A0A5K4FA98_SCHMA Loading...

Vacuolar protein sorting-associated protein 51 homolog

Acts as component of the GARP complex that is involved in retrograde transport from early and late endosomes to the trans-Golgi network (TGN).

AlphaFold DB , UniProt , Accession A0A5K4FA98, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 603 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	34.9	Very low	245 Å²	245	164.5 Å²	164.5	100%	1.207	83%	0.833	S	S	*	*				0	121.5	0	-100.7	175.9	157.7	0	0	107.9
2	R	35.8	Very low	34.5	Very low	239 Å²	239	160.6 Å²	160.6	90%	0.902	83%	0.832	S	S	*	*			trans	68.7	84.3	169.1	-62.8	-174.3	-168.1	168.2	5	118.9
3	N	29.4	Very low	34.5	Very low	159 Å²	159	159.3 Å²	159.3	85%	0.85	84%	0.836	S	S	*	*			trans	-69.1	137.5	140.1	-80.9	-16.3	0	0	0	109.5
4	V	42.1	Very low	34.7	Very low	130 Å²	130	159.6 Å²	159.6	79%	0.788	83%	0.831	S	S	*	*			trans	-139.7	108.6	153.8	177.8	0	0	0	0	107.5
5	Q	31.9	Very low	34.6	Very low	168 Å²	168	159.6 Å²	159.6	79%	0.785	83%	0.832	S	S	*	*			trans	-68.4	143.5	161.7	-80.2	159.9	-77.2	0	0	109.7
6	R	34.3	Very low	34.5	Very low	247 Å²	247	159.5 Å²	159.5	93%	0.932	83%	0.831	S	S	*	*			trans	-142.8	124.6	146	-114.7	179.2	-175.3	141	1.1	109.9
7	D	33.3	Very low	34.6	Very low	130 Å²	130	157.4 Å²	157.4	70%	0.695	83%	0.826	S	S	*	*			trans	-81.2	158.8	-174.4	-113.4	-34.1	0	0	0	112.7
8	E	35.8	Very low	34.6	Very low	159 Å²	159	156.6 Å²	156.6	74%	0.743	82%	0.823	S	S	*	*			trans	89.3	116.7	138	-79.8	179	178.1	0	0	122.4
9	T	32.8	Very low	34.5	Very low	124 Å²	124	153.3 Å²	153.3	76%	0.761	81%	0.814	S	S	*	*				94.5	87.2	129.7	59.8	0	0	0	0	120.6
10	V	38.5	Very low	34.3	Very low	154 Å²	154	155 Å²	155	93%	0.933	81%	0.814	S	S	*	*			trans	-159.3	127.7	132.2	-172.8	0	0	0	0	104.4
11	G	31	Very low	34.5	Very low	55 Å²	55	153.8 Å²	153.8	57%	0.567	81%	0.813	S	S	*	*			cis	135.5	85.1	24.6	0	0	0	0	0	107.3
12	S	30	Very low	34.4	Very low	117 Å²	117	151.1 Å²	151.1	82%	0.818	80%	0.798	S	S	*	*			trans	54.5	81.7	145.4	55.8	0	0	0	0	120.1
13	T	35.2	Very low	34.4	Very low	144 Å²	144	148.6 Å²	148.6	88%	0.883	80%	0.796	S	S	*	*			trans	-159.4	4.9	151.5	33.8	0	0	0	0	116.3
14	E	36.8	Very low	34.8	Very low	164 Å²	164	143.4 Å²	143.4	77%	0.766	77%	0.771	S	S	*	*			trans	-104.2	1.7	-170.1	-71.7	-176	158.6	0	0	116.4	I16	E14-I16 PolarHBondContact O-N 2.99Å
15	N	33.6	Very low	34.7	Very low	159 Å²	159	140.6 Å²	140.6	85%	0.85	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	20.6	-167.7	-87.1	-19.7	0	0	0	116.9
16	I	33.4	Very low	35.7	Very low	158 Å²	158	138.4 Å²	138.4	81%	0.81	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	-9.9	179.3	-60.5	179.6	0	0	0	113.7	E14	E14-I16 PolarHBondContact O-N 2.99Å
17	V	36.3	Very low	36.3	Very low	124 Å²	124	135.1 Å²	135.1	75%	0.752	76%	0.755	S	S	*	*	S	Bend	trans	-102.9	-13.4	-178.6	-175.3	0	0	0	0	113.5	S19	V17-S19 PolarHBondContact O-N 2.99Å
18	N	34.4	Very low	37.1	Very low	143 Å²	143	134.2 Å²	134.2	77%	0.765	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	22.7	-173.4	-78.4	-13.5	0	0	0	115.9
19	S	32.4	Very low	38.6	Very low	94 Å²	94	130.7 Å²	130.7	66%	0.657	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	4.2	-177	64.9	0	0	0	0	116.2	V17	V17-S19 PolarHBondContact O-N 2.99Å
20	F	31.1	Very low	41	Very low	186 Å²	186	127.7 Å²	127.7	82%	0.816	71%	0.711	S	S	*	*	S	Bend	trans	-142.8	138.8	170.2	-93.8	-96.8	0	0	0	108.5
21	V	37.3	Very low	43.3	Very low	131 Å²	131	120.3 Å²	120.3	79%	0.794	67%	0.666	S	S	*	*			trans	95.3	90.8	-177.7	-165.7	0	0	0	0	113.9	E23	V21-E23 PolarHBondContact O-N 3.38Å
22	Q	36.5	Very low	46.1	Very low	189 Å²	189	119.8 Å²	119.8	88%	0.883	65%	0.65	S	S	*	*			trans	-60.8	114.4	159.7	-163.6	163.8	-11.4	0	0	107.8	P24	Q22-P24 WeakPolarHBondContact O-CD 3.15Å
23	E	35.5	Very low	49	Very low	185 Å²	185	118.7 Å²	118.7	86%	0.864	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-59.9	120.9	178.5	-88.3	-178.9	151.8	0	0	110.5	V21	V21-E23 PolarHBondContact O-N 3.38Å
24	P	38.8	Very low	51.7	Low	51 Å²	51	113.4 Å²	113.4	33%	0.331	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-76.3	152.5	176.9	30.5	-31.2	0	0	0	111.4	Q22 E28	Q22-P24 WeakPolarHBondContact O-CD 3.15Å; P24-E28 VanDerWaalsContact CA-OE2 3.27Å; P24-E28 WeakPolarHBondContact CA-OE2 3.5Å; P24-E28 HydrophobicContact CB-CB 3.75Å; P24-E28 HydrophobicContact CB-CG 4.34Å; P24-E28 WeakPolarHBondContact CB-OE2 3.38Å
25	S	40.2	Very low	54.3	Low	71 Å²	71	105.6 Å²	105.6	50%	0.497	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-69.2	160	-175.7	61.6	0	0	0	0	112.5	E27 E28	S25-E27 PolarHBondContact O-N 3.18Å; S25-E28 PolarHBondContact N-OE2 3.29Å; S25-E28 WeakPolarHBondContact O-CB 3.45Å; S25-E28 PolarHBondContact O-N 3.32Å; S25-E28 PolarHBondContact OG-OE2 3.04Å
26	S	52.2	Low	57.1	Low	121 Å²	121	100 Å²	100	85%	0.846	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.3	-171.2	68	0	0	0	0	116
27	E	47.1	Very low	60	Low	178 Å²	178	96.1 Å²	96.1	83%	0.832	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-13.4	173.2	-70.9	-177.8	163.4	0	0	113.2	S25	S25-E27 PolarHBondContact O-N 3.18Å
28	E	51.2	Low	62.7	Low	112 Å²	112	90.8 Å²	90.8	52%	0.523	48%	0.475	S	S	.	.	S	Bend	trans	-89.7	-9.5	179.9	-81.2	174.1	130.1	0	0	113.9	P24 S25 D30	P24-E28 VanDerWaalsContact CA-OE2 3.27Å; P24-E28 WeakPolarHBondContact CA-OE2 3.5Å; P24-E28 HydrophobicContact CB-CB 3.75Å; P24-E28 HydrophobicContact CB-CG 4.34Å; P24-E28 WeakPolarHBondContact CB-OE2 3.38Å; S25-E28 PolarHBondContact N-OE2 3.29Å; S25-E28 WeakPolarHBondContact O-CB 3.45Å; S25-E28 PolarHBondContact O-N 3.32Å; S25-E28 PolarHBondContact OG-OE2 3.04Å; E28-D30 PolarHBondContact O-N 3.39Å
29	M	66.4	Low	65.4	Low	85 Å²	85	84 Å²	84	42%	0.419	44%	0.438	S	S	.	.			trans	-97	57.5	175.9	-70.7	-171.7	65.9	0	0	111.9	Y33 R112	M29-Y33 HydrophobicContact CB-CD1 4.32Å; M29-Y33 HydrophobicContact CE-CE1 4.49Å; M29-Y33 HydrophobicContact CG-CD1 4.13Å; M29-Y33 HydrophobicContact CG-CE1 4.09Å; M29-R112 PolarHBondContact O-NH2 3.37Å
30	D	82.9	Confident	68.2	Low	60 Å²	60	82.5 Å²	82.5	32%	0.321	42%	0.423	S	S	.	.			trans	-69.7	169.7	176.7	74	19.2	0	0	0	112.8	E28 L32 Y33 F34 L124	E28-D30 PolarHBondContact O-N 3.39Å; D30-L32 PolarHBondContact O-N 3.03Å; D30-L32 VanDerWaalsContact O-N 3.16Å; D30-L32 WeakPolarHBondContact OD1-CA 3.45Å; D30-L32 WeakPolarHBondContact OD1-CB 3.13Å; D30-L32 PolarHBondContact OD1-N 2.95Å; D30-Y33 WeakPolarHBondContact O-CB 3.45Å; D30-Y33 PolarHBondContact O-N 2.9Å; D30-Y33 VanDerWaalsContact O-N 3.17Å; D30-Y33 WeakPolarHBondContact OD1-CB 3.22Å; D30-Y33 PolarHBondContact OD1-N 2.83Å; D30-F34 PolarHBondContact O-N 2.98Å; D30-L124 HydrophobicContact CB-CD2 4.03Å
31	V	87.8	Confident	71	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-59.7	-29.1	-177.8	74.3	0	0	0	0	112.6	A35 F113 E116 L124 L125 A128	V31-A35 WeakPolarHBondContact O-CB 3.37Å; V31-A35 PolarHBondContact O-N 3.25Å; V31-F113 HydrophobicContact CG2-CD1 4.01Å; V31-F113 HydrophobicContact CG2-CD2 4.41Å; V31-F113 HydrophobicContact CG2-CE1 3.6Å; V31-F113 HydrophobicContact CG2-CE2 4.04Å; V31-F113 HydrophobicContact CG2-CG 4.41Å; V31-F113 HydrophobicContact CG2-CZ 3.64Å; V31-E116 WeakPolarHBondContact CA-OE2 3.38Å; V31-E116 WeakPolarHBondContact CB-OE2 3.48Å; V31-E116 WeakPolarHBondContact CG2-OE2 3.47Å; V31-L124 HydrophobicContact CG1-CD2 4.37Å; V31-L124 HydrophobicContact CG1-CG 4.02Å; V31-L125 HydrophobicContact CG2-CD1 4.49Å; V31-A128 HydrophobicContact CB-CB 4.34Å; V31-A128 HydrophobicContact CG1-CB 3.67Å; V31-A128 HydrophobicContact CG2-CB 4.1Å
32	L	89.1	Confident	73.6	Confident	44 Å²	44	71.7 Å²	71.7	23%	0.23	38%	0.375	C	S	.	.	H	α-helix	trans	-77.6	-39	-179.5	-177	62.8	0	0	0	110.8	D30 F34 A35 N36 L124 R127 A128	D30-L32 PolarHBondContact O-N 3.03Å; D30-L32 VanDerWaalsContact O-N 3.16Å; D30-L32 WeakPolarHBondContact OD1-CA 3.45Å; D30-L32 WeakPolarHBondContact OD1-CB 3.13Å; D30-L32 PolarHBondContact OD1-N 2.95Å; L32-F34 VanDerWaalsContact C-N 3.34Å; L32-A35 PolarHBondContact O-N 3.18Å; L32-N36 PolarHBondContact O-N 3Å; L32-N36 PolarHBondContact O-ND2 2.84Å; L32-L124 HydrophobicContact CB-CD1 3.82Å; L32-L124 HydrophobicContact CB-CG 4.44Å; L32-L124 HydrophobicContact CD2-CD1 3.96Å; L32-R127 HydrophobicContact CD1-CB 4.33Å; L32-A128 HydrophobicContact CB-CB 4.29Å; L32-A128 HydrophobicContact CD1-CB 4.11Å
33	Y	90.9	Very high	76.2	Confident	94 Å²	94	62.9 Å²	62.9	37%	0.369	33%	0.334	S	S	.	.	H	α-helix	trans	-58.3	-48.2	169.6	178	-94.1	0	0	0	110.2	M29 D30 A35 N36 L37	M29-Y33 HydrophobicContact CB-CD1 4.32Å; M29-Y33 HydrophobicContact CE-CE1 4.49Å; M29-Y33 HydrophobicContact CG-CD1 4.13Å; M29-Y33 HydrophobicContact CG-CE1 4.09Å; D30-Y33 WeakPolarHBondContact O-CB 3.45Å; D30-Y33 PolarHBondContact O-N 2.9Å; D30-Y33 VanDerWaalsContact O-N 3.17Å; D30-Y33 WeakPolarHBondContact OD1-CB 3.22Å; D30-Y33 PolarHBondContact OD1-N 2.83Å; Y33-A35 PolarHBondContact O-N 3.09Å; Y33-N36 PolarHBondContact O-N 2.75Å; Y33-L37 HydrophobicContact CE1-CB 4.5Å; Y33-L37 HydrophobicContact CE1-CD2 4.02Å; Y33-L37 WeakPolarHBondContact O-CB 3.32Å; Y33-L37 PolarHBondContact O-N 3.43Å
34	F	91.7	Very high	78.7	Confident	33 Å²	33	56.6 Å²	56.6	15%	0.145	31%	0.306	C	S	.	.	H	α-helix	trans	-56.7	-48.6	173.6	169.6	-99.8	0	0	0	111.9	D30 L32 N36 L37 I38 R112 F113	D30-F34 PolarHBondContact O-N 2.98Å; L32-F34 VanDerWaalsContact C-N 3.34Å; F34-N36 VanDerWaalsContact C-N 3.31Å; F34-N36 PolarHBondContact O-N 3.28Å; F34-L37 PolarHBondContact O-N 3.17Å; F34-I38 HydrophobicContact CD1-CG2 4.44Å; F34-I38 HydrophobicContact CE1-CD1 4.32Å; F34-I38 HydrophobicContact CE1-CG2 4.09Å; F34-I38 HydrophobicContact CE2-CB 4.26Å; F34-I38 HydrophobicContact CE2-CD1 3.9Å; F34-I38 HydrophobicContact CZ-CB 4.25Å; F34-I38 HydrophobicContact CZ-CD1 3.49Å; F34-I38 VanDerWaalsContact CZ-CD1 3.49Å; F34-I38 HydrophobicContact CZ-CG1 4.46Å; F34-I38 HydrophobicContact CZ-CG2 4.18Å; F34-I38 WeakPolarHBondContact O-CB 3.39Å; F34-I38 VanDerWaalsContact O-CG2 3.27Å; F34-I38 WeakPolarHBondContact O-CG2 3.22Å; F34-I38 PolarHBondContact O-N 3.36Å; F34-R112 HydrophobicContact CB-CG 4.49Å; F34-R112 HydrophobicContact CD1-CB 4.01Å; F34-R112 HydrophobicContact CD1-CG 3.56Å; F34-R112 HydrophobicContact CD2-CG 4Å; F34-R112 HydrophobicContact CE1-CB 3.51Å; F34-R112 HydrophobicContact CE1-CG 3.62Å; F34-R112 HydrophobicContact CE2-CB 4.09Å; F34-R112 HydrophobicContact CE2-CG 4.05Å; F34-R112 HydrophobicContact CG-CB 4.49Å; F34-R112 HydrophobicContact CG-CG 3.74Å; F34-R112 HydrophobicContact CZ-CB 3.54Å; F34-R112 HydrophobicContact CZ-CG 3.86Å; F34-F113 HydrophobicContact CD1-CE2 4.04Å; F34-F113 HydrophobicContact CE1-CD2 4.29Å; F34-F113 HydrophobicContact CE1-CE2 4.02Å
35	A	92.1	Very high	81.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.9	-40.8	179.2	0	0	0	0	0	112.5	V31 L32 Y33 T39 A128 R131 I132	V31-A35 WeakPolarHBondContact O-CB 3.37Å; V31-A35 PolarHBondContact O-N 3.25Å; L32-A35 PolarHBondContact O-N 3.18Å; Y33-A35 PolarHBondContact O-N 3.09Å; A35-T39 WeakPolarHBondContact O-CB 3.29Å; A35-T39 WeakPolarHBondContact O-CG2 3.49Å; A35-T39 PolarHBondContact O-N 3.31Å; A35-T39 PolarHBondContact O-OG1 3.14Å; A35-A128 HydrophobicContact CB-CB 3.94Å; A35-R131 HydrophobicContact CB-CB 4.5Å; A35-R131 HydrophobicContact CB-CG 4.48Å; A35-I132 HydrophobicContact CB-CD1 3.97Å; A35-I132 HydrophobicContact CB-CG1 3.91Å
36	N	92.6	Very high	83.4	Confident	41 Å²	41	57.5 Å²	57.5	22%	0.219	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-50	174	-70.2	-50.7	0	0	0	111	L32 Y33 F34 I38 T39 D40 R131	L32-N36 PolarHBondContact O-N 3Å; L32-N36 PolarHBondContact O-ND2 2.84Å; Y33-N36 PolarHBondContact O-N 2.75Å; F34-N36 VanDerWaalsContact C-N 3.31Å; F34-N36 PolarHBondContact O-N 3.28Å; N36-I38 PolarHBondContact O-N 3.11Å; N36-T39 PolarHBondContact O-N 2.82Å; N36-T39 PolarHBondContact O-OG1 2.94Å; N36-D40 VanDerWaalsContact O-CB 3.26Å; N36-D40 WeakPolarHBondContact O-CB 3.27Å; N36-D40 PolarHBondContact O-N 3.22Å; N36-R131 PolarHBondContact OD1-NE 3.43Å; N36-R131 PolarHBondContact OD1-NH2 2.81Å
37	L	93.2	Very high	85	Confident	76 Å²	76	53 Å²	53	40%	0.398	26%	0.264	S	S	.	.	H	α-helix	trans	-58.8	-47.8	-177.2	-179.8	65.5	0	0	0	112	Y33 F34 S41	Y33-L37 HydrophobicContact CE1-CB 4.5Å; Y33-L37 HydrophobicContact CE1-CD2 4.02Å; Y33-L37 WeakPolarHBondContact O-CB 3.32Å; Y33-L37 PolarHBondContact O-N 3.43Å; F34-L37 PolarHBondContact O-N 3.17Å; L37-S41 WeakPolarHBondContact O-CB 3.28Å; L37-S41 PolarHBondContact O-N 2.98Å; L37-S41 PolarHBondContact O-OG 2.58Å
38	I	92.4	Very high	86.9	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.062	25%	0.252	C	S	.	.	H	α-helix	trans	-71.6	-38.8	-176.9	-162	167.8	0	0	0	111.8	F34 N36 V42 F105 L108 V109	F34-I38 HydrophobicContact CD1-CG2 4.44Å; F34-I38 HydrophobicContact CE1-CD1 4.32Å; F34-I38 HydrophobicContact CE1-CG2 4.09Å; F34-I38 HydrophobicContact CE2-CB 4.26Å; F34-I38 HydrophobicContact CE2-CD1 3.9Å; F34-I38 HydrophobicContact CZ-CB 4.25Å; F34-I38 HydrophobicContact CZ-CD1 3.49Å; F34-I38 VanDerWaalsContact CZ-CD1 3.49Å; F34-I38 HydrophobicContact CZ-CG1 4.46Å; F34-I38 HydrophobicContact CZ-CG2 4.18Å; F34-I38 WeakPolarHBondContact O-CB 3.39Å; F34-I38 VanDerWaalsContact O-CG2 3.27Å; F34-I38 WeakPolarHBondContact O-CG2 3.22Å; F34-I38 PolarHBondContact O-N 3.36Å; N36-I38 PolarHBondContact O-N 3.11Å; I38-V42 HydrophobicContact CG1-CG2 4.3Å; I38-V42 WeakPolarHBondContact O-CB 3.44Å; I38-V42 WeakPolarHBondContact O-CG2 3.29Å; I38-V42 PolarHBondContact O-N 2.96Å; I38-F105 HydrophobicContact CD1-CD2 4.27Å; I38-F105 HydrophobicContact CD1-CE2 4.36Å; I38-F105 HydrophobicContact CG1-CD2 3.98Å; I38-F105 HydrophobicContact CG1-CE2 3.9Å; I38-F105 HydrophobicContact CG2-CE2 4.13Å; I38-L108 HydrophobicContact CD1-CB 3.69Å; I38-L108 HydrophobicContact CD1-CD1 4.35Å; I38-V109 HydrophobicContact CD1-CG2 3.94Å; I38-V109 HydrophobicContact CG2-CG2 4.3Å
39	T	93.1	Very high	88.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-71.6	-38.4	178.8	56.2	0	0	0	0	111.8	A35 N36 L43 I44 F105 I132 R135	A35-T39 WeakPolarHBondContact O-CB 3.29Å; A35-T39 WeakPolarHBondContact O-CG2 3.49Å; A35-T39 PolarHBondContact O-N 3.31Å; A35-T39 PolarHBondContact O-OG1 3.14Å; N36-T39 PolarHBondContact O-N 2.82Å; N36-T39 PolarHBondContact O-OG1 2.94Å; T39-L43 HydrophobicContact CG2-CD1 4Å; T39-L43 WeakPolarHBondContact O-CB 3.4Å; T39-L43 PolarHBondContact O-N 2.87Å; T39-I44 PolarHBondContact O-N 3.16Å; T39-I44 VanDerWaalsContact O-N 3.16Å; T39-F105 HydrophobicContact CG2-CE2 4.33Å; T39-F105 HydrophobicContact CG2-CZ 4.13Å; T39-I132 HydrophobicContact CG2-CG1 4.04Å; T39-R135 HydrophobicContact CG2-CB 3.74Å; T39-R135 HydrophobicContact CG2-CG 3.98Å
40	D	91.2	Very high	89.4	Confident	63 Å²	63	45.3 Å²	45.3	34%	0.337	23%	0.226	S	C	.	.	I	π-helix	trans	-72.6	-36.3	176.4	-65.8	-11.2	0	0	0	111.6	N36 I44 R135	N36-D40 VanDerWaalsContact O-CB 3.26Å; N36-D40 WeakPolarHBondContact O-CB 3.27Å; N36-D40 PolarHBondContact O-N 3.22Å; D40-I44 HydrophobicContact CB-CD1 4.15Å; D40-I44 WeakPolarHBondContact OD1-CD1 3.02Å; D40-R135 IonicContact OD1-CZ 3.78Å; D40-R135 IonicContact OD1-NE 3.12Å; D40-R135 IonicContact OD1-NH2 3.52Å; D40-R135 PolarHBondContact OD1-NH2 2.86Å
