContact O-N 2.84Å; Y628-T634 HydrophobicContact CD1-CG2 3.68Å; Y628-T634 HydrophobicContact CE1-CG2 3.98Å; Y628-T634 WeakPolarHBondContact CE1-OG1 3.41Å; Y628-T634 HydrophobicContact CG-CG2 4.4Å; Y628-V636 CarbonylContact O-C 3.42Å; Y628-V636 WeakPolarHBondContact O-CA 3.4Å; Y628-S637 PolarHBondContact O-N 2.72Å; Y628-K640 HydrophobicContact CD1-CB 3.93Å; Y628-K640 HydrophobicContact CD1-CD 3.74Å; Y628-K640 HydrophobicContact CD2-CB 3.8Å; Y628-K640 HydrophobicContact CE1-CB 4.23Å; Y628-K640 HydrophobicContact CE1-CD 3.36Å; Y628-K640 HydrophobicContact CE1-CG 4.45Å; Y628-K640 HydrophobicContact CE2-CB 4.09Å; Y628-K640 HydrophobicContact CE2-CD 4.3Å; Y628-K640 HydrophobicContact CG-CB 3.7Å; Y628-K640 HydrophobicContact CG-CD 4.35Å; Y628-H644 AromaticContact CD2-CD2 3.61Å; Y628-H644 AromaticContact CD2-NE2 3.91Å; Y628-H644 AromaticContact CE2-CD2 3.62Å; Y628-H644 AromaticContact CE2-NE2 3.39Å; Y628-H644 WeakPolarHBondContact CE2-NE2 3.5Å
629	Y	98	Very high	96.7	Very high	35 Å²	35	45.8 Å²	45.8	14%	0.137	24%	0.239	C	C	.	.	H	α-helix	trans	-67.7	-45.3	178.4	179.1	-87.2	0	0	0	112	G625 D626 Y627 Y638 Y663 M664 L669	G625-Y629 WeakPolarHBondContact O-CB 3.36Å; G625-Y629 PolarHBondContact O-N 3.41Å; D626-Y629 WeakPolarHBondContact O-CB 3.32Å; D626-Y629 PolarHBondContact O-N 2.94Å; D626-Y629 VanDerWaalsContact O-N 3.15Å; Y627-Y629 VanDerWaalsContact C-N 3.34Å; Y629-Y638 AromaticContact CD2-CD1 3.75Å; Y629-Y638 HydrophobicContact CD2-CD1 3.75Å; Y629-Y638 AromaticContact CD2-CE1 3.73Å; Y629-Y638 HydrophobicContact CD2-CE1 3.73Å; Y629-Y638 HydrophobicContact CE2-CD1 4.02Å; Y629-Y638 AromaticContact CE2-CE1 3.7Å; Y629-Y638 HydrophobicContact CE2-CE1 3.7Å; Y629-Y638 HydrophobicContact CG-CE1 4.35Å; Y629-Y663 WeakPolarHBondContact OH-CE1 3.37Å; Y629-M664 HydrophobicContact CD2-CE 4.3Å; Y629-L669 HydrophobicContact CE2-CD1 3.7Å; Y629-L669 VanDerWaalsContact OH-CD1 3.31Å; Y629-L669 WeakPolarHBondContact OH-CD1 3.38Å
630	Y	97.4	Very high	97	Very high	154 Å²	154	48.7 Å²	48.7	60%	0.604	25%	0.247	S	C	*	.	H	α-helix	trans	-91.8	-14.2	-178	-69	-65.7	0	0	0	114.1	D626	D626-Y630 HydrophobicContact CB-CD2 4.32Å; D626-Y630 HydrophobicContact CB-CE2 4.46Å; D626-Y630 VanDerWaalsContact O-CD2 3.25Å; D626-Y630 WeakPolarHBondContact O-CD2 3.48Å; D626-Y630 PolarHBondContact O-N 2.93Å
631	G	96.8	Very high	97.1	Very high	24 Å²	24	48.7 Å²	48.7	25%	0.247	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	39.3	-175.4	0	0	0	0	0	113	Y627 T634	Y627-G631 VanDerWaalsContact O-CA 3.29Å; Y627-G631 WeakPolarHBondContact O-CA 3.32Å; Y627-G631 PolarHBondContact O-N 3.5Å; G631-T634 CarbonylContact C-O 3.56Å; G631-T634 WeakPolarHBondContact CA-O 3.43Å
632	L	95.6	Very high	97.2	Very high	58 Å²	58	47.1 Å²	47.1	30%	0.304	24%	0.241	S	C	.	.	S	Bend	trans	-86	114	179.2	-59.3	176.6	0	0	0	109.2	H602 Y627 T634	H602-L632 HydrophobicContact CB-CB 4.36Å; Y627-L632 HydrophobicContact CD1-CB 3.77Å; Y627-L632 WeakPolarHBondContact CD1-O 3.17Å; Y627-L632 HydrophobicContact CD2-CD1 4.46Å; Y627-L632 HydrophobicContact CE1-CB 3.97Å; Y627-L632 HydrophobicContact CE2-CD1 4.4Å; Y627-L632 HydrophobicContact CG-CB 4.09Å; Y627-L632 PolarHBondContact O-N 3.27Å; L632-T634 PolarHBondContact O-N 3.06Å
633	G	93.3	Very high	97.2	Very high	31 Å²	31	51.4 Å²	51.4	32%	0.32	26%	0.261	S	S	.	.	S	Bend	trans	65.6	0.8	-179.2	0	0	0	0	0	115.4
634	T	96.5	Very high	97.2	Very high	34 Å²	34	50.1 Å²	50.1	21%	0.209	26%	0.256	C	S	.	.	S	Bend	trans	-146.5	166.1	176.8	179.8	0	0	0	0	108.7	F606 Y628 G631 L632	F606-T634 HydrophobicContact CD2-CG2 4.09Å; F606-T634 HydrophobicContact CE2-CG2 3.78Å; F606-T634 HydrophobicContact CZ-CG2 4.31Å; Y628-T634 HydrophobicContact CD1-CG2 3.68Å; Y628-T634 HydrophobicContact CE1-CG2 3.98Å; Y628-T634 WeakPolarHBondContact CE1-OG1 3.41Å; Y628-T634 HydrophobicContact CG-CG2 4.4Å; G631-T634 CarbonylContact C-O 3.56Å; G631-T634 WeakPolarHBondContact CA-O 3.43Å; L632-T634 PolarHBondContact O-N 3.06Å
635	D	96.9	Very high	97.2	Very high	140 Å²	140	50.3 Å²	50.3	75%	0.749	26%	0.256	S	S	*	.			trans	-69.4	149.2	170.8	-56.9	-50.8	0	0	0	112	S637	D635-S637 PolarHBondContact O-N 3.36Å
636	V	97.8	Very high	97.2	Very high	82 Å²	82	55.6 Å²	55.6	50%	0.497	28%	0.276	S	S	.	.			trans	-60.3	123.1	173	177.8	0	0	0	0	109.6	Y628 Y638	Y628-V636 CarbonylContact O-C 3.42Å; Y628-V636 WeakPolarHBondContact O-CA 3.4Å; V636-Y638 HydrophobicContact CG1-CE1 4.19Å; V636-Y638 HydrophobicContact CG1-CE2 4.38Å
637	S	97.8	Very high	97.1	Very high	33 Å²	33	56.8 Å²	56.8	23%	0.231	28%	0.282	C	S	.	.			trans	-146.1	93.5	177.2	-172.4	0	0	0	0	110.9	Y628 D635 Q639 K640 A641	Y628-S637 PolarHBondContact O-N 2.72Å; D635-S637 PolarHBondContact O-N 3.36Å; S637-Q639 PolarHBondContact O-N 3.36Å; S637-K640 PolarHBondContact O-N 2.91Å; S637-K640 WeakPolarHBondContact OG-CG 3.23Å; S637-K640 PolarHBondContact OG-N 2.64Å; S637-A641 PolarHBondContact O-N 3.22Å
638	Y	97.9	Very high	97	Very high	82 Å²	82	56.6 Å²	56.6	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-57.4	-36	175.8	-61.1	-52	0	0	0	112.2	Y629 V636 K640 A641 I642 M664 L669	Y629-Y638 AromaticContact CD2-CD1 3.75Å; Y629-Y638 HydrophobicContact CD2-CD1 3.75Å; Y629-Y638 AromaticContact CD2-CE1 3.73Å; Y629-Y638 HydrophobicContact CD2-CE1 3.73Å; Y629-Y638 HydrophobicContact CE2-CD1 4.02Å; Y629-Y638 AromaticContact CE2-CE1 3.7Å; Y629-Y638 HydrophobicContact CE2-CE1 3.7Å; Y629-Y638 HydrophobicContact CG-CE1 4.35Å; V636-Y638 HydrophobicContact CG1-CE1 4.19Å; V636-Y638 HydrophobicContact CG1-CE2 4.38Å; Y638-K640 PolarHBondContact O-N 2.81Å; Y638-A641 WeakPolarHBondContact O-CB 3.31Å; Y638-A641 PolarHBondContact O-N 3.49Å; Y638-I642 WeakPolarHBondContact O-CB 3.23Å; Y638-I642 WeakPolarHBondContact O-CD1 3.46Å; Y638-I642 WeakPolarHBondContact O-CG1 3.37Å; Y638-I642 PolarHBondContact O-N 2.53Å; Y638-M664 HydrophobicContact CD1-CE 4.02Å; Y638-M664 HydrophobicContact CG-CE 4.29Å; Y638-L669 HydrophobicContact CD1-CB 4.33Å; Y638-L669 HydrophobicContact CE2-CD2 4.4Å; Y638-L669 HydrophobicContact CG-CB 4.39Å
639	Q	97.6	Very high	96.8	Very high	105 Å²	105	55.8 Å²	55.8	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-43.2	178.9	-172.7	63.8	1.6	0	0	112.6	S637 I642 Q643	S637-Q639 PolarHBondContact O-N 3.36Å; Q639-I642 PolarHBondContact O-N 3.44Å; Q639-Q643 WeakPolarHBondContact O-CG 3.36Å; Q639-Q643 PolarHBondContact O-N 3.15Å; Q639-Q643 VanDerWaalsContact O-N 3.13Å
640	K	97.3	Very high	96.6	Very high	91 Å²	91	59.1 Å²	59.1	40%	0.396	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-41.7	174.9	-68.9	-178.1	-179.4	-179	0	111.1	Y628 S637 Y638 I642 Q643 H644	Y628-K640 HydrophobicContact CD1-CB 3.93Å; Y628-K640 HydrophobicContact CD1-CD 3.74Å; Y628-K640 HydrophobicContact CD2-CB 3.8Å; Y628-K640 HydrophobicContact CE1-CB 4.23Å; Y628-K640 HydrophobicContact CE1-CD 3.36Å; Y628-K640 HydrophobicContact CE1-CG 4.45Å; Y628-K640 HydrophobicContact CE2-CB 4.09Å; Y628-K640 HydrophobicContact CE2-CD 4.3Å; Y628-K640 HydrophobicContact CG-CB 3.7Å; Y628-K640 HydrophobicContact CG-CD 4.35Å; S637-K640 PolarHBondContact O-N 2.91Å; S637-K640 WeakPolarHBondContact OG-CG 3.23Å; S637-K640 PolarHBondContact OG-N 2.64Å; Y638-K640 PolarHBondContact O-N 2.81Å; K640-I642 VanDerWaalsContact C-N 3.33Å; K640-I642 PolarHBondContact O-N 3.15Å; K640-Q643 WeakPolarHBondContact O-CB 3.33Å; K640-Q643 PolarHBondContact O-N 2.81Å; K640-Q643 VanDerWaalsContact O-N 3.16Å; K640-H644 PolarHBondContact O-CD2 3.32Å; K640-H644 PolarHBondContact O-N 3.3Å; K640-H644 VanDerWaalsContact O-N 3.09Å
641	A	98.1	Very high	96.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-55.8	-47.3	174.6	0	0	0	0	0	111.8	G625 S637 Y638 Q643 H644 Y645	G625-A641 VanDerWaalsContact O-CB 3.29Å; G625-A641 WeakPolarHBondContact O-CB 3.34Å; S637-A641 PolarHBondContact O-N 3.22Å; Y638-A641 WeakPolarHBondContact O-CB 3.31Å; Y638-A641 PolarHBondContact O-N 3.49Å; A641-Q643 VanDerWaalsContact C-N 3.34Å; A641-Q643 PolarHBondContact O-N 3.35Å; A641-H644 PolarHBondContact O-N 3.15Å; A641-Y645 HydrophobicContact CB-CD2 4.43Å; A641-Y645 HydrophobicContact CB-CE2 3.96Å; A641-Y645 WeakPolarHBondContact O-CD2 3.26Å; A641-Y645 PolarHBondContact O-N 3.1Å
642	I	97.8	Very high	95.8	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-44.2	176.4	-68.1	154.4	0	0	0	111.4	Y638 Q639 K640 H644 Y645 R646 L661 M664 L671	Y638-I642 WeakPolarHBondContact O-CB 3.23Å; Y638-I642 WeakPolarHBondContact O-CD1 3.46Å; Y638-I642 WeakPolarHBondContact O-CG1 3.37Å; Y638-I642 PolarHBondContact O-N 2.53Å; Q639-I642 PolarHBondContact O-N 3.44Å; K640-I642 VanDerWaalsContact C-N 3.33Å; K640-I642 PolarHBondContact O-N 3.15Å; I642-H644 VanDerWaalsContact C-N 3.34Å; I642-H644 PolarHBondContact O-N 2.88Å; I642-Y645 PolarHBondContact O-N 2.87Å; I642-R646 HydrophobicContact CG2-CG 4.13Å; I642-R646 VanDerWaalsContact O-CB 3.31Å; I642-R646 WeakPolarHBondContact O-CB 3.26Å; I642-R646 VanDerWaalsContact O-CG 3.28Å; I642-R646 WeakPolarHBondContact O-CG 3.44Å; I642-R646 PolarHBondContact O-N 3.38Å; I642-L661 HydrophobicContact CG2-CD2 4.24Å; I642-M664 HydrophobicContact CD1-CE 3.82Å; I642-M664 HydrophobicContact CG1-CE 3.42Å; I642-M664 VanDerWaalsContact CG1-CE 3.42Å; I642-M664 HydrophobicContact CG1-SD 3.77Å; I642-L671 HydrophobicContact CD1-CD1 3.98Å; I642-L671 HydrophobicContact CD1-CD2 3.93Å; I642-L671 HydrophobicContact CD1-CG 3.53Å; I642-L671 HydrophobicContact CG1-CD1 4.01Å; I642-L671 HydrophobicContact CG1-CG 4.13Å; I642-L671 HydrophobicContact CG2-CD1 4.47Å; I642-L671 HydrophobicContact CG2-CD2 4.31Å
643	Q	96.4	Very high	95.6	Very high	100 Å²	100	63.7 Å²	63.7	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-59.2	-46.5	178.1	-72.3	172.5	-4.6	0	0	111.1	Q639 K640 A641 R646 I647	Q639-Q643 WeakPolarHBondContact O-CG 3.36Å; Q639-Q643 PolarHBondContact O-N 3.15Å; Q639-Q643 VanDerWaalsContact O-N 3.13Å; K640-Q643 WeakPolarHBondContact O-CB 3.33Å; K640-Q643 PolarHBondContact O-N 2.81Å; K640-Q643 VanDerWaalsContact O-N 3.16Å; A641-Q643 VanDerWaalsContact C-N 3.34Å; A641-Q643 PolarHBondContact O-N 3.35Å; Q643-R646 PolarHBondContact O-N 3.38Å; Q643-I647 WeakPolarHBondContact O-CD1 3.08Å; Q643-I647 VanDerWaalsContact O-CG1 3.23Å; Q643-I647 WeakPolarHBondContact O-CG1 3.13Å; Q643-I647 PolarHBondContact O-N 2.73Å
644	H	97.4	Very high	95.6	Very high	21 Å²	21	64 Å²	64	10%	0.097	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-44.1	178.6	-70.8	-62.6	0	0	0	112.7	R621 L624 Y628 K640 A641 I642 I647 A648	R621-H644 WeakPolarHBondContact CD-O 3.39Å; R621-H644 HydrophobicContact CG-CB 4.1Å; L624-H644 WeakPolarHBondContact CD2-CE1 3.33Å; Y628-H644 AromaticContact CD2-CD2 3.61Å; Y628-H644 AromaticContact CD2-NE2 3.91Å; Y628-H644 AromaticContact CE2-CD2 3.62Å; Y628-H644 AromaticContact CE2-NE2 3.39Å; Y628-H644 WeakPolarHBondContact CE2-NE2 3.5Å; K640-H644 PolarHBondContact O-CD2 3.32Å; K640-H644 PolarHBondContact O-N 3.3Å; K640-H644 VanDerWaalsContact O-N 3.09Å; A641-H644 PolarHBondContact O-N 3.15Å; I642-H644 VanDerWaalsContact C-N 3.34Å; I642-H644 PolarHBondContact O-N 2.88Å; H644-I647 PolarHBondContact O-N 2.93Å; H644-A648 WeakPolarHBondContact O-CB 3.29Å; H644-A648 PolarHBondContact O-N 3.36Å