41	S	89.9	Confident	89.3	Confident	50 Å²	50	43.3 Å²	43.3	35%	0.35	22%	0.22	S	C	.	.	I	π-helix	trans	-76.3	-31.1	-179	-61.3	0	0	0	0	113.9	L37 K45	L37-S41 WeakPolarHBondContact O-CB 3.28Å; L37-S41 PolarHBondContact O-N 2.98Å; L37-S41 PolarHBondContact O-OG 2.58Å; S41-K45 VanDerWaalsContact O-CD 3.28Å; S41-K45 WeakPolarHBondContact O-CD 3Å; S41-K45 WeakPolarHBondContact O-CG 3.5Å
42	V	90.6	Very high	89	Confident	41 Å²	41	49.1 Å²	49.1	25%	0.248	25%	0.25	C	S	.	.	I	π-helix	trans	-107.8	-64.1	-175.2	-175.8	0	0	0	0	110.8	I38 I44 L46 F105	I38-V42 HydrophobicContact CG1-CG2 4.3Å; I38-V42 WeakPolarHBondContact O-CB 3.44Å; I38-V42 WeakPolarHBondContact O-CG2 3.29Å; I38-V42 PolarHBondContact O-N 2.96Å; V42-I44 PolarHBondContact O-N 2.92Å; V42-L46 WeakPolarHBondContact O-CB 3.35Å; V42-L46 PolarHBondContact O-N 2.94Å; V42-F105 HydrophobicContact CB-CD2 3.97Å; V42-F105 HydrophobicContact CG1-CB 4.23Å; V42-F105 HydrophobicContact CG1-CD2 4.01Å; V42-F105 HydrophobicContact CG1-CG 4.46Å; V42-F105 HydrophobicContact CG2-CD2 4.33Å
43	L	91.2	Very high	88.4	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.021	24%	0.243	C	C	.	.	I	π-helix	trans	-67.9	-41.7	-169.8	-58.5	-178.5	0	0	0	112.9	T39 S47 M102 F105 R135 V136 F139	T39-L43 HydrophobicContact CG2-CD1 4Å; T39-L43 WeakPolarHBondContact O-CB 3.4Å; T39-L43 PolarHBondContact O-N 2.87Å; L43-S47 VanDerWaalsContact O-CB 3.29Å; L43-S47 WeakPolarHBondContact O-CB 3.19Å; L43-S47 PolarHBondContact O-N 3.15Å; L43-M102 HydrophobicContact CD2-CE 3.97Å; L43-M102 HydrophobicContact CD2-SD 3.47Å; L43-M102 WeakPolarHBondContact CD2-SD 3.47Å; L43-F105 HydrophobicContact CD1-CE1 4.19Å; L43-F105 HydrophobicContact CD1-CE2 4.1Å; L43-F105 HydrophobicContact CD1-CZ 3.68Å; L43-F105 HydrophobicContact CD2-CD1 4.27Å; L43-F105 HydrophobicContact CD2-CD2 4.26Å; L43-F105 HydrophobicContact CD2-CE1 4.21Å; L43-F105 HydrophobicContact CD2-CE2 4.18Å; L43-F105 HydrophobicContact CD2-CG 4.31Å; L43-F105 HydrophobicContact CD2-CZ 4.17Å; L43-F105 HydrophobicContact CG-CD2 4.36Å; L43-F105 HydrophobicContact CG-CE1 4.45Å; L43-F105 HydrophobicContact CG-CE2 3.87Å; L43-F105 HydrophobicContact CG-CZ 3.94Å; L43-R135 HydrophobicContact CD1-CB 3.92Å; L43-V136 HydrophobicContact CD1-CG2 3.88Å; L43-F139 HydrophobicContact CB-CB 4.45Å; L43-F139 HydrophobicContact CD2-CG 4.31Å
44	I	88.2	Confident	87.5	Confident	53 Å²	53	43.8 Å²	43.8	27%	0.272	23%	0.23	S	C	.	.	I	π-helix	trans	-67.3	-50	178.5	-61.7	-175.7	0	0	0	110.3	T39 D40 V42 L46 S47 E48	T39-I44 PolarHBondContact O-N 3.16Å; T39-I44 VanDerWaalsContact O-N 3.16Å; D40-I44 HydrophobicContact CB-CD1 4.15Å; D40-I44 WeakPolarHBondContact OD1-CD1 3.02Å; V42-I44 PolarHBondContact O-N 2.92Å; I44-L46 VanDerWaalsContact C-N 3.31Å; I44-L46 PolarHBondContact O-N 3.15Å; I44-S47 WeakPolarHBondContact O-CB 3.42Å; I44-S47 PolarHBondContact O-N 3.14Å; I44-S47 VanDerWaalsContact O-N 3.13Å; I44-E48 HydrophobicContact CG2-CG 4.48Å; I44-E48 WeakPolarHBondContact O-CG 3Å; I44-E48 PolarHBondContact O-N 3.46Å
45	K	88.7	Confident	86.6	Confident	129 Å²	129	47.1 Å²	47.1	56%	0.561	25%	0.249	S	C	*	.	H	α-helix	trans	-61.1	-39	178.7	-64.2	-167.5	-170.5	170.4	0	112.6	S41 E48 F49	S41-K45 VanDerWaalsContact O-CD 3.28Å; S41-K45 WeakPolarHBondContact O-CD 3Å; S41-K45 WeakPolarHBondContact O-CG 3.5Å; K45-E48 PolarHBondContact O-N 3.2Å; K45-F49 WeakPolarHBondContact O-CB 3.35Å; K45-F49 PolarHBondContact O-N 2.99Å
46	L	88.2	Confident	85.5	Confident	12 Å²	12	49.8 Å²	49.8	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-41.5	175.4	-175.8	59.1	0	0	0	111.2	V42 I44 F49 I50 L101 M102 F139	V42-L46 WeakPolarHBondContact O-CB 3.35Å; V42-L46 PolarHBondContact O-N 2.94Å; I44-L46 VanDerWaalsContact C-N 3.31Å; I44-L46 PolarHBondContact O-N 3.15Å; L46-F49 PolarHBondContact O-N 3.06Å; L46-I50 HydrophobicContact CD1-CD1 4.01Å; L46-I50 HydrophobicContact CD1-CG1 4.28Å; L46-I50 HydrophobicContact CG-CD1 3.9Å; L46-I50 WeakPolarHBondContact O-CB 3.21Å; L46-I50 WeakPolarHBondContact O-CG1 3.39Å; L46-I50 PolarHBondContact O-N 3.29Å; L46-L101 HydrophobicContact CD1-CD1 3.69Å; L46-L101 HydrophobicContact CD2-CB 4.34Å; L46-L101 HydrophobicContact CD2-CD1 4.43Å; L46-M102 HydrophobicContact CD2-SD 4.44Å; L46-F139 HydrophobicContact CB-CE2 4.16Å; L46-F139 HydrophobicContact CD2-CE2 3.72Å; L46-F139 HydrophobicContact CD2-CZ 3.57Å; L46-F139 HydrophobicContact CG-CE2 3.76Å; L46-F139 HydrophobicContact CG-CZ 4.04Å
47	S	87	Confident	84.1	Confident	26 Å²	26	49.7 Å²	49.7	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-41.7	174.7	-166.1	0	0	0	0	112.5	L43 I44 G51 S142	L43-S47 VanDerWaalsContact O-CB 3.29Å; L43-S47 WeakPolarHBondContact O-CB 3.19Å; L43-S47 PolarHBondContact O-N 3.15Å; I44-S47 WeakPolarHBondContact O-CB 3.42Å; I44-S47 PolarHBondContact O-N 3.14Å; I44-S47 VanDerWaalsContact O-N 3.13Å; S47-G51 PolarHBondContact O-N 3.47Å; S47-S142 VanDerWaalsContact OG-CB 3.27Å; S47-S142 WeakPolarHBondContact OG-CB 3.2Å; S47-S142 PolarHBondContact OG-OG 3.39Å
48	E	86.5	Confident	82.6	Confident	121 Å²	121	50.2 Å²	50.2	57%	0.565	26%	0.257	S	S	*	.	H	α-helix	trans	-65	-44.7	175.6	-72.2	174.3	-179.3	0	0	111.4	I44 K45 G51 L52	I44-E48 HydrophobicContact CG2-CG 4.48Å; I44-E48 WeakPolarHBondContact O-CG 3Å; I44-E48 PolarHBondContact O-N 3.46Å; K45-E48 PolarHBondContact O-N 3.2Å; E48-G51 PolarHBondContact O-N 3.29Å; E48-L52 WeakPolarHBondContact O-CG 3.31Å; E48-L52 PolarHBondContact O-N 2.81Å
49	F	85.7	Confident	81	Confident	89 Å²	89	54.7 Å²	54.7	39%	0.39	29%	0.285	S	S	.	.	H	α-helix	trans	-59.7	-48.1	176.5	177.2	-103.3	0	0	0	111.8	K45 L46 G51 L52 L53 L97	K45-F49 WeakPolarHBondContact O-CB 3.35Å; K45-F49 PolarHBondContact O-N 2.99Å; L46-F49 PolarHBondContact O-N 3.06Å; F49-G51 VanDerWaalsContact C-N 3.34Å; F49-G51 PolarHBondContact O-N 2.9Å; F49-L52 PolarHBondContact O-N 2.95Å; F49-L53 HydrophobicContact CE1-CD1 4.01Å; F49-L53 HydrophobicContact CE2-CD1 4.39Å; F49-L53 HydrophobicContact CZ-CD1 3.74Å; F49-L53 VanDerWaalsContact O-CB 3.23Å; F49-L53 WeakPolarHBondContact O-CB 3.23Å; F49-L53 PolarHBondContact O-N 2.97Å; F49-L97 HydrophobicContact CE1-CD2 4.17Å
50	I	84	Confident	79.1	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-38.5	178.9	-66.1	170.4	0	0	0	111.2	L46 L53 A54 L94 V98 F139 L143	L46-I50 HydrophobicContact CD1-CD1 4.01Å; L46-I50 HydrophobicContact CD1-CG1 4.28Å; L46-I50 HydrophobicContact CG-CD1 3.9Å; L46-I50 WeakPolarHBondContact O-CB 3.21Å; L46-I50 WeakPolarHBondContact O-CG1 3.39Å; L46-I50 PolarHBondContact O-N 3.29Å; I50-L53 PolarHBondContact O-N 3.41Å; I50-A54 WeakPolarHBondContact O-CB 3.46Å; I50-A54 PolarHBondContact O-N 3.29Å; I50-L94 HydrophobicContact CG1-CD1 4.4Å; I50-V98 HydrophobicContact CD1-CG2 3.6Å; I50-V98 HydrophobicContact CG1-CG2 4.47Å; I50-F139 HydrophobicContact CD1-CE2 4.18Å; I50-F139 HydrophobicContact CD1-CZ 4.24Å; I50-L143 HydrophobicContact CD1-CD1 3.72Å; I50-L143 HydrophobicContact CG2-CD1 4.07Å
51	G	81	Confident	77.2	Confident	18 Å²	18	61.5 Å²	61.5	19%	0.186	33%	0.325	C	S	.	.	H	α-helix	trans	-60.6	-48.4	174.4	0	0	0	0	0	112.4	S47 E48 F49 L53 A54 D55	S47-G51 PolarHBondContact O-N 3.47Å; E48-G51 PolarHBondContact O-N 3.29Å; F49-G51 VanDerWaalsContact C-N 3.34Å; F49-G51 PolarHBondContact O-N 2.9Å; G51-L53 VanDerWaalsContact C-N 3.3Å; G51-L53 PolarHBondContact O-N 2.89Å; G51-A54 PolarHBondContact O-N 3.33Å; G51-D55 WeakPolarHBondContact O-CB 3.31Å; G51-D55 PolarHBondContact O-N 3.44Å
52	L	82.2	Confident	75.2	Confident	121 Å²	121	66.9 Å²	66.9	63%	0.634	35%	0.35	S	S	*	.	H	α-helix	trans	-63	-37.5	176.5	-71.2	173.4	0	0	0	112.6	E48 F49 F56	E48-L52 WeakPolarHBondContact O-CG 3.31Å; E48-L52 PolarHBondContact O-N 2.81Å; F49-L52 PolarHBondContact O-N 2.95Å; L52-F56 VanDerWaalsContact O-CB 3.29Å; L52-F56 WeakPolarHBondContact O-CB 3.5Å; L52-F56 PolarHBondContact O-N 3.23Å
53	L	76.5	Confident	73.4	Confident	16 Å²	16	71.4 Å²	71.4	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-69.7	-41.8	179.9	-166.4	111.6	0	0	0	111.3	F49 I50 G51 F56 Y57 I74 F90 L94	F49-L53 HydrophobicContact CE1-CD1 4.01Å; F49-L53 HydrophobicContact CE2-CD1 4.39Å; F49-L53 HydrophobicContact CZ-CD1 3.74Å; F49-L53 VanDerWaalsContact O-CB 3.23Å; F49-L53 WeakPolarHBondContact O-CB 3.23Å; F49-L53 PolarHBondContact O-N 2.97Å; I50-L53 PolarHBondContact O-N 3.41Å; G51-L53 VanDerWaalsContact C-N 3.3Å; G51-L53 PolarHBondContact O-N 2.89Å; L53-F56 PolarHBondContact O-N 3.47Å; L53-Y57 WeakPolarHBondContact O-CB 3.42Å; L53-Y57 PolarHBondContact O-N 3.38Å; L53-I74 HydrophobicContact CD1-CD1 3.94Å; L53-F90 HydrophobicContact CD1-CE2 4.21Å; L53-F90 HydrophobicContact CD1-CZ 4.3Å; L53-F90 HydrophobicContact CD2-CE1 4.01Å; L53-F90 HydrophobicContact CD2-CE2 3.66Å; L53-F90 HydrophobicContact CD2-CZ 3.14Å; L53-F90 HydrophobicContact CG-CE2 4.01Å; L53-F90 HydrophobicContact CG-CZ 3.59Å; L53-L94 HydrophobicContact CD2-CD1 3.7Å; L53-L94 HydrophobicContact CD2-CD2 3.82Å; L53-L94 HydrophobicContact CD2-CG 4.3Å
54	A	72	Confident	71.6	Confident	11 Å²	11	75.9 Å²	75.9	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-64.1	-48.6	172.6	0	0	0	0	0	110.9	I50 G51 F56 Y57 F58	I50-A54 WeakPolarHBondContact O-CB 3.46Å; I50-A54 PolarHBondContact O-N 3.29Å; G51-A54 PolarHBondContact O-N 3.33Å; A54-F56 VanDerWaalsContact C-N 3.27Å; A54-F56 PolarHBondContact O-N 2.92Å; A54-Y57 PolarHBondContact O-N 2.87Å; A54-F58 HydrophobicContact CB-CD2 4.14Å; A54-F58 HydrophobicContact CB-CE2 4.12Å; A54-F58 WeakPolarHBondContact O-CD2 3.44Å; A54-F58 PolarHBondContact O-N 3.39Å
55	D	73.2	Confident	70	Confident	102 Å²	102	81.5 Å²	81.5	55%	0.545	43%	0.426	S	S	.	.	H	α-helix	trans	-56.3	-43.1	176.1	-75.7	-13.4	0	0	0	111.1	G51 T59	G51-D55 WeakPolarHBondContact O-CB 3.31Å; G51-D55 PolarHBondContact O-N 3.44Å; D55-T59 VanDerWaalsContact O-CB 3.22Å; D55-T59 WeakPolarHBondContact O-CB 3.3Å; D55-T59 WeakPolarHBondContact O-CG2 3.32Å; D55-T59 PolarHBondContact O-N 3.44Å; D55-T59 PolarHBondContact O-OG1 3.36Å
56	F	67.6	Low	68.4	Low	56 Å²	56	77.9 Å²	77.9	25%	0.246	42%	0.415	C	S	.	.	H	α-helix	trans	-65.9	-44.3	178.7	-173.9	-99.6	0	0	0	112.8	L52 L53 A54 K60 P66 M67 I70	L52-F56 VanDerWaalsContact O-CB 3.29Å; L52-F56 WeakPolarHBondContact O-CB 3.5Å; L52-F56 PolarHBondContact O-N 3.23Å; L53-F56 PolarHBondContact O-N 3.47Å; A54-F56 VanDerWaalsContact C-N 3.27Å; A54-F56 PolarHBondContact O-N 2.92Å; F56-K60 HydrophobicContact CD2-CD 4.5Å; F56-K60 HydrophobicContact CE2-CD 4.12Å; F56-P66 HydrophobicContact CZ-CB 4.09Å; F56-P66 HydrophobicContact CZ-CG 3.98Å; F56-M67 HydrophobicContact CD1-SD 3.8Å; F56-M67 HydrophobicContact CE1-CG 3.93Å; F56-M67 HydrophobicContact CE1-SD 3.45Å; F56-M67 WeakPolarHBondContact CE1-SD 3.45Å; F56-I70 HydrophobicContact CD1-CD1 4.11Å; F56-I70 HydrophobicContact CE1-CD1 3.55Å; F56-I70 HydrophobicContact CE2-CD1 4.49Å; F56-I70 HydrophobicContact CZ-CD1 3.78Å
57	Y	64.1	Low	66.7	Low	40 Å²	40	79.1 Å²	79.1	16%	0.157	42%	0.421	C	S	.	.	H	α-helix	trans	-67.4	-41.9	-179.4	-163.7	-89.8	0	0	0	111.6	L53 A54 M67 D87 F90	L53-Y57 WeakPolarHBondContact O-CB 3.42Å; L53-Y57 PolarHBondContact O-N 3.38Å; A54-Y57 PolarHBondContact O-N 2.87Å; Y57-M67 HydrophobicContact CD2-CE 3.25Å; Y57-M67 HydrophobicContact CD2-SD 4.28Å; Y57-M67 HydrophobicContact CE2-CE 3.32Å; Y57-M67 HydrophobicContact CG-CE 4.35Å; Y57-D87 PolarHBondContact OH-OD1 2.94Å; Y57-F90 HydrophobicContact CD1-CE1 4.44Å; Y57-F90 AromaticContact CD2-CD1 3.59Å; Y57-F90 HydrophobicContact CD2-CD1 3.59Å; Y57-F90 AromaticContact CD2-CE1 3.4Å; Y57-F90 HydrophobicContact CD2-CE1 3.4Å; Y57-F90 HydrophobicContact CD2-CE2 4.37Å; Y57-F90 HydrophobicContact CD2-CG 4.12Å; Y57-F90 AromaticContact CD2-CZ 3.75Å; Y57-F90 HydrophobicContact CD2-CZ 3.75Å; Y57-F90 HydrophobicContact CE2-CB 4.14Å; Y57-F90 AromaticContact CE2-CD1 3.48Å; Y57-F90 HydrophobicContact CE2-CD1 3.48Å; Y57-F90 VanDerWaalsContact CE2-CD1 3.48Å; Y57-F90 AromaticContact CE2-CE1 3.84Å; Y57-F90 HydrophobicContact CE2-CE1 3.84Å; Y57-F90 AromaticContact CE2-CG 3.84Å; Y57-F90 HydrophobicContact CE2-CG 3.84Å; Y57-F90 HydrophobicContact CE2-CZ 4.43Å; Y57-F90 HydrophobicContact CG-CD1 4.24Å; Y57-F90 AromaticContact CG-CE1 3.77Å; Y57-F90 HydrophobicContact CG-CE1 3.77Å; Y57-F90 HydrophobicContact CG-CZ 4.28Å
58	F	61.6	Low	65.1	Low	86 Å²	86	81.6 Å²	81.6	38%	0.377	43%	0.432	S	S	.	.	H	α-helix	trans	-87.1	-22.3	-175.7	-61.9	-60.8	0	0	0	114.8	A54 V150	A54-F58 HydrophobicContact CB-CD2 4.14Å; A54-F58 HydrophobicContact CB-CE2 4.12Å; A54-F58 WeakPolarHBondContact O-CD2 3.44Å; A54-F58 PolarHBondContact O-N 3.39Å; F58-V150 HydrophobicContact CD1-CB 4.25Å; F58-V150 HydrophobicContact CD1-CG1 3.65Å; F58-V150 HydrophobicContact CD1-CG2 3.82Å; F58-V150 HydrophobicContact CD2-CG2 3.85Å; F58-V150 HydrophobicContact CE1-CB 3.88Å; F58-V150 HydrophobicContact CE1-CG1 3.29Å; F58-V150 HydrophobicContact CE1-CG2 3.26Å; F58-V150 HydrophobicContact CE2-CG2 3.32Å; F58-V150 HydrophobicContact CG-CG2 4.13Å; F58-V150 HydrophobicContact CZ-CB 4.13Å; F58-V150 HydrophobicContact CZ-CG1 4.01Å; F58-V150 HydrophobicContact CZ-CG2 3.02Å
59	T	59.1	Low	63.8	Low	107 Å²	107	80.1 Å²	80.1	66%	0.656	43%	0.432	S	S	*	.	H	α-helix	trans	-90.9	-11.4	179.1	62.9	0	0	0	0	114.7	D55	D55-T59 VanDerWaalsContact O-CB 3.22Å; D55-T59 WeakPolarHBondContact O-CB 3.3Å; D55-T59 WeakPolarHBondContact O-CG2 3.32Å; D55-T59 PolarHBondContact O-N 3.44Å; D55-T59 PolarHBondContact O-OG1 3.36Å
60	K	52.9	Low	62.4	Low	94 Å²	94	79 Å²	79	41%	0.409	43%	0.429	S	S	.	.			trans	-127.2	24.5	-171.7	-80.6	-164.5	172	-160.1	0	116.4	F56 D62 E63	F56-K60 HydrophobicContact CD2-CD 4.5Å; F56-K60 HydrophobicContact CE2-CD 4.12Å; K60-D62 PolarHBondContact O-N 2.93Å; K60-E63 PolarHBondContact O-N 3.42Å
61	S	50.8	Low	61	Low	111 Å²	111	79.6 Å²	79.6	78%	0.776	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-13.3	173.3	164.4	0	0	0	0	115.4
62	D	49.3	Very low	59.8	Low	163 Å²	163	82.3 Å²	82.3	87%	0.872	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-4	-178.8	-94.3	-16.9	0	0	0	116.1	K60	K60-D62 PolarHBondContact O-N 2.93Å
63	E	51.5	Low	58.7	Low	137 Å²	137	82 Å²	82	64%	0.64	45%	0.445	S	S	*	.			trans	-132.1	101.2	178.3	-70.2	-170.9	164.3	0	0	112.2	K60 E65 P66	K60-E63 PolarHBondContact O-N 3.42Å; E63-E65 PolarHBondContact O-N 2.93Å; E63-P66 WeakPolarHBondContact O-CD 3.33Å
64	S	53.4	Low	57.7	Low	98 Å²	98	83.6 Å²	83.6	69%	0.685	45%	0.454	S	S	*	.			trans	-79.1	-0.6	-165.3	80.8	0	0	0	0	117.4
65	E	54.2	Low	56.8	Low	171 Å²	171	85 Å²	85	80%	0.799	46%	0.463	S	S	*	.	H	α-helix	trans	-84.9	-37.5	-170.1	-74.6	-170.2	160.4	0	0	116.9	E63 M67	E63-E65 PolarHBondContact O-N 2.93Å; E65-M67 VanDerWaalsContact C-N 3.34Å
66	P	55.9	Low	55.8	Low	52 Å²	52	82.9 Å²	82.9	34%	0.338	47%	0.465	S	S	.	.	H	α-helix	trans	-81.8	-12.6	-178.9	30.8	-33.2	0	0	0	113.8	F56 E63	F56-P66 HydrophobicContact CZ-CB 4.09Å; F56-P66 HydrophobicContact CZ-CG 3.98Å; E63-P66 WeakPolarHBondContact O-CD 3.33Å
67	M	51.9	Low	54.9	Low	39 Å²	39	87.2 Å²	87.2	19%	0.192	48%	0.484	C	S	.	.	H	α-helix	trans	-72	-42.6	-175.9	-89.4	-69.8	-79.7	0	0	112.9	F56 Y57 E65 T69 I70 L71	F56-M67 HydrophobicContact CD1-SD 3.8Å; F56-M67 HydrophobicContact CE1-CG 3.93Å; F56-M67 HydrophobicContact CE1-SD 3.45Å; F56-M67 WeakPolarHBondContact CE1-SD 3.45Å; Y57-M67 HydrophobicContact CD2-CE 3.25Å; Y57-M67 HydrophobicContact CD2-SD 4.28Å; Y57-M67 HydrophobicContact CE2-CE 3.32Å; Y57-M67 HydrophobicContact CG-CE 4.35Å; E65-M67 VanDerWaalsContact C-N 3.34Å; M67-T69 PolarHBondContact O-N 2.91Å; M67-I70 PolarHBondContact O-N 3Å; M67-L71 HydrophobicContact CE-CD1 4.22Å; M67-L71 WeakPolarHBondContact O-CG 3.5Å; M67-L71 PolarHBondContact O-N 2.81Å
68	D	53.4	Low	54	Low	77 Å²	77	91.7 Å²	91.7	41%	0.412	52%	0.515	S	S	.	.	H	α-helix	trans	-59.1	-36.3	178.7	-72.5	-21.6	0	0	0	111.5	D72	D68-D72 VanDerWaalsContact O-CB 3.22Å; D68-D72 WeakPolarHBondContact O-CB 3.22Å; D68-D72 VanDerWaalsContact O-CG 3.24Å; D68-D72 PolarHBondContact O-N 3.35Å
69	T	59.1	Low	53	Low	91 Å²	91	96 Å²	96	56%	0.558	54%	0.537	S	S	*	.	H	α-helix	trans	-68.7	-37.9	179.8	-45.7	0	0	0	0	112.5	M67 V73	M67-T69 PolarHBondContact O-N 2.91Å; T69-V73 WeakPolarHBondContact O-CB 3.48Å; T69-V73 WeakPolarHBondContact O-CG2 3.28Å; T69-V73 PolarHBondContact O-N 2.99Å; T69-V73 VanDerWaalsContact O-N 3.11Å
70	I	56.2	Low	52.1	Low	64 Å²	64	98.3 Å²	98.3	33%	0.328	55%	0.545	S	S	.	.	H	α-helix	trans	-75.8	-39.2	179.5	-66.6	169	0	0	0	110	F56 M67 V73 I74	F56-I70 HydrophobicContact CD1-CD1 4.11Å; F56-I70 HydrophobicContact CE1-CD1 3.55Å; F56-I70 HydrophobicContact CE2-CD1 4.49Å; F56-I70 HydrophobicContact CZ-CD1 3.78Å; M67-I70 PolarHBondContact O-N 3Å; I70-V73 PolarHBondContact O-N 3.33Å; I70-I74 HydrophobicContact CG2-CD1 3.72Å; I70-I74 HydrophobicContact CG2-CG1 4.36Å; I70-I74 WeakPolarHBondContact O-CB 3.34Å; I70-I74 VanDerWaalsContact O-CG1 3.27Å; I70-I74 WeakPolarHBondContact O-CG1 3.42Å; I70-I74 PolarHBondContact O-N 3.1Å
71	L	54.5	Low	51.5	Low	17 Å²	17	99.1 Å²	99.1	9%	0.089	56%	0.562	C	S	.	*	H	α-helix	trans	-65.7	-38.2	174.7	-72.5	170.5	0	0	0	112.4	M67 V73 I74 S75 V85 F90	M67-L71 HydrophobicContact CE-CD1 4.22Å; M67-L71 WeakPolarHBondContact O-CG 3.5Å; M67-L71 PolarHBondContact O-N 2.81Å; L71-V73 VanDerWaalsContact C-N 3.34Å; L71-I74 PolarHBondContact O-N 2.94Å; L71-S75 WeakPolarHBondContact O-CB 3.38Å; L71-S75 PolarHBondContact O-N 2.95Å; L71-S75 PolarHBondContact O-OG 2.92Å; L71-V85 HydrophobicContact CD1-CG1 4.03Å; L71-F90 HydrophobicContact CD2-CB 3.82Å; L71-F90 HydrophobicContact CD2-CD2 3.43Å; L71-F90 VanDerWaalsContact CD2-CD2 3.43Å; L71-F90 HydrophobicContact CD2-CE2 4.34Å; L71-F90 HydrophobicContact CD2-CG 4.04Å
72	D	56.6	Low	50.8	Low	75 Å²	75	99.4 Å²	99.4	40%	0.401	57%	0.572	S	S	.	*	H	α-helix	trans	-64.9	-38.6	172.9	-81.4	-14.8	0	0	0	111.7	D68 G76 K77	D68-D72 VanDerWaalsContact O-CB 3.22Å; D68-D72 WeakPolarHBondContact O-CB 3.22Å; D68-D72 VanDerWaalsContact O-CG 3.24Å; D68-D72 PolarHBondContact O-N 3.35Å; D72-G76 PolarHBondContact O-N 2.97Å; D72-K77 PolarHBondContact O-N 3.09Å; D72-K77 VanDerWaalsContact O-N 3.09Å
73	V	58.3	Low	50.4	Low	114 Å²	114	96 Å²	96	69%	0.691	56%	0.561	S	S	*	*	H	α-helix	trans	-68.2	-41.8	175.6	169.8	0	0	0	0	111.8	T69 I70 L71	T69-V73 WeakPolarHBondContact O-CB 3.48Å; T69-V73 WeakPolarHBondContact O-CG2 3.28Å; T69-V73 PolarHBondContact O-N 2.99Å; T69-V73 VanDerWaalsContact O-N 3.11Å; I70-V73 PolarHBondContact O-N 3.33Å; L71-V73 VanDerWaalsContact C-N 3.34Å
74	I	56.2	Low	50	Low	51 Å²	51	98.7 Å²	98.7	26%	0.262	57%	0.573	S	S	.	*	H	α-helix	trans	-72.1	-37.9	178.4	-67.5	169	0	0	0	111.1	L53 I70 L71 G76 F90 N93	L53-I74 HydrophobicContact CD1-CD1 3.94Å; I70-I74 HydrophobicContact CG2-CD1 3.72Å; I70-I74 HydrophobicContact CG2-CG1 4.36Å; I70-I74 WeakPolarHBondContact O-CB 3.34Å; I70-I74 VanDerWaalsContact O-CG1 3.27Å; I70-I74 WeakPolarHBondContact O-CG1 3.42Å; I70-I74 PolarHBondContact O-N 3.1Å; L71-I74 PolarHBondContact O-N 2.94Å; I74-G76 VanDerWaalsContact C-N 3.31Å; I74-F90 HydrophobicContact CD1-CE2 4.28Å; I74-N93 HydrophobicContact CG2-CB 4.01Å
75	S	52.9	Low	49.6	Very low	40 Å²	40	98.2 Å²	98.2	28%	0.28	57%	0.566	S	S	.	*	H	α-helix	trans	-83.6	-4.7	-179.9	69.9	0	0	0	0	114	L71 K77	L71-S75 WeakPolarHBondContact O-CB 3.38Å; L71-S75 PolarHBondContact O-N 2.95Å; L71-S75 PolarHBondContact O-OG 2.92Å; S75-K77 PolarHBondContact O-N 3.02Å
76	G	52.5	Low	49.2	Very low	58 Å²	58	96.1 Å²	96.1	60%	0.598	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.8	16	-177.8	0	0	0	0	0	114	D72 I74 T78	D72-G76 PolarHBondContact O-N 2.97Å; I74-G76 VanDerWaalsContact C-N 3.31Å; G76-T78 PolarHBondContact O-N 2.93Å
77	K	48.8	Very low	48.9	Very low	147 Å²	147	99.4 Å²	99.4	64%	0.639	58%	0.575	S	S	*	*			trans	-84.5	102.4	-179.4	-73.4	179.1	-179	170.7	0	109.2	D72 S75	D72-K77 PolarHBondContact O-N 3.09Å; D72-K77 VanDerWaalsContact O-N 3.09Å; S75-K77 PolarHBondContact O-N 3.02Å
78	T	44.6	Very low	49.1	Very low	134 Å²	134	99 Å²	99	82%	0.822	58%	0.581	S	S	*	*			trans	-82.5	118.8	170	42.8	0	0	0	0	109	G76	G76-T78 PolarHBondContact O-N 2.93Å
79	E	41	Very low	49.7	Very low	176 Å²	176	97.2 Å²	97.2	82%	0.822	57%	0.574	S	S	*	*	S	Bend	trans	25.7	101.1	159.6	-62.1	-179.9	177.5	0	0	116.5
80	N	39.4	Very low	50	Low	156 Å²	156	93.6 Å²	93.6	83%	0.834	55%	0.551	S	S	*	*			trans	135.4	73.8	153.2	-70.7	-44.8	0	0	0	112.5
81	S	41.6	Very low	50.7	Low	110 Å²	110	93.2 Å²	93.2	77%	0.769	55%	0.548	S	S	*	.			trans	-171.9	89.8	149.7	-76.5	0	0	0	0	108.7	S83	S81-S83 VanDerWaalsContact C-N 3.32Å; S81-S83 PolarHBondContact O-N 3.21Å
82	A	34.8	Very low	51.6	Low	118 Å²	118	97.9 Å²	97.9	98%	0.975	57%	0.569	S	S	*	*			trans	-70.5	91.7	166.8	0	0	0	0	0	108.5
83	S	42	Very low	52.6	Low	92 Å²	92	97 Å²	97	64%	0.643	56%	0.564	S	S	*	*			trans	-137.1	116.7	165.8	59.2	0	0	0	0	107.4	S81 V85	S81-S83 VanDerWaalsContact C-N 3.32Å; S81-S83 PolarHBondContact O-N 3.21Å; S83-V85 PolarHBondContact O-N 2.95Å
84	E	42.4	Very low	53.7	Low	193 Å²	193	92.3 Å²	92.3	90%	0.902	54%	0.536	S	S	*	.			trans	2.9	103.7	168.4	-65.8	174.6	168.8	0	0	114.2	D86	E84-D86 PolarHBondContact O-N 3.15Å
85	V	45.2	Very low	55	Low	88 Å²	88	89.9 Å²	89.9	53%	0.533	52%	0.523	S	S	.	.			trans	-64.7	101.9	172.2	177.5	0	0	0	0	107.3	L71 S83 D87	L71-V85 HydrophobicContact CD1-CG1 4.03Å; S83-V85 PolarHBondContact O-N 2.95Å; V85-D87 PolarHBondContact O-N 3.22Å
86	D	45.7	Very low	56.5	Low	126 Å²	126	91 Å²	91	67%	0.674	53%	0.531	S	S	*	.			trans	-63.3	118.4	170.5	-169.5	25.1	0	0	0	108.3	E84 G88 S89	E84-D86 PolarHBondContact O-N 3.15Å; D86-G88 PolarHBondContact O-N 3.46Å; D86-S89 WeakPolarHBondContact O-CB 3.39Å; D86-S89 PolarHBondContact O-N 3.31Å; D86-S89 PolarHBondContact O-OG 3.48Å
87	D	50.6	Low	58.2	Low	121 Å²	121	90.9 Å²	90.9	65%	0.647	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.9	-172.8	-147.7	8.7	0	0	0	111.8	Y57 V85 S89	Y57-D87 PolarHBondContact OH-OD1 2.94Å; V85-D87 PolarHBondContact O-N 3.22Å; D87-S89 VanDerWaalsContact C-N 3.31Å; D87-S89 PolarHBondContact O-N 3.14Å
88	G	56.1	Low	60.1	Low	31 Å²	31	83.9 Å²	83.9	32%	0.32	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-8.9	174.1	0	0	0	0	0	116	D86	D86-G88 PolarHBondContact O-N 3.46Å
89	S	64.6	Low	62.3	Low	39 Å²	39	81.7 Å²	81.7	27%	0.273	47%	0.466	S	S	.	.	H	α-helix	trans	-74.5	-29.7	-175.8	69	0	0	0	0	114.2	D86 D87 N93	D86-S89 WeakPolarHBondContact O-CB 3.39Å; D86-S89 PolarHBondContact O-N 3.31Å; D86-S89 PolarHBondContact O-OG 3.48Å; D87-S89 VanDerWaalsContact C-N 3.31Å; D87-S89 PolarHBondContact O-N 3.14Å; S89-N93 WeakPolarHBondContact O-CB 3.48Å; S89-N93 PolarHBondContact O-N 3.36Å; S89-N93 VanDerWaalsContact O-N 3.14Å; S89-N93 PolarHBondContact O-ND2 2.94Å
90	F	67	Low	64.7	Low	15 Å²	15	79.9 Å²	79.9	7%	0.066	46%	0.458	C	S	.	.	H	α-helix	trans	-70.3	-45.6	-175.3	175.6	-113.1	0	0	0	112.5	L53 Y57 L71 I74 N93 L94	L53-F90 HydrophobicContact CD1-CE2 4.21Å; L53-F90 HydrophobicContact CD1-CZ 4.3Å; L53-F90 HydrophobicContact CD2-CE1 4.01Å; L53-F90 HydrophobicContact CD2-CE2 3.66Å; L53-F90 HydrophobicContact CD2-CZ 3.14Å; L53-F90 HydrophobicContact CG-CE2 4.01Å; L53-F90 HydrophobicContact CG-CZ 3.59Å; Y57-F90 HydrophobicContact CD1-CE1 4.44Å; Y57-F90 AromaticContact CD2-CD1 3.59Å; Y57-F90 HydrophobicContact CD2-CD1 3.59Å; Y57-F90 AromaticContact CD2-CE1 3.4Å; Y57-F90 HydrophobicContact CD2-CE1 3.4Å; Y57-F90 HydrophobicContact CD2-CE2 4.37Å; Y57-F90 HydrophobicContact CD2-CG 4.12Å; Y57-F90 AromaticContact CD2-CZ 3.75Å; Y57-F90 HydrophobicContact CD2-CZ 3.75Å; Y57-F90 HydrophobicContact CE2-CB 4.14Å; Y57-F90 AromaticContact CE2-CD1 3.48Å; Y57-F90 HydrophobicContact CE2-CD1 3.48Å; Y57-F90 VanDerWaalsContact CE2-CD1 3.48Å; Y57-F90 AromaticContact CE2-CE1 3.84Å; Y57-F90 HydrophobicContact CE2-CE1 3.84Å; Y57-F90 AromaticContact CE2-CG 3.84Å; Y57-F90 HydrophobicContact CE2-CG 3.84Å; Y57-F90 HydrophobicContact CE2-CZ 4.43Å; Y57-F90 HydrophobicContact CG-CD1 4.24Å; Y57-F90 AromaticContact CG-CE1 3.77Å; Y57-F90 HydrophobicContact CG-CE1 3.77Å; Y57-F90 HydrophobicContact CG-CZ 4.28Å; L71-F90 HydrophobicContact CD2-CB 3.82Å; L71-F90 HydrophobicContact CD2-CD2 3.43Å; L71-F90 VanDerWaalsContact CD2-CD2 3.43Å; L71-F90 HydrophobicContact CD2-CE2 4.34Å; L71-F90 HydrophobicContact CD2-CG 4.04Å; I74-F90 HydrophobicContact CD1-CE2 4.28Å; F90-N93 PolarHBondContact O-N 2.95Å; F90-L94 WeakPolarHBondContact O-CB 3.39Å; F90-L94 PolarHBondContact O-N 3.34Å
91	E	69.9	Low	67.1	Low	56 Å²	56	75.8 Å²	75.8	26%	0.262	44%	0.435	S	S	.	.	H	α-helix	trans	-70.5	-38.1	-175.5	-62.1	165.2	158	0	0	111.3	L94 S95 I167	E91-L94 PolarHBondContact O-N 2.98Å; E91-S95 VanDerWaalsContact O-CB 3.31Å; E91-S95 WeakPolarHBondContact O-CB 3.45Å; E91-S95 PolarHBondContact O-N 3.34Å; E91-S95 PolarHBondContact O-OG 3.01Å; E91-I167 HydrophobicContact CG-CD1 4.47Å; E91-I167 WeakPolarHBondContact OE1-CD1 3.31Å; E91-I167 WeakPolarHBondContact OE2-CD1 3.5Å; E91-I167 WeakPolarHBondContact OE2-CG1 3.49Å
92	E	72.7	Confident	69.6	Low	116 Å²	116	70.6 Å²	70.6	54%	0.542	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-46.6	172	-68.1	-162.5	150.6	0	0	111.2	S95 S96 R170	E92-S95 PolarHBondContact O-N 2.99Å; E92-S95 PolarHBondContact O-OG 3.38Å; E92-S96 WeakPolarHBondContact O-CB 3.17Å; E92-S96 PolarHBondContact O-N 3.47Å; E92-R170 IonicContact OE1-NH1 2.74Å
93	N	77.4	Confident	72.4	Confident	55 Å²	55	70.9 Å²	70.9	29%	0.294	38%	0.38	S	S	.	.	H	α-helix	trans	-63.6	-42.3	177.1	-72	-26.6	0	0	0	112.1	I74 S89 F90 S96 L97	I74-N93 HydrophobicContact CG2-CB 4.01Å; S89-N93 WeakPolarHBondContact O-CB 3.48Å; S89-N93 PolarHBondContact O-N 3.36Å; S89-N93 VanDerWaalsContact O-N 3.14Å; S89-N93 PolarHBondContact O-ND2 2.94Å; F90-N93 PolarHBondContact O-N 2.95Å; N93-S96 PolarHBondContact O-N 3.41Å; N93-L97 WeakPolarHBondContact O-CB 3.44Å; N93-L97 PolarHBondContact O-N 2.91Å
94	L	82.2	Confident	74.8	Confident	17 Å²	17	71.3 Å²	71.3	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-63.8	-46.3	177.3	-179.4	60.4	0	0	0	111.2	I50 L53 F90 E91 S96 L97 V98 F171	I50-L94 HydrophobicContact CG1-CD1 4.4Å; L53-L94 HydrophobicContact CD2-CD1 3.7Å; L53-L94 HydrophobicContact CD2-CD2 3.82Å; L53-L94 HydrophobicContact CD2-CG 4.3Å; F90-L94 WeakPolarHBondContact O-CB 3.39Å; F90-L94 PolarHBondContact O-N 3.34Å; E91-L94 PolarHBondContact O-N 2.98Å; L94-S96 VanDerWaalsContact C-N 3.32Å; L94-S96 PolarHBondContact O-N 3.38Å; L94-L97 PolarHBondContact O-N 3.3Å; L94-V98 HydrophobicContact CD1-CG2 4.22Å; L94-V98 WeakPolarHBondContact O-CB 3.48Å; L94-V98 VanDerWaalsContact O-CG2 3.28Å; L94-V98 WeakPolarHBondContact O-CG2 3.49Å; L94-V98 PolarHBondContact O-N 3.22Å; L94-F171 HydrophobicContact CD2-CZ 4.15Å; L94-F171 HydrophobicContact CG-CZ 4.18Å
95	S	83.4	Confident	77.3	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-40.5	178	72.7	0	0	0	0	111.9	E91 E92 V98 E99 R170	E91-S95 VanDerWaalsContact O-CB 3.31Å; E91-S95 WeakPolarHBondContact O-CB 3.45Å; E91-S95 PolarHBondContact O-N 3.34Å; E91-S95 PolarHBondContact O-OG 3.01Å; E92-S95 PolarHBondContact O-N 2.99Å; E92-S95 PolarHBondContact O-OG 3.38Å; S95-V98 PolarHBondContact O-N 2.94Å; S95-E99 WeakPolarHBondContact O-CB 3.26Å; S95-E99 PolarHBondContact O-N 2.9Å; S95-R170 PolarHBondContact OG-NE 2.91Å; S95-R170 PolarHBondContact OG-NH2 2.92Å
96	S	85.6	Confident	79.7	Confident	63 Å²	63	58.5 Å²	58.5	44%	0.441	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-43.9	176.4	-171.5	0	0	0	0	111.8	E92 N93 L94 E99 E100	E92-S96 WeakPolarHBondContact O-CB 3.17Å; E92-S96 PolarHBondContact O-N 3.47Å; N93-S96 PolarHBondContact O-N 3.41Å; L94-S96 VanDerWaalsContact C-N 3.32Å; L94-S96 PolarHBondContact O-N 3.38Å; S96-E99 PolarHBondContact O-N 3.01Å; S96-E100 WeakPolarHBondContact O-CB 3.31Å; S96-E100 PolarHBondContact O-N 3.01Å
97	L	86.8	Confident	81.9	Confident	55 Å²	55	55.2 Å²	55.2	29%	0.288	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-44.5	177.6	179	66.6	0	0	0	111.5	F49 N93 L94 E99 E100 L101	F49-L97 HydrophobicContact CE1-CD2 4.17Å; N93-L97 WeakPolarHBondContact O-CB 3.44Å; N93-L97 PolarHBondContact O-N 2.91Å; L94-L97 PolarHBondContact O-N 3.3Å; L97-E99 VanDerWaalsContact C-N 3.35Å; L97-E100 PolarHBondContact O-N 2.89Å; L97-L101 HydrophobicContact CD1-CD1 3.99Å; L97-L101 HydrophobicContact CD1-CG 4.25Å; L97-L101 HydrophobicContact CG-CD1 4.01Å; L97-L101 WeakPolarHBondContact O-CB 3.36Å; L97-L101 WeakPolarHBondContact O-CG 3.23Å; L97-L101 PolarHBondContact O-N 3.36Å
98	V	89.4	Confident	83.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-42	177.4	172.8	0	0	0	0	110.8	I50 L94 S95 M102 F139 L143 F178	I50-V98 HydrophobicContact CD1-CG2 3.6Å; I50-V98 HydrophobicContact CG1-CG2 4.47Å; L94-V98 HydrophobicContact CD1-CG2 4.22Å; L94-V98 WeakPolarHBondContact O-CB 3.48Å; L94-V98 VanDerWaalsContact O-CG2 3.28Å; L94-V98 WeakPolarHBondContact O-CG2 3.49Å; L94-V98 PolarHBondContact O-N 3.22Å; S95-V98 PolarHBondContact O-N 2.94Å; V98-M102 HydrophobicContact CG1-CG 4.26Å; V98-M102 VanDerWaalsContact O-CB 3.23Å; V98-M102 WeakPolarHBondContact O-CB 3.32Å; V98-M102 WeakPolarHBondContact O-CG 3.45Å; V98-M102 PolarHBondContact O-N 3.49Å; V98-F139 HydrophobicContact CG1-CE1 4.36Å; V98-F139 HydrophobicContact CG1-CZ 4.09Å; V98-L143 HydrophobicContact CG1-CD2 4.05Å; V98-F178 HydrophobicContact CG1-CE2 3.88Å; V98-F178 HydrophobicContact CG1-CZ 3.97Å
99	E	90.5	Very high	85.7	Confident	89 Å²	89	52 Å²	52	42%	0.416	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-46.6	176.8	-171	174.6	178.2	0	0	112	S95 S96 L97 M102 H103 L174	S95-E99 WeakPolarHBondContact O-CB 3.26Å; S95-E99 PolarHBondContact O-N 2.9Å; S96-E99 PolarHBondContact O-N 3.01Å; L97-E99 VanDerWaalsContact C-N 3.35Å; E99-M102 PolarHBondContact O-N 3.4Å; E99-H103 VanDerWaalsContact O-CB 3.32Å; E99-H103 WeakPolarHBondContact O-CB 3.37Å; E99-H103 PolarHBondContact O-N 2.87Å; E99-L174 HydrophobicContact CB-CD2 4.06Å; E99-L174 HydrophobicContact CG-CD2 4.01Å