645	Y	97.9	Very high	95.6	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-39.2	176.3	-60.5	-40.8	0	0	0	112.5	V622 D626 A641 I642 A648 S649 A657 N660 M664	V622-Y645 HydrophobicContact CG1-CE1 4.22Å; V622-Y645 WeakPolarHBondContact O-CE1 3.29Å; D626-Y645 WeakPolarHBondContact CA-OH 3.41Å; D626-Y645 PolarHBondContact N-OH 3.28Å; D626-Y645 WeakPolarHBondContact OD1-CE1 3.36Å; D626-Y645 PolarHBondContact OD1-OH 2.84Å; A641-Y645 HydrophobicContact CB-CD2 4.43Å; A641-Y645 HydrophobicContact CB-CE2 3.96Å; A641-Y645 WeakPolarHBondContact O-CD2 3.26Å; A641-Y645 PolarHBondContact O-N 3.1Å; I642-Y645 PolarHBondContact O-N 2.87Å; Y645-A648 PolarHBondContact O-N 3.4Å; Y645-S649 VanDerWaalsContact O-CB 3.31Å; Y645-S649 WeakPolarHBondContact O-CB 3.4Å; Y645-S649 PolarHBondContact O-N 3.2Å; Y645-A657 WeakPolarHBondContact O-CB 3.24Å; Y645-N660 HydrophobicContact CD1-CB 4.28Å; Y645-N660 HydrophobicContact CD2-CB 4.05Å; Y645-N660 HydrophobicContact CE1-CB 4.18Å; Y645-N660 WeakPolarHBondContact CE1-ND2 3.31Å; Y645-N660 HydrophobicContact CE2-CB 3.95Å; Y645-N660 HydrophobicContact CG-CB 4.21Å; Y645-N660 PolarHBondContact OH-ND2 2.82Å; Y645-M664 HydrophobicContact CD2-SD 3.8Å; Y645-M664 HydrophobicContact CE2-SD 3.8Å
646	R	96.5	Very high	95.4	Very high	110 Å²	110	61.1 Å²	61.1	42%	0.415	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-47.2	175.6	-78.7	-178.9	178.6	-176.2	-0.2	111.7	I642 Q643 A648 S649 D650 L661	I642-R646 HydrophobicContact CG2-CG 4.13Å; I642-R646 VanDerWaalsContact O-CB 3.31Å; I642-R646 WeakPolarHBondContact O-CB 3.26Å; I642-R646 VanDerWaalsContact O-CG 3.28Å; I642-R646 WeakPolarHBondContact O-CG 3.44Å; I642-R646 PolarHBondContact O-N 3.38Å; Q643-R646 PolarHBondContact O-N 3.38Å; R646-A648 VanDerWaalsContact C-N 3.29Å; R646-A648 PolarHBondContact O-N 2.71Å; R646-S649 PolarHBondContact O-N 3.11Å; R646-D650 WeakPolarHBondContact O-CB 3.4Å; R646-D650 VanDerWaalsContact O-CG 3.29Å; R646-D650 PolarHBondContact O-N 3.3Å; R646-L661 HydrophobicContact CG-CD1 4Å; R646-L661 HydrophobicContact CG-CD2 3.98Å
647	I	95.5	Very high	95.4	Very high	62 Å²	62	57.2 Å²	57.2	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176.9	-65.2	164	0	0	0	110.6	R621 Q643 H644 L651	R621-I647 VanDerWaalsContact CD-CG2 3.44Å; Q643-I647 WeakPolarHBondContact O-CD1 3.08Å; Q643-I647 VanDerWaalsContact O-CG1 3.23Å; Q643-I647 WeakPolarHBondContact O-CG1 3.13Å; Q643-I647 PolarHBondContact O-N 2.73Å; H644-I647 PolarHBondContact O-N 2.93Å; I647-L651 HydrophobicContact CG2-CD1 3.76Å; I647-L651 HydrophobicContact CG2-CG 4.36Å; I647-L651 WeakPolarHBondContact O-CB 3.14Å; I647-L651 PolarHBondContact O-N 3.4Å; I647-L651 VanDerWaalsContact O-N 3.11Å
648	A	95.8	Very high	95.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-36.3	176.9	0	0	0	0	0	113.4	T618 R621 V622 H644 Y645 R646 H652 H653 N654 A657	T618-A648 HydrophobicContact CG2-CB 4.15Å; R621-A648 HydrophobicContact CG-CB 4.45Å; V622-A648 HydrophobicContact CG2-CB 3.97Å; H644-A648 WeakPolarHBondContact O-CB 3.29Å; H644-A648 PolarHBondContact O-N 3.36Å; Y645-A648 PolarHBondContact O-N 3.4Å; R646-A648 VanDerWaalsContact C-N 3.29Å; R646-A648 PolarHBondContact O-N 2.71Å; A648-H652 CarbonylContact O-C 3.49Å; A648-H652 WeakPolarHBondContact O-CB 3.38Å; A648-H652 PolarHBondContact O-N 3.14Å; A648-H653 PolarHBondContact O-N 3.31Å; A648-N654 HydrophobicContact CB-CB 4.34Å; A648-N654 WeakPolarHBondContact O-CB 3.36Å; A648-N654 PolarHBondContact O-N 3.22Å; A648-A657 HydrophobicContact CB-CB 3.66Å
649	S	95.3	Very high	95.4	Very high	4 Å²	4	54.1 Å²	54.1	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-68.9	-56.3	175.1	171.2	0	0	0	0	111.3	Y645 R646 H653 M658	Y645-S649 VanDerWaalsContact O-CB 3.31Å; Y645-S649 WeakPolarHBondContact O-CB 3.4Å; Y645-S649 PolarHBondContact O-N 3.2Å; R646-S649 PolarHBondContact O-N 3.11Å; S649-H653 WeakPolarHBondContact O-CA 3.36Å; S649-H653 PolarHBondContact O-N 3.02Å; S649-M658 WeakPolarHBondContact OG-CG 3.46Å
650	D	92.4	Very high	95.3	Very high	106 Å²	106	50.2 Å²	50.2	57%	0.567	24%	0.24	S	C	*	.	H	α-helix	trans	-75.9	-40.2	-166.9	-62.2	-14.2	0	0	0	112.3	R646	R646-D650 WeakPolarHBondContact O-CB 3.4Å; R646-D650 VanDerWaalsContact O-CG 3.29Å; R646-D650 PolarHBondContact O-N 3.3Å
651	L	89.6	Confident	95.3	Very high	123 Å²	123	45.9 Å²	45.9	64%	0.644	22%	0.221	S	C	*	.	H	α-helix	trans	-85.5	-30.9	-179	-60.1	-175.7	0	0	0	112.9	I647	I647-L651 HydrophobicContact CG2-CD1 3.76Å; I647-L651 HydrophobicContact CG2-CG 4.36Å; I647-L651 WeakPolarHBondContact O-CB 3.14Å; I647-L651 PolarHBondContact O-N 3.4Å; I647-L651 VanDerWaalsContact O-N 3.11Å
652	H	88	Confident	95.3	Very high	76 Å²	76	45.9 Å²	45.9	35%	0.352	22%	0.221	S	C	.	.	H	α-helix	trans	-123.2	3.1	-168.8	-53.1	-66	0	0	0	114.4	T618 A648 N654	T618-H652 HydrophobicContact CG2-CB 3.51Å; T618-H652 WeakPolarHBondContact OG1-CB 3.26Å; T618-H652 PolarHBondContact OG1-CD2 3.3Å; T618-H652 VanDerWaalsContact OG1-CD2 3.25Å; T618-H652 PolarHBondContact OG1-ND1 3.49Å; A648-H652 CarbonylContact O-C 3.49Å; A648-H652 WeakPolarHBondContact O-CB 3.38Å; A648-H652 PolarHBondContact O-N 3.14Å; H652-N654 PolarHBondContact O-N 3.25Å; H652-N654 VanDerWaalsContact O-N 3.15Å
653	H	91.8	Very high	95.2	Very high	133 Å²	133	49.3 Å²	49.3	62%	0.616	24%	0.235	S	C	*	.			trans	51.7	37.8	178.7	-64.2	62.1	0	0	0	112.5	A648 S649 A655 M658	A648-H653 PolarHBondContact O-N 3.31Å; S649-H653 WeakPolarHBondContact O-CA 3.36Å; S649-H653 PolarHBondContact O-N 3.02Å; H653-A655 PolarHBondContact O-N 2.87Å; H653-M658 HydrophobicContact CB-CE 4.26Å
654	N	94.1	Very high	95.3	Very high	36 Å²	36	44.6 Å²	44.6	19%	0.193	21%	0.213	C	C	.	.			trans	-76.5	118.5	-174.4	-175.9	-85.2	0	0	0	111.8	T618 A648 H652 Q656 A657 M658	T618-N654 HydrophobicContact CG2-CB 3.7Å; A648-N654 HydrophobicContact CB-CB 4.34Å; A648-N654 WeakPolarHBondContact O-CB 3.36Å; A648-N654 PolarHBondContact O-N 3.22Å; H652-N654 PolarHBondContact O-N 3.25Å; H652-N654 VanDerWaalsContact O-N 3.15Å; N654-Q656 PolarHBondContact O-N 3.43Å; N654-Q656 WeakPolarHBondContact OD1-CB 3.47Å; N654-Q656 PolarHBondContact OD1-N 2.95Å; N654-Q656 VanDerWaalsContact OD1-N 3.14Å; N654-A657 HydrophobicContact CB-CB 4Å; N654-A657 PolarHBondContact O-N 2.66Å; N654-A657 PolarHBondContact OD1-N 2.94Å; N654-M658 WeakPolarHBondContact O-CG 3.33Å; N654-M658 PolarHBondContact O-N 3.25Å
655	A	94.8	Very high	95.2	Very high	12 Å²	12	44.2 Å²	44.2	10%	0.099	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-38.8	-176.9	0	0	0	0	0	113.5	H653 M658 F659 A685 A688 A692	H653-A655 PolarHBondContact O-N 2.87Å; A655-M658 PolarHBondContact O-N 2.99Å; A655-F659 WeakPolarHBondContact O-CB 3.43Å; A655-F659 PolarHBondContact O-N 3.43Å; A655-A685 WeakPolarHBondContact O-CB 3.26Å; A655-A688 HydrophobicContact CB-CB 4.05Å; A655-A692 HydrophobicContact CB-CB 3.99Å
656	Q	94.5	Very high	95.1	Very high	103 Å²	103	44.1 Å²	44.1	48%	0.481	21%	0.21	S	C	.	.	H	α-helix	trans	-65.2	-42	177.7	-173.5	64.4	35.8	0	0	111.2	V622 N654 F659 N660	V622-Q656 HydrophobicContact CG1-CB 4.44Å; V622-Q656 HydrophobicContact CG1-CG 3.92Å; N654-Q656 PolarHBondContact O-N 3.43Å; N654-Q656 WeakPolarHBondContact OD1-CB 3.47Å; N654-Q656 PolarHBondContact OD1-N 2.95Å; N654-Q656 VanDerWaalsContact OD1-N 3.14Å; Q656-F659 PolarHBondContact O-N 3.33Å; Q656-N660 PolarHBondContact NE2-OD1 3.38Å; Q656-N660 WeakPolarHBondContact O-CB 3.02Å; Q656-N660 VanDerWaalsContact O-CG 3.22Å; Q656-N660 PolarHBondContact O-N 3.1Å; Q656-N660 PolarHBondContact O-OD1 2.94Å
657	A	96.7	Very high	95	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-42.9	176.2	0	0	0	0	0	112	V622 Y645 A648 N654 N660 L661	V622-A657 HydrophobicContact CG2-CB 4.08Å; Y645-A657 WeakPolarHBondContact O-CB 3.24Å; A648-A657 HydrophobicContact CB-CB 3.66Å; N654-A657 HydrophobicContact CB-CB 4Å; N654-A657 PolarHBondContact O-N 2.66Å; N654-A657 PolarHBondContact OD1-N 2.94Å; A657-N660 PolarHBondContact O-N 2.89Å; A657-L661 WeakPolarHBondContact O-CG 3.03Å; A657-L661 PolarHBondContact O-N 2.94Å
658	M	97.5	Very high	95	Very high	11 Å²	11	40.7 Å²	40.7	5%	0.054	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-45.4	174	-69	169.8	-179.7	0	0	111.2	S649 H653 N654 A655 N660 L661 G662 F681 M684 A685 A688	S649-M658 WeakPolarHBondContact OG-CG 3.46Å; H653-M658 HydrophobicContact CB-CE 4.26Å; N654-M658 WeakPolarHBondContact O-CG 3.33Å; N654-M658 PolarHBondContact O-N 3.25Å; A655-M658 PolarHBondContact O-N 2.99Å; M658-N660 PolarHBondContact O-N 2.93Å; M658-L661 PolarHBondContact O-N 2.92Å; M658-G662 PolarHBondContact O-N 3.14Å; M658-F681 HydrophobicContact CB-CD1 4.47Å; M658-F681 WeakPolarHBondContact O-CB 3.34Å; M658-M684 HydrophobicContact SD-CB 3.84Å; M658-A685 HydrophobicContact CB-CB 3.87Å; M658-A688 HydrophobicContact SD-CB 4.02Å
659	F	97.4	Very high	94.9	Very high	39 Å²	39	42.5 Å²	42.5	17%	0.171	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-45.2	176.6	-174.7	-87	0	0	0	111.9	A655 Q656 G662 Y663 Y682 A685 A695 V696 A699	A655-F659 WeakPolarHBondContact O-CB 3.43Å; A655-F659 PolarHBondContact O-N 3.43Å; Q656-F659 PolarHBondContact O-N 3.33Å; F659-G662 PolarHBondContact O-N 3.49Å; F659-Y663 PolarHBondContact O-N 2.87Å; F659-Y682 AromaticContact CD2-CD1 3.67Å; F659-Y682 HydrophobicContact CD2-CD1 3.67Å; F659-Y682 AromaticContact CD2-CE1 3.71Å; F659-Y682 HydrophobicContact CD2-CE1 3.71Å; F659-Y682 AromaticContact CE2-CD1 3.92Å; F659-Y682 HydrophobicContact CE2-CD1 3.92Å; F659-Y682 AromaticContact CE2-CE1 3.72Å; F659-Y682 HydrophobicContact CE2-CE1 3.72Å; F659-Y682 HydrophobicContact CG-CD1 4.34Å; F659-Y682 HydrophobicContact CG-CE1 4.14Å; F659-Y682 HydrophobicContact CZ-CE1 4.17Å; F659-Y682 WeakPolarHBondContact O-CE1 3.29Å; F659-A685 HydrophobicContact CB-CB 4.27Å; F659-A695 HydrophobicContact CD2-CB 4.46Å; F659-A695 HydrophobicContact CE2-CB 3.92Å; F659-A695 HydrophobicContact CZ-CB 4.25Å; F659-V696 HydrophobicContact CD2-CG2 3.99Å; F659-V696 HydrophobicContact CE2-CG2 4.43Å; F659-A699 HydrophobicContact CE2-CB 3.87Å; F659-A699 HydrophobicContact CZ-CB 4.2Å
660	N	97.1	Very high	94.7	Very high	22 Å²	22	44.5 Å²	44.5	12%	0.118	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-43.9	177.1	-71	-1.6	0	0	0	111.2	D626 Y645 Q656 A657 M658 G662 Y663 M664	D626-N660 PolarHBondContact OD1-ND2 3.24Å; Y645-N660 HydrophobicContact CD1-CB 4.28Å; Y645-N660 HydrophobicContact CD2-CB 4.05Å; Y645-N660 HydrophobicContact CE1-CB 4.18Å; Y645-N660 WeakPolarHBondContact CE1-ND2 3.31Å; Y645-N660 HydrophobicContact CE2-CB 3.95Å; Y645-N660 HydrophobicContact CG-CB 4.21Å; Y645-N660 PolarHBondContact OH-ND2 2.82Å; Q656-N660 PolarHBondContact NE2-OD1 3.38Å; Q656-N660 WeakPolarHBondContact O-CB 3.02Å; Q656-N660 VanDerWaalsContact O-CG 3.22Å; Q656-N660 PolarHBondContact O-N 3.1Å; Q656-N660 PolarHBondContact O-OD1 2.94Å; A657-N660 PolarHBondContact O-N 2.89Å; M658-N660 PolarHBondContact O-N 2.93Å; N660-G662 PolarHBondContact O-N 2.82Å; N660-Y663 WeakPolarHBondContact O-CB 3.18Å; N660-Y663 PolarHBondContact O-N 3.45Å; N660-M664 VanDerWaalsContact O-CG 3.3Å; N660-M664 WeakPolarHBondContact O-CG 3.41Å; N660-M664 PolarHBondContact O-N 2.85Å