100	E	90.5	Very high	87.1	Confident	137 Å²	137	53.4 Å²	53.4	64%	0.64	26%	0.262	S	S	*	.	H	α-helix	trans	-63.7	-47.7	179.1	-174.2	177.3	-177.1	0	0	112.2	S96 L97 M102 H103 E104	S96-E100 WeakPolarHBondContact O-CB 3.31Å; S96-E100 PolarHBondContact O-N 3.01Å; L97-E100 PolarHBondContact O-N 2.89Å; E100-M102 PolarHBondContact O-N 2.72Å; E100-H103 WeakPolarHBondContact O-CB 3.41Å; E100-H103 PolarHBondContact O-N 3.08Å; E100-E104 PolarHBondContact O-N 2.82Å
101	L	91.1	Very high	88.2	Confident	71 Å²	71	56.9 Å²	56.9	37%	0.372	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-40	179	-71.7	174.3	0	0	0	112.2	L46 L97 H103 F105	L46-L101 HydrophobicContact CD1-CD1 3.69Å; L46-L101 HydrophobicContact CD2-CB 4.34Å; L46-L101 HydrophobicContact CD2-CD1 4.43Å; L97-L101 HydrophobicContact CD1-CD1 3.99Å; L97-L101 HydrophobicContact CD1-CG 4.25Å; L97-L101 HydrophobicContact CG-CD1 4.01Å; L97-L101 WeakPolarHBondContact O-CB 3.36Å; L97-L101 WeakPolarHBondContact O-CG 3.23Å; L97-L101 PolarHBondContact O-N 3.36Å; L101-H103 VanDerWaalsContact C-N 3.34Å; L101-F105 WeakPolarHBondContact O-CB 3.46Å; L101-F105 PolarHBondContact O-N 3.27Å
102	M	93.6	Very high	89.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-34.9	176.1	-72.1	-64.4	-59.6	0	0	111.7	L43 L46 V98 E99 E100 F105 F106 F139 F178	L43-M102 HydrophobicContact CD2-CE 3.97Å; L43-M102 HydrophobicContact CD2-SD 3.47Å; L43-M102 WeakPolarHBondContact CD2-SD 3.47Å; L46-M102 HydrophobicContact CD2-SD 4.44Å; V98-M102 HydrophobicContact CG1-CG 4.26Å; V98-M102 VanDerWaalsContact O-CB 3.23Å; V98-M102 WeakPolarHBondContact O-CB 3.32Å; V98-M102 WeakPolarHBondContact O-CG 3.45Å; V98-M102 PolarHBondContact O-N 3.49Å; E99-M102 PolarHBondContact O-N 3.4Å; E100-M102 PolarHBondContact O-N 2.72Å; M102-F105 HydrophobicContact CE-CD1 4.27Å; M102-F105 WeakPolarHBondContact O-CB 3.14Å; M102-F105 PolarHBondContact O-N 3.3Å; M102-F106 HydrophobicContact CB-CE2 4.35Å; M102-F106 HydrophobicContact CE-CD2 4.43Å; M102-F106 HydrophobicContact CE-CE2 3.51Å; M102-F106 HydrophobicContact CE-CZ 3.63Å; M102-F106 WeakPolarHBondContact O-CD2 3.27Å; M102-F106 PolarHBondContact O-N 3.35Å; M102-F139 HydrophobicContact CE-CD1 4.18Å; M102-F139 HydrophobicContact CE-CE1 4.23Å; M102-F139 HydrophobicContact CG-CE1 4.02Å; M102-F139 HydrophobicContact CG-CZ 4.49Å; M102-F139 HydrophobicContact SD-CD1 3.94Å; M102-F139 HydrophobicContact SD-CE1 3.58Å; M102-F139 VanDerWaalsContact SD-CE1 3.58Å; M102-F139 HydrophobicContact SD-CZ 4.16Å; M102-F178 HydrophobicContact CB-CD1 3.87Å; M102-F178 HydrophobicContact CB-CE1 3.46Å; M102-F178 VanDerWaalsContact CB-CE1 3.46Å; M102-F178 HydrophobicContact CB-CE2 4.32Å; M102-F178 HydrophobicContact CB-CG 4.47Å; M102-F178 HydrophobicContact CB-CZ 3.71Å; M102-F178 HydrophobicContact CE-CB 4.05Å; M102-F178 HydrophobicContact CE-CD1 4.22Å; M102-F178 HydrophobicContact CE-CD2 4.06Å; M102-F178 HydrophobicContact CE-CG 3.85Å; M102-F178 HydrophobicContact CG-CD1 4.26Å; M102-F178 HydrophobicContact CG-CD2 4.17Å; M102-F178 HydrophobicContact CG-CE1 3.89Å; M102-F178 HydrophobicContact CG-CE2 3.8Å; M102-F178 HydrophobicContact CG-CG 4.41Å; M102-F178 HydrophobicContact CG-CZ 3.64Å
103	H	93.2	Very high	90	Very high	124 Å²	124	52.3 Å²	52.3	57%	0.574	26%	0.26	S	S	*	.	H	α-helix	trans	-60.1	-50.5	173.9	-174.3	71.9	0	0	0	111.4	E99 E100 L101 F105 F106 I107	E99-H103 VanDerWaalsContact O-CB 3.32Å; E99-H103 WeakPolarHBondContact O-CB 3.37Å; E99-H103 PolarHBondContact O-N 2.87Å; E100-H103 WeakPolarHBondContact O-CB 3.41Å; E100-H103 PolarHBondContact O-N 3.08Å; L101-H103 VanDerWaalsContact C-N 3.34Å; H103-F105 VanDerWaalsContact C-N 3.34Å; H103-F105 PolarHBondContact O-N 3.44Å; H103-F106 PolarHBondContact O-N 3.46Å; H103-I107 WeakPolarHBondContact NE2-CD1 3.48Å; H103-I107 WeakPolarHBondContact O-CG1 2.99Å; H103-I107 PolarHBondContact O-N 3.48Å
104	E	92.8	Very high	90.5	Very high	102 Å²	102	52.9 Å²	52.9	48%	0.477	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-39.3	178.5	-168.3	62	-166.5	0	0	111.8	E100 F106 I107 L108	E100-E104 PolarHBondContact O-N 2.82Å; E104-F106 PolarHBondContact O-N 2.92Å; E104-I107 PolarHBondContact O-N 2.94Å; E104-L108 WeakPolarHBondContact O-CG 3.29Å; E104-L108 PolarHBondContact O-N 3.01Å
105	F	94.4	Very high	90.6	Very high	2 Å²	2	56 Å²	56	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-54.9	-49.5	171.8	170.8	-96.3	0	0	0	111.9	I38 T39 V42 L43 L101 M102 H103 I107 L108 V109 I132 V136	I38-F105 HydrophobicContact CD1-CD2 4.27Å; I38-F105 HydrophobicContact CD1-CE2 4.36Å; I38-F105 HydrophobicContact CG1-CD2 3.98Å; I38-F105 HydrophobicContact CG1-CE2 3.9Å; I38-F105 HydrophobicContact CG2-CE2 4.13Å; T39-F105 HydrophobicContact CG2-CE2 4.33Å; T39-F105 HydrophobicContact CG2-CZ 4.13Å; V42-F105 HydrophobicContact CB-CD2 3.97Å; V42-F105 HydrophobicContact CG1-CB 4.23Å; V42-F105 HydrophobicContact CG1-CD2 4.01Å; V42-F105 HydrophobicContact CG1-CG 4.46Å; V42-F105 HydrophobicContact CG2-CD2 4.33Å; L43-F105 HydrophobicContact CD1-CE1 4.19Å; L43-F105 HydrophobicContact CD1-CE2 4.1Å; L43-F105 HydrophobicContact CD1-CZ 3.68Å; L43-F105 HydrophobicContact CD2-CD1 4.27Å; L43-F105 HydrophobicContact CD2-CD2 4.26Å; L43-F105 HydrophobicContact CD2-CE1 4.21Å; L43-F105 HydrophobicContact CD2-CE2 4.18Å; L43-F105 HydrophobicContact CD2-CG 4.31Å; L43-F105 HydrophobicContact CD2-CZ 4.17Å; L43-F105 HydrophobicContact CG-CD2 4.36Å; L43-F105 HydrophobicContact CG-CE1 4.45Å; L43-F105 HydrophobicContact CG-CE2 3.87Å; L43-F105 HydrophobicContact CG-CZ 3.94Å; L101-F105 WeakPolarHBondContact O-CB 3.46Å; L101-F105 PolarHBondContact O-N 3.27Å; M102-F105 HydrophobicContact CE-CD1 4.27Å; M102-F105 WeakPolarHBondContact O-CB 3.14Å; M102-F105 PolarHBondContact O-N 3.3Å; H103-F105 VanDerWaalsContact C-N 3.34Å; H103-F105 PolarHBondContact O-N 3.44Å; F105-I107 PolarHBondContact O-N 2.89Å; F105-L108 PolarHBondContact O-N 3.21Å; F105-V109 HydrophobicContact CD1-CG2 4.4Å; F105-V109 HydrophobicContact CD2-CG2 4.43Å; F105-V109 HydrophobicContact CE1-CG2 3.98Å; F105-V109 HydrophobicContact CE2-CG2 4.02Å; F105-V109 HydrophobicContact CZ-CG2 3.76Å; F105-V109 WeakPolarHBondContact O-CG2 3.36Å; F105-V109 PolarHBondContact O-N 2.92Å; F105-I132 HydrophobicContact CE1-CG2 4.48Å; F105-I132 HydrophobicContact CZ-CG2 4.31Å; F105-V136 HydrophobicContact CE1-CG2 3.92Å; F105-V136 HydrophobicContact CZ-CG2 4.41Å
106	F	95.4	Very high	90.5	Very high	10 Å²	10	57.1 Å²	57.1	4%	0.044	29%	0.289	C	S	.	.	H	α-helix	trans	-68.2	-32.7	-179.6	-73.9	-56.3	0	0	0	112.9	M102 H103 E104 R110 V136 F178 A182 I185	M102-F106 HydrophobicContact CB-CE2 4.35Å; M102-F106 HydrophobicContact CE-CD2 4.43Å; M102-F106 HydrophobicContact CE-CE2 3.51Å; M102-F106 HydrophobicContact CE-CZ 3.63Å; M102-F106 WeakPolarHBondContact O-CD2 3.27Å; M102-F106 PolarHBondContact O-N 3.35Å; H103-F106 PolarHBondContact O-N 3.46Å; E104-F106 PolarHBondContact O-N 2.92Å; F106-R110 VanDerWaalsContact O-CB 3.24Å; F106-R110 WeakPolarHBondContact O-CB 3.47Å; F106-R110 PolarHBondContact O-N 3.28Å; F106-V136 HydrophobicContact CE1-CG2 4.15Å; F106-V136 HydrophobicContact CZ-CG1 4.22Å; F106-V136 HydrophobicContact CZ-CG2 4.25Å; F106-F178 HydrophobicContact CE2-CB 3.96Å; F106-F178 AromaticContact CE2-CD1 3.87Å; F106-F178 HydrophobicContact CE2-CD1 3.87Å; F106-F178 HydrophobicContact CE2-CG 4.21Å; F106-F178 HydrophobicContact CZ-CB 3.99Å; F106-F178 VanDerWaalsContact CZ-O 3.26Å; F106-F178 WeakPolarHBondContact CZ-O 3.14Å; F106-A182 HydrophobicContact CE1-CB 4.07Å; F106-I185 HydrophobicContact CB-CD1 4.21Å; F106-I185 HydrophobicContact CD1-CD1 3.63Å; F106-I185 HydrophobicContact CG-CD1 4.35Å
107	I	93.3	Very high	90.1	Very high	57 Å²	57	54.1 Å²	54.1	29%	0.292	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-52.1	172.3	-72.2	171.9	0	0	0	110.2	H103 E104 F105 V109 R110 T111	H103-I107 WeakPolarHBondContact NE2-CD1 3.48Å; H103-I107 WeakPolarHBondContact O-CG1 2.99Å; H103-I107 PolarHBondContact O-N 3.48Å; E104-I107 PolarHBondContact O-N 2.94Å; F105-I107 PolarHBondContact O-N 2.89Å; I107-V109 VanDerWaalsContact C-N 3.33Å; I107-V109 PolarHBondContact O-N 3.48Å; I107-R110 PolarHBondContact O-N 2.99Å; I107-T111 PolarHBondContact O-N 2.94Å; I107-T111 PolarHBondContact O-OG1 3.13Å
108	L	92.5	Very high	89.4	Confident	84 Å²	84	53.7 Å²	53.7	44%	0.44	27%	0.268	S	S	.	.	H	α-helix	trans	-60.3	-43.4	-179.4	-70	173.3	0	0	0	112	I38 E104 F105 R112	I38-L108 HydrophobicContact CD1-CB 3.69Å; I38-L108 HydrophobicContact CD1-CD1 4.35Å; E104-L108 WeakPolarHBondContact O-CG 3.29Å; E104-L108 PolarHBondContact O-N 3.01Å; F105-L108 PolarHBondContact O-N 3.21Å; L108-R112 PolarHBondContact O-N 3.46Å; L108-R112 VanDerWaalsContact O-N 3.17Å
109	V	93.8	Very high	88.4	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-50.2	174.7	171.2	0	0	0	0	110.6	I38 F105 I107 T111 R112 F113 I132 I185	I38-V109 HydrophobicContact CD1-CG2 3.94Å; I38-V109 HydrophobicContact CG2-CG2 4.3Å; F105-V109 HydrophobicContact CD1-CG2 4.4Å; F105-V109 HydrophobicContact CD2-CG2 4.43Å; F105-V109 HydrophobicContact CE1-CG2 3.98Å; F105-V109 HydrophobicContact CE2-CG2 4.02Å; F105-V109 HydrophobicContact CZ-CG2 3.76Å; F105-V109 WeakPolarHBondContact O-CG2 3.36Å; F105-V109 PolarHBondContact O-N 2.92Å; I107-V109 VanDerWaalsContact C-N 3.33Å; I107-V109 PolarHBondContact O-N 3.48Å; V109-T111 PolarHBondContact O-N 2.96Å; V109-R112 PolarHBondContact O-N 3.06Å; V109-F113 HydrophobicContact CG1-CD2 3.86Å; V109-F113 HydrophobicContact CG1-CE2 4.09Å; V109-F113 VanDerWaalsContact O-CD2 3.29Å; V109-F113 WeakPolarHBondContact O-CD2 3.46Å; V109-F113 PolarHBondContact O-N 3.24Å; V109-I132 HydrophobicContact CG1-CD1 3.7Å; V109-I132 HydrophobicContact CG1-CG2 4.38Å; V109-I132 HydrophobicContact CG2-CD1 4.17Å; V109-I185 HydrophobicContact CB-CD1 4.31Å; V109-I185 HydrophobicContact CG1-CD1 3.96Å; V109-I185 HydrophobicContact CG1-CG2 4.12Å
110	R	93.8	Very high	87.5	Confident	67 Å²	67	58.1 Å²	58.1	25%	0.253	30%	0.295	S	S	.	.	H	α-helix	trans	-57.8	-51.7	-178.6	179	179.1	-75.6	134.3	-3.9	111.2	F106 I107 R112 F113 E114 E184 I185	F106-R110 VanDerWaalsContact O-CB 3.24Å; F106-R110 WeakPolarHBondContact O-CB 3.47Å; F106-R110 PolarHBondContact O-N 3.28Å; I107-R110 PolarHBondContact O-N 2.99Å; R110-R112 VanDerWaalsContact C-N 3.3Å; R110-R112 PolarHBondContact O-N 2.97Å; R110-F113 PolarHBondContact O-N 3.44Å; R110-E114 WeakPolarHBondContact CD-OE1 3.37Å; R110-E114 HydrophobicContact CG-CG 4.31Å; R110-E114 WeakPolarHBondContact CG-OE1 3.49Å; R110-E114 WeakPolarHBondContact O-CB 3.36Å; R110-E114 VanDerWaalsContact O-CG 3.28Å; R110-E114 WeakPolarHBondContact O-CG 3.46Å; R110-E114 PolarHBondContact O-N 3.47Å; R110-E184 IonicContact NH2-OE2 2.92Å; R110-E184 PolarHBondContact NH2-OE2 3.3Å; R110-E184 VanDerWaalsContact NH2-OE2 3.12Å; R110-I185 HydrophobicContact CB-CD1 4.41Å; R110-I185 HydrophobicContact CB-CG1 4.35Å
111	T	90.9	Very high	87.1	Confident	88 Å²	88	56 Å²	56	54%	0.54	29%	0.288	S	S	.	.	H	α-helix	trans	-58.9	-41.1	-178.8	-58.5	0	0	0	0	112.1	I107 V109 S115	I107-T111 PolarHBondContact O-N 2.94Å; I107-T111 PolarHBondContact O-OG1 3.13Å; V109-T111 PolarHBondContact O-N 2.96Å; T111-S115 PolarHBondContact O-N 2.96Å
112	R	89.6	Confident	86.9	Confident	77 Å²	77	53.2 Å²	53.2	29%	0.291	27%	0.274	S	S	.	.	H	α-helix	trans	-68.6	-48.1	179.4	-173.3	62.9	179	-157.2	-0	112	M29 F34 L108 V109 R110 E114 S115 E116	M29-R112 PolarHBondContact O-NH2 3.37Å; F34-R112 HydrophobicContact CB-CG 4.49Å; F34-R112 HydrophobicContact CD1-CB 4.01Å; F34-R112 HydrophobicContact CD1-CG 3.56Å; F34-R112 HydrophobicContact CD2-CG 4Å; F34-R112 HydrophobicContact CE1-CB 3.51Å; F34-R112 HydrophobicContact CE1-CG 3.62Å; F34-R112 HydrophobicContact CE2-CB 4.09Å; F34-R112 HydrophobicContact CE2-CG 4.05Å; F34-R112 HydrophobicContact CG-CB 4.49Å; F34-R112 HydrophobicContact CG-CG 3.74Å; F34-R112 HydrophobicContact CZ-CB 3.54Å; F34-R112 HydrophobicContact CZ-CG 3.86Å; L108-R112 PolarHBondContact O-N 3.46Å; L108-R112 VanDerWaalsContact O-N 3.17Å; V109-R112 PolarHBondContact O-N 3.06Å; R110-R112 VanDerWaalsContact C-N 3.3Å; R110-R112 PolarHBondContact O-N 2.97Å; R112-E114 PolarHBondContact O-N 3.02Å; R112-S115 PolarHBondContact O-N 3.36Å; R112-S115 PolarHBondContact O-OG 2.83Å; R112-E116 IonicContact CZ-OE1 3.8Å; R112-E116 IonicContact NE-OE1 2.83Å; R112-E116 PolarHBondContact NE-OE1 2.87Å; R112-E116 IonicContact NE-OE2 3.96Å; R112-E116 IonicContact NH2-OE1 3.68Å; R112-E116 PolarHBondContact NH2-OE1 3.42Å; R112-E116 PolarHBondContact O-N 2.98Å
113	F	90.9	Very high	86.5	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.9	-31.5	-177.4	-84.3	-99.4	0	0	0	113.3	V31 F34 V109 R110 S115 E116 S117 L125 A128 L129 I132 V189	V31-F113 HydrophobicContact CG2-CD1 4.01Å; V31-F113 HydrophobicContact CG2-CD2 4.41Å; V31-F113 HydrophobicContact CG2-CE1 3.6Å; V31-F113 HydrophobicContact CG2-CE2 4.04Å; V31-F113 HydrophobicContact CG2-CG 4.41Å; V31-F113 HydrophobicContact CG2-CZ 3.64Å; F34-F113 HydrophobicContact CD1-CE2 4.04Å; F34-F113 HydrophobicContact CE1-CD2 4.29Å; F34-F113 HydrophobicContact CE1-CE2 4.02Å; V109-F113 HydrophobicContact CG1-CD2 3.86Å; V109-F113 HydrophobicContact CG1-CE2 4.09Å; V109-F113 VanDerWaalsContact O-CD2 3.29Å; V109-F113 WeakPolarHBondContact O-CD2 3.46Å; V109-F113 PolarHBondContact O-N 3.24Å; R110-F113 PolarHBondContact O-N 3.44Å; F113-S115 VanDerWaalsContact C-N 3.34Å; F113-E116 PolarHBondContact O-N 3.49Å; F113-S117 WeakPolarHBondContact O-CB 3.28Å; F113-S117 PolarHBondContact O-N 2.9Å; F113-S117 VanDerWaalsContact O-N 3.08Å; F113-L125 HydrophobicContact CD1-CD1 3.71Å; F113-L125 HydrophobicContact CE1-CD1 4.03Å; F113-A128 HydrophobicContact CE1-CB 3.88Å; F113-A128 HydrophobicContact CZ-CB 3.69Å; F113-L129 HydrophobicContact CD1-CD2 3.44Å; F113-L129 VanDerWaalsContact CD1-CD2 3.44Å; F113-L129 HydrophobicContact CD1-CG 3.87Å; F113-L129 HydrophobicContact CE1-CB 4.45Å; F113-L129 HydrophobicContact CE1-CD2 3.47Å; F113-L129 VanDerWaalsContact CE1-CD2 3.47Å; F113-L129 HydrophobicContact CE1-CG 3.6Å; F113-L129 HydrophobicContact CG-CD2 4.18Å; F113-L129 HydrophobicContact CZ-CD2 4.22Å; F113-I132 HydrophobicContact CD2-CD1 4.22Å; F113-I132 HydrophobicContact CE2-CD1 3.19Å; F113-I132 HydrophobicContact CZ-CD1 3.44Å; F113-I132 VanDerWaalsContact CZ-CD1 3.44Å; F113-V189 HydrophobicContact CB-CG2 3.68Å; F113-V189 HydrophobicContact CD1-CG2 4.38Å; F113-V189 HydrophobicContact CG-CG2 4.43Å
114	E	87.2	Confident	86.3	Confident	67 Å²	67	52.7 Å²	52.7	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-60.2	-44.7	171.8	-75.3	174.6	-175.5	0	0	111.3	R110 R112 E116 S117 Q188 M192	R110-E114 WeakPolarHBondContact CD-OE1 3.37Å; R110-E114 HydrophobicContact CG-CG 4.31Å; R110-E114 WeakPolarHBondContact CG-OE1 3.49Å; R110-E114 WeakPolarHBondContact O-CB 3.36Å; R110-E114 VanDerWaalsContact O-CG 3.28Å; R110-E114 WeakPolarHBondContact O-CG 3.46Å; R110-E114 PolarHBondContact O-N 3.47Å; R112-E114 PolarHBondContact O-N 3.02Å; E114-E116 VanDerWaalsContact C-N 3.26Å; E114-E116 PolarHBondContact O-N 3.09Å; E114-S117 PolarHBondContact O-OG 3Å; E114-Q188 PolarHBondContact OE1-NE2 3.26Å; E114-M192 HydrophobicContact CB-CE 4.29Å; E114-M192 HydrophobicContact CB-SD 4.21Å; E114-M192 HydrophobicContact CG-SD 3.9Å; E114-M192 WeakPolarHBondContact O-CE 3.35Å
115	S	84	Confident	86.1	Confident	81 Å²	81	47.8 Å²	47.8	57%	0.566	25%	0.252	S	S	*	.	H	α-helix	trans	-67.3	-23.5	-177.5	72.1	0	0	0	0	114.6	T111 R112 F113	T111-S115 PolarHBondContact O-N 2.96Å; R112-S115 PolarHBondContact O-N 3.36Å; R112-S115 PolarHBondContact O-OG 2.83Å; F113-S115 VanDerWaalsContact C-N 3.34Å
116	E	81.9	Confident	85.9	Confident	24 Å²	24	48 Å²	48	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-111	-6.6	-172.3	-79.7	-178.3	175.5	0	0	113.9	V31 R112 F113 E114 T118 N120	V31-E116 WeakPolarHBondContact CA-OE2 3.38Å; V31-E116 WeakPolarHBondContact CB-OE2 3.48Å; V31-E116 WeakPolarHBondContact CG2-OE2 3.47Å; R112-E116 IonicContact CZ-OE1 3.8Å; R112-E116 IonicContact NE-OE1 2.83Å; R112-E116 PolarHBondContact NE-OE1 2.87Å; R112-E116 IonicContact NE-OE2 3.96Å; R112-E116 IonicContact NH2-OE1 3.68Å; R112-E116 PolarHBondContact NH2-OE1 3.42Å; R112-E116 PolarHBondContact O-N 2.98Å; F113-E116 PolarHBondContact O-N 3.49Å; E114-E116 VanDerWaalsContact C-N 3.26Å; E114-E116 PolarHBondContact O-N 3.09Å; E116-T118 PolarHBondContact O-N 2.84Å; E116-N120 WeakPolarHBondContact CB-ND2 3.44Å
117	S	76.7	Confident	85.6	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.007	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-42.7	-172.4	55	0	0	0	0	113.9	F113 E114 M192 Q193	F113-S117 WeakPolarHBondContact O-CB 3.28Å; F113-S117 PolarHBondContact O-N 2.9Å; F113-S117 VanDerWaalsContact O-N 3.08Å; E114-S117 PolarHBondContact O-OG 3Å; S117-M192 VanDerWaalsContact OG-CE 3.32Å; S117-M192 WeakPolarHBondContact OG-CE 3.42Å; S117-Q193 PolarHBondContact O-OE1 3.33Å
118	T	72	Confident	85.5	Confident	45 Å²	45	52 Å²	52	28%	0.276	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-20.2	-169.2	64	0	0	0	0	115.6	E116 Y196	E116-T118 PolarHBondContact O-N 2.84Å; T118-Y196 HydrophobicContact CG2-CD2 4.09Å; T118-Y196 HydrophobicContact CG2-CG 4.09Å; T118-Y196 WeakPolarHBondContact O-CE1 3.18Å
119	N	68.8	Low	85.6	Confident	130 Å²	130	48.1 Å²	48.1	70%	0.695	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-6.4	-167.5	-70	-13.4	0	0	0	114.5
120	N	70.8	Confident	85.5	Confident	53 Å²	53	49.4 Å²	49.4	28%	0.283	25%	0.251	S	S	.	.	S	Bend	trans	-100.8	158.6	-177.1	-76.4	-14.6	0	0	0	112.3	E116 V122	E116-N120 WeakPolarHBondContact CB-ND2 3.44Å; N120-V122 PolarHBondContact O-N 3.15Å; N120-V122 VanDerWaalsContact O-N 3.12Å
121	D	83.4	Confident	85.4	Confident	93 Å²	93	51.2 Å²	51.2	50%	0.497	26%	0.258	S	S	.	.			trans	-55.6	119	172.1	179	-4.8	0	0	0	109.3	N123 L124 L125	D121-N123 PolarHBondContact O-N 2.83Å; D121-N123 VanDerWaalsContact O-N 3.09Å; D121-N123 WeakPolarHBondContact OD1-CB 3.49Å; D121-N123 PolarHBondContact OD1-N 3.13Å; D121-N123 PolarHBondContact OD1-ND2 3.06Å; D121-L124 HydrophobicContact CB-CB 4.03Å; D121-L124 WeakPolarHBondContact O-CA 3.32Å; D121-L124 VanDerWaalsContact O-CB 3.32Å; D121-L124 WeakPolarHBondContact O-CB 3.42Å; D121-L124 PolarHBondContact O-N 3.23Å; D121-L125 PolarHBondContact O-N 2.93Å
122	V	85.5	Confident	85.5	Confident	12 Å²	12	47.3 Å²	47.3	7%	0.073	23%	0.234	C	C	.	.	H	α-helix	trans	-52	-36.3	-178.9	179.3	0	0	0	0	111.2	N120 L125 I126 Q193 Y197 A268 F269	N120-V122 PolarHBondContact O-N 3.15Å; N120-V122 VanDerWaalsContact O-N 3.12Å; V122-L125 PolarHBondContact O-N 3.33Å; V122-I126 HydrophobicContact CG1-CD1 3.64Å; V122-I126 HydrophobicContact CG1-CG1 4.37Å; V122-I126 WeakPolarHBondContact O-CB 3.46Å; V122-I126 WeakPolarHBondContact O-CD1 3.44Å; V122-I126 WeakPolarHBondContact O-CG1 3.26Å; V122-I126 PolarHBondContact O-N 3.04Å; V122-Q193 VanDerWaalsContact CG2-NE2 3.33Å; V122-Y197 HydrophobicContact CG2-CE2 4.19Å; V122-Y197 VanDerWaalsContact CG2-OH 3.32Å; V122-Y197 WeakPolarHBondContact CG2-OH 3.17Å; V122-A268 HydrophobicContact CG1-CB 4.01Å; V122-F269 HydrophobicContact CG1-CE2 4.16Å
123	N	86.4	Confident	85.7	Confident	80 Å²	80	43.9 Å²	43.9	43%	0.428	22%	0.221	S	C	.	.	H	α-helix	trans	-68.7	-36.5	178.1	-62.3	-80.8	0	0	0	112.3	D121 R127	D121-N123 PolarHBondContact O-N 2.83Å; D121-N123 VanDerWaalsContact O-N 3.09Å; D121-N123 WeakPolarHBondContact OD1-CB 3.49Å; D121-N123 PolarHBondContact OD1-N 3.13Å; D121-N123 PolarHBondContact OD1-ND2 3.06Å; N123-R127 WeakPolarHBondContact O-CB 3.24Å; N123-R127 VanDerWaalsContact O-CG 3.25Å; N123-R127 WeakPolarHBondContact O-CG 3.36Å; N123-R127 PolarHBondContact O-N 2.98Å; N123-R127 VanDerWaalsContact O-N 3.09Å
124	L	88.2	Confident	85.7	Confident	32 Å²	32	45.8 Å²	45.8	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-68.4	-43	176.1	-171.7	67.6	0	0	0	110.5	D30 V31 L32 D121 R127 A128	D30-L124 HydrophobicContact CB-CD2 4.03Å; V31-L124 HydrophobicContact CG1-CD2 4.37Å; V31-L124 HydrophobicContact CG1-CG 4.02Å; L32-L124 HydrophobicContact CB-CD1 3.82Å; L32-L124 HydrophobicContact CB-CG 4.44Å; L32-L124 HydrophobicContact CD2-CD1 3.96Å; D121-L124 HydrophobicContact CB-CB 4.03Å; D121-L124 WeakPolarHBondContact O-CA 3.32Å; D121-L124 VanDerWaalsContact O-CB 3.32Å; D121-L124 WeakPolarHBondContact O-CB 3.42Å; D121-L124 PolarHBondContact O-N 3.23Å; L124-R127 PolarHBondContact O-N 3.08Å; L124-A128 PolarHBondContact O-N 3.27Å
125	L	89.5	Confident	86.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-58	-49.4	175.1	-174.9	67.9	0	0	0	111.6	V31 F113 D121 V122 R127 A128 L129 V189	V31-L125 HydrophobicContact CG2-CD1 4.49Å; F113-L125 HydrophobicContact CD1-CD1 3.71Å; F113-L125 HydrophobicContact CE1-CD1 4.03Å; D121-L125 PolarHBondContact O-N 2.93Å; V122-L125 PolarHBondContact O-N 3.33Å; L125-R127 PolarHBondContact O-N 3.31Å; L125-A128 PolarHBondContact O-N 2.94Å; L125-L129 HydrophobicContact CG-CD1 4.5Å; L125-L129 WeakPolarHBondContact O-CG 3.41Å; L125-L129 PolarHBondContact O-N 3.11Å; L125-V189 HydrophobicContact CD1-CG1 4.06Å; L125-V189 HydrophobicContact CD2-CG1 3.7Å; L125-V189 HydrophobicContact CG-CG1 4.05Å
126	I	89.5	Confident	86.5	Confident	6 Å²	6	42 Å²	42	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-42	179.2	-71.2	163	0	0	0	111.5	V122 A128 L129 D130 A268 F269 S274 F276	V122-I126 HydrophobicContact CG1-CD1 3.64Å; V122-I126 HydrophobicContact CG1-CG1 4.37Å; V122-I126 WeakPolarHBondContact O-CB 3.46Å; V122-I126 WeakPolarHBondContact O-CD1 3.44Å; V122-I126 WeakPolarHBondContact O-CG1 3.26Å; V122-I126 PolarHBondContact O-N 3.04Å; I126-A128 VanDerWaalsContact C-N 3.32Å; I126-A128 PolarHBondContact O-N 2.87Å; I126-L129 PolarHBondContact O-N 2.87Å; I126-D130 WeakPolarHBondContact O-CB 3.37Å; I126-D130 PolarHBondContact O-N 2.88Å; I126-A268 HydrophobicContact CD1-CB 3.46Å; I126-A268 VanDerWaalsContact CD1-CB 3.46Å; I126-A268 WeakPolarHBondContact CD1-O 3.41Å; I126-F269 HydrophobicContact CD1-CD1 4.15Å; I126-F269 HydrophobicContact CD1-CD2 4.29Å; I126-F269 HydrophobicContact CD1-CE1 4.44Å; I126-F269 HydrophobicContact CD1-CG 4.07Å; I126-F269 HydrophobicContact CG1-CD1 3.84Å; I126-F269 HydrophobicContact CG1-CE1 3.88Å; I126-F269 HydrophobicContact CG1-CG 4.28Å; I126-F269 HydrophobicContact CG1-CZ 4.34Å; I126-S274 WeakPolarHBondContact CG2-OG 3.45Å; I126-F276 HydrophobicContact CG2-CE1 4.4Å; I126-F276 HydrophobicContact CG2-CZ 4.09Å
127	R	90.1	Very high	87	Confident	150 Å²	150	42.8 Å²	42.8	57%	0.566	21%	0.208	S	C	*	.	H	α-helix	trans	-62.2	-40.3	176.1	-75.4	174.3	-168.7	141	4.4	112.1	L32 N123 L124 L125 D130 R131	L32-R127 HydrophobicContact CD1-CB 4.33Å; N123-R127 WeakPolarHBondContact O-CB 3.24Å; N123-R127 VanDerWaalsContact O-CG 3.25Å; N123-R127 WeakPolarHBondContact O-CG 3.36Å; N123-R127 PolarHBondContact O-N 2.98Å; N123-R127 VanDerWaalsContact O-N 3.09Å; L124-R127 PolarHBondContact O-N 3.08Å; L125-R127 PolarHBondContact O-N 3.31Å; R127-D130 PolarHBondContact O-N 3.47Å; R127-R131 VanDerWaalsContact O-CB 3.3Å; R127-R131 WeakPolarHBondContact O-CB 3.33Å; R127-R131 PolarHBondContact O-N 3.35Å
128	A	91	Very high	87.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-69.5	-40	178.7	0	0	0	0	0	112.1	V31 L32 A35 F113 L124 L125 I126 R131 I132	V31-A128 HydrophobicContact CB-CB 4.34Å; V31-A128 HydrophobicContact CG1-CB 3.67Å; V31-A128 HydrophobicContact CG2-CB 4.1Å; L32-A128 HydrophobicContact CB-CB 4.29Å; L32-A128 HydrophobicContact CD1-CB 4.11Å; A35-A128 HydrophobicContact CB-CB 3.94Å; F113-A128 HydrophobicContact CE1-CB 3.88Å; F113-A128 HydrophobicContact CZ-CB 3.69Å; L124-A128 PolarHBondContact O-N 3.27Å; L125-A128 PolarHBondContact O-N 2.94Å; I126-A128 VanDerWaalsContact C-N 3.32Å; I126-A128 PolarHBondContact O-N 2.87Å; A128-R131 WeakPolarHBondContact O-CB 3.5Å; A128-R131 PolarHBondContact O-N 2.9Å; A128-I132 WeakPolarHBondContact O-CG1 3.19Å; A128-I132 PolarHBondContact O-N 3.16Å; A128-I132 VanDerWaalsContact O-N 3.1Å
129	L	92.7	Very high	88.7	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-46.6	171.5	-75.1	176.1	0	0	0	112	F113 L125 I126 R131 I132 H133 I185 I186 V189 F269 F276	F113-L129 HydrophobicContact CD1-CD2 3.44Å; F113-L129 VanDerWaalsContact CD1-CD2 3.44Å; F113-L129 HydrophobicContact CD1-CG 3.87Å; F113-L129 HydrophobicContact CE1-CB 4.45Å; F113-L129 HydrophobicContact CE1-CD2 3.47Å; F113-L129 VanDerWaalsContact CE1-CD2 3.47Å; F113-L129 HydrophobicContact CE1-CG 3.6Å; F113-L129 HydrophobicContact CG-CD2 4.18Å; F113-L129 HydrophobicContact CZ-CD2 4.22Å; L125-L129 HydrophobicContact CG-CD1 4.5Å; L125-L129 WeakPolarHBondContact O-CG 3.41Å; L125-L129 PolarHBondContact O-N 3.11Å; I126-L129 PolarHBondContact O-N 2.87Å; L129-R131 VanDerWaalsContact C-N 3.29Å; L129-R131 PolarHBondContact O-N 3.3Å; L129-I132 PolarHBondContact O-N 3.03Å; L129-H133 WeakPolarHBondContact O-CB 3.26Å; L129-H133 PolarHBondContact O-N 2.94Å; L129-I185 HydrophobicContact CD2-CG2 4.43Å; L129-I186 HydrophobicContact CB-CG1 4.24Å; L129-I186 HydrophobicContact CD1-CG2 4.47Å; L129-I186 HydrophobicContact CD2-CG1 4.02Å; L129-I186 HydrophobicContact CG-CG1 4.49Å; L129-V189 HydrophobicContact CD1-CB 4.17Å; L129-V189 HydrophobicContact CD1-CG1 3.89Å; L129-V189 HydrophobicContact CD2-CG2 4.31Å; L129-F269 HydrophobicContact CD1-CE1 4.28Å; L129-F276 HydrophobicContact CB-CE1 4.24Å
130	D	92.2	Very high	89.9	Confident	28 Å²	28	39.1 Å²	39.1	15%	0.15	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-38.2	178.4	-171.1	57.1	0	0	0	111.7	I126 R127 H133 C134 T275 F276	I126-D130 WeakPolarHBondContact O-CB 3.37Å; I126-D130 PolarHBondContact O-N 2.88Å; R127-D130 PolarHBondContact O-N 3.47Å; D130-H133 PolarHBondContact O-N 3.18Å; D130-C134 WeakPolarHBondContact O-CB 3.11Å; D130-C134 PolarHBondContact O-N 3.02Å; D130-C134 PolarHBondContact O-SG 3.4Å; D130-T275 WeakPolarHBondContact OD1-CB 3.38Å; D130-T275 PolarHBondContact OD1-N 3.45Å; D130-T275 PolarHBondContact OD1-OG1 3.27Å; D130-F276 HydrophobicContact CB-CD1 4.17Å; D130-F276 HydrophobicContact CB-CE1 3.94Å
131	R	91.8	Very high	90.8	Very high	104 Å²	104	45.4 Å²	45.4	39%	0.392	21%	0.209	S	C	.	.	H	α-helix	trans	-59.2	-48.2	174.6	-175.8	61.1	138.7	-165.9	-6.9	111.6	A35 N36 R127 A128 L129 C134 R135	A35-R131 HydrophobicContact CB-CB 4.5Å; A35-R131 HydrophobicContact CB-CG 4.48Å; N36-R131 PolarHBondContact OD1-NE 3.43Å; N36-R131 PolarHBondContact OD1-NH2 2.81Å; R127-R131 VanDerWaalsContact O-CB 3.3Å; R127-R131 WeakPolarHBondContact O-CB 3.33Å; R127-R131 PolarHBondContact O-N 3.35Å; A128-R131 WeakPolarHBondContact O-CB 3.5Å; A128-R131 PolarHBondContact O-N 2.9Å; L129-R131 VanDerWaalsContact C-N 3.29Å; L129-R131 PolarHBondContact O-N 3.3Å; R131-C134 PolarHBondContact O-N 3Å; R131-R135 WeakPolarHBondContact O-CB 3.27Å; R131-R135 WeakPolarHBondContact O-CG 3.39Å; R131-R135 PolarHBondContact O-N 3.22Å
132	I	93.2	Very high	91	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-47.4	178.2	-70.1	169.7	0	0	0	110.4	A35 T39 F105 V109 F113 A128 L129 C134 R135 V136	A35-I132 HydrophobicContact CB-CD1 3.97Å; A35-I132 HydrophobicContact CB-CG1 3.91Å; T39-I132 HydrophobicContact CG2-CG1 4.04Å; F105-I132 HydrophobicContact CE1-CG2 4.48Å; F105-I132 HydrophobicContact CZ-CG2 4.31Å; V109-I132 HydrophobicContact CG1-CD1 3.7Å; V109-I132 HydrophobicContact CG1-CG2 4.38Å; V109-I132 HydrophobicContact CG2-CD1 4.17Å; F113-I132 HydrophobicContact CD2-CD1 4.22Å; F113-I132 HydrophobicContact CE2-CD1 3.19Å; F113-I132 HydrophobicContact CZ-CD1 3.44Å; F113-I132 VanDerWaalsContact CZ-CD1 3.44Å; A128-I132 WeakPolarHBondContact O-CG1 3.19Å; A128-I132 PolarHBondContact O-N 3.16Å; A128-I132 VanDerWaalsContact O-N 3.1Å; L129-I132 PolarHBondContact O-N 3.03Å; I132-C134 PolarHBondContact O-N 2.9Å; I132-R135 PolarHBondContact O-N 3.15Å; I132-V136 HydrophobicContact CG2-CG2 4.29Å; I132-V136 VanDerWaalsContact O-CG2 3.31Å; I132-V136 WeakPolarHBondContact O-CG2 3.5Å; I132-V136 PolarHBondContact O-N 3.37Å
133	H	93.3	Very high	91.1	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.019	20%	0.195	C	C	.	.	H	α-helix	trans	-57.2	-49.2	177.4	178.8	-100.9	0	0	0	111.6	L129 D130 R135 V136 Q137 I186 T275	L129-H133 WeakPolarHBondContact O-CB 3.26Å; L129-H133 PolarHBondContact O-N 2.94Å; D130-H133 PolarHBondContact O-N 3.18Å; H133-R135 PolarHBondContact O-N 3.4Å; H133-V136 PolarHBondContact O-N 3.48Å; H133-Q137 VanDerWaalsContact O-CG 3.27Å; H133-Q137 WeakPolarHBondContact O-CG 3.36Å; H133-Q137 PolarHBondContact O-N 3.27Å; H133-I186 HydrophobicContact CB-CD1 3.95Å; H133-T275 PolarHBondContact ND1-OG1 3.36Å
134	C	92.8	Very high	91	Very high	41 Å²	41	41.3 Å²	41.3	28%	0.277	19%	0.19	S	C	.	.	H	α-helix	trans	-58.9	-45.1	176.5	-71.7	0	0	0	0	112.4	D130 R131 I132 Q137 T138 T275	D130-C134 WeakPolarHBondContact O-CB 3.11Å; D130-C134 PolarHBondContact O-N 3.02Å; D130-C134 PolarHBondContact O-SG 3.4Å; R131-C134 PolarHBondContact O-N 3Å; I132-C134 PolarHBondContact O-N 2.9Å; C134-Q137 PolarHBondContact O-N 2.99Å; C134-T138 PolarHBondContact O-N 3.12Å; C134-T138 PolarHBondContact O-OG1 2.9Å; C134-T138 VanDerWaalsContact O-OG1 3.1Å; C134-T275 WeakPolarHBondContact SG-CG2 3.41Å; C134-T275 PolarHBondContact SG-OG1 2.93Å; C134-T275 VanDerWaalsContact SG-OG1 3.33Å
135	R	93.6	Very high	90.8	Very high	68 Å²	68	43.9 Å²	43.9	26%	0.257	21%	0.207	S	C	.	.	H	α-helix	trans	-67.5	-38.4	-178.6	-71.5	-70.6	-155.9	-174.7	9.5	112.3	T39 D40 L43 R131 I132 H133 T138 F139	T39-R135 HydrophobicContact CG2-CB 3.74Å; T39-R135 HydrophobicContact CG2-CG 3.98Å; D40-R135 IonicContact OD1-CZ 3.78Å; D40-R135 IonicContact OD1-NE 3.12Å; D40-R135 IonicContact OD1-NH2 3.52Å; D40-R135 PolarHBondContact OD1-NH2 2.86Å; L43-R135 HydrophobicContact CD1-CB 3.92Å; R131-R135 WeakPolarHBondContact O-CB 3.27Å; R131-R135 WeakPolarHBondContact O-CG 3.39Å; R131-R135 PolarHBondContact O-N 3.22Å; I132-R135 PolarHBondContact O-N 3.15Å; H133-R135 PolarHBondContact O-N 3.4Å; R135-T138 PolarHBondContact O-N 2.71Å; R135-F139 WeakPolarHBondContact O-CB 3.31Å; R135-F139 PolarHBondContact O-N 2.77Å