661	L	97.4	Very high	94.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-40.9	174.3	-73.3	170	0	0	0	112.4	I642 R646 A657 M658 Y663 M664 H665 F681	I642-L661 HydrophobicContact CG2-CD2 4.24Å; R646-L661 HydrophobicContact CG-CD1 4Å; R646-L661 HydrophobicContact CG-CD2 3.98Å; A657-L661 WeakPolarHBondContact O-CG 3.03Å; A657-L661 PolarHBondContact O-N 2.94Å; M658-L661 PolarHBondContact O-N 2.92Å; L661-Y663 VanDerWaalsContact C-N 3.33Å; L661-Y663 PolarHBondContact O-N 3.26Å; L661-M664 PolarHBondContact O-N 3.45Å; L661-H665 PolarHBondContact O-CD2 3.47Å; L661-H665 PolarHBondContact O-N 3.1Å; L661-F681 HydrophobicContact CB-CD1 4Å; L661-F681 HydrophobicContact CB-CD2 4.37Å; L661-F681 HydrophobicContact CB-CE1 4.07Å; L661-F681 HydrophobicContact CB-CE2 4.43Å; L661-F681 HydrophobicContact CB-CG 4.18Å; L661-F681 HydrophobicContact CB-CZ 4.29Å; L661-F681 HydrophobicContact CD1-CD1 4.38Å; L661-F681 HydrophobicContact CD1-CE1 3.82Å; L661-F681 HydrophobicContact CD1-CZ 4.22Å
662	G	96.8	Very high	94.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-45.5	174.1	0	0	0	0	0	111.7	M658 F659 N660 H665 E666 A678	M658-G662 PolarHBondContact O-N 3.14Å; F659-G662 PolarHBondContact O-N 3.49Å; N660-G662 PolarHBondContact O-N 2.82Å; G662-H665 PolarHBondContact O-N 3.41Å; G662-E666 WeakPolarHBondContact O-CB 3.25Å; G662-E666 PolarHBondContact O-N 3.16Å; G662-A678 VanDerWaalsContact O-CB 3.23Å; G662-A678 WeakPolarHBondContact O-CB 3.5Å
663	Y	96.7	Very high	95.3	Very high	74 Å²	74	46.1 Å²	46.1	29%	0.29	23%	0.23	S	C	.	.	H	α-helix	trans	-62.5	-42.8	175.3	-179.3	-103.3	0	0	0	113.1	Y629 F659 N660 L661 H665 E666 Q667 L669 Y682	Y629-Y663 WeakPolarHBondContact OH-CE1 3.37Å; F659-Y663 PolarHBondContact O-N 2.87Å; N660-Y663 WeakPolarHBondContact O-CB 3.18Å; N660-Y663 PolarHBondContact O-N 3.45Å; L661-Y663 VanDerWaalsContact C-N 3.33Å; L661-Y663 PolarHBondContact O-N 3.26Å; Y663-H665 VanDerWaalsContact C-N 3.34Å; Y663-H665 PolarHBondContact O-N 2.93Å; Y663-E666 WeakPolarHBondContact O-CB 3.37Å; Y663-E666 PolarHBondContact O-N 2.82Å; Y663-Q667 HydrophobicContact CD2-CG 4.08Å; Y663-Q667 HydrophobicContact CE1-CG 4.1Å; Y663-Q667 HydrophobicContact CE2-CG 3.62Å; Y663-Q667 WeakPolarHBondContact O-CG 3.48Å; Y663-Q667 PolarHBondContact O-N 3.4Å; Y663-L669 HydrophobicContact CD1-CD1 4.44Å; Y663-L669 HydrophobicContact CE1-CD1 3.94Å; Y663-Y682 WeakPolarHBondContact CA-OH 3.41Å; Y663-Y682 PolarHBondContact N-OH 2.78Å
664	M	97.3	Very high	95.4	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-36.8	177.2	-67.1	-177.5	84.5	0	0	112.3	Y629 Y638 I642 Y645 N660 L661 G668 L669 L671	Y629-M664 HydrophobicContact CD2-CE 4.3Å; Y638-M664 HydrophobicContact CD1-CE 4.02Å; Y638-M664 HydrophobicContact CG-CE 4.29Å; I642-M664 HydrophobicContact CD1-CE 3.82Å; I642-M664 HydrophobicContact CG1-CE 3.42Å; I642-M664 VanDerWaalsContact CG1-CE 3.42Å; I642-M664 HydrophobicContact CG1-SD 3.77Å; Y645-M664 HydrophobicContact CD2-SD 3.8Å; Y645-M664 HydrophobicContact CE2-SD 3.8Å; N660-M664 VanDerWaalsContact O-CG 3.3Å; N660-M664 WeakPolarHBondContact O-CG 3.41Å; N660-M664 PolarHBondContact O-N 2.85Å; L661-M664 PolarHBondContact O-N 3.45Å; M664-G668 WeakPolarHBondContact O-CA 3.44Å; M664-G668 PolarHBondContact O-N 3.1Å; M664-L669 HydrophobicContact CB-CB 4.43Å; M664-L669 HydrophobicContact CE-CB 4.24Å; M664-L669 VanDerWaalsContact CE-O 3.26Å; M664-L669 WeakPolarHBondContact CE-O 3.31Å; M664-L669 HydrophobicContact CG-CB 4.41Å; M664-L669 PolarHBondContact O-N 2.73Å; M664-L671 HydrophobicContact CB-CD1 4.01Å
665	H	97	Very high	95.4	Very high	13 Å²	13	41.9 Å²	41.9	6%	0.06	21%	0.212	C	C	.	.	H	α-helix	trans	-69.3	-36.2	171.6	-85.7	-64.7	0	0	0	113.1	L661 G662 Y663 K672 R673 D674 L677 A678 F681	L661-H665 PolarHBondContact O-CD2 3.47Å; L661-H665 PolarHBondContact O-N 3.1Å; G662-H665 PolarHBondContact O-N 3.41Å; Y663-H665 VanDerWaalsContact C-N 3.34Å; Y663-H665 PolarHBondContact O-N 2.93Å; H665-K672 PolarHBondContact ND1-O 2.95Å; H665-R673 CarbonylContact O-C 3.55Å; H665-R673 VanDerWaalsContact O-CA 3.25Å; H665-R673 WeakPolarHBondContact O-CA 3.45Å; H665-D674 PolarHBondContact O-N 3.45Å; H665-L677 WeakPolarHBondContact CE1-CD2 3.35Å; H665-L677 WeakPolarHBondContact NE2-CD2 3.29Å; H665-A678 HydrophobicContact CB-CB 3.98Å; H665-F681 AromaticContact CD2-CD2 3.73Å; H665-F681 AromaticContact CD2-CE2 3.54Å; H665-F681 AromaticContact NE2-CE2 3.71Å
666	E	95.4	Very high	95.4	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-44.3	177.3	-170.8	-165.9	118.3	0	0	111.2	G662 Y663 R673 L675 A678 Y682 R702 L703 Y706	G662-E666 WeakPolarHBondContact O-CB 3.25Å; G662-E666 PolarHBondContact O-N 3.16Å; Y663-E666 WeakPolarHBondContact O-CB 3.37Å; Y663-E666 PolarHBondContact O-N 2.82Å; E666-R673 WeakPolarHBondContact O-CD 3.37Å; E666-R673 WeakPolarHBondContact O-CG 3.41Å; E666-R673 PolarHBondContact O-NE 3.04Å; E666-L675 HydrophobicContact CG-CD2 4.16Å; E666-A678 HydrophobicContact CB-CB 3.97Å; E666-Y682 PolarHBondContact OE2-OH 2.87Å; E666-R702 VanDerWaalsContact CD-NH2 3.26Å; E666-R702 IonicContact OE1-CZ 2.71Å; E666-R702 IonicContact OE1-NE 3.88Å; E666-R702 PolarHBondContact OE1-NE 2.83Å; E666-R702 IonicContact OE1-NH2 3.78Å; E666-R702 PolarHBondContact OE1-NH2 3.36Å; E666-R702 VanDerWaalsContact OE1-NH2 3.11Å; E666-R702 IonicContact OE2-CZ 2.84Å; E666-R702 IonicContact OE2-NE 3.14Å; E666-R702 PolarHBondContact OE2-NE 2.91Å; E666-R702 IonicContact OE2-NH2 3.58Å; E666-R702 PolarHBondContact OE2-NH2 3.15Å; E666-L703 HydrophobicContact CG-CD1 4.13Å; E666-Y706 HydrophobicContact CG-CE2 4.3Å; E666-Y706 WeakPolarHBondContact OE1-CE2 3.29Å
667	Q	94.4	Very high	95.5	Very high	71 Å²	71	46.5 Å²	46.5	33%	0.332	23%	0.227	S	C	.	.	H	α-helix	trans	-90.2	-16.9	-175.1	-62.2	-59.6	-46.9	0	0	113.5	Y663 L669	Y663-Q667 HydrophobicContact CD2-CG 4.08Å; Y663-Q667 HydrophobicContact CE1-CG 4.1Å; Y663-Q667 HydrophobicContact CE2-CG 3.62Å; Y663-Q667 WeakPolarHBondContact O-CG 3.48Å; Y663-Q667 PolarHBondContact O-N 3.4Å; Q667-L669 HydrophobicContact CB-CD1 3.96Å; Q667-L669 HydrophobicContact CB-CG 3.79Å
668	G	94.6	Very high	95.5	Very high	29 Å²	29	46.5 Å²	46.5	30%	0.299	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	34.8	-175.6	0	0	0	0	0	113.7	M664 G670 L671	M664-G668 WeakPolarHBondContact O-CA 3.44Å; M664-G668 PolarHBondContact O-N 3.1Å; G668-G670 PolarHBondContact O-N 2.71Å; G668-L671 CarbonylContact C-O 3.5Å; G668-L671 WeakPolarHBondContact CA-O 3.5Å
669	L	93.5	Very high	95.4	Very high	38 Å²	38	48.4 Å²	48.4	20%	0.199	24%	0.235	C	C	.	.	S	Bend	trans	-86.6	102	-177.4	-62.5	173.2	0	0	0	110.2	Y629 Y638 Y663 M664 Q667 L671	Y629-L669 HydrophobicContact CE2-CD1 3.7Å; Y629-L669 VanDerWaalsContact OH-CD1 3.31Å; Y629-L669 WeakPolarHBondContact OH-CD1 3.38Å; Y638-L669 HydrophobicContact CD1-CB 4.33Å; Y638-L669 HydrophobicContact CE2-CD2 4.4Å; Y638-L669 HydrophobicContact CG-CB 4.39Å; Y663-L669 HydrophobicContact CD1-CD1 4.44Å; Y663-L669 HydrophobicContact CE1-CD1 3.94Å; M664-L669 HydrophobicContact CB-CB 4.43Å; M664-L669 HydrophobicContact CE-CB 4.24Å; M664-L669 VanDerWaalsContact CE-O 3.26Å; M664-L669 WeakPolarHBondContact CE-O 3.31Å; M664-L669 HydrophobicContact CG-CB 4.41Å; M664-L669 PolarHBondContact O-N 2.73Å; Q667-L669 HydrophobicContact CB-CD1 3.96Å; Q667-L669 HydrophobicContact CB-CG 3.79Å; L669-L671 PolarHBondContact O-N 3.29Å
670	G	92.3	Very high	95.4	Very high	47 Å²	47	54.3 Å²	54.3	49%	0.485	26%	0.256	S	S	.	.	S	Bend	trans	67.8	-10	-174.8	0	0	0	0	0	114.8	G668	G668-G670 PolarHBondContact O-N 2.71Å
671	L	92.5	Very high	95.4	Very high	26 Å²	26	54.4 Å²	54.4	14%	0.136	26%	0.255	C	S	.	.	S	Bend	trans	-117.1	154.1	175.4	-67.4	164.9	0	0	0	109.3	I642 M664 G668 L669 R673	I642-L671 HydrophobicContact CD1-CD1 3.98Å; I642-L671 HydrophobicContact CD1-CD2 3.93Å; I642-L671 HydrophobicContact CD1-CG 3.53Å; I642-L671 HydrophobicContact CG1-CD1 4.01Å; I642-L671 HydrophobicContact CG1-CG 4.13Å; I642-L671 HydrophobicContact CG2-CD1 4.47Å; I642-L671 HydrophobicContact CG2-CD2 4.31Å; M664-L671 HydrophobicContact CB-CD1 4.01Å; G668-L671 CarbonylContact C-O 3.5Å; G668-L671 WeakPolarHBondContact CA-O 3.5Å; L669-L671 PolarHBondContact O-N 3.29Å; L671-R673 PolarHBondContact O-N 3.19Å
672	K	93.4	Very high	95.4	Very high	187 Å²	187	54.4 Å²	54.4	81%	0.813	26%	0.255	S	S	*	.			trans	-61.2	131.3	165.8	-173.9	-179.9	178.3	-176.2	0	108.5	H665 D674	H665-K672 PolarHBondContact ND1-O 2.95Å; K672-D674 PolarHBondContact O-N 3.26Å
673	R	95.3	Very high	95.4	Very high	126 Å²	126	56.7 Å²	56.7	48%	0.475	27%	0.268	S	S	.	.			trans	-59.1	123	174.1	179.1	169	166	-172	-7.7	109.9	H665 E666 L671 L675	H665-R673 CarbonylContact O-C 3.55Å; H665-R673 VanDerWaalsContact O-CA 3.25Å; H665-R673 WeakPolarHBondContact O-CA 3.45Å; E666-R673 WeakPolarHBondContact O-CD 3.37Å; E666-R673 WeakPolarHBondContact O-CG 3.41Å; E666-R673 PolarHBondContact O-NE 3.04Å; L671-R673 PolarHBondContact O-N 3.19Å; R673-L675 HydrophobicContact CG-CD2 4.44Å
674	D	95.6	Very high	95.4	Very high	63 Å²	63	55.6 Å²	55.6	34%	0.337	27%	0.266	S	S	.	.			trans	-147.9	101.8	-178.8	-173.1	-27.6	0	0	0	109.4	H665 K672 Y676 L677 A678	H665-D674 PolarHBondContact O-N 3.45Å; K672-D674 PolarHBondContact O-N 3.26Å; D674-Y676 VanDerWaalsContact C-N 3.32Å; D674-Y676 PolarHBondContact O-N 2.8Å; D674-Y676 PolarHBondContact OD1-N 3.41Å; D674-L677 HydrophobicContact CB-CB 3.96Å; D674-L677 PolarHBondContact OD1-N 2.96Å; D674-A678 WeakPolarHBondContact O-CB 3.37Å; D674-A678 PolarHBondContact O-N 3.44Å
675	L	93.9	Very high	95.3	Very high	16 Å²	16	55.6 Å²	55.6	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-70.1	-29	-176.1	-58.7	-173.9	0	0	0	112.5	E666 R673 K679 L703 F707	E666-L675 HydrophobicContact CG-CD2 4.16Å; R673-L675 HydrophobicContact CG-CD2 4.44Å; L675-K679 PolarHBondContact O-N 3.45Å; L675-L703 HydrophobicContact CB-CD1 4Å; L675-L703 HydrophobicContact CD2-CD1 3.84Å; L675-L703 HydrophobicContact CG-CD1 4.36Å; L675-F707 HydrophobicContact CB-CE1 3.91Å; L675-F707 HydrophobicContact CB-CZ 3.72Å; L675-F707 HydrophobicContact CD1-CD1 4.44Å; L675-F707 HydrophobicContact CD1-CE1 4.14Å
676	Y	94.5	Very high	95.3	Very high	161 Å²	161	55.9 Å²	55.9	63%	0.631	27%	0.27	S	S	*	.	H	α-helix	trans	-73.8	-42.2	178.5	-65.1	-80	0	0	0	110.8	D674 K679 R680 F707	D674-Y676 VanDerWaalsContact C-N 3.32Å; D674-Y676 PolarHBondContact O-N 2.8Å; D674-Y676 PolarHBondContact OD1-N 3.41Å; Y676-K679 WeakPolarHBondContact O-CB 3.46Å; Y676-K679 PolarHBondContact O-N 3.4Å; Y676-R680 PolarHBondContact O-N 2.89Å; Y676-F707 HydrophobicContact CD1-CZ 4.37Å; Y676-F707 HydrophobicContact CE1-CE1 4.17Å; Y676-F707 HydrophobicContact CE1-CZ 4.27Å; Y676-F707 HydrophobicContact CE2-CE1 4.39Å