136	V	93.8	Very high	90.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.7	-42.2	171.9	171.7	0	0	0	0	110.8	L43 F105 F106 I132 H133 T138 F139 N140 F178 A182	L43-V136 HydrophobicContact CD1-CG2 3.88Å; F105-V136 HydrophobicContact CE1-CG2 3.92Å; F105-V136 HydrophobicContact CZ-CG2 4.41Å; F106-V136 HydrophobicContact CE1-CG2 4.15Å; F106-V136 HydrophobicContact CZ-CG1 4.22Å; F106-V136 HydrophobicContact CZ-CG2 4.25Å; I132-V136 HydrophobicContact CG2-CG2 4.29Å; I132-V136 VanDerWaalsContact O-CG2 3.31Å; I132-V136 WeakPolarHBondContact O-CG2 3.5Å; I132-V136 PolarHBondContact O-N 3.37Å; H133-V136 PolarHBondContact O-N 3.48Å; V136-T138 PolarHBondContact O-N 3.08Å; V136-F139 PolarHBondContact O-N 3.22Å; V136-N140 WeakPolarHBondContact O-CB 3.48Å; V136-N140 VanDerWaalsContact O-CG 3.25Å; V136-N140 PolarHBondContact O-N 3.48Å; V136-F178 HydrophobicContact CG1-CB 4.23Å; V136-A182 HydrophobicContact CG1-CB 4.32Å
137	Q	92.1	Very high	89.7	Confident	40 Å²	40	45.4 Å²	45.4	19%	0.187	22%	0.217	C	C	.	.	H	α-helix	trans	-64	-39.2	175.8	-68.2	-59.2	-38.8	0	0	112.3	H133 C134 N140 R141 S179	H133-Q137 VanDerWaalsContact O-CG 3.27Å; H133-Q137 WeakPolarHBondContact O-CG 3.36Å; H133-Q137 PolarHBondContact O-N 3.27Å; C134-Q137 PolarHBondContact O-N 2.99Å; Q137-N140 PolarHBondContact O-N 3.49Å; Q137-R141 WeakPolarHBondContact O-CG 3.46Å; Q137-R141 PolarHBondContact O-N 3.03Å; Q137-R141 VanDerWaalsContact O-N 3.08Å; Q137-S179 PolarHBondContact NE2-OG 2.97Å
138	T	91.9	Very high	88.7	Confident	86 Å²	86	41.3 Å²	41.3	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-64.8	-44.3	174	-60.7	0	0	0	0	111.4	C134 R135 V136 R141 S142	C134-T138 PolarHBondContact O-N 3.12Å; C134-T138 PolarHBondContact O-OG1 2.9Å; C134-T138 VanDerWaalsContact O-OG1 3.1Å; R135-T138 PolarHBondContact O-N 2.71Å; V136-T138 PolarHBondContact O-N 3.08Å; T138-R141 PolarHBondContact O-N 3.3Å; T138-S142 PolarHBondContact O-N 3.43Å
139	F	93.1	Very high	87.2	Confident	5 Å²	5	45 Å²	45	2%	0.022	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-48.6	174.8	173.3	-103.5	0	0	0	111.3	L43 L46 I50 V98 M102 R135 V136 R141 S142 L143 F178	L43-F139 HydrophobicContact CB-CB 4.45Å; L43-F139 HydrophobicContact CD2-CG 4.31Å; L46-F139 HydrophobicContact CB-CE2 4.16Å; L46-F139 HydrophobicContact CD2-CE2 3.72Å; L46-F139 HydrophobicContact CD2-CZ 3.57Å; L46-F139 HydrophobicContact CG-CE2 3.76Å; L46-F139 HydrophobicContact CG-CZ 4.04Å; I50-F139 HydrophobicContact CD1-CE2 4.18Å; I50-F139 HydrophobicContact CD1-CZ 4.24Å; V98-F139 HydrophobicContact CG1-CE1 4.36Å; V98-F139 HydrophobicContact CG1-CZ 4.09Å; M102-F139 HydrophobicContact CE-CD1 4.18Å; M102-F139 HydrophobicContact CE-CE1 4.23Å; M102-F139 HydrophobicContact CG-CE1 4.02Å; M102-F139 HydrophobicContact CG-CZ 4.49Å; M102-F139 HydrophobicContact SD-CD1 3.94Å; M102-F139 HydrophobicContact SD-CE1 3.58Å; M102-F139 VanDerWaalsContact SD-CE1 3.58Å; M102-F139 HydrophobicContact SD-CZ 4.16Å; R135-F139 WeakPolarHBondContact O-CB 3.31Å; R135-F139 PolarHBondContact O-N 2.77Å; V136-F139 PolarHBondContact O-N 3.22Å; F139-R141 VanDerWaalsContact C-N 3.3Å; F139-R141 PolarHBondContact O-N 3.45Å; F139-S142 PolarHBondContact O-N 2.96Å; F139-S142 VanDerWaalsContact O-N 3.11Å; F139-L143 HydrophobicContact CE1-CD2 4.05Å; F139-L143 HydrophobicContact CZ-CD2 4.22Å; F139-L143 WeakPolarHBondContact O-CB 3.39Å; F139-L143 PolarHBondContact O-N 2.9Å; F139-F178 HydrophobicContact CE1-CD2 4.25Å; F139-F178 HydrophobicContact CE1-CE2 4.21Å
140	N	92	Very high	85.3	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.043	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-41.6	177.4	-74.1	-14.6	0	0	0	112.7	V136 Q137 L144 T175 S179	V136-N140 WeakPolarHBondContact O-CB 3.48Å; V136-N140 VanDerWaalsContact O-CG 3.25Å; V136-N140 PolarHBondContact O-N 3.48Å; Q137-N140 PolarHBondContact O-N 3.49Å; N140-L144 WeakPolarHBondContact O-CB 3.12Å; N140-L144 PolarHBondContact O-N 2.88Å; N140-L144 VanDerWaalsContact O-N 3.08Å; N140-T175 HydrophobicContact CB-CG2 3.79Å; N140-T175 PolarHBondContact ND2-O 3.39Å; N140-S179 PolarHBondContact ND2-OG 3Å
141	R	89.9	Confident	83	Confident	186 Å²	186	52 Å²	52	70%	0.702	27%	0.273	S	S	*	.	H	α-helix	trans	-65.6	-44.7	175.6	-71.8	176.9	-172.9	-159.8	1.7	111.6	Q137 T138 F139 L144 T145	Q137-R141 WeakPolarHBondContact O-CG 3.46Å; Q137-R141 PolarHBondContact O-N 3.03Å; Q137-R141 VanDerWaalsContact O-N 3.08Å; T138-R141 PolarHBondContact O-N 3.3Å; F139-R141 VanDerWaalsContact C-N 3.3Å; F139-R141 PolarHBondContact O-N 3.45Å; R141-L144 PolarHBondContact O-N 3.1Å; R141-T145 WeakPolarHBondContact O-CB 3.28Å; R141-T145 PolarHBondContact O-N 3.47Å; R141-T145 PolarHBondContact O-OG1 3.33Å
142	S	88.2	Confident	80.8	Confident	38 Å²	38	50.6 Å²	50.6	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-44.1	178.5	-163.8	0	0	0	0	111.5	S47 T138 F139 L144 T145 S146	S47-S142 VanDerWaalsContact OG-CB 3.27Å; S47-S142 WeakPolarHBondContact OG-CB 3.2Å; S47-S142 PolarHBondContact OG-OG 3.39Å; T138-S142 PolarHBondContact O-N 3.43Å; F139-S142 PolarHBondContact O-N 2.96Å; F139-S142 VanDerWaalsContact O-N 3.11Å; S142-L144 PolarHBondContact O-N 3.22Å; S142-T145 PolarHBondContact O-N 2.97Å; S142-S146 PolarHBondContact O-N 3.03Å; S142-S146 PolarHBondContact O-OG 3.33Å; S142-S146 VanDerWaalsContact O-OG 3.14Å
143	L	87.4	Confident	78.3	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-57.6	-48	177.5	-177.8	61.1	0	0	0	111.3	I50 V98 F139 S146 V147 F171 T175 F178	I50-L143 HydrophobicContact CD1-CD1 3.72Å; I50-L143 HydrophobicContact CG2-CD1 4.07Å; V98-L143 HydrophobicContact CG1-CD2 4.05Å; F139-L143 HydrophobicContact CE1-CD2 4.05Å; F139-L143 HydrophobicContact CZ-CD2 4.22Å; F139-L143 WeakPolarHBondContact O-CB 3.39Å; F139-L143 PolarHBondContact O-N 2.9Å; L143-S146 PolarHBondContact O-N 3.27Å; L143-V147 VanDerWaalsContact O-CG2 3.3Å; L143-V147 WeakPolarHBondContact O-CG2 3.46Å; L143-V147 PolarHBondContact O-N 3.17Å; L143-F171 HydrophobicContact CD1-CD1 3.99Å; L143-F171 HydrophobicContact CD1-CE1 3.95Å; L143-F171 HydrophobicContact CD2-CD1 3.94Å; L143-F171 HydrophobicContact CD2-CE1 4.47Å; L143-F171 HydrophobicContact CG-CD1 3.94Å; L143-F171 HydrophobicContact CG-CE1 4.41Å; L143-T175 HydrophobicContact CD2-CG2 3.95Å; L143-F178 HydrophobicContact CD2-CE2 4.34Å
144	L	85.3	Confident	76.3	Confident	59 Å²	59	64 Å²	64	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-67.8	-39.6	178.8	-168.4	65.4	0	0	0	112.1	N140 R141 S142 V147 T148 V168	N140-L144 WeakPolarHBondContact O-CB 3.12Å; N140-L144 PolarHBondContact O-N 2.88Å; N140-L144 VanDerWaalsContact O-N 3.08Å; R141-L144 PolarHBondContact O-N 3.1Å; S142-L144 PolarHBondContact O-N 3.22Å; L144-V147 PolarHBondContact O-N 2.96Å; L144-T148 HydrophobicContact CD1-CG2 4.17Å; L144-T148 HydrophobicContact CG-CG2 4.23Å; L144-T148 WeakPolarHBondContact O-CB 3.29Å; L144-T148 VanDerWaalsContact O-CG2 3.26Å; L144-T148 WeakPolarHBondContact O-CG2 3.27Å; L144-T148 PolarHBondContact O-N 3.24Å; L144-T148 PolarHBondContact O-OG1 3.41Å; L144-V168 HydrophobicContact CD1-CG1 4.48Å
145	T	83.8	Confident	74	Confident	86 Å²	86	65 Å²	65	53%	0.528	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-47.4	175.4	-59.6	0	0	0	0	111.3	R141 S142 V147 T148 S149	R141-T145 WeakPolarHBondContact O-CB 3.28Å; R141-T145 PolarHBondContact O-N 3.47Å; R141-T145 PolarHBondContact O-OG1 3.33Å; S142-T145 PolarHBondContact O-N 2.97Å; T145-V147 VanDerWaalsContact C-N 3.25Å; T145-V147 PolarHBondContact O-N 3.32Å; T145-T148 WeakPolarHBondContact CA-OG1 3.2Å; T145-T148 PolarHBondContact O-N 2.66Å; T145-T148 PolarHBondContact O-OG1 2.94Å; T145-S149 WeakPolarHBondContact O-CB 3.34Å; T145-S149 PolarHBondContact O-N 3.26Å; T145-S149 PolarHBondContact O-OG 3.36Å
146	S	80.1	Confident	71.9	Confident	17 Å²	17	68.2 Å²	68.2	12%	0.119	38%	0.38	C	S	.	.	H	α-helix	trans	-63.2	-29.4	-180	-64.2	0	0	0	0	113.5	S142 L143 S149	S142-S146 PolarHBondContact O-N 3.03Å; S142-S146 PolarHBondContact O-OG 3.33Å; S142-S146 VanDerWaalsContact O-OG 3.14Å; L143-S146 PolarHBondContact O-N 3.27Å; S146-S149 PolarHBondContact O-OG 2.83Å
147	V	74.7	Confident	70	Confident	20 Å²	20	74.7 Å²	74.7	12%	0.121	42%	0.415	C	S	.	.	H	α-helix	trans	-86.4	-24.9	177.8	176.2	0	0	0	0	112.3	L143 L144 T145 V150 I167 F171	L143-V147 VanDerWaalsContact O-CG2 3.3Å; L143-V147 WeakPolarHBondContact O-CG2 3.46Å; L143-V147 PolarHBondContact O-N 3.17Å; L144-V147 PolarHBondContact O-N 2.96Å; T145-V147 VanDerWaalsContact C-N 3.25Å; T145-V147 PolarHBondContact O-N 3.32Å; V147-V150 WeakPolarHBondContact O-CG2 3.39Å; V147-I167 HydrophobicContact CG1-CG2 3.8Å; V147-F171 HydrophobicContact CB-CD2 4.48Å; V147-F171 HydrophobicContact CG1-CD2 3.88Å; V147-F171 HydrophobicContact CG1-CE2 4.38Å; V147-F171 HydrophobicContact CG2-CD1 4.41Å; V147-F171 HydrophobicContact CG2-CD2 3.9Å; V147-F171 HydrophobicContact CG2-CE2 4.01Å; V147-F171 HydrophobicContact CG2-CG 4.1Å; V147-F171 HydrophobicContact CG2-CZ 4.33Å
148	T	69.7	Low	68.2	Low	65 Å²	65	80.1 Å²	80.1	40%	0.399	45%	0.445	S	S	.	.	H	α-helix	trans	-95.4	-14.9	-179.2	53.7	0	0	0	0	114.1	L144 T145 V150 V168	L144-T148 HydrophobicContact CD1-CG2 4.17Å; L144-T148 HydrophobicContact CG-CG2 4.23Å; L144-T148 WeakPolarHBondContact O-CB 3.29Å; L144-T148 VanDerWaalsContact O-CG2 3.26Å; L144-T148 WeakPolarHBondContact O-CG2 3.27Å; L144-T148 PolarHBondContact O-N 3.24Å; L144-T148 PolarHBondContact O-OG1 3.41Å; T145-T148 WeakPolarHBondContact CA-OG1 3.2Å; T145-T148 PolarHBondContact O-N 2.66Å; T145-T148 PolarHBondContact O-OG1 2.94Å; T148-V150 PolarHBondContact O-N 3.4Å; T148-V168 HydrophobicContact CG2-CG1 4.46Å; T148-V168 HydrophobicContact CG2-CG2 4.19Å
149	S	60.2	Low	66.4	Low	78 Å²	78	81.8 Å²	81.8	55%	0.545	45%	0.45	S	S	.	.			trans	-69.8	7.3	174.7	53.3	0	0	0	0	114.2	T145 S146 D151	T145-S149 WeakPolarHBondContact O-CB 3.34Å; T145-S149 PolarHBondContact O-N 3.26Å; T145-S149 PolarHBondContact O-OG 3.36Å; S146-S149 PolarHBondContact O-OG 2.83Å; S149-D151 PolarHBondContact O-N 3.3Å
150	V	52.5	Low	64.7	Low	37 Å²	37	82.9 Å²	82.9	22%	0.224	46%	0.456	C	S	.	.	S	Bend	trans	-80.2	96.2	171.4	-167.6	0	0	0	0	108.3	F58 V147 T148 F152	F58-V150 HydrophobicContact CD1-CB 4.25Å; F58-V150 HydrophobicContact CD1-CG1 3.65Å; F58-V150 HydrophobicContact CD1-CG2 3.82Å; F58-V150 HydrophobicContact CD2-CG2 3.85Å; F58-V150 HydrophobicContact CE1-CB 3.88Å; F58-V150 HydrophobicContact CE1-CG1 3.29Å; F58-V150 HydrophobicContact CE1-CG2 3.26Å; F58-V150 HydrophobicContact CE2-CG2 3.32Å; F58-V150 HydrophobicContact CG-CG2 4.13Å; F58-V150 HydrophobicContact CZ-CB 4.13Å; F58-V150 HydrophobicContact CZ-CG1 4.01Å; F58-V150 HydrophobicContact CZ-CG2 3.02Å; V147-V150 WeakPolarHBondContact O-CG2 3.39Å; T148-V150 PolarHBondContact O-N 3.4Å; V150-F152 WeakPolarHBondContact O-CD2 3.33Å; V150-F152 PolarHBondContact O-N 2.94Å
151	D	43.4	Very low	63.2	Low	140 Å²	140	84.9 Å²	84.9	75%	0.749	47%	0.471	S	S	*	.	S	Bend	trans	53.9	51.2	161.1	-68	-24.6	0	0	0	119.9	S149	S149-D151 PolarHBondContact O-N 3.3Å
152	F	45.9	Very low	61.9	Low	76 Å²	76	81.3 Å²	81.3	33%	0.333	47%	0.472	S	S	.	.			trans	-137.2	53.2	161.2	-62.8	-66.1	0	0	0	114.4	V150 G154 V155 L160	V150-F152 WeakPolarHBondContact O-CD2 3.33Å; V150-F152 PolarHBondContact O-N 2.94Å; F152-G154 PolarHBondContact O-N 3.44Å; F152-V155 HydrophobicContact CB-CB 4.34Å; F152-V155 HydrophobicContact CD1-CB 3.25Å; F152-V155 HydrophobicContact CD1-CG1 3.54Å; F152-V155 HydrophobicContact CD1-CG2 3.69Å; F152-V155 HydrophobicContact CE1-CB 3.89Å; F152-V155 HydrophobicContact CE1-CG1 3.63Å; F152-V155 HydrophobicContact CE1-CG2 4.27Å; F152-V155 HydrophobicContact CG-CB 4.17Å; F152-L160 HydrophobicContact CD2-CD2 3.74Å; F152-L160 HydrophobicContact CD2-CG 4.06Å; F152-L160 HydrophobicContact CE1-CG 4.33Å; F152-L160 HydrophobicContact CE2-CB 4.49Å; F152-L160 HydrophobicContact CE2-CD1 4.47Å; F152-L160 HydrophobicContact CE2-CD2 2.97Å; F152-L160 HydrophobicContact CE2-CG 3.44Å; F152-L160 VanDerWaalsContact CE2-CG 3.44Å; F152-L160 HydrophobicContact CZ-CB 4.19Å; F152-L160 HydrophobicContact CZ-CD2 3.47Å; F152-L160 VanDerWaalsContact CZ-CD2 3.47Å; F152-L160 HydrophobicContact CZ-CG 3.51Å
153	E	40.9	Very low	60.8	Low	210 Å²	210	86.6 Å²	86.6	98%	0.981	49%	0.492	S	S	*	.	S	Bend	trans	-66.6	89.7	150.6	-93.2	-169.4	156.8	0	0	108.8
154	G	50.4	Low	59.7	Low	81 Å²	81	88.3 Å²	88.3	84%	0.835	51%	0.505	S	S	*	.	S	Bend	trans	112.1	11.4	163.4	0	0	0	0	0	117.9	F152	F152-G154 PolarHBondContact O-N 3.44Å
155	V	46.1	Very low	59	Low	62 Å²	62	88.5 Å²	88.5	38%	0.376	51%	0.506	S	S	.	.			trans	-119.1	137	-176.2	179.8	0	0	0	0	110.1	F152 D159	F152-V155 HydrophobicContact CB-CB 4.34Å; F152-V155 HydrophobicContact CD1-CB 3.25Å; F152-V155 HydrophobicContact CD1-CG1 3.54Å; F152-V155 HydrophobicContact CD1-CG2 3.69Å; F152-V155 HydrophobicContact CE1-CB 3.89Å; F152-V155 HydrophobicContact CE1-CG1 3.63Å; F152-V155 HydrophobicContact CE1-CG2 4.27Å; F152-V155 HydrophobicContact CG-CB 4.17Å; V155-D159 HydrophobicContact CG1-CB 3.25Å
156	L	49.4	Very low	58.6	Low	136 Å²	136	88.1 Å²	88.1	71%	0.712	51%	0.506	S	S	*	.			trans	-68.3	147.9	177.5	-70.3	165.3	0	0	0	109.9	D158 D159	L156-D158 PolarHBondContact O-N 3.2Å; L156-D159 PolarHBondContact O-N 2.84Å
157	L	53.3	Low	58.3	Low	137 Å²	137	88.5 Å²	88.5	72%	0.717	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-47.5	-18.4	176.1	-87.9	148.3	0	0	0	114.9	L160	L157-L160 HydrophobicContact CD2-CD1 3.95Å
158	D	53.6	Low	58.5	Low	153 Å²	153	89.2 Å²	89.2	82%	0.818	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-79.8	-11.1	-179.7	-71.1	-22	0	0	0	114.5	L156	L156-D158 PolarHBondContact O-N 3.2Å
159	D	55	Low	59.2	Low	121 Å²	121	91.1 Å²	91.1	65%	0.647	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-106.3	8.7	-176.9	-79.6	-26.1	0	0	0	113.3	V155 L156	V155-D159 HydrophobicContact CG1-CB 3.25Å; L156-D159 PolarHBondContact O-N 2.84Å
160	L	57.1	Low	60.3	Low	29 Å²	29	92.3 Å²	92.3	15%	0.152	51%	0.511	C	S	.	.	S	Bend	trans	-68	142.2	173.8	-86.7	146.4	0	0	0	111.9	F152 L157 L165	F152-L160 HydrophobicContact CD2-CD2 3.74Å; F152-L160 HydrophobicContact CD2-CG 4.06Å; F152-L160 HydrophobicContact CE1-CG 4.33Å; F152-L160 HydrophobicContact CE2-CB 4.49Å; F152-L160 HydrophobicContact CE2-CD1 4.47Å; F152-L160 HydrophobicContact CE2-CD2 2.97Å; F152-L160 HydrophobicContact CE2-CG 3.44Å; F152-L160 VanDerWaalsContact CE2-CG 3.44Å; F152-L160 HydrophobicContact CZ-CB 4.19Å; F152-L160 HydrophobicContact CZ-CD2 3.47Å; F152-L160 VanDerWaalsContact CZ-CD2 3.47Å; F152-L160 HydrophobicContact CZ-CG 3.51Å; L157-L160 HydrophobicContact CD2-CD1 3.95Å; L160-L165 HydrophobicContact CB-CD1 4.06Å; L160-L165 HydrophobicContact CB-CD2 4.13Å; L160-L165 HydrophobicContact CB-CG 3.71Å; L160-L165 HydrophobicContact CD1-CD2 3.97Å; L160-L165 HydrophobicContact CD1-CG 4.43Å
161	S	59.7	Low	62	Low	50 Å²	50	90.7 Å²	90.7	35%	0.35	50%	0.501	S	S	.	.			trans	-61.1	147.4	170.7	87.9	0	0	0	0	110.3	E163 S164 L165	S161-E163 PolarHBondContact O-N 3.46Å; S161-E163 VanDerWaalsContact O-N 3.16Å; S161-S164 PolarHBondContact O-N 2.73Å; S161-S164 VanDerWaalsContact O-N 3.15Å; S161-S164 PolarHBondContact OG-N 3.24Å; S161-S164 VanDerWaalsContact OG-N 3.15Å; S161-S164 PolarHBondContact OG-OG 2.91Å; S161-L165 PolarHBondContact O-N 2.86Å
162	P	64	Low	64.1	Low	110 Å²	110	86 Å²	86	71%	0.714	48%	0.48	S	S	*	.	H	α-helix	trans	-59.3	-26.7	179.3	21.6	-31.6	0	0	0	113.1	S166	P162-S166 PolarHBondContact O-N 3.48Å
163	E	63.5	Low	66.2	Low	150 Å²	150	87.5 Å²	87.5	70%	0.701	49%	0.49	S	S	*	.	H	α-helix	trans	-70.2	-49.9	174.5	-72.4	166	-175.6	0	0	110.9	S161 L165 S166 I167	S161-E163 PolarHBondContact O-N 3.46Å; S161-E163 VanDerWaalsContact O-N 3.16Å; E163-L165 VanDerWaalsContact C-N 3.29Å; E163-L165 PolarHBondContact O-N 2.83Å; E163-S166 WeakPolarHBondContact O-CA 3.34Å; E163-S166 VanDerWaalsContact O-CB 3.28Å; E163-S166 WeakPolarHBondContact O-CB 3.44Å; E163-S166 PolarHBondContact O-N 3.43Å; E163-I167 VanDerWaalsContact O-CD1 3.29Å; E163-I167 WeakPolarHBondContact O-CD1 3.27Å; E163-I167 WeakPolarHBondContact O-CG1 3.03Å; E163-I167 PolarHBondContact O-N 3.13Å; E163-I167 VanDerWaalsContact O-N 3.14Å
164	S	65	Low	68.6	Low	38 Å²	38	77.9 Å²	77.9	27%	0.266	45%	0.446	S	S	.	.	H	α-helix	trans	-57.5	-39.7	176	-54.7	0	0	0	0	112.6	S161 I167 V168	S161-S164 PolarHBondContact O-N 2.73Å; S161-S164 VanDerWaalsContact O-N 3.15Å; S161-S164 PolarHBondContact OG-N 3.24Å; S161-S164 VanDerWaalsContact OG-N 3.15Å; S161-S164 PolarHBondContact OG-OG 2.91Å; S164-I167 PolarHBondContact O-N 2.85Å; S164-V168 WeakPolarHBondContact O-CG2 3.48Å; S164-V168 PolarHBondContact O-N 3.33Å; S164-V168 VanDerWaalsContact O-N 3.1Å
165	L	70.8	Confident	70.5	Confident	63 Å²	63	74.6 Å²	74.6	33%	0.33	41%	0.409	S	S	.	.	H	α-helix	trans	-64.3	-39.2	174.1	-77.9	163.2	0	0	0	112.6	L160 S161 E163 N169	L160-L165 HydrophobicContact CB-CD1 4.06Å; L160-L165 HydrophobicContact CB-CD2 4.13Å; L160-L165 HydrophobicContact CB-CG 3.71Å; L160-L165 HydrophobicContact CD1-CD2 3.97Å; L160-L165 HydrophobicContact CD1-CG 4.43Å; S161-L165 PolarHBondContact O-N 2.86Å; E163-L165 VanDerWaalsContact C-N 3.29Å; E163-L165 PolarHBondContact O-N 2.83Å; L165-N169 VanDerWaalsContact O-CB 3.31Å; L165-N169 WeakPolarHBondContact O-CB 3.44Å; L165-N169 PolarHBondContact O-N 2.61Å; L165-N169 PolarHBondContact O-ND2 2.84Å
166	S	75.2	Confident	72.6	Confident	77 Å²	77	75.6 Å²	75.6	54%	0.538	41%	0.413	S	S	.	.	H	α-helix	trans	-61.5	-44	177.7	-174.7	0	0	0	0	111.7	P162 E163 N169 R170	P162-S166 PolarHBondContact O-N 3.48Å; E163-S166 WeakPolarHBondContact O-CA 3.34Å; E163-S166 VanDerWaalsContact O-CB 3.28Å; E163-S166 WeakPolarHBondContact O-CB 3.44Å; E163-S166 PolarHBondContact O-N 3.43Å; S166-N169 PolarHBondContact O-N 3.2Å; S166-R170 PolarHBondContact O-N 3.42Å
167	I	74.4	Confident	74.7	Confident	25 Å²	25	72.9 Å²	72.9	13%	0.128	40%	0.396	C	S	.	.	H	α-helix	trans	-66.4	-48.7	-179.6	-61.1	146.5	0	0	0	110.9	E91 V147 E163 S164 N169 R170 F171	E91-I167 HydrophobicContact CG-CD1 4.47Å; E91-I167 WeakPolarHBondContact OE1-CD1 3.31Å; E91-I167 WeakPolarHBondContact OE2-CD1 3.5Å; E91-I167 WeakPolarHBondContact OE2-CG1 3.49Å; V147-I167 HydrophobicContact CG1-CG2 3.8Å; E163-I167 VanDerWaalsContact O-CD1 3.29Å; E163-I167 WeakPolarHBondContact O-CD1 3.27Å; E163-I167 WeakPolarHBondContact O-CG1 3.03Å; E163-I167 PolarHBondContact O-N 3.13Å; E163-I167 VanDerWaalsContact O-N 3.14Å; S164-I167 PolarHBondContact O-N 2.85Å; I167-N169 VanDerWaalsContact C-N 3.26Å; I167-N169 PolarHBondContact O-N 3.46Å; I167-R170 WeakPolarHBondContact O-CB 3.35Å; I167-R170 PolarHBondContact O-N 3.43Å; I167-R170 VanDerWaalsContact O-N 3.09Å; I167-F171 HydrophobicContact CG2-CD2 3.79Å; I167-F171 HydrophobicContact CG2-CE2 3.87Å; I167-F171 WeakPolarHBondContact O-CD2 3.3Å; I167-F171 PolarHBondContact O-N 3.37Å
168	V	78.5	Confident	76.7	Confident	35 Å²	35	66.7 Å²	66.7	21%	0.212	36%	0.364	C	S	.	.	H	α-helix	trans	-58.8	-40.9	176.7	172.9	0	0	0	0	110.6	L144 T148 S164 S172	L144-V168 HydrophobicContact CD1-CG1 4.48Å; T148-V168 HydrophobicContact CG2-CG1 4.46Å; T148-V168 HydrophobicContact CG2-CG2 4.19Å; S164-V168 WeakPolarHBondContact O-CG2 3.48Å; S164-V168 PolarHBondContact O-N 3.33Å; S164-V168 VanDerWaalsContact O-N 3.1Å; V168-S172 WeakPolarHBondContact O-CB 3.45Å; V168-S172 PolarHBondContact O-N 3.38Å
169	N	83.5	Confident	78.5	Confident	106 Å²	106	60.2 Å²	60.2	57%	0.567	33%	0.331	S	S	*	.	H	α-helix	trans	-64	-41.1	175.3	-75.4	-35.3	0	0	0	112.5	L165 S166 I167 S172 L173	L165-N169 VanDerWaalsContact O-CB 3.31Å; L165-N169 WeakPolarHBondContact O-CB 3.44Å; L165-N169 PolarHBondContact O-N 2.61Å; L165-N169 PolarHBondContact O-ND2 2.84Å; S166-N169 PolarHBondContact O-N 3.2Å; I167-N169 VanDerWaalsContact C-N 3.26Å; I167-N169 PolarHBondContact O-N 3.46Å; N169-S172 PolarHBondContact O-N 3.27Å; N169-L173 WeakPolarHBondContact O-CB 3.3Å; N169-L173 PolarHBondContact O-N 2.85Å
170	R	85.2	Confident	80.3	Confident	102 Å²	102	58.1 Å²	58.1	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-48.5	177.6	-174.3	173.4	-179.4	150.8	-3.6	111.8	E92 S95 S166 I167 L173 L174	E92-R170 IonicContact OE1-NH1 2.74Å; S95-R170 PolarHBondContact OG-NE 2.91Å; S95-R170 PolarHBondContact OG-NH2 2.92Å; S166-R170 PolarHBondContact O-N 3.42Å; I167-R170 WeakPolarHBondContact O-CB 3.35Å; I167-R170 PolarHBondContact O-N 3.43Å; I167-R170 VanDerWaalsContact O-N 3.09Å; R170-L173 WeakPolarHBondContact O-CB 3.45Å; R170-L173 PolarHBondContact O-N 3.49Å; R170-L174 PolarHBondContact O-N 2.64Å
171	F	86.7	Confident	82	Confident	3 Å²	3	58.4 Å²	58.4	1%	0.013	32%	0.323	C	S	.	.	H	α-helix	trans	-68.8	-32.9	176.5	-78.8	-76.5	0	0	0	112.6	L94 L143 V147 I167 L173 L174 T175	L94-F171 HydrophobicContact CD2-CZ 4.15Å; L94-F171 HydrophobicContact CG-CZ 4.18Å; L143-F171 HydrophobicContact CD1-CD1 3.99Å; L143-F171 HydrophobicContact CD1-CE1 3.95Å; L143-F171 HydrophobicContact CD2-CD1 3.94Å; L143-F171 HydrophobicContact CD2-CE1 4.47Å; L143-F171 HydrophobicContact CG-CD1 3.94Å; L143-F171 HydrophobicContact CG-CE1 4.41Å; V147-F171 HydrophobicContact CB-CD2 4.48Å; V147-F171 HydrophobicContact CG1-CD2 3.88Å; V147-F171 HydrophobicContact CG1-CE2 4.38Å; V147-F171 HydrophobicContact CG2-CD1 4.41Å; V147-F171 HydrophobicContact CG2-CD2 3.9Å; V147-F171 HydrophobicContact CG2-CE2 4.01Å; V147-F171 HydrophobicContact CG2-CG 4.1Å; V147-F171 HydrophobicContact CG2-CZ 4.33Å; I167-F171 HydrophobicContact CG2-CD2 3.79Å; I167-F171 HydrophobicContact CG2-CE2 3.87Å; I167-F171 WeakPolarHBondContact O-CD2 3.3Å; I167-F171 PolarHBondContact O-N 3.37Å; F171-L173 VanDerWaalsContact C-N 3.32Å; F171-L173 PolarHBondContact O-N 3.42Å; F171-L174 HydrophobicContact CD1-CD1 4.2Å; F171-L174 HydrophobicContact CE1-CD1 4.43Å; F171-L174 PolarHBondContact O-N 3.23Å; F171-T175 VanDerWaalsContact O-CG2 3.31Å; F171-T175 WeakPolarHBondContact O-CG2 3.29Å; F171-T175 PolarHBondContact O-N 3.39Å; F171-T175 PolarHBondContact O-OG1 2.93Å
172	S	87.6	Confident	83.6	Confident	43 Å²	43	56.2 Å²	56.2	30%	0.301	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-39.5	170.7	-171.2	0	0	0	0	111.7	V168 N169 T175 N176	V168-S172 WeakPolarHBondContact O-CB 3.45Å; V168-S172 PolarHBondContact O-N 3.38Å; N169-S172 PolarHBondContact O-N 3.27Å; S172-T175 WeakPolarHBondContact CA-OG1 3.5Å; S172-T175 PolarHBondContact O-OG1 3.08Å; S172-N176 WeakPolarHBondContact O-CB 3.4Å; S172-N176 PolarHBondContact O-N 3.1Å; S172-N176 VanDerWaalsContact O-N 3.09Å; S172-N176 PolarHBondContact O-ND2 2.97Å
173	L	90.3	Very high	85	Confident	106 Å²	106	51.4 Å²	51.4	56%	0.555	28%	0.277	S	S	*	.	H	α-helix	trans	-65	-45.6	174.3	-172.9	66.4	0	0	0	111.7	N169 R170 F171 N176 Q177	N169-L173 WeakPolarHBondContact O-CB 3.3Å; N169-L173 PolarHBondContact O-N 2.85Å; R170-L173 WeakPolarHBondContact O-CB 3.45Å; R170-L173 PolarHBondContact O-N 3.49Å; F171-L173 VanDerWaalsContact C-N 3.32Å; F171-L173 PolarHBondContact O-N 3.42Å; L173-N176 WeakPolarHBondContact O-CB 3.32Å; L173-N176 PolarHBondContact O-N 3.38Å; L173-Q177 WeakPolarHBondContact O-CG 3.46Å; L173-Q177 PolarHBondContact O-N 2.94Å
174	L	90.7	Very high	86.4	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-47.3	177.1	-75.2	173	0	0	0	112.1	E99 R170 F171 N176 Q177 F178	E99-L174 HydrophobicContact CB-CD2 4.06Å; E99-L174 HydrophobicContact CG-CD2 4.01Å; R170-L174 PolarHBondContact O-N 2.64Å; F171-L174 HydrophobicContact CD1-CD1 4.2Å; F171-L174 HydrophobicContact CE1-CD1 4.43Å; F171-L174 PolarHBondContact O-N 3.23Å; L174-N176 VanDerWaalsContact C-N 3.28Å; L174-N176 PolarHBondContact O-N 2.92Å; L174-Q177 CarbonylContact O-C 3.55Å; L174-Q177 WeakPolarHBondContact O-CA 3.49Å; L174-Q177 WeakPolarHBondContact O-CB 3.41Å; L174-Q177 PolarHBondContact O-N 3.3Å; L174-F178 HydrophobicContact CB-CE2 3.97Å; L174-F178 HydrophobicContact CB-CZ 3.96Å; L174-F178 HydrophobicContact CD2-CE1 4.41Å; L174-F178 HydrophobicContact CD2-CZ 4.09Å; L174-F178 WeakPolarHBondContact O-CD1 3.41Å; L174-F178 VanDerWaalsContact O-CD2 3.32Å; L174-F178 WeakPolarHBondContact O-CD2 3.09Å; L174-F178 WeakPolarHBondContact O-CG 3.39Å; L174-F178 PolarHBondContact O-N 2.86Å
175	T	91	Very high	87.7	Confident	12 Å²	12	47.8 Å²	47.8	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-34.1	178.2	53.6	0	0	0	0	112.7	N140 L143 F171 S172 S179	N140-T175 HydrophobicContact CB-CG2 3.79Å; N140-T175 PolarHBondContact ND2-O 3.39Å; L143-T175 HydrophobicContact CD2-CG2 3.95Å; F171-T175 VanDerWaalsContact O-CG2 3.31Å; F171-T175 WeakPolarHBondContact O-CG2 3.29Å; F171-T175 PolarHBondContact O-N 3.39Å; F171-T175 PolarHBondContact O-OG1 2.93Å; S172-T175 WeakPolarHBondContact CA-OG1 3.5Å; S172-T175 PolarHBondContact O-OG1 3.08Å; T175-S179 WeakPolarHBondContact O-CB 3Å; T175-S179 PolarHBondContact O-N 2.97Å; T175-S179 PolarHBondContact O-OG 3.45Å
176	N	91.1	Very high	88.7	Confident	83 Å²	83	44.9 Å²	44.9	44%	0.444	24%	0.241	S	C	.	.	H	α-helix	trans	-66.2	-43.7	170.4	-79.3	-52.6	0	0	0	111.7	S172 L173 L174 S179 N180	S172-N176 WeakPolarHBondContact O-CB 3.4Å; S172-N176 PolarHBondContact O-N 3.1Å; S172-N176 VanDerWaalsContact O-N 3.09Å; S172-N176 PolarHBondContact O-ND2 2.97Å; L173-N176 WeakPolarHBondContact O-CB 3.32Å; L173-N176 PolarHBondContact O-N 3.38Å; L174-N176 VanDerWaalsContact C-N 3.28Å; L174-N176 PolarHBondContact O-N 2.92Å; N176-S179 PolarHBondContact O-N 3.16Å; N176-N180 WeakPolarHBondContact O-CB 3.4Å; N176-N180 PolarHBondContact O-N 3.45Å; N176-N180 PolarHBondContact O-ND2 2.79Å
177	Q	93.5	Very high	89.5	Confident	79 Å²	79	42.5 Å²	42.5	37%	0.369	22%	0.222	S	C	.	.	H	α-helix	trans	-59.6	-46.2	174.3	-72.3	176.4	-6.8	0	0	111.6	L173 L174 S179 N180 S181	L173-Q177 WeakPolarHBondContact O-CG 3.46Å; L173-Q177 PolarHBondContact O-N 2.94Å; L174-Q177 CarbonylContact O-C 3.55Å; L174-Q177 WeakPolarHBondContact O-CA 3.49Å; L174-Q177 WeakPolarHBondContact O-CB 3.41Å; L174-Q177 PolarHBondContact O-N 3.3Å; Q177-S179 VanDerWaalsContact C-N 3.34Å; Q177-S179 PolarHBondContact O-N 3.06Å; Q177-N180 PolarHBondContact O-N 3.39Å; Q177-N180 VanDerWaalsContact O-N 3.15Å; Q177-S181 PolarHBondContact O-N 2.7Å; Q177-S181 PolarHBondContact O-OG 3.23Å; Q177-S181 VanDerWaalsContact O-OG 3.13Å
178	F	93.6	Very high	90.4	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.035	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-39	178.1	-55.9	-27	0	0	0	112.4	V98 M102 F106 V136 F139 L143 L174 N180 S181 A182	V98-F178 HydrophobicContact CG1-CE2 3.88Å; V98-F178 HydrophobicContact CG1-CZ 3.97Å; M102-F178 HydrophobicContact CB-CD1 3.87Å; M102-F178 HydrophobicContact CB-CE1 3.46Å; M102-F178 VanDerWaalsContact CB-CE1 3.46Å; M102-F178 HydrophobicContact CB-CE2 4.32Å; M102-F178 HydrophobicContact CB-CG 4.47Å; M102-F178 HydrophobicContact CB-CZ 3.71Å; M102-F178 HydrophobicContact CE-CB 4.05Å; M102-F178 HydrophobicContact CE-CD1 4.22Å; M102-F178 HydrophobicContact CE-CD2 4.06Å; M102-F178 HydrophobicContact CE-CG 3.85Å; M102-F178 HydrophobicContact CG-CD1 4.26Å; M102-F178 HydrophobicContact CG-CD2 4.17Å; M102-F178 HydrophobicContact CG-CE1 3.89Å; M102-F178 HydrophobicContact CG-CE2 3.8Å; M102-F178 HydrophobicContact CG-CG 4.41Å; M102-F178 HydrophobicContact CG-CZ 3.64Å; F106-F178 HydrophobicContact CE2-CB 3.96Å; F106-F178 AromaticContact CE2-CD1 3.87Å; F106-F178 HydrophobicContact CE2-CD1 3.87Å; F106-F178 HydrophobicContact CE2-CG 4.21Å; F106-F178 HydrophobicContact CZ-CB 3.99Å; F106-F178 VanDerWaalsContact CZ-O 3.26Å; F106-F178 WeakPolarHBondContact CZ-O 3.14Å; V136-F178 HydrophobicContact CG1-CB 4.23Å; F139-F178 HydrophobicContact CE1-CD2 4.25Å; F139-F178 HydrophobicContact CE1-CE2 4.21Å; L143-F178 HydrophobicContact CD2-CE2 4.34Å; L174-F178 HydrophobicContact CB-CE2 3.97Å; L174-F178 HydrophobicContact CB-CZ 3.96Å; L174-F178 HydrophobicContact CD2-CE1 4.41Å; L174-F178 HydrophobicContact CD2-CZ 4.09Å; L174-F178 WeakPolarHBondContact O-CD1 3.41Å; L174-F178 VanDerWaalsContact O-CD2 3.32Å; L174-F178 WeakPolarHBondContact O-CD2 3.09Å; L174-F178 WeakPolarHBondContact O-CG 3.39Å; L174-F178 PolarHBondContact O-N 2.86Å; F178-N180 VanDerWaalsContact C-N 3.34Å; F178-S181 PolarHBondContact O-N 3.39Å; F178-A182 WeakPolarHBondContact O-CB 3.45Å; F178-A182 PolarHBondContact O-N 3.34Å
179	S	92.2	Very high	91	Very high	17 Å²	17	41.6 Å²	41.6	12%	0.119	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-42.1	173.6	-62.1	0	0	0	0	111.7	Q137 N140 T175 N176 Q177 L183	Q137-S179 PolarHBondContact NE2-OG 2.97Å; N140-S179 PolarHBondContact ND2-OG 3Å; T175-S179 WeakPolarHBondContact O-CB 3Å; T175-S179 PolarHBondContact O-N 2.97Å; T175-S179 PolarHBondContact O-OG 3.45Å; N176-S179 PolarHBondContact O-N 3.16Å; Q177-S179 VanDerWaalsContact C-N 3.34Å; Q177-S179 PolarHBondContact O-N 3.06Å; S179-L183 WeakPolarHBondContact O-CG 3.44Å; S179-L183 PolarHBondContact O-N 3.17Å; S179-L183 VanDerWaalsContact O-N 3.08Å
180	N	92.2	Very high	91.4	Very high	77 Å²	77	36.6 Å²	36.6	41%	0.412	19%	0.188	S	C	.	.	H	α-helix	trans	-67.5	-42	177.1	-69.5	-26.3	0	0	0	111.7	N176 Q177 F178 A182 L183 E184	N176-N180 WeakPolarHBondContact O-CB 3.4Å; N176-N180 PolarHBondContact O-N 3.45Å; N176-N180 PolarHBondContact O-ND2 2.79Å; Q177-N180 PolarHBondContact O-N 3.39Å; Q177-N180 VanDerWaalsContact O-N 3.15Å; F178-N180 VanDerWaalsContact C-N 3.34Å; N180-A182 PolarHBondContact O-N 2.71Å; N180-L183 CarbonylContact O-C 3.59Å; N180-L183 PolarHBondContact O-N 2.67Å; N180-E184 WeakPolarHBondContact O-CB 3.31Å; N180-E184 PolarHBondContact O-N 3.34Å
181	S	93.5	Very high	91.8	Very high	34 Å²	34	38.7 Å²	38.7	24%	0.238	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-42.6	175.6	-63.6	0	0	0	0	111.9	Q177 F178 E184 I185	Q177-S181 PolarHBondContact O-N 2.7Å; Q177-S181 PolarHBondContact O-OG 3.23Å; Q177-S181 VanDerWaalsContact O-OG 3.13Å; F178-S181 PolarHBondContact O-N 3.39Å; S181-E184 PolarHBondContact O-N 2.85Å; S181-I185 WeakPolarHBondContact O-CG1 3.41Å; S181-I185 PolarHBondContact O-N 2.91Å
182	A	93.2	Very high	92	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-43.8	174.3	0	0	0	0	0	111.9	F106 V136 F178 N180 I185 I186	F106-A182 HydrophobicContact CE1-CB 4.07Å; V136-A182 HydrophobicContact CG1-CB 4.32Å; F178-A182 WeakPolarHBondContact O-CB 3.45Å; F178-A182 PolarHBondContact O-N 3.34Å; N180-A182 PolarHBondContact O-N 2.71Å; A182-I185 PolarHBondContact O-N 3.38Å; A182-I186 WeakPolarHBondContact O-CD1 3.28Å; A182-I186 VanDerWaalsContact O-CG1 3.31Å; A182-I186 WeakPolarHBondContact O-CG1 3.41Å; A182-I186 PolarHBondContact O-N 2.95Å; A182-I186 VanDerWaalsContact O-N 3.13Å