677	L	95.3	Very high	95.3	Very high	52 Å²	52	63.5 Å²	63.5	27%	0.272	31%	0.306	S	S	.	.	H	α-helix	trans	-68.3	-38.5	175	-171.7	53.5	0	0	0	111.4	H665 D674 K679 R680 F681	H665-L677 WeakPolarHBondContact CE1-CD2 3.35Å; H665-L677 WeakPolarHBondContact NE2-CD2 3.29Å; D674-L677 HydrophobicContact CB-CB 3.96Å; D674-L677 PolarHBondContact OD1-N 2.96Å; L677-K679 PolarHBondContact O-N 2.86Å; L677-R680 PolarHBondContact O-N 3.13Å; L677-F681 HydrophobicContact CD1-CD2 4.04Å; L677-F681 HydrophobicContact CD1-CE2 3.72Å; L677-F681 HydrophobicContact CD2-CE2 4.28Å; L677-F681 HydrophobicContact CG-CD2 3.94Å; L677-F681 HydrophobicContact CG-CE2 3.72Å; L677-F681 VanDerWaalsContact O-CD2 3.27Å; L677-F681 WeakPolarHBondContact O-CD2 3.45Å; L677-F681 PolarHBondContact O-N 3.49Å
678	A	97	Very high	95.2	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-55.7	-49	171.3	0	0	0	0	0	111.9	G662 H665 E666 D674 R680 F681 Y682	G662-A678 VanDerWaalsContact O-CB 3.23Å; G662-A678 WeakPolarHBondContact O-CB 3.5Å; H665-A678 HydrophobicContact CB-CB 3.98Å; E666-A678 HydrophobicContact CB-CB 3.97Å; D674-A678 WeakPolarHBondContact O-CB 3.37Å; D674-A678 PolarHBondContact O-N 3.44Å; A678-R680 VanDerWaalsContact C-N 3.34Å; A678-R680 PolarHBondContact O-N 3.29Å; A678-F681 PolarHBondContact O-N 3.26Å; A678-Y682 HydrophobicContact CB-CE2 4.39Å; A678-Y682 VanDerWaalsContact O-CD2 3.27Å; A678-Y682 WeakPolarHBondContact O-CD2 3.07Å; A678-Y682 PolarHBondContact O-N 2.7Å
679	K	96	Very high	95.1	Very high	50 Å²	50	62.7 Å²	62.7	22%	0.217	31%	0.306	C	S	.	.	H	α-helix	trans	-54.2	-49.9	174.4	-169.8	-172	176.9	-66.6	0	111.6	L675 Y676 L677 F681 Y682 D683 L700 L703 F764	L675-K679 PolarHBondContact O-N 3.45Å; Y676-K679 WeakPolarHBondContact O-CB 3.46Å; Y676-K679 PolarHBondContact O-N 3.4Å; L677-K679 PolarHBondContact O-N 2.86Å; K679-F681 VanDerWaalsContact C-N 3.28Å; K679-F681 PolarHBondContact O-N 3.32Å; K679-Y682 WeakPolarHBondContact O-CB 3.39Å; K679-Y682 PolarHBondContact O-N 3.25Å; K679-Y682 VanDerWaalsContact O-N 3.08Å; K679-D683 IonicContact NZ-OD1 2.92Å; K679-D683 IonicContact NZ-OD2 3.99Å; K679-D683 PolarHBondContact NZ-OD2 3.48Å; K679-D683 VanDerWaalsContact O-CG 3.31Å; K679-D683 PolarHBondContact O-N 3.39Å; K679-L700 HydrophobicContact CG-CD2 3.81Å; K679-L703 HydrophobicContact CB-CD2 3.58Å; K679-L703 HydrophobicContact CG-CD2 4.07Å; K679-F764 HydrophobicContact CD-CZ 4.07Å
680	R	96.5	Very high	94.9	Very high	163 Å²	163	65.8 Å²	65.8	62%	0.615	32%	0.322	S	S	*	.	H	α-helix	trans	-58.1	-42.7	-179.1	-175.3	-178.5	174.2	-179.1	-1.4	111.3	Y676 L677 A678 D683 M684	Y676-R680 PolarHBondContact O-N 2.89Å; L677-R680 PolarHBondContact O-N 3.13Å; A678-R680 VanDerWaalsContact C-N 3.34Å; A678-R680 PolarHBondContact O-N 3.29Å; R680-D683 PolarHBondContact O-N 2.69Å; R680-M684 HydrophobicContact CG-CE 4.25Å; R680-M684 HydrophobicContact CG-SD 4.43Å; R680-M684 WeakPolarHBondContact O-CB 3.48Å; R680-M684 VanDerWaalsContact O-CG 3.25Å; R680-M684 WeakPolarHBondContact O-CG 3.11Å; R680-M684 PolarHBondContact O-N 2.85Å
681	F	97.3	Very high	94.6	Very high	24 Å²	24	70 Å²	70	11%	0.105	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-39.8	175.1	-84.9	-65.7	0	0	0	113	M658 L661 H665 L677 A678 K679 M684 A685	M658-F681 HydrophobicContact CB-CD1 4.47Å; M658-F681 WeakPolarHBondContact O-CB 3.34Å; L661-F681 HydrophobicContact CB-CD1 4Å; L661-F681 HydrophobicContact CB-CD2 4.37Å; L661-F681 HydrophobicContact CB-CE1 4.07Å; L661-F681 HydrophobicContact CB-CE2 4.43Å; L661-F681 HydrophobicContact CB-CG 4.18Å; L661-F681 HydrophobicContact CB-CZ 4.29Å; L661-F681 HydrophobicContact CD1-CD1 4.38Å; L661-F681 HydrophobicContact CD1-CE1 3.82Å; L661-F681 HydrophobicContact CD1-CZ 4.22Å; H665-F681 AromaticContact CD2-CD2 3.73Å; H665-F681 AromaticContact CD2-CE2 3.54Å; H665-F681 AromaticContact NE2-CE2 3.71Å; L677-F681 HydrophobicContact CD1-CD2 4.04Å; L677-F681 HydrophobicContact CD1-CE2 3.72Å; L677-F681 HydrophobicContact CD2-CE2 4.28Å; L677-F681 HydrophobicContact CG-CD2 3.94Å; L677-F681 HydrophobicContact CG-CE2 3.72Å; L677-F681 VanDerWaalsContact O-CD2 3.27Å; L677-F681 WeakPolarHBondContact O-CD2 3.45Å; L677-F681 PolarHBondContact O-N 3.49Å; A678-F681 PolarHBondContact O-N 3.26Å; K679-F681 VanDerWaalsContact C-N 3.28Å; K679-F681 PolarHBondContact O-N 3.32Å; F681-M684 HydrophobicContact CB-CE 4.37Å; F681-M684 HydrophobicContact CD1-CE 3.29Å; F681-M684 HydrophobicContact CE1-CE 3.6Å; F681-M684 HydrophobicContact CG-CE 3.88Å; F681-M684 HydrophobicContact CZ-CE 4.43Å; F681-M684 PolarHBondContact O-N 3.45Å; F681-A685 WeakPolarHBondContact O-CB 3.43Å; F681-A685 PolarHBondContact O-N 3.37Å
682	Y	97.9	Very high	94.6	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-44	174.1	-67.1	-39.7	0	0	0	112.8	F659 Y663 E666 A678 K679 A685 A686 V696 A699 L700 R702	F659-Y682 AromaticContact CD2-CD1 3.67Å; F659-Y682 HydrophobicContact CD2-CD1 3.67Å; F659-Y682 AromaticContact CD2-CE1 3.71Å; F659-Y682 HydrophobicContact CD2-CE1 3.71Å; F659-Y682 AromaticContact CE2-CD1 3.92Å; F659-Y682 HydrophobicContact CE2-CD1 3.92Å; F659-Y682 AromaticContact CE2-CE1 3.72Å; F659-Y682 HydrophobicContact CE2-CE1 3.72Å; F659-Y682 HydrophobicContact CG-CD1 4.34Å; F659-Y682 HydrophobicContact CG-CE1 4.14Å; F659-Y682 HydrophobicContact CZ-CE1 4.17Å; F659-Y682 WeakPolarHBondContact O-CE1 3.29Å; Y663-Y682 WeakPolarHBondContact CA-OH 3.41Å; Y663-Y682 PolarHBondContact N-OH 2.78Å; E666-Y682 PolarHBondContact OE2-OH 2.87Å; A678-Y682 HydrophobicContact CB-CE2 4.39Å; A678-Y682 VanDerWaalsContact O-CD2 3.27Å; A678-Y682 WeakPolarHBondContact O-CD2 3.07Å; A678-Y682 PolarHBondContact O-N 2.7Å; K679-Y682 WeakPolarHBondContact O-CB 3.39Å; K679-Y682 PolarHBondContact O-N 3.25Å; K679-Y682 VanDerWaalsContact O-N 3.08Å; Y682-A685 WeakPolarHBondContact O-CB 3.49Å; Y682-A685 PolarHBondContact O-N 3.15Å; Y682-A686 PolarHBondContact O-N 2.98Å; Y682-V696 WeakPolarHBondContact O-CG1 3.26Å; Y682-V696 VanDerWaalsContact O-CG2 3.24Å; Y682-V696 WeakPolarHBondContact O-CG2 3.36Å; Y682-A699 HydrophobicContact CD1-CB 4.16Å; Y682-A699 HydrophobicContact CD2-CB 4.03Å; Y682-A699 HydrophobicContact CE1-CB 3.94Å; Y682-A699 HydrophobicContact CE2-CB 3.78Å; Y682-A699 HydrophobicContact CG-CB 4.22Å; Y682-L700 HydrophobicContact CD2-CD2 4.46Å; Y682-R702 PolarHBondContact OH-NH2 3.04Å
683	D	96.3	Very high	94.7	Very high	49 Å²	49	65.9 Å²	65.9	26%	0.262	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-46.9	175.9	-63.6	-28.5	0	0	0	110.6	K679 R680 A685 A686 E687	K679-D683 IonicContact NZ-OD1 2.92Å; K679-D683 IonicContact NZ-OD2 3.99Å; K679-D683 PolarHBondContact NZ-OD2 3.48Å; K679-D683 VanDerWaalsContact O-CG 3.31Å; K679-D683 PolarHBondContact O-N 3.39Å; R680-D683 PolarHBondContact O-N 2.69Å; D683-A685 VanDerWaalsContact C-N 3.29Å; D683-A685 PolarHBondContact O-N 3.41Å; D683-A686 PolarHBondContact O-N 2.7Å; D683-A686 VanDerWaalsContact O-N 3.16Å; D683-E687 WeakPolarHBondContact O-CG 3.23Å; D683-E687 PolarHBondContact O-N 2.89Å
684	M	96.7	Very high	94.6	Very high	51 Å²	51	64.9 Å²	64.9	25%	0.251	32%	0.322	S	S	.	.	H	α-helix	trans	-59	-39	175.5	-71.4	-175.1	-53.9	0	0	112.1	M658 R680 F681 E687 A688	M658-M684 HydrophobicContact SD-CB 3.84Å; R680-M684 HydrophobicContact CG-CE 4.25Å; R680-M684 HydrophobicContact CG-SD 4.43Å; R680-M684 WeakPolarHBondContact O-CB 3.48Å; R680-M684 VanDerWaalsContact O-CG 3.25Å; R680-M684 WeakPolarHBondContact O-CG 3.11Å; R680-M684 PolarHBondContact O-N 2.85Å; F681-M684 HydrophobicContact CB-CE 4.37Å; F681-M684 HydrophobicContact CD1-CE 3.29Å; F681-M684 HydrophobicContact CE1-CE 3.6Å; F681-M684 HydrophobicContact CG-CE 3.88Å; F681-M684 HydrophobicContact CZ-CE 4.43Å; F681-M684 PolarHBondContact O-N 3.45Å; M684-E687 PolarHBondContact O-N 3.36Å; M684-A688 VanDerWaalsContact O-CB 3.26Å; M684-A688 WeakPolarHBondContact O-CB 3.38Å; M684-A688 PolarHBondContact O-N 2.96Å
685	A	97	Very high	94.5	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-42.4	176.2	0	0	0	0	0	112.3	A655 M658 F659 F681 Y682 D683 E687 A688 S689 A692 V696	A655-A685 WeakPolarHBondContact O-CB 3.26Å; M658-A685 HydrophobicContact CB-CB 3.87Å; F659-A685 HydrophobicContact CB-CB 4.27Å; F681-A685 WeakPolarHBondContact O-CB 3.43Å; F681-A685 PolarHBondContact O-N 3.37Å; Y682-A685 WeakPolarHBondContact O-CB 3.49Å; Y682-A685 PolarHBondContact O-N 3.15Å; D683-A685 VanDerWaalsContact C-N 3.29Å; D683-A685 PolarHBondContact O-N 3.41Å; A685-E687 VanDerWaalsContact C-N 3.34Å; A685-A688 PolarHBondContact O-N 3.48Å; A685-S689 PolarHBondContact O-N 3.47Å; A685-S689 VanDerWaalsContact O-N 3.11Å; A685-A692 HydrophobicContact CB-CB 4.42Å; A685-A692 WeakPolarHBondContact O-CB 3.16Å; A685-V696 HydrophobicContact CB-CG2 3.93Å
686	A	96.1	Very high	94.7	Very high	19 Å²	19	63.2 Å²	63.2	16%	0.157	32%	0.319	C	S	.	.	H	α-helix	trans	-70.4	-28	177.8	0	0	0	0	0	113.8	Y682 D683 R693 V696	Y682-A686 PolarHBondContact O-N 2.98Å; D683-A686 PolarHBondContact O-N 2.7Å; D683-A686 VanDerWaalsContact O-N 3.16Å; A686-R693 HydrophobicContact CB-CG 4.09Å; A686-V696 HydrophobicContact CB-CB 4.01Å; A686-V696 HydrophobicContact CB-CG1 3.73Å; A686-V696 HydrophobicContact CB-CG2 4.04Å
687	E	95.1	Very high	94.7	Very high	161 Å²	161	62.5 Å²	62.5	75%	0.752	32%	0.317	S	S	*	.	H	α-helix	trans	-74.3	-38.9	171.2	-72.4	178.4	180	0	0	111.6	D683 M684 A685	D683-E687 WeakPolarHBondContact O-CG 3.23Å; D683-E687 PolarHBondContact O-N 2.89Å; M684-E687 PolarHBondContact O-N 3.36Å; A685-E687 VanDerWaalsContact C-N 3.34Å
688	A	92.8	Very high	94.8	Very high	49 Å²	49	65.5 Å²	65.5	41%	0.405	33%	0.332	S	S	.	.	H	α-helix	trans	-70.8	-37.3	-178.1	0	0	0	0	0	113.5	A655 M658 M684 A685	A655-A688 HydrophobicContact CB-CB 4.05Å; M658-A688 HydrophobicContact SD-CB 4.02Å; M684-A688 VanDerWaalsContact O-CB 3.26Å; M684-A688 WeakPolarHBondContact O-CB 3.38Å; M684-A688 PolarHBondContact O-N 2.96Å; A685-A688 PolarHBondContact O-N 3.48Å
689	S	91.7	Very high	94.7	Very high	34 Å²	34	65.7 Å²	65.7	24%	0.238	33%	0.334	C	S	.	.			trans	-142.2	142.3	176.9	-180	0	0	0	0	113.3	A685 D691 A692	A685-S689 PolarHBondContact O-N 3.47Å; A685-S689 VanDerWaalsContact O-N 3.11Å; S689-D691 VanDerWaalsContact C-N 3.27Å; S689-D691 PolarHBondContact O-N 3.49Å; S689-D691 PolarHBondContact OG-N 3.21Å; S689-D691 VanDerWaalsContact OG-N 3.15Å; S689-D691 PolarHBondContact OG-OD2 2.91Å; S689-A692 PolarHBondContact O-N 2.9Å
690	I	90.1	Very high	94.7	Very high	104 Å²	104	65.2 Å²	65.2	53%	0.533	33%	0.333	S	S	.	.	S	Bend	trans	-62.4	-35.9	171.5	-172.4	65.4	0	0	0	111.7	A692 R693	I690-A692 VanDerWaalsContact C-N 3.25Å; I690-A692 PolarHBondContact O-N 3.27Å; I690-R693 WeakPolarHBondContact O-CB 3.32Å; I690-R693 WeakPolarHBondContact O-CG 3.47Å; I690-R693 PolarHBondContact O-N 3.39Å
691	D	86.7	Confident	94.6	Very high	136 Å²	136	62.7 Å²	62.7	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-27.9	-176	-55.8	-42.3	0	0	0	111.6	S689 R693	S689-D691 VanDerWaalsContact C-N 3.27Å; S689-D691 PolarHBondContact O-N 3.49Å; S689-D691 PolarHBondContact OG-N 3.21Å; S689-D691 VanDerWaalsContact OG-N 3.15Å; S689-D691 PolarHBondContact OG-OD2 2.91Å; D691-R693 VanDerWaalsContact C-N 3.32Å; D691-R693 PolarHBondContact O-N 2.89Å
692	A	92.3	Very high	94.4	Very high	15 Å²	15	65.7 Å²	65.7	12%	0.124	34%	0.342	C	S	.	.	H	α-helix	trans	-74.4	-19.9	177.9	0	0	0	0	0	113.2	A655 A685 S689 I690 V694 A695 V696	A655-A692 HydrophobicContact CB-CB 3.99Å; A685-A692 HydrophobicContact CB-CB 4.42Å; A685-A692 WeakPolarHBondContact O-CB 3.16Å; S689-A692 PolarHBondContact O-N 2.9Å; I690-A692 VanDerWaalsContact C-N 3.25Å; I690-A692 PolarHBondContact O-N 3.27Å; A692-V694 PolarHBondContact O-N 3.5Å; A692-A695 PolarHBondContact O-N 2.81Å; A692-V696 HydrophobicContact CB-CG2 4.41Å; A692-V696 WeakPolarHBondContact O-CB 3.48Å; A692-V696 VanDerWaalsContact O-CG2 3.28Å; A692-V696 WeakPolarHBondContact O-CG2 3.1Å; A692-V696 PolarHBondContact O-N 2.96Å
693	R	94.1	Very high	94.1	Very high	111 Å²	111	65.9 Å²	65.9	42%	0.419	34%	0.342	S	S	.	.	H	α-helix	trans	-59.3	-42.3	-170	-68.4	-167.3	-171.3	165.1	1.5	113.3	A686 I690 D691 V696 Y697	A686-R693 HydrophobicContact CB-CG 4.09Å; I690-R693 WeakPolarHBondContact O-CB 3.32Å; I690-R693 WeakPolarHBondContact O-CG 3.47Å; I690-R693 PolarHBondContact O-N 3.39Å; D691-R693 VanDerWaalsContact C-N 3.32Å; D691-R693 PolarHBondContact O-N 2.89Å; R693-V696 PolarHBondContact O-N 3.32Å; R693-Y697 HydrophobicContact CB-CD2 4.32Å; R693-Y697 HydrophobicContact CB-CE2 4.02Å; R693-Y697 WeakPolarHBondContact O-CB 3.25Å; R693-Y697 WeakPolarHBondContact O-CD2 3.02Å; R693-Y697 PolarHBondContact O-N 3.33Å
694	V	93.9	Very high	93.9	Very high	105 Å²	105	66.4 Å²	66.4	64%	0.636	35%	0.35	S	S	*	.	H	α-helix	trans	-63.8	-48.4	-179.3	178.2	0	0	0	0	110.6	A692 V696 Y697 L698	A692-V694 PolarHBondContact O-N 3.5Å; V694-V696 VanDerWaalsContact C-N 3.33Å; V694-V696 PolarHBondContact O-N 2.81Å; V694-Y697 PolarHBondContact O-N 3.47Å; V694-L698 WeakPolarHBondContact O-CG 3.16Å; V694-L698 PolarHBondContact O-N 3.25Å; V694-L698 VanDerWaalsContact O-N 3.14Å
695	A	94.2	Very high	93.7	Very high	42 Å²	42	70 Å²	70	35%	0.347	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-42.2	177	0	0	0	0	0	111.6	F659 A692 L698 A699	F659-A695 HydrophobicContact CD2-CB 4.46Å; F659-A695 HydrophobicContact CE2-CB 3.92Å; F659-A695 HydrophobicContact CZ-CB 4.25Å; A692-A695 PolarHBondContact O-N 2.81Å; A695-L698 PolarHBondContact O-N 3.39Å; A695-A699 WeakPolarHBondContact O-CB 3.29Å; A695-A699 PolarHBondContact O-N 3.46Å
696	V	96.4	Very high	93.3	Very high	2 Å²	2	73 Å²	73	1%	0.012	38%	0.376	C	S	.	.	H	α-helix	trans	-62.3	-46.3	176.1	164.9	0	0	0	0	111.6	F659 Y682 A685 A686 A692 R693 V694 L698 A699 L700	F659-V696 HydrophobicContact CD2-CG2 3.99Å; F659-V696 HydrophobicContact CE2-CG2 4.43Å; Y682-V696 WeakPolarHBondContact O-CG1 3.26Å; Y682-V696 VanDerWaalsContact O-CG2 3.24Å; Y682-V696 WeakPolarHBondContact O-CG2 3.36Å; A685-V696 HydrophobicContact CB-CG2 3.93Å; A686-V696 HydrophobicContact CB-CB 4.01Å; A686-V696 HydrophobicContact CB-CG1 3.73Å; A686-V696 HydrophobicContact CB-CG2 4.04Å; A692-V696 HydrophobicContact CB-CG2 4.41Å; A692-V696 WeakPolarHBondContact O-CB 3.48Å; A692-V696 VanDerWaalsContact O-CG2 3.28Å; A692-V696 WeakPolarHBondContact O-CG2 3.1Å; A692-V696 PolarHBondContact O-N 2.96Å; R693-V696 PolarHBondContact O-N 3.32Å; V694-V696 VanDerWaalsContact C-N 3.33Å; V694-V696 PolarHBondContact O-N 2.81Å; V696-L698 VanDerWaalsContact C-N 3.3Å; V696-L698 PolarHBondContact O-N 3.33Å; V696-A699 CarbonylContact O-C 3.53Å; V696-A699 WeakPolarHBondContact O-CB 3.17Å; V696-A699 PolarHBondContact O-N 3.17Å; V696-A699 VanDerWaalsContact O-N 3.12Å; V696-L700 HydrophobicContact CG1-CD1 3.77Å; V696-L700 HydrophobicContact CG1-CG 4.08Å; V696-L700 WeakPolarHBondContact O-CB 3.45Å; V696-L700 VanDerWaalsContact O-CG 3.32Å; V696-L700 WeakPolarHBondContact O-CG 3.22Å; V696-L700 PolarHBondContact O-N 2.93Å
697	Y	96	Very high	92.9	Very high	146 Å²	146	73.2 Å²	73.2	57%	0.573	37%	0.373	S	S	*	.	H	α-helix	trans	-59.9	-41.3	177.7	-75.4	-55.3	0	0	0	111.9	R693 V694 L700 I701	R693-Y697 HydrophobicContact CB-CD2 4.32Å; R693-Y697 HydrophobicContact CB-CE2 4.02Å; R693-Y697 WeakPolarHBondContact O-CB 3.25Å; R693-Y697 WeakPolarHBondContact O-CD2 3.02Å; R693-Y697 PolarHBondContact O-N 3.33Å; V694-Y697 PolarHBondContact O-N 3.47Å; Y697-L700 PolarHBondContact O-N 3.48Å; Y697-I701 VanDerWaalsContact O-CG1 3.28Å; Y697-I701 WeakPolarHBondContact O-CG1 3.44Å; Y697-I701 PolarHBondContact O-N 3.27Å
698	L	96.3	Very high	92.6	Very high	115 Å²	115	68.5 Å²	68.5	60%	0.602	36%	0.356	S	S	*	.	H	α-helix	trans	-63.6	-42.3	174.6	-68.1	174.7	0	0	0	111.8	V694 A695 V696 I701 R702	V694-L698 WeakPolarHBondContact O-CG 3.16Å; V694-L698 PolarHBondContact O-N 3.25Å; V694-L698 VanDerWaalsContact O-N 3.14Å; A695-L698 PolarHBondContact O-N 3.39Å; V696-L698 VanDerWaalsContact C-N 3.3Å; V696-L698 PolarHBondContact O-N 3.33Å; L698-I701 PolarHBondContact O-N 3.36Å; L698-R702 PolarHBondContact O-N 2.62Å
699	A	95.5	Very high	92.2	Very high	4 Å²	4	69.8 Å²	69.8	3%	0.033	35%	0.354	C	S	.	.	H	α-helix	trans	-64	-39.8	175.4	0	0	0	0	0	112.1	F659 Y682 A695 V696 R702 L703	F659-A699 HydrophobicContact CE2-CB 3.87Å; F659-A699 HydrophobicContact CZ-CB 4.2Å; Y682-A699 HydrophobicContact CD1-CB 4.16Å; Y682-A699 HydrophobicContact CD2-CB 4.03Å; Y682-A699 HydrophobicContact CE1-CB 3.94Å; Y682-A699 HydrophobicContact CE2-CB 3.78Å; Y682-A699 HydrophobicContact CG-CB 4.22Å; A695-A699 WeakPolarHBondContact O-CB 3.29Å; A695-A699 PolarHBondContact O-N 3.46Å; V696-A699 CarbonylContact O-C 3.53Å; V696-A699 WeakPolarHBondContact O-CB 3.17Å; V696-A699 PolarHBondContact O-N 3.17Å; V696-A699 VanDerWaalsContact O-N 3.12Å; A699-R702 WeakPolarHBondContact O-CB 3.44Å; A699-R702 PolarHBondContact O-N 2.81Å; A699-L703 WeakPolarHBondContact O-CB 3.44Å; A699-L703 PolarHBondContact O-N 2.9Å
700	L	95.1	Very high	91.8	Very high	40 Å²	40	71.1 Å²	71.1	21%	0.209	36%	0.359	C	S	.	.	H	α-helix	trans	-69	-36.1	176.5	-70.3	176.7	0	0	0	112.6	K679 Y682 V696 Y697 L703 S704	K679-L700 HydrophobicContact CG-CD2 3.81Å; Y682-L700 HydrophobicContact CD2-CD2 4.46Å; V696-L700 HydrophobicContact CG1-CD1 3.77Å; V696-L700 HydrophobicContact CG1-CG 4.08Å; V696-L700 WeakPolarHBondContact O-CB 3.45Å; V696-L700 VanDerWaalsContact O-CG 3.32Å; V696-L700 WeakPolarHBondContact O-CG 3.22Å; V696-L700 PolarHBondContact O-N 2.93Å; Y697-L700 PolarHBondContact O-N 3.48Å; L700-L703 HydrophobicContact CD2-CD2 4.39Å; L700-L703 PolarHBondContact O-N 3.08Å; L700-S704 WeakPolarHBondContact O-CB 3.46Å; L700-S704 PolarHBondContact O-N 3.43Å
701	I	95	Very high	91.4	Very high	109 Å²	109	71.6 Å²	71.6	56%	0.559	36%	0.357	S	S	*	.	H	α-helix	trans	-61.2	-48	170.7	-70.3	164.3	0	0	0	109.5	Y697 L698 L703 S704 F705	Y697-I701 VanDerWaalsContact O-CG1 3.28Å; Y697-I701 WeakPolarHBondContact O-CG1 3.44Å; Y697-I701 PolarHBondContact O-N 3.27Å; L698-I701 PolarHBondContact O-N 3.36Å; I701-L703 VanDerWaalsContact C-N 3.3Å; I701-L703 PolarHBondContact O-N 3.31Å; I701-S704 PolarHBondContact O-N 3.48Å; I701-S704 PolarHBondContact O-OG 3.48Å; I701-F705 PolarHBondContact O-N 3.39Å; I701-F705 VanDerWaalsContact O-N 3.1Å
702	R	92.6	Very high	91.2	Very high	88 Å²	88	69 Å²	69	33%	0.332	34%	0.339	S	S	.	.	H	α-helix	trans	-58.7	-42.8	175.1	-176.1	179.1	67.7	-156	-5.2	111.6	E666 Y682 L698 A699 F705 Y706	E666-R702 VanDerWaalsContact CD-NH2 3.26Å; E666-R702 IonicContact OE1-CZ 2.71Å; E666-R702 IonicContact OE1-NE 3.88Å; E666-R702 PolarHBondContact OE1-NE 2.83Å; E666-R702 IonicContact OE1-NH2 3.78Å; E666-R702 PolarHBondContact OE1-NH2 3.36Å; E666-R702 VanDerWaalsContact OE1-NH2 3.11Å; E666-R702 IonicContact OE2-CZ 2.84Å; E666-R702 IonicContact OE2-NE 3.14Å; E666-R702 PolarHBondContact OE2-NE 2.91Å; E666-R702 IonicContact OE2-NH2 3.58Å; E666-R702 PolarHBondContact OE2-NH2 3.15Å; Y682-R702 PolarHBondContact OH-NH2 3.04Å; L698-R702 PolarHBondContact O-N 2.62Å; A699-R702 WeakPolarHBondContact O-CB 3.44Å; A699-R702 PolarHBondContact O-N 2.81Å; R702-F705 WeakPolarHBondContact O-CB 3.45Å; R702-F705 PolarHBondContact O-N 2.73Å; R702-Y706 HydrophobicContact CG-CD2 4.38Å; R702-Y706 HydrophobicContact CG-CE2 3.87Å; R702-Y706 WeakPolarHBondContact O-CD2 3.39Å; R702-Y706 PolarHBondContact O-N 3.01Å
703	L	92.9	Very high	90.5	Very high	3 Å²	3	73 Å²	73	2%	0.016	36%	0.359	C	S	.	.	H	α-helix	trans	-65	-39.5	178	-163.1	69.2	0	0	0	112.5	E666 L675 K679 A699 L700 I701 F705 Y706 F707	E666-L703 HydrophobicContact CG-CD1 4.13Å; L675-L703 HydrophobicContact CB-CD1 4Å; L675-L703 HydrophobicContact CD2-CD1 3.84Å; L675-L703 HydrophobicContact CG-CD1 4.36Å; K679-L703 HydrophobicContact CB-CD2 3.58Å; K679-L703 HydrophobicContact CG-CD2 4.07Å; A699-L703 WeakPolarHBondContact O-CB 3.44Å; A699-L703 PolarHBondContact O-N 2.9Å; L700-L703 HydrophobicContact CD2-CD2 4.39Å; L700-L703 PolarHBondContact O-N 3.08Å; I701-L703 VanDerWaalsContact C-N 3.3Å; I701-L703 PolarHBondContact O-N 3.31Å; L703-F705 VanDerWaalsContact C-N 3.26Å; L703-F705 PolarHBondContact O-N 3.21Å; L703-Y706 WeakPolarHBondContact O-CB 3.47Å; L703-Y706 PolarHBondContact O-N 2.81Å; L703-Y706 VanDerWaalsContact O-N 3.14Å; L703-F707 HydrophobicContact CD1-CE2 4.44Å; L703-F707 HydrophobicContact CD2-CE2 3.85Å; L703-F707 HydrophobicContact CG-CD2 4.16Å; L703-F707 HydrophobicContact CG-CE2 3.64Å; L703-F707 HydrophobicContact CG-CZ 4.4Å; L703-F707 VanDerWaalsContact O-CD2 3.24Å; L703-F707 WeakPolarHBondContact O-CD2 3.44Å; L703-F707 PolarHBondContact O-N 3.02Å
704	S	90.9	Very high	89.8	Confident	60 Å²	60	75.3 Å²	75.3	42%	0.42	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-36.6	175	77.1	0	0	0	0	111.7	L700 I701 F707 V708	L700-S704 WeakPolarHBondContact O-CB 3.46Å; L700-S704 PolarHBondContact O-N 3.43Å; I701-S704 PolarHBondContact O-N 3.48Å; I701-S704 PolarHBondContact O-OG 3.48Å; S704-F707 PolarHBondContact O-N 3.28Å; S704-V708 VanDerWaalsContact O-CG2 3.29Å; S704-V708 WeakPolarHBondContact O-CG2 3.47Å; S704-V708 PolarHBondContact O-N 3.12Å
705	F	92.6	Very high	89.1	Confident	127 Å²	127	71.4 Å²	71.4	56%	0.557	35%	0.352	S	S	*	.	H	α-helix	trans	-63.7	-42.6	173.9	-177.3	-95.3	0	0	0	111.7	I701 R702 L703 F707 V708 M709	I701-F705 PolarHBondContact O-N 3.39Å; I701-F705 VanDerWaalsContact O-N 3.1Å; R702-F705 WeakPolarHBondContact O-CB 3.45Å; R702-F705 PolarHBondContact O-N 2.73Å; L703-F705 VanDerWaalsContact C-N 3.26Å; L703-F705 PolarHBondContact O-N 3.21Å; F705-F707 PolarHBondContact O-N 3.37Å; F705-V708 PolarHBondContact O-N 3.47Å; F705-M709 HydrophobicContact CD1-CG 4.09Å; F705-M709 HydrophobicContact CE1-CG 3.64Å; F705-M709 HydrophobicContact CE1-SD 4.42Å; F705-M709 HydrophobicContact CE2-CG 4.3Å; F705-M709 HydrophobicContact CE2-SD 4.43Å; F705-M709 HydrophobicContact CZ-CG 3.77Å; F705-M709 HydrophobicContact CZ-SD 3.98Å; F705-M709 WeakPolarHBondContact O-CG 3.47Å; F705-M709 PolarHBondContact O-N 2.96Å
706	Y	88.4	Confident	87.9	Confident	64 Å²	64	73.8 Å²	73.8	25%	0.251	37%	0.366	S	S	.	.	H	α-helix	trans	-58.6	-46.6	173.3	-74	-62.7	0	0	0	112	E666 R702 L703 V708 M709 D710	E666-Y706 HydrophobicContact CG-CE2 4.3Å; E666-Y706 WeakPolarHBondContact OE1-CE2 3.29Å; R702-Y706 HydrophobicContact CG-CD2 4.38Å; R702-Y706 HydrophobicContact CG-CE2 3.87Å; R702-Y706 WeakPolarHBondContact O-CD2 3.39Å; R702-Y706 PolarHBondContact O-N 3.01Å; L703-Y706 WeakPolarHBondContact O-CB 3.47Å; L703-Y706 PolarHBondContact O-N 2.81Å; L703-Y706 VanDerWaalsContact O-N 3.14Å; Y706-V708 PolarHBondContact O-N 2.87Å; Y706-M709 PolarHBondContact O-N 3.44Å; Y706-D710 PolarHBondContact O-N 3.02Å
707	F	89.3	Confident	86.7	Confident	22 Å²	22	79.6 Å²	79.6	10%	0.096	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-38.1	178.3	-71.9	-57.5	0	0	0	113.4	L675 Y676 L703 S704 F705 D710 F711 Y765	L675-F707 HydrophobicContact CB-CE1 3.91Å; L675-F707 HydrophobicContact CB-CZ 3.72Å; L675-F707 HydrophobicContact CD1-CD1 4.44Å; L675-F707 HydrophobicContact CD1-CE1 4.14Å; Y676-F707 HydrophobicContact CD1-CZ 4.37Å; Y676-F707 HydrophobicContact CE1-CE1 4.17Å; Y676-F707 HydrophobicContact CE1-CZ 4.27Å; Y676-F707 HydrophobicContact CE2-CE1 4.39Å; L703-F707 HydrophobicContact CD1-CE2 4.44Å; L703-F707 HydrophobicContact CD2-CE2 3.85Å; L703-F707 HydrophobicContact CG-CD2 4.16Å; L703-F707 HydrophobicContact CG-CE2 3.64Å; L703-F707 HydrophobicContact CG-CZ 4.4Å; L703-F707 VanDerWaalsContact O-CD2 3.24Å; L703-F707 WeakPolarHBondContact O-CD2 3.44Å; L703-F707 PolarHBondContact O-N 3.02Å; S704-F707 PolarHBondContact O-N 3.28Å; F705-F707 PolarHBondContact O-N 3.37Å; F707-D710 PolarHBondContact O-N 3.37Å; F707-F711 WeakPolarHBondContact O-CB 3.48Å; F707-F711 PolarHBondContact O-N 3.01Å; F707-Y765 HydrophobicContact CB-CE1 4.41Å
708	V	87.9	Confident	85	Confident	63 Å²	63	76.5 Å²	76.5	38%	0.382	38%	0.381	S	S	.	.	H	α-helix	trans	-64.8	-42.6	175.6	168.6	0	0	0	0	110.6	S704 F705 Y706 F711 F712	S704-V708 VanDerWaalsContact O-CG2 3.29Å; S704-V708 WeakPolarHBondContact O-CG2 3.47Å; S704-V708 PolarHBondContact O-N 3.12Å; F705-V708 PolarHBondContact O-N 3.47Å; Y706-V708 PolarHBondContact O-N 2.87Å; V708-F711 PolarHBondContact O-N 3.4Å; V708-F712 HydrophobicContact CG1-CD2 3.65Å; V708-F712 HydrophobicContact CG1-CE2 3.31Å; V708-F712 HydrophobicContact CG1-CZ 4.37Å; V708-F712 WeakPolarHBondContact O-CD2 3.31Å; V708-F712 PolarHBondContact O-N 2.83Å
709	M	84.6	Confident	83.4	Confident	76 Å²	76	76.8 Å²	76.8	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.3	-71.9	-58	-58.8	0	0	112.2	F705 Y706 F711 F712 N713	F705-M709 HydrophobicContact CD1-CG 4.09Å; F705-M709 HydrophobicContact CE1-CG 3.64Å; F705-M709 HydrophobicContact CE1-SD 4.42Å; F705-M709 HydrophobicContact CE2-CG 4.3Å; F705-M709 HydrophobicContact CE2-SD 4.43Å; F705-M709 HydrophobicContact CZ-CG 3.77Å; F705-M709 HydrophobicContact CZ-SD 3.98Å; F705-M709 WeakPolarHBondContact O-CG 3.47Å; F705-M709 PolarHBondContact O-N 2.96Å; Y706-M709 PolarHBondContact O-N 3.44Å; M709-F711 VanDerWaalsContact C-N 3.33Å; M709-F711 PolarHBondContact O-N 3.48Å; M709-F712 PolarHBondContact O-N 2.94Å; M709-N713 WeakPolarHBondContact O-CB 3.13Å; M709-N713 VanDerWaalsContact O-CG 3.22Å; M709-N713 PolarHBondContact O-N 3.17Å; M709-N713 PolarHBondContact O-ND2 2.82Å
710	D	82.6	Confident	82	Confident	61 Å²	61	83.5 Å²	83.5	33%	0.326	41%	0.405	S	S	.	.	H	α-helix	trans	-62.8	-41.1	176.1	-72.2	-15.2	0	0	0	111	Y706 F707 F712 N713 E714	Y706-D710 PolarHBondContact O-N 3.02Å; F707-D710 PolarHBondContact O-N 3.37Å; D710-F712 PolarHBondContact O-N 3.26Å; D710-N713 PolarHBondContact O-N 3.15Å; D710-E714 WeakPolarHBondContact O-CG 3.32Å; D710-E714 PolarHBondContact O-N 3.41Å
711	F	82.1	Confident	80.6	Confident	115 Å²	115	83.8 Å²	83.8	50%	0.504	41%	0.406	S	S	.	.	H	α-helix	trans	-60.3	-43.9	173.5	175.6	-97.3	0	0	0	112.6	F707 V708 M709 N713 E714 S715	F707-F711 WeakPolarHBondContact O-CB 3.48Å; F707-F711 PolarHBondContact O-N 3.01Å; V708-F711 PolarHBondContact O-N 3.4Å; M709-F711 VanDerWaalsContact C-N 3.33Å; M709-F711 PolarHBondContact O-N 3.48Å; F711-N713 VanDerWaalsContact C-N 3.3Å; F711-N713 PolarHBondContact O-N 2.83Å; F711-E714 PolarHBondContact O-N 3.2Å; F711-S715 VanDerWaalsContact O-CB 3.24Å; F711-S715 WeakPolarHBondContact O-CB 3.45Å; F711-S715 PolarHBondContact O-N 3.25Å
712	F	81.8	Confident	78.9	Confident	80 Å²	80	80.7 Å²	80.7	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-66	-33.7	176.4	-76	-56.1	0	0	0	112.4	V708 M709 D710 F718	V708-F712 HydrophobicContact CG1-CD2 3.65Å; V708-F712 HydrophobicContact CG1-CE2 3.31Å; V708-F712 HydrophobicContact CG1-CZ 4.37Å; V708-F712 WeakPolarHBondContact O-CD2 3.31Å; V708-F712 PolarHBondContact O-N 2.83Å; M709-F712 PolarHBondContact O-N 2.94Å; D710-F712 PolarHBondContact O-N 3.26Å; F712-F718 HydrophobicContact CD1-CD1 4.02Å; F712-F718 AromaticContact CD1-CD2 3.56Å; F712-F718 HydrophobicContact CD1-CD2 3.56Å; F712-F718 AromaticContact CD1-CE1 3.91Å; F712-F718 HydrophobicContact CD1-CE1 3.91Å; F712-F718 AromaticContact CD1-CE2 3.44Å; F712-F718 HydrophobicContact CD1-CE2 3.44Å; F712-F718 VanDerWaalsContact CD1-CE2 3.44Å; F712-F718 AromaticContact CD1-CG 3.85Å; F712-F718 HydrophobicContact CD1-CG 3.85Å; F712-F718 AromaticContact CD1-CZ 3.63Å; F712-F718 HydrophobicContact CD1-CZ 3.63Å; F712-F718 HydrophobicContact CE1-CD1 4.49Å; F712-F718 HydrophobicContact CE1-CD2 4.03Å; F712-F718 AromaticContact CE1-CE1 3.93Å; F712-F718 HydrophobicContact CE1-CE1 3.93Å; F712-F718 AromaticContact CE1-CE2 3.39Å; F712-F718 HydrophobicContact CE1-CE2 3.39Å; F712-F718 AromaticContact CE1-CZ 3.33Å; F712-F718 HydrophobicContact CE1-CZ 3.33Å; F712-F718 HydrophobicContact CZ-CZ 4.49Å; F712-F718 WeakPolarHBondContact O-CB 3.32Å
713	N	79.4	Confident	77.5	Confident	100 Å²	100	79.4 Å²	79.4	54%	0.535	41%	0.406	S	S	.	.	H	α-helix	trans	-71.5	-36	176.4	-70.4	-23.6	0	0	0	112.7	M709 D710 F711 Q719	M709-N713 WeakPolarHBondContact O-CB 3.13Å; M709-N713 VanDerWaalsContact O-CG 3.22Å; M709-N713 PolarHBondContact O-N 3.17Å; M709-N713 PolarHBondContact O-ND2 2.82Å; D710-N713 PolarHBondContact O-N 3.15Å; F711-N713 VanDerWaalsContact C-N 3.3Å; F711-N713 PolarHBondContact O-N 2.83Å; N713-Q719 PolarHBondContact O-NE2 2.65Å
714	E	78.2	Confident	75.4	Confident	159 Å²	159	83.9 Å²	83.9	74%	0.743	43%	0.427	S	S	*	.	H	α-helix	trans	-85.3	-23.6	179.9	-70.7	-172.6	173.3	0	0	113.9	D710 F711 S716	D710-E714 WeakPolarHBondContact O-CG 3.32Å; D710-E714 PolarHBondContact O-N 3.41Å; F711-E714 PolarHBondContact O-N 3.2Å; E714-S716 PolarHBondContact O-N 3.37Å; E714-S716 VanDerWaalsContact O-N 3.13Å
715	S	79.3	Confident	73.6	Confident	24 Å²	24	89 Å²	89	17%	0.168	44%	0.442	C	S	.	.			trans	-65.9	114.3	-178.2	-178.6	0	0	0	0	111.3	F711 F717 F718 Q719	F711-S715 VanDerWaalsContact O-CB 3.24Å; F711-S715 WeakPolarHBondContact O-CB 3.45Å; F711-S715 PolarHBondContact O-N 3.25Å; S715-F717 PolarHBondContact O-N 2.92Å; S715-F717 VanDerWaalsContact O-N 3.14Å; S715-F718 PolarHBondContact O-N 3.24Å; S715-Q719 PolarHBondContact O-N 2.86Å
716	S	68.9	Low	71.5	Confident	92 Å²	92	87.6 Å²	87.6	64%	0.643	45%	0.449	S	S	*	.	H	α-helix	trans	-55.8	-30.8	176.4	59.1	0	0	0	0	112.8	E714 Y720	E714-S716 PolarHBondContact O-N 3.37Å; E714-S716 VanDerWaalsContact O-N 3.13Å; S716-Y720 WeakPolarHBondContact O-CB 3.47Å; S716-Y720 PolarHBondContact O-N 2.89Å
717	F	72.4	Confident	69.4	Low	123 Å²	123	88.7 Å²	88.7	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-63.1	-40.7	173.9	176.9	-103.7	0	0	0	112.2	S715 Y720 I721	S715-F717 PolarHBondContact O-N 2.92Å; S715-F717 VanDerWaalsContact O-N 3.14Å; F717-Y720 PolarHBondContact O-N 2.83Å; F717-I721 HydrophobicContact CD1-CD1 3.86Å; F717-I721 HydrophobicContact CD2-CD1 4.48Å; F717-I721 HydrophobicContact CE1-CD1 3.28Å; F717-I721 HydrophobicContact CE1-CG1 4.45Å; F717-I721 HydrophobicContact CE2-CD1 3.98Å; F717-I721 HydrophobicContact CG-CD1 4.44Å; F717-I721 HydrophobicContact CZ-CD1 3.36Å; F717-I721 HydrophobicContact CZ-CG1 4.39Å; F717-I721 WeakPolarHBondContact O-CB 3.23Å; F717-I721 WeakPolarHBondContact O-CG1 3.43Å; F717-I721 PolarHBondContact O-N 3.46Å
718	F	58.4	Low	66.6	Low	82 Å²	82	98.9 Å²	98.9	36%	0.36	50%	0.503	S	S	.	.	H	α-helix	trans	-79.8	-34.4	177.4	-80	-83	0	0	0	112.7	F712 S715 Y720 I721 G722	F712-F718 HydrophobicContact CD1-CD1 4.02Å; F712-F718 AromaticContact CD1-CD2 3.56Å; F712-F718 HydrophobicContact CD1-CD2 3.56Å; F712-F718 AromaticContact CD1-CE1 3.91Å; F712-F718 HydrophobicContact CD1-CE1 3.91Å; F712-F718 AromaticContact CD1-CE2 3.44Å; F712-F718 HydrophobicContact CD1-CE2 3.44Å; F712-F718 VanDerWaalsContact CD1-CE2 3.44Å; F712-F718 AromaticContact CD1-CG 3.85Å; F712-F718 HydrophobicContact CD1-CG 3.85Å; F712-F718 AromaticContact CD1-CZ 3.63Å; F712-F718 HydrophobicContact CD1-CZ 3.63Å; F712-F718 HydrophobicContact CE1-CD1 4.49Å; F712-F718 HydrophobicContact CE1-CD2 4.03Å; F712-F718 AromaticContact CE1-CE1 3.93Å; F712-F718 HydrophobicContact CE1-CE1 3.93Å; F712-F718 AromaticContact CE1-CE2 3.39Å; F712-F718 HydrophobicContact CE1-CE2 3.39Å; F712-F718 AromaticContact CE1-CZ 3.33Å; F712-F718 HydrophobicContact CE1-CZ 3.33Å; F712-F718 HydrophobicContact CZ-CZ 4.49Å; F712-F718 WeakPolarHBondContact O-CB 3.32Å; S715-F718 PolarHBondContact O-N 3.24Å; F718-Y720 VanDerWaalsContact C-N 3.26Å; F718-Y720 PolarHBondContact O-N 2.78Å; F718-I721 PolarHBondContact O-N 3.36Å; F718-G722 PolarHBondContact O-N 3.44Å
719	Q	64.2	Low	63.8	Low	120 Å²	120	101.1 Å²	101.1	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-59.4	-41.4	167.2	-67.2	-175.9	-3.8	0	0	110.9	N713 S715 G722 S723	N713-Q719 PolarHBondContact O-NE2 2.65Å; S715-Q719 PolarHBondContact O-N 2.86Å; Q719-G722 PolarHBondContact O-N 3.03Å; Q719-S723 WeakPolarHBondContact O-CB 3.49Å; Q719-S723 PolarHBondContact O-N 3.3Å
720	Y	65.2	Low	61.3	Low	145 Å²	145	108 Å²	108	57%	0.569	55%	0.545	S	S	*	.	H	α-helix	trans	-66.5	-44.7	175.9	-179.3	-107.2	0	0	0	112.3	S716 F717 F718 S723 M724	S716-Y720 WeakPolarHBondContact O-CB 3.47Å; S716-Y720 PolarHBondContact O-N 2.89Å; F717-Y720 PolarHBondContact O-N 2.83Å; F718-Y720 VanDerWaalsContact C-N 3.26Å; F718-Y720 PolarHBondContact O-N 2.78Å; Y720-S723 PolarHBondContact O-N 2.93Å; Y720-S723 PolarHBondContact O-OG 3.46Å; Y720-M724 HydrophobicContact CD1-CE 3.88Å; Y720-M724 HydrophobicContact CE1-CE 3.15Å; Y720-M724 WeakPolarHBondContact O-CB 3.36Å; Y720-M724 PolarHBondContact O-N 3.23Å
721	I	64.9	Low	58.8	Low	46 Å²	46	110 Å²	110	24%	0.236	57%	0.57	C	S	.	*	H	α-helix	trans	-62.8	-43.7	173.9	-77.8	177.4	0	0	0	111.4	F717 F718 S723 M724 F725	F717-I721 HydrophobicContact CD1-CD1 3.86Å; F717-I721 HydrophobicContact CD2-CD1 4.48Å; F717-I721 HydrophobicContact CE1-CD1 3.28Å; F717-I721 HydrophobicContact CE1-CG1 4.45Å; F717-I721 HydrophobicContact CE2-CD1 3.98Å; F717-I721 HydrophobicContact CG-CD1 4.44Å; F717-I721 HydrophobicContact CZ-CD1 3.36Å; F717-I721 HydrophobicContact CZ-CG1 4.39Å; F717-I721 WeakPolarHBondContact O-CB 3.23Å; F717-I721 WeakPolarHBondContact O-CG1 3.43Å; F717-I721 PolarHBondContact O-N 3.46Å; F718-I721 PolarHBondContact O-N 3.36Å; I721-S723 VanDerWaalsContact C-N 3.26Å; I721-S723 PolarHBondContact O-N 3.46Å; I721-M724 PolarHBondContact O-N 3.45Å; I721-F725 HydrophobicContact CG2-CD2 3.62Å; I721-F725 HydrophobicContact CG2-CE2 3.79Å; I721-F725 WeakPolarHBondContact O-CD2 3.28Å; I721-F725 PolarHBondContact O-N 3.44Å
722	G	60.1	Low	56.2	Low	44 Å²	44	110.2 Å²	110.2	45%	0.454	58%	0.576	S	S	.	*	H	α-helix	trans	-56.7	-43.1	174	0	0	0	0	0	111.3	F718 Q719 M724 S726	F718-G722 PolarHBondContact O-N 3.44Å; Q719-G722 PolarHBondContact O-N 3.03Å; G722-M724 PolarHBondContact O-N 3.31Å; G722-S726 VanDerWaalsContact O-CB 3.29Å; G722-S726 WeakPolarHBondContact O-CB 3.09Å; G722-S726 PolarHBondContact O-N 2.95Å; G722-S726 PolarHBondContact O-OG 2.85Å
723	S	62.7	Low	53.6	Low	62 Å²	62	113.6 Å²	113.6	43%	0.434	59%	0.593	S	S	.	*	H	α-helix	trans	-65.1	-37.5	173.5	79.9	0	0	0	0	112.8	Q719 Y720 I721 S726	Q719-S723 WeakPolarHBondContact O-CB 3.49Å; Q719-S723 PolarHBondContact O-N 3.3Å; Y720-S723 PolarHBondContact O-N 2.93Å; Y720-S723 PolarHBondContact O-OG 3.46Å; I721-S723 VanDerWaalsContact C-N 3.26Å; I721-S723 PolarHBondContact O-N 3.46Å; S723-S726 WeakPolarHBondContact CA-OG 3.22Å; S723-S726 PolarHBondContact O-N 3.23Å; S723-S726 PolarHBondContact O-OG 3.36Å
724	M	49.7	Very low	51.2	Low	96 Å²	96	116.7 Å²	116.7	47%	0.473	60%	0.604	S	S	.	*	H	α-helix	trans	-72.8	-34.8	-177.9	-157.8	-165.2	-65.4	0	0	112.9	Y720 I721 G722 S727	Y720-M724 HydrophobicContact CD1-CE 3.88Å; Y720-M724 HydrophobicContact CE1-CE 3.15Å; Y720-M724 WeakPolarHBondContact O-CB 3.36Å; Y720-M724 PolarHBondContact O-N 3.23Å; I721-M724 PolarHBondContact O-N 3.45Å; G722-M724 PolarHBondContact O-N 3.31Å; M724-S727 PolarHBondContact O-OG 3.01Å
725	F	52.8	Low	48.7	Very low	168 Å²	168	117.1 Å²	117.1	74%	0.737	61%	0.606	S	S	*	*	H	α-helix	trans	-84.7	-18	174.6	-77	-77.5	0	0	0	113.2	I721 S727	I721-F725 HydrophobicContact CG2-CD2 3.62Å; I721-F725 HydrophobicContact CG2-CE2 3.79Å; I721-F725 WeakPolarHBondContact O-CD2 3.28Å; I721-F725 PolarHBondContact O-N 3.44Å; F725-S727 PolarHBondContact O-N 2.61Å
726	S	48.3	Very low	46.1	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-4.6	171.4	73.2	0	0	0	0	113.9	G722 S723	G722-S726 VanDerWaalsContact O-CB 3.29Å; G722-S726 WeakPolarHBondContact O-CB 3.09Å; G722-S726 PolarHBondContact O-N 2.95Å; G722-S726 PolarHBondContact O-OG 2.85Å; S723-S726 WeakPolarHBondContact CA-OG 3.22Å; S723-S726 PolarHBondContact O-N 3.23Å; S723-S726 PolarHBondContact O-OG 3.36Å
727	S	44.6	Very low	43.9	Very low	86 Å²	86	124.6 Å²	124.6	60%	0.601	64%	0.641	S	S	*	*			trans	-114.5	64.7	178.7	71.5	0	0	0	0	113.6	M724 F725	M724-S727 PolarHBondContact O-OG 3.01Å; F725-S727 PolarHBondContact O-N 2.61Å
728	R	29.7	Very low	41.6	Very low	237 Å²	237	123.8 Å²	123.8	89%	0.894	65%	0.651	S	S	*	*	S	Bend	trans	-157.7	118.1	154.2	-139.4	159.9	-178.9	162.7	-0.7	113.2
729	S	30	Very low	40	Very low	110 Å²	110	126.3 Å²	126.3	77%	0.769	67%	0.672	S	S	*	*	S	Bend	trans	68.9	93.8	168.8	74.6	0	0	0	0	119.4
730	Y	31.5	Very low	38	Very low	220 Å²	220	127.4 Å²	127.4	86%	0.863	69%	0.688	S	S	*	*				-160.4	96.7	106.5	-132.5	-99.6	0	0	0	108.6
731	A	29.6	Very low	36.1	Very low	103 Å²	103	127.9 Å²	127.9	85%	0.851	70%	0.7	S	S	*	*			trans	-107.3	93.7	164.6	0	0	0	0	0	105.3
732	D	29.2	Very low	34.2	Very low	119 Å²	119	131.1 Å²	131.1	64%	0.636	73%	0.727	S	S	*	*			trans	-157	110.2	151.9	-129.8	-1.1	0	0	0	109.4
733	E	27	Very low	32.6	Very low	152 Å²	152	135.6 Å²	135.6	71%	0.71	75%	0.745	S	S	*	*			trans	38.9	108.2	137.5	-61.5	-179.7	167.1	0	0	119.3
734	H	28.3	Very low	30.7	Very low	164 Å²	164	139 Å²	139	76%	0.759	76%	0.764	S	S	*	*				-179.6	141.7	87.2	-103.2	-72.2	0	0	0	112.4
735	E	25.7	Very low	29.5	Very low	169 Å²	169	140.4 Å²	140.4	79%	0.79	78%	0.778	S	S	*	*			trans	-40.4	129.8	171.6	-85.2	178.8	127.9	0	0	115.6
736	V	25.8	Very low	28.5	Very low	119 Å²	119	137.3 Å²	137.3	72%	0.721	78%	0.775	S	S	*	*				89.6	108.3	88.8	175	0	0	0	0	112
737	D	22.7	Very low	27.3	Very low	154 Å²	154	138.4 Å²	138.4	82%	0.824	78%	0.777	S	S	*	*			trans	-152	145.6	135.4	-106.4	-24.5	0	0	0	111.1
738	S	23.6	Very low	26.3	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	79%	0.787	S	S	*	*			trans	77.2	91.4	174.4	71.2	0	0	0	0	117
739	V	25	Very low	25.9	Very low	135 Å²	135	134.3 Å²	134.3	82%	0.818	78%	0.78	S	S	*	*				65.5	98.3	81.9	-178	0	0	0	0	112.8
740	T	22.5	Very low	25.7	Very low	144 Å²	144	134 Å²	134	88%	0.883	78%	0.778	S	S	*	*			trans	-135.3	129.9	148.2	39.9	0	0	0	0	110.1
741	D	24.9	Very low	25.5	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	78%	0.777	S	S	*	*			trans	-59.9	137.2	174.9	-93.2	-43.3	0	0	0	112.2
742	S	24.4	Very low	25.9	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	77%	0.772	S	S	*	*			trans	-80.4	114.8	164.6	53.5	0	0	0	0	110.1
743	T	26.3	Very low	25.8	Very low	138 Å²	138	132.7 Å²	132.7	85%	0.847	78%	0.781	S	S	*	*			trans	-120	131.5	153.6	24.5	0	0	0	0	109.5
744	T	24.1	Very low	26	Very low	135 Å²	135	128.9 Å²	128.9	83%	0.828	78%	0.782	S	S	*	*			trans	-77.1	151.2	-172	28.4	0	0	0	0	113.8
745	T	23.8	Very low	26.2	Very low	124 Å²	124	129.7 Å²	129.7	76%	0.761	79%	0.786	S	S	*	*			trans	-39.8	169.5	162.7	43.7	0	0	0	0	115.6
746	P	31.6	Very low	26.4	Very low	104 Å²	104	129.7 Å²	129.7	68%	0.675	79%	0.79	S	S	*	*			cis	-158.1	163.5	39.1	41.9	-17.7	0	0	0	122.3
747	T	22.6	Very low	26.8	Very low	120 Å²	120	131 Å²	131	74%	0.736	79%	0.792	S	S	*	*			trans	80.1	140.4	132	52.4	0	0	0	0	126.5
748	T	23.5	Very low	27.6	Very low	132 Å²	132	128.9 Å²	128.9	81%	0.81	79%	0.789	S	S	*	*			trans	79.8	142.5	153.6	63.5	0	0	0	0	118.4
749	S	22.5	Very low	28.3	Very low	106 Å²	106	130 Å²	130	74%	0.741	79%	0.791	S	S	*	*			cis	177.1	142.4	-14.4	51.6	0	0	0	0	107.1
750	S	26.1	Very low	29.6	Very low	104 Å²	104	127.1 Å²	127.1	73%	0.727	77%	0.77	S	S	*	*			trans	147.3	113.4	135.9	70.2	0	0	0	0	116.5
751	H	27	Very low	31	Very low	182 Å²	182	125.2 Å²	125.2	84%	0.843	76%	0.755	S	S	*	*				68	159.3	129.5	-76.3	-57.1	0	0	0	122.9
752	P	37.9	Very low	32.1	Very low	115 Å²	115	126 Å²	126	75%	0.747	75%	0.746	S	S	*	*				-132.7	145.3	-76.8	31.3	-9.2	0	0	0	114
753	S	26	Very low	33.3	Very low	117 Å²	117	126.3 Å²	126.3	82%	0.818	74%	0.739	S	S	*	*			trans	-93.9	107	177.4	48.3	0	0	0	0	112.2
754	G	30.9	Very low	34.6	Very low	72 Å²	72	124.1 Å²	124.1	74%	0.742	72%	0.718	S	S	*	*			trans	-91.7	121.2	163	0	0	0	0	0	110.3	L756	G754-L756 PolarHBondContact O-N 3.46Å
755	H	32.6	Very low	36.4	Very low	181 Å²	181	121.7 Å²	121.7	84%	0.838	69%	0.694	S	S	*	*			trans	-64.7	106.4	179.5	-89.7	-89.9	0	0	0	112.3
756	L	30.4	Very low	38.2	Very low	168 Å²	168	116.4 Å²	116.4	88%	0.88	66%	0.663	S	S	*	*			trans	-86	101.2	155.1	-97.6	137.5	0	0	0	107.5	G754 S758	G754-L756 PolarHBondContact O-N 3.46Å; L756-S758 PolarHBondContact O-N 2.8Å
757	I	34.5	Very low	39.8	Very low	146 Å²	146	115.8 Å²	115.8	75%	0.749	65%	0.653	S	S	*	*			trans	-70.1	98.9	168	-64.5	171.2	0	0	0	106.4	T759	I757-T759 PolarHBondContact O-N 3.4Å
758	S	38.4	Very low	41.9	Very low	110 Å²	110	113.7 Å²	113.7	77%	0.769	64%	0.642	S	S	*	*			trans	-58	113.2	170.5	172.4	0	0	0	0	109	L756 M760	L756-S758 PolarHBondContact O-N 2.8Å; S758-M760 PolarHBondContact O-N 3.31Å
759	T	39.7	Very low	44.1	Very low	128 Å²	128	114.2 Å²	114.2	79%	0.785	63%	0.633	S	S	*	*			trans	-68.7	110.2	174.4	49.7	0	0	0	0	108.8	I757 D761	I757-T759 PolarHBondContact O-N 3.4Å; T759-D761 PolarHBondContact O-N 3.25Å
760	M	51.7	Low	46.3	Very low	76 Å²	76	114 Å²	114	37%	0.374	62%	0.623	S	S	.	*			trans	-50.1	126.2	174.5	-173	172.9	72.3	0	0	110.8	S758 W762 Y765	S758-M760 PolarHBondContact O-N 3.31Å; M760-W762 HydrophobicContact CE-CD2 3.96Å; M760-W762 HydrophobicContact CE-CE3 4.12Å; M760-W762 HydrophobicContact CE-CH2 3.83Å; M760-W762 HydrophobicContact CE-CZ2 3.65Å; M760-W762 HydrophobicContact CE-CZ3 4.06Å; M760-W762 PolarHBondContact O-N 3.49Å; M760-Y765 HydrophobicContact CG-CD2 3.71Å; M760-Y765 HydrophobicContact CG-CE2 4.35Å; M760-Y765 HydrophobicContact CG-CG 4.4Å
761	D	51.6	Low	48.6	Very low	104 Å²	104	112.4 Å²	112.4	56%	0.556	61%	0.609	S	S	*	*			trans	-76.4	96.8	177.2	-158.3	-9	0	0	0	109.2	T759 D763 F764 Y765	T759-D761 PolarHBondContact O-N 3.25Å; D761-D763 PolarHBondContact O-N 3.41Å; D761-F764 HydrophobicContact CB-CB 4.48Å; D761-F764 PolarHBondContact O-N 2.83Å; D761-Y765 WeakPolarHBondContact O-CD2 3.43Å; D761-Y765 PolarHBondContact O-N 3.47Å
762	W	49.2	Very low	51	Low	169 Å²	169	105.3 Å²	105.3	64%	0.64	58%	0.584	S	S	*	*	H	α-helix	trans	-59.3	-31.2	-170.5	-79.3	86.8	0	0	0	112.8	M760 F764 A766	M760-W762 HydrophobicContact CE-CD2 3.96Å; M760-W762 HydrophobicContact CE-CE3 4.12Å; M760-W762 HydrophobicContact CE-CH2 3.83Å; M760-W762 HydrophobicContact CE-CZ2 3.65Å; M760-W762 HydrophobicContact CE-CZ3 4.06Å; M760-W762 PolarHBondContact O-N 3.49Å; W762-F764 PolarHBondContact O-N 3.17Å; W762-A766 HydrophobicContact CE3-CB 3.53Å; W762-A766 HydrophobicContact CZ3-CB 4.04Å; W762-A766 WeakPolarHBondContact O-CB 3.36Å; W762-A766 PolarHBondContact O-N 2.97Å; W762-A766 VanDerWaalsContact O-N 3.08Å
763	D	49.1	Very low	52.9	Low	121 Å²	121	104 Å²	104	65%	0.647	57%	0.571	S	S	*	*	H	α-helix	trans	-66.4	-30.1	179.6	-69.7	-16.1	0	0	0	111.7	D761 I767	D761-D763 PolarHBondContact O-N 3.41Å; D763-I767 HydrophobicContact CB-CD1 4.25Å
764	F	53.4	Low	55.4	Low	92 Å²	92	103.4 Å²	103.4	40%	0.404	56%	0.558	S	S	.	*	H	α-helix	trans	-88.2	-42.7	-174.4	-166.2	-101.6	0	0	0	113.6	K679 D761 W762 P768	K679-F764 HydrophobicContact CD-CZ 4.07Å; D761-F764 HydrophobicContact CB-CB 4.48Å; D761-F764 PolarHBondContact O-N 2.83Å; W762-F764 PolarHBondContact O-N 3.17Å; F764-P768 VanDerWaalsContact O-CD 3.26Å; F764-P768 WeakPolarHBondContact O-CD 3.49Å; F764-P768 WeakPolarHBondContact O-CG 3.4Å
765	Y	61.4	Low	57.9	Low	85 Å²	85	105.8 Å²	105.8	33%	0.333	55%	0.553	S	S	.	*	H	α-helix	trans	-94.2	-41.9	-176.1	-60.8	-76.3	0	0	0	112.9	F707 M760 D761 F769	F707-Y765 HydrophobicContact CB-CE1 4.41Å; M760-Y765 HydrophobicContact CG-CD2 3.71Å; M760-Y765 HydrophobicContact CG-CE2 4.35Å; M760-Y765 HydrophobicContact CG-CG 4.4Å; D761-Y765 WeakPolarHBondContact O-CD2 3.43Å; D761-Y765 PolarHBondContact O-N 3.47Å; Y765-F769 WeakPolarHBondContact O-CB 3.43Å; Y765-F769 PolarHBondContact O-N 3.48Å
766	A	61.2	Low	60.2	Low	13 Å²	13	103 Å²	103	11%	0.107	54%	0.544	C	S	.	.	H	α-helix	trans	-80.2	-37.4	-169.6	0	0	0	0	0	111.8	W762 F769 L770	W762-A766 HydrophobicContact CE3-CB 3.53Å; W762-A766 HydrophobicContact CZ3-CB 4.04Å; W762-A766 WeakPolarHBondContact O-CB 3.36Å; W762-A766 PolarHBondContact O-N 2.97Å; W762-A766 VanDerWaalsContact O-N 3.08Å; A766-F769 PolarHBondContact O-N 3.24Å; A766-L770 HydrophobicContact CB-CD1 4.03Å; A766-L770 WeakPolarHBondContact O-CA 3.3Å; A766-L770 WeakPolarHBondContact O-CB 3.49Å; A766-L770 WeakPolarHBondContact O-CD1 3.4Å; A766-L770 WeakPolarHBondContact O-CG 3.32Å; A766-L770 PolarHBondContact O-N 3.44Å
767	I	65.7	Low	62.5	Low	90 Å²	90	100.5 Å²	100.5	46%	0.462	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-49.6	-177	-57.3	177.7	0	0	0	111.6	D763 F769 T771	D763-I767 HydrophobicContact CB-CD1 4.25Å; I767-F769 PolarHBondContact O-N 2.74Å; I767-T771 HydrophobicContact CG2-CG2 4.17Å; I767-T771 VanDerWaalsContact O-CB 3.28Å; I767-T771 WeakPolarHBondContact O-CB 3.49Å; I767-T771 WeakPolarHBondContact O-CG2 3.24Å; I767-T771 PolarHBondContact O-N 3.17Å; I767-T771 PolarHBondContact O-OG1 3.38Å
768	P	67.6	Low	64.7	Low	77 Å²	77	98.1 Å²	98.1	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-40.3	177	-20.9	34	0	0	0	112.2	F764 T771 G772	F764-P768 VanDerWaalsContact O-CD 3.26Å; F764-P768 WeakPolarHBondContact O-CD 3.49Å; F764-P768 WeakPolarHBondContact O-CG 3.4Å; P768-T771 VanDerWaalsContact CA-OG1 3.29Å; P768-T771 WeakPolarHBondContact CA-OG1 3.33Å; P768-T771 PolarHBondContact O-OG1 3.43Å; P768-G772 PolarHBondContact O-N 3.24Å
769	F	69.5	Low	66.8	Low	142 Å²	142	99.6 Å²	99.6	62%	0.623	51%	0.507	S	S	*	.	H	α-helix	trans	-66.7	-47.7	178.8	-175.7	-101.2	0	0	0	111.9	Y765 A766 I767 G772 L773	Y765-F769 WeakPolarHBondContact O-CB 3.43Å; Y765-F769 PolarHBondContact O-N 3.48Å; A766-F769 PolarHBondContact O-N 3.24Å; I767-F769 PolarHBondContact O-N 2.74Å; F769-G772 PolarHBondContact O-N 3.24Å; F769-L773 HydrophobicContact CD1-CD1 4.34Å; F769-L773 HydrophobicContact CE1-CD1 3.63Å; F769-L773 HydrophobicContact CZ-CD1 3.97Å; F769-L773 WeakPolarHBondContact O-CB 3.18Å; F769-L773 PolarHBondContact O-N 3.45Å
770	L	68.7	Low	68.8	Low	103 Å²	103	99.5 Å²	99.5	54%	0.539	49%	0.493	S	S	.	.	H	α-helix	trans	-66.6	-36.1	177.6	-72.7	166.8	0	0	0	111.9	A766 L773 L774	A766-L770 HydrophobicContact CB-CD1 4.03Å; A766-L770 WeakPolarHBondContact O-CA 3.3Å; A766-L770 WeakPolarHBondContact O-CB 3.49Å; A766-L770 WeakPolarHBondContact O-CD1 3.4Å; A766-L770 WeakPolarHBondContact O-CG 3.32Å; A766-L770 PolarHBondContact O-N 3.44Å; L770-L773 PolarHBondContact O-N 2.99Å; L770-L774 WeakPolarHBondContact O-CB 3.44Å; L770-L774 PolarHBondContact O-N 3.01Å
771	T	73.9	Confident	70	Confident	70 Å²	70	98.9 Å²	98.9	43%	0.429	49%	0.491	S	S	.	.	H	α-helix	trans	-68.3	-39.8	174	52.5	0	0	0	0	111.4	I767 P768 L774 L775	I767-T771 HydrophobicContact CG2-CG2 4.17Å; I767-T771 VanDerWaalsContact O-CB 3.28Å; I767-T771 WeakPolarHBondContact O-CB 3.49Å; I767-T771 WeakPolarHBondContact O-CG2 3.24Å; I767-T771 PolarHBondContact O-N 3.17Å; I767-T771 PolarHBondContact O-OG1 3.38Å; P768-T771 VanDerWaalsContact CA-OG1 3.29Å; P768-T771 WeakPolarHBondContact CA-OG1 3.33Å; P768-T771 PolarHBondContact O-OG1 3.43Å; T771-L774 PolarHBondContact O-N 3.39Å; T771-L775 WeakPolarHBondContact O-CB 3.48Å; T771-L775 PolarHBondContact O-N 3.23Å
772	G	78.2	Confident	71.2	Confident	32 Å²	32	103.5 Å²	103.5	33%	0.33	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-44.1	170.9	0	0	0	0	0	112.6	P768 F769 L775 L776	P768-G772 PolarHBondContact O-N 3.24Å; F769-G772 PolarHBondContact O-N 3.24Å; G772-L775 PolarHBondContact O-N 3.5Å; G772-L776 WeakPolarHBondContact O-CB 3.22Å; G772-L776 PolarHBondContact O-N 3.02Å
773	L	78.2	Confident	72.5	Confident	88 Å²	88	101.8 Å²	101.8	46%	0.461	50%	0.499	S	S	.	.	H	α-helix	trans	-68.4	-37.8	177.7	-140.2	160.6	0	0	0	111.4	F769 L770 L776 F777	F769-L773 HydrophobicContact CD1-CD1 4.34Å; F769-L773 HydrophobicContact CE1-CD1 3.63Å; F769-L773 HydrophobicContact CZ-CD1 3.97Å; F769-L773 WeakPolarHBondContact O-CB 3.18Å; F769-L773 PolarHBondContact O-N 3.45Å; L770-L773 PolarHBondContact O-N 2.99Å; L773-L776 PolarHBondContact O-N 2.69Å; L773-F777 VanDerWaalsContact O-CB 3.23Å; L773-F777 WeakPolarHBondContact O-CB 3.26Å; L773-F777 PolarHBondContact O-N 3.28Å
774	L	76.8	Confident	73.3	Confident	105 Å²	105	105.2 Å²	105.2	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-41.2	174	-171.3	110	0	0	0	111.4	L770 T771 F777 L778	L770-L774 WeakPolarHBondContact O-CB 3.44Å; L770-L774 PolarHBondContact O-N 3.01Å; T771-L774 PolarHBondContact O-N 3.39Å; L774-F777 PolarHBondContact O-N 3.08Å; L774-L778 HydrophobicContact CD2-CD1 3.87Å; L774-L778 HydrophobicContact CG-CD1 4.27Å; L774-L778 HydrophobicContact CG-CG 4.48Å; L774-L778 WeakPolarHBondContact O-CB 3.44Å; L774-L778 VanDerWaalsContact O-CG 3.26Å; L774-L778 WeakPolarHBondContact O-CG 3.07Å; L774-L778 PolarHBondContact O-N 3.1Å
775	L	84	Confident	73.6	Confident	122 Å²	122	111.4 Å²	111.4	64%	0.639	52%	0.524	S	S	*	.	H	α-helix	trans	-62.4	-45.3	173.8	-90	166.1	0	0	0	111.3	T771 G772 F777 L778 F779	T771-L775 WeakPolarHBondContact O-CB 3.48Å; T771-L775 PolarHBondContact O-N 3.23Å; G772-L775 PolarHBondContact O-N 3.5Å; L775-F777 VanDerWaalsContact C-N 3.31Å; L775-F777 PolarHBondContact O-N 3.24Å; L775-L778 PolarHBondContact O-N 2.74Å; L775-F779 VanDerWaalsContact O-CB 3.26Å; L775-F779 WeakPolarHBondContact O-CB 3.37Å; L775-F779 PolarHBondContact O-N 3.22Å
776	L	82	Confident	73.3	Confident	122 Å²	122	115.4 Å²	115.4	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-60.6	-40.6	173.2	-87.1	166	0	0	0	111.9	G772 L773 F779 Y780	G772-L776 WeakPolarHBondContact O-CB 3.22Å; G772-L776 PolarHBondContact O-N 3.02Å; L773-L776 PolarHBondContact O-N 2.69Å; L776-F779 PolarHBondContact O-N 3.31Å; L776-Y780 VanDerWaalsContact O-CB 3.3Å; L776-Y780 WeakPolarHBondContact O-CB 3.47Å; L776-Y780 PolarHBondContact O-N 3.4Å
777	F	77.8	Confident	73.9	Confident	116 Å²	116	120.6 Å²	120.6	51%	0.509	58%	0.579	S	S	.	*	H	α-helix	trans	-69.9	-40.5	178.8	-173	-109.1	0	0	0	112.5	L773 L774 L775 Y780 I781	L773-F777 VanDerWaalsContact O-CB 3.23Å; L773-F777 WeakPolarHBondContact O-CB 3.26Å; L773-F777 PolarHBondContact O-N 3.28Å; L774-F777 PolarHBondContact O-N 3.08Å; L775-F777 VanDerWaalsContact C-N 3.31Å; L775-F777 PolarHBondContact O-N 3.24Å; F777-Y780 PolarHBondContact O-N 3.41Å; F777-I781 HydrophobicContact CD1-CD1 3.71Å; F777-I781 HydrophobicContact CD1-CG1 4.45Å; F777-I781 HydrophobicContact CE1-CD1 3.26Å; F777-I781 HydrophobicContact CE1-CG1 4.18Å; F777-I781 HydrophobicContact CE2-CD1 4.46Å; F777-I781 HydrophobicContact CG-CD1 4.49Å; F777-I781 HydrophobicContact CZ-CD1 3.69Å; F777-I781 HydrophobicContact CZ-CG1 4.26Å; F777-I781 WeakPolarHBondContact O-CG1 3.22Å; F777-I781 PolarHBondContact O-N 3.06Å
778	L	80.8	Confident	74.4	Confident	95 Å²	95	122.2 Å²	122.2	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-64.7	-41.2	173.2	-74.2	173	0	0	0	111.1	L774 L775 I781 R782	L774-L778 HydrophobicContact CD2-CD1 3.87Å; L774-L778 HydrophobicContact CG-CD1 4.27Å; L774-L778 HydrophobicContact CG-CG 4.48Å; L774-L778 WeakPolarHBondContact O-CB 3.44Å; L774-L778 VanDerWaalsContact O-CG 3.26Å; L774-L778 WeakPolarHBondContact O-CG 3.07Å; L774-L778 PolarHBondContact O-N 3.1Å; L775-L778 PolarHBondContact O-N 2.74Å; L778-I781 PolarHBondContact O-N 3Å; L778-R782 WeakPolarHBondContact O-CB 3.29Å; L778-R782 PolarHBondContact O-N 3.5Å
779	F	83.2	Confident	74.7	Confident	142 Å²	142	124.7 Å²	124.7	62%	0.623	59%	0.59	S	S	*	*	H	α-helix	trans	-60.4	-46.1	172.8	-174.6	-94.1	0	0	0	111.1	L775 L776 R782 H783	L775-F779 VanDerWaalsContact O-CB 3.26Å; L775-F779 WeakPolarHBondContact O-CB 3.37Å; L775-F779 PolarHBondContact O-N 3.22Å; L776-F779 PolarHBondContact O-N 3.31Å; F779-R782 PolarHBondContact O-N 3.26Å; F779-H783 WeakPolarHBondContact O-CB 3.16Å; F779-H783 PolarHBondContact O-N 3.21Å
780	Y	81.1	Confident	75.1	Confident	126 Å²	126	123.6 Å²	123.6	49%	0.494	59%	0.588	S	S	.	*	H	α-helix	trans	-61.4	-46.4	176.5	178.6	-97.9	0	0	0	112.7	L776 F777 R782 H783 R784	L776-Y780 VanDerWaalsContact O-CB 3.3Å; L776-Y780 WeakPolarHBondContact O-CB 3.47Å; L776-Y780 PolarHBondContact O-N 3.4Å; F777-Y780 PolarHBondContact O-N 3.41Å; Y780-R782 VanDerWaalsContact C-N 3.33Å; Y780-R782 PolarHBondContact O-N 2.99Å; Y780-H783 PolarHBondContact O-N 2.74Å; Y780-R784 PolarHBondContact O-N 3.43Å
781	I	75.9	Confident	75.5	Confident	63 Å²	63	124.9 Å²	124.9	32%	0.323	59%	0.591	S	S	.	*	H	α-helix	trans	-61.5	-43.1	175.9	-72.7	173.5	0	0	0	110.9	F777 L778 H783 R784 R785	F777-I781 HydrophobicContact CD1-CD1 3.71Å; F777-I781 HydrophobicContact CD1-CG1 4.45Å; F777-I781 HydrophobicContact CE1-CD1 3.26Å; F777-I781 HydrophobicContact CE1-CG1 4.18Å; F777-I781 HydrophobicContact CE2-CD1 4.46Å; F777-I781 HydrophobicContact CG-CD1 4.49Å; F777-I781 HydrophobicContact CZ-CD1 3.69Å; F777-I781 HydrophobicContact CZ-CG1 4.26Å; F777-I781 WeakPolarHBondContact O-CG1 3.22Å; F777-I781 PolarHBondContact O-N 3.06Å; L778-I781 PolarHBondContact O-N 3Å; I781-H783 VanDerWaalsContact C-N 3.29Å; I781-H783 PolarHBondContact O-N 3.46Å; I781-R784 PolarHBondContact O-N 3.29Å; I781-R785 PolarHBondContact O-N 3.46Å
782	R	77.4	Confident	75.6	Confident	200 Å²	200	128.6 Å²	128.6	76%	0.755	60%	0.602	S	S	*	*	H	α-helix	trans	-61.9	-41.1	178.9	-172.2	175.9	-179.9	152.8	-0.4	110.9	L778 F779 Y780 R784 R785	L778-R782 WeakPolarHBondContact O-CB 3.29Å; L778-R782 PolarHBondContact O-N 3.5Å; F779-R782 PolarHBondContact O-N 3.26Å; Y780-R782 VanDerWaalsContact C-N 3.33Å; Y780-R782 PolarHBondContact O-N 2.99Å; R782-R784 VanDerWaalsContact C-N 3.31Å; R782-R784 PolarHBondContact O-N 3.34Å; R782-R785 PolarHBondContact O-N 2.74Å
783	H	77.2	Confident	75.4	Confident	133 Å²	133	135.5 Å²	135.5	62%	0.616	62%	0.621	S	S	*	*	H	α-helix	trans	-70.6	-25.5	178.6	-156.5	-42.5	0	0	0	113.1	F779 Y780 I781	F779-H783 WeakPolarHBondContact O-CB 3.16Å; F779-H783 PolarHBondContact O-N 3.21Å; Y780-H783 PolarHBondContact O-N 2.74Å; I781-H783 VanDerWaalsContact C-N 3.29Å; I781-H783 PolarHBondContact O-N 3.46Å
784	R	66.4	Low	75.2	Confident	194 Å²	194	139.2 Å²	139.2	73%	0.732	63%	0.634	S	S	*	*	H	α-helix	trans	-87	-12.4	178.5	-135.6	-173.4	-173.9	-167.8	3.7	114.5	Y780 I781 R782	Y780-R784 PolarHBondContact O-N 3.43Å; I781-R784 PolarHBondContact O-N 3.29Å; R782-R784 VanDerWaalsContact C-N 3.31Å; R782-R784 PolarHBondContact O-N 3.34Å
785	R	58.1	Low	75	Confident	222 Å²	222	142 Å²	142	84%	0.838	64%	0.641	S	S	*	*	H	α-helix	trans	-91.4	-12.2	173.8	-84.7	-168.7	-172	174.3	4.2	113.6	I781 R782	I781-R785 PolarHBondContact O-N 3.46Å; R782-R785 PolarHBondContact O-N 2.74Å
786	V	56.3	Low	74.2	Confident	169 Å²	169	143.8 Å²	143.8	100%	1.024	64%	0.641	S	S	*	*			trans	-89.9	0	164.7	-176.4	0	0	0	0	107.3

Retrieved 786 of 786 residues in 1523.1 ms (Link to these results)

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