183	L	92.2	Very high	92.2	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.047	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-33.5	175.9	-73.6	172.1	0	0	0	112.8	S179 N180 I186 N187 F276 K279 F282	S179-L183 WeakPolarHBondContact O-CG 3.44Å; S179-L183 PolarHBondContact O-N 3.17Å; S179-L183 VanDerWaalsContact O-N 3.08Å; N180-L183 CarbonylContact O-C 3.59Å; N180-L183 PolarHBondContact O-N 2.67Å; L183-I186 HydrophobicContact CD2-CD1 4.46Å; L183-I186 PolarHBondContact O-N 3.2Å; L183-N187 WeakPolarHBondContact O-CB 3.28Å; L183-N187 PolarHBondContact O-N 2.92Å; L183-N187 PolarHBondContact O-ND2 2.81Å; L183-F276 HydrophobicContact CD2-CB 4.18Å; L183-K279 HydrophobicContact CD2-CB 4.29Å; L183-K279 HydrophobicContact CD2-CG 4.27Å; L183-F282 HydrophobicContact CD2-CB 4.21Å
184	E	93	Very high	92.3	Very high	107 Å²	107	34.6 Å²	34.6	50%	0.5	17%	0.17	S	C	.	.	H	α-helix	trans	-64.7	-45.9	175.7	-172.7	-174.2	-163.6	0	0	110.7	R110 N180 S181 I186 N187 Q188	R110-E184 IonicContact NH2-OE2 2.92Å; R110-E184 PolarHBondContact NH2-OE2 3.3Å; R110-E184 VanDerWaalsContact NH2-OE2 3.12Å; N180-E184 WeakPolarHBondContact O-CB 3.31Å; N180-E184 PolarHBondContact O-N 3.34Å; S181-E184 PolarHBondContact O-N 2.85Å; E184-I186 VanDerWaalsContact C-N 3.32Å; E184-I186 PolarHBondContact O-N 2.8Å; E184-N187 PolarHBondContact O-N 3.24Å; E184-Q188 VanDerWaalsContact O-CB 3.3Å; E184-Q188 WeakPolarHBondContact O-CB 3.29Å; E184-Q188 PolarHBondContact O-N 3.24Å
185	I	92.6	Very high	92.4	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-45.8	175	-67.5	168.8	0	0	0	110.3	F106 V109 R110 L129 S181 A182 N187 Q188 V189	F106-I185 HydrophobicContact CB-CD1 4.21Å; F106-I185 HydrophobicContact CD1-CD1 3.63Å; F106-I185 HydrophobicContact CG-CD1 4.35Å; V109-I185 HydrophobicContact CB-CD1 4.31Å; V109-I185 HydrophobicContact CG1-CD1 3.96Å; V109-I185 HydrophobicContact CG1-CG2 4.12Å; R110-I185 HydrophobicContact CB-CD1 4.41Å; R110-I185 HydrophobicContact CB-CG1 4.35Å; L129-I185 HydrophobicContact CD2-CG2 4.43Å; S181-I185 WeakPolarHBondContact O-CG1 3.41Å; S181-I185 PolarHBondContact O-N 2.91Å; A182-I185 PolarHBondContact O-N 3.38Å; I185-N187 PolarHBondContact O-N 3.48Å; I185-Q188 WeakPolarHBondContact O-CB 3.35Å; I185-Q188 PolarHBondContact O-N 2.76Å; I185-V189 HydrophobicContact CG2-CG2 4.38Å; I185-V189 VanDerWaalsContact O-CG2 3.29Å; I185-V189 WeakPolarHBondContact O-CG2 3.4Å; I185-V189 PolarHBondContact O-N 3.06Å
186	I	92.9	Very high	92.5	Very high	3 Å²	3	41 Å²	41	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-47.7	177.2	-67.1	163.7	0	0	0	111	L129 H133 A182 L183 E184 Q188 V189 A190 F276 F282	L129-I186 HydrophobicContact CB-CG1 4.24Å; L129-I186 HydrophobicContact CD1-CG2 4.47Å; L129-I186 HydrophobicContact CD2-CG1 4.02Å; L129-I186 HydrophobicContact CG-CG1 4.49Å; H133-I186 HydrophobicContact CB-CD1 3.95Å; A182-I186 WeakPolarHBondContact O-CD1 3.28Å; A182-I186 VanDerWaalsContact O-CG1 3.31Å; A182-I186 WeakPolarHBondContact O-CG1 3.41Å; A182-I186 PolarHBondContact O-N 2.95Å; A182-I186 VanDerWaalsContact O-N 3.13Å; L183-I186 HydrophobicContact CD2-CD1 4.46Å; L183-I186 PolarHBondContact O-N 3.2Å; E184-I186 VanDerWaalsContact C-N 3.32Å; E184-I186 PolarHBondContact O-N 2.8Å; I186-Q188 VanDerWaalsContact C-N 3.28Å; I186-Q188 PolarHBondContact O-N 3.29Å; I186-V189 PolarHBondContact O-N 3.28Å; I186-A190 VanDerWaalsContact O-CB 3.3Å; I186-A190 WeakPolarHBondContact O-CB 3.3Å; I186-A190 PolarHBondContact O-N 3.36Å; I186-F276 HydrophobicContact CD1-CB 3.72Å; I186-F276 HydrophobicContact CD1-CD1 3.87Å; I186-F276 HydrophobicContact CD1-CD2 4.41Å; I186-F276 HydrophobicContact CD1-CG 3.76Å; I186-F276 HydrophobicContact CG2-CD2 3.7Å; I186-F276 HydrophobicContact CG2-CE2 3.78Å; I186-F276 HydrophobicContact CG2-CG 4.13Å; I186-F276 HydrophobicContact CG2-CZ 4.25Å; I186-F282 HydrophobicContact CG2-CD2 3.73Å; I186-F282 HydrophobicContact CG2-CE2 3.5Å; I186-F282 VanDerWaalsContact CG2-CE2 3.5Å; I186-F282 HydrophobicContact CG2-CZ 4.12Å
187	N	91.8	Very high	92.6	Very high	27 Å²	27	39.1 Å²	39.1	14%	0.144	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-39.5	177.3	-85.7	-68.5	0	0	0	112.1	L183 E184 I185 R191 F282 S285 Q290	L183-N187 WeakPolarHBondContact O-CB 3.28Å; L183-N187 PolarHBondContact O-N 2.92Å; L183-N187 PolarHBondContact O-ND2 2.81Å; E184-N187 PolarHBondContact O-N 3.24Å; I185-N187 PolarHBondContact O-N 3.48Å; N187-R191 VanDerWaalsContact O-CB 3.29Å; N187-R191 WeakPolarHBondContact O-CB 3.47Å; N187-R191 PolarHBondContact O-N 2.76Å; N187-F282 WeakPolarHBondContact OD1-CD2 3.29Å; N187-S285 VanDerWaalsContact OD1-CB 3.28Å; N187-S285 WeakPolarHBondContact OD1-CB 3.49Å; N187-S285 PolarHBondContact OD1-OG 3.36Å; N187-Q290 PolarHBondContact O-NE2 3.48Å; N187-Q290 VanDerWaalsContact O-NE2 3.16Å
188	Q	92.5	Very high	92.7	Very high	39 Å²	39	37.6 Å²	37.6	18%	0.182	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-46.9	179.2	-177.8	175.7	0.8	0	0	111.4	E114 E184 I185 I186 R191 M192	E114-Q188 PolarHBondContact OE1-NE2 3.26Å; E184-Q188 VanDerWaalsContact O-CB 3.3Å; E184-Q188 WeakPolarHBondContact O-CB 3.29Å; E184-Q188 PolarHBondContact O-N 3.24Å; I185-Q188 WeakPolarHBondContact O-CB 3.35Å; I185-Q188 PolarHBondContact O-N 2.76Å; I186-Q188 VanDerWaalsContact C-N 3.28Å; I186-Q188 PolarHBondContact O-N 3.29Å; Q188-R191 PolarHBondContact O-N 3.2Å; Q188-M192 WeakPolarHBondContact O-CG 3.38Å; Q188-M192 PolarHBondContact O-N 2.93Å
189	V	92	Very high	92.8	Very high	2 Å²	2	41 Å²	41	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-44.1	177.9	174.6	0	0	0	0	111	F113 L125 L129 I185 I186 R191 M192 Q193	F113-V189 HydrophobicContact CB-CG2 3.68Å; F113-V189 HydrophobicContact CD1-CG2 4.38Å; F113-V189 HydrophobicContact CG-CG2 4.43Å; L125-V189 HydrophobicContact CD1-CG1 4.06Å; L125-V189 HydrophobicContact CD2-CG1 3.7Å; L125-V189 HydrophobicContact CG-CG1 4.05Å; L129-V189 HydrophobicContact CD1-CB 4.17Å; L129-V189 HydrophobicContact CD1-CG1 3.89Å; L129-V189 HydrophobicContact CD2-CG2 4.31Å; I185-V189 HydrophobicContact CG2-CG2 4.38Å; I185-V189 VanDerWaalsContact O-CG2 3.29Å; I185-V189 WeakPolarHBondContact O-CG2 3.4Å; I185-V189 PolarHBondContact O-N 3.06Å; I186-V189 PolarHBondContact O-N 3.28Å; V189-R191 VanDerWaalsContact C-N 3.3Å; V189-R191 PolarHBondContact O-N 3.5Å; V189-M192 PolarHBondContact O-N 3.33Å; V189-Q193 PolarHBondContact O-N 2.97Å
190	A	91.5	Very high	92.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.4	-43.8	173.7	0	0	0	0	0	111.3	I186 M192 Q193 T194 F269 F282 F286	I186-A190 VanDerWaalsContact O-CB 3.3Å; I186-A190 WeakPolarHBondContact O-CB 3.3Å; I186-A190 PolarHBondContact O-N 3.36Å; A190-M192 PolarHBondContact O-N 2.69Å; A190-Q193 PolarHBondContact O-N 2.75Å; A190-Q193 VanDerWaalsContact O-N 3.16Å; A190-T194 PolarHBondContact O-N 3.23Å; A190-T194 PolarHBondContact O-OG1 2.96Å; A190-T194 VanDerWaalsContact O-OG1 3.12Å; A190-F269 HydrophobicContact CB-CD1 4.13Å; A190-F269 HydrophobicContact CB-CE1 3.9Å; A190-F269 HydrophobicContact CB-CZ 4.2Å; A190-F282 HydrophobicContact CB-CE2 4.13Å; A190-F282 HydrophobicContact CB-CZ 4.47Å; A190-F286 HydrophobicContact CB-CD2 3.82Å; A190-F286 HydrophobicContact CB-CE2 3.93Å
191	R	93	Very high	93.1	Very high	147 Å²	147	38.8 Å²	38.8	56%	0.555	19%	0.185	S	C	*	.	H	α-helix	trans	-63.6	-41.4	177.8	-176.5	179.8	66.8	179.9	-0.9	112.3	N187 Q188 V189 Q193 T195 Q290	N187-R191 VanDerWaalsContact O-CB 3.29Å; N187-R191 WeakPolarHBondContact O-CB 3.47Å; N187-R191 PolarHBondContact O-N 2.76Å; Q188-R191 PolarHBondContact O-N 3.2Å; V189-R191 VanDerWaalsContact C-N 3.3Å; V189-R191 PolarHBondContact O-N 3.5Å; R191-Q193 VanDerWaalsContact C-N 3.29Å; R191-T195 WeakPolarHBondContact O-CB 3.39Å; R191-T195 PolarHBondContact O-N 3.18Å; R191-T195 PolarHBondContact O-OG1 3.16Å; R191-Q290 VanDerWaalsContact CA-OE1 3.24Å
192	M	91.5	Very high	93.2	Very high	59 Å²	59	37.7 Å²	37.7	29%	0.291	18%	0.178	S	C	.	.	H	α-helix	trans	-61.1	-42.4	175.2	-71.1	179.7	74.7	0	0	110.6	E114 S117 Q188 V189 A190 T195 Y196	E114-M192 HydrophobicContact CB-CE 4.29Å; E114-M192 HydrophobicContact CB-SD 4.21Å; E114-M192 HydrophobicContact CG-SD 3.9Å; E114-M192 WeakPolarHBondContact O-CE 3.35Å; S117-M192 VanDerWaalsContact OG-CE 3.32Å; S117-M192 WeakPolarHBondContact OG-CE 3.42Å; Q188-M192 WeakPolarHBondContact O-CG 3.38Å; Q188-M192 PolarHBondContact O-N 2.93Å; V189-M192 PolarHBondContact O-N 3.33Å; A190-M192 PolarHBondContact O-N 2.69Å; M192-T195 PolarHBondContact O-N 3.4Å; M192-Y196 PolarHBondContact O-N 2.98Å
193	Q	91.2	Very high	93.4	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.009	20%	0.203	C	C	.	.	H	α-helix	trans	-67.5	-44.8	179.2	-165.2	61.8	-3.7	0	0	112.8	S117 V122 V189 A190 R191 T195 Y196 Y197 F269	S117-Q193 PolarHBondContact O-OE1 3.33Å; V122-Q193 VanDerWaalsContact CG2-NE2 3.33Å; V189-Q193 PolarHBondContact O-N 2.97Å; A190-Q193 PolarHBondContact O-N 2.75Å; A190-Q193 VanDerWaalsContact O-N 3.16Å; R191-Q193 VanDerWaalsContact C-N 3.29Å; Q193-T195 VanDerWaalsContact C-N 3.27Å; Q193-T195 PolarHBondContact O-N 3.28Å; Q193-Y196 WeakPolarHBondContact O-CB 3.43Å; Q193-Y196 PolarHBondContact O-N 2.74Å; Q193-Y197 HydrophobicContact CG-CD2 3.86Å; Q193-Y197 HydrophobicContact CG-CE2 3.68Å; Q193-Y197 VanDerWaalsContact NE2-CE2 3.26Å; Q193-Y197 WeakPolarHBondContact O-CD2 3.25Å; Q193-Y197 PolarHBondContact O-N 3.44Å; Q193-F269 HydrophobicContact CB-CE2 4.09Å; Q193-F269 HydrophobicContact CB-CZ 4.1Å; Q193-F269 HydrophobicContact CG-CE2 3.98Å; Q193-F269 HydrophobicContact CG-CZ 4.28Å
194	T	92.3	Very high	93.6	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-36.2	174.4	-57.9	0	0	0	0	112	A190 F198 E266 Q290 L295	A190-T194 PolarHBondContact O-N 3.23Å; A190-T194 PolarHBondContact O-OG1 2.96Å; A190-T194 VanDerWaalsContact O-OG1 3.12Å; T194-F198 WeakPolarHBondContact O-CB 3.32Å; T194-F198 PolarHBondContact O-N 2.72Å; T194-E266 WeakPolarHBondContact CA-OE1 3.5Å; T194-E266 PolarHBondContact N-OE1 2.97Å; T194-E266 PolarHBondContact OG1-OE1 3.4Å; T194-Q290 HydrophobicContact CG2-CB 4.3Å; T194-L295 HydrophobicContact CG2-CB 3.85Å; T194-L295 HydrophobicContact CG2-CD1 4.47Å; T194-L295 HydrophobicContact CG2-CD2 4.45Å; T194-L295 HydrophobicContact CG2-CG 4.48Å
195	T	93.5	Very high	93.7	Very high	72 Å²	72	40 Å²	40	44%	0.442	19%	0.189	S	C	.	.	H	α-helix	trans	-66.9	-44.2	175.1	-54.5	0	0	0	0	111.3	R191 M192 Q193 Y197 F198 D199	R191-T195 WeakPolarHBondContact O-CB 3.39Å; R191-T195 PolarHBondContact O-N 3.18Å; R191-T195 PolarHBondContact O-OG1 3.16Å; M192-T195 PolarHBondContact O-N 3.4Å; Q193-T195 VanDerWaalsContact C-N 3.27Å; Q193-T195 PolarHBondContact O-N 3.28Å; T195-Y197 PolarHBondContact O-N 2.9Å; T195-F198 WeakPolarHBondContact O-CB 3.49Å; T195-F198 PolarHBondContact O-N 2.98Å; T195-D199 PolarHBondContact O-N 3.45Å
196	Y	92.7	Very high	93.9	Very high	83 Å²	83	42.2 Å²	42.2	33%	0.325	20%	0.203	S	C	.	.	H	α-helix	trans	-59.3	-47.5	175.7	169.1	-105.4	0	0	0	112.1	T118 M192 Q193 F198 D199 I200	T118-Y196 HydrophobicContact CG2-CD2 4.09Å; T118-Y196 HydrophobicContact CG2-CG 4.09Å; T118-Y196 WeakPolarHBondContact O-CE1 3.18Å; M192-Y196 PolarHBondContact O-N 2.98Å; Q193-Y196 WeakPolarHBondContact O-CB 3.43Å; Q193-Y196 PolarHBondContact O-N 2.74Å; Y196-F198 VanDerWaalsContact C-N 3.34Å; Y196-F198 PolarHBondContact O-N 3.02Å; Y196-D199 PolarHBondContact O-N 3.09Å; Y196-I200 HydrophobicContact CD1-CD1 4.03Å; Y196-I200 HydrophobicContact CD2-CD1 4.42Å; Y196-I200 HydrophobicContact CE1-CD1 3.45Å; Y196-I200 VanDerWaalsContact CE1-CD1 3.45Å; Y196-I200 HydrophobicContact CE2-CD1 3.89Å; Y196-I200 HydrophobicContact CG-CD1 4.49Å; Y196-I200 PolarHBondContact O-N 3.27Å; Y196-I200 VanDerWaalsContact O-N 3.12Å
197	Y	93	Very high	94	Very high	43 Å²	43	47.4 Å²	47.4	17%	0.169	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-33.3	176.2	-83	-62	0	0	0	113.2	V122 Q193 T195 I200 L201 V262 A265 E266	V122-Y197 HydrophobicContact CG2-CE2 4.19Å; V122-Y197 VanDerWaalsContact CG2-OH 3.32Å; V122-Y197 WeakPolarHBondContact CG2-OH 3.17Å; Q193-Y197 HydrophobicContact CG-CD2 3.86Å; Q193-Y197 HydrophobicContact CG-CE2 3.68Å; Q193-Y197 VanDerWaalsContact NE2-CE2 3.26Å; Q193-Y197 WeakPolarHBondContact O-CD2 3.25Å; Q193-Y197 PolarHBondContact O-N 3.44Å; T195-Y197 PolarHBondContact O-N 2.9Å; Y197-I200 PolarHBondContact O-N 3.18Å; Y197-L201 VanDerWaalsContact O-CB 3.26Å; Y197-L201 WeakPolarHBondContact O-CB 3.24Å; Y197-L201 PolarHBondContact O-N 3.23Å; Y197-V262 HydrophobicContact CD1-CG1 4.35Å; Y197-V262 HydrophobicContact CG-CG1 4.16Å; Y197-A265 HydrophobicContact CE1-CB 4.05Å; Y197-A265 HydrophobicContact CE2-CB 4.27Å; Y197-E266 HydrophobicContact CD2-CG 4.35Å; Y197-E266 WeakPolarHBondContact CD2-OE1 3.43Å
198	F	96	Very high	94.1	Very high	46 Å²	46	46.7 Å²	46.7	20%	0.202	22%	0.224	C	C	.	.	H	α-helix	trans	-61.2	-43.5	172	170.9	-95.6	0	0	0	111.7	T194 T195 Y196 L201 C202 L295 G298 F302	T194-F198 WeakPolarHBondContact O-CB 3.32Å; T194-F198 PolarHBondContact O-N 2.72Å; T195-F198 WeakPolarHBondContact O-CB 3.49Å; T195-F198 PolarHBondContact O-N 2.98Å; Y196-F198 VanDerWaalsContact C-N 3.34Å; Y196-F198 PolarHBondContact O-N 3.02Å; F198-L201 WeakPolarHBondContact O-CB 3.42Å; F198-L201 PolarHBondContact O-N 3.46Å; F198-C202 WeakPolarHBondContact CZ-SG 3.24Å; F198-C202 PolarHBondContact O-N 3.34Å; F198-C202 PolarHBondContact O-SG 3.02Å; F198-L295 HydrophobicContact CB-CD1 3.87Å; F198-L295 HydrophobicContact CD2-CD1 4.32Å; F198-G298 VanDerWaalsContact CE2-C 3.49Å; F198-F302 HydrophobicContact CZ-CB 4.42Å
199	D	95.3	Very high	94.2	Very high	81 Å²	81	45.6 Å²	45.6	43%	0.433	22%	0.219	S	C	.	.	H	α-helix	trans	-64.1	-44.1	177.7	-73.4	-23.1	0	0	0	111.7	T195 Y196 L201 C202 Q203	T195-D199 PolarHBondContact O-N 3.45Å; Y196-D199 PolarHBondContact O-N 3.09Å; D199-L201 VanDerWaalsContact C-N 3.32Å; D199-L201 PolarHBondContact O-N 2.93Å; D199-C202 PolarHBondContact O-N 3.41Å; D199-Q203 WeakPolarHBondContact O-CG 3.29Å; D199-Q203 PolarHBondContact O-N 2.97Å
200	I	94.1	Very high	94.2	Very high	46 Å²	46	48.4 Å²	48.4	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-44.7	173.4	-70.2	170.8	0	0	0	110.9	Y196 Y197 C202 Q203 N204	Y196-I200 HydrophobicContact CD1-CD1 4.03Å; Y196-I200 HydrophobicContact CD2-CD1 4.42Å; Y196-I200 HydrophobicContact CE1-CD1 3.45Å; Y196-I200 VanDerWaalsContact CE1-CD1 3.45Å; Y196-I200 HydrophobicContact CE2-CD1 3.89Å; Y196-I200 HydrophobicContact CG-CD1 4.49Å; Y196-I200 PolarHBondContact O-N 3.27Å; Y196-I200 VanDerWaalsContact O-N 3.12Å; Y197-I200 PolarHBondContact O-N 3.18Å; I200-C202 VanDerWaalsContact C-N 3.31Å; I200-C202 PolarHBondContact O-N 3.22Å; I200-Q203 PolarHBondContact O-N 2.99Å; I200-N204 WeakPolarHBondContact CG2-ND2 3.24Å; I200-N204 WeakPolarHBondContact O-CB 3.47Å; I200-N204 PolarHBondContact O-N 3.32Å; I200-N204 PolarHBondContact O-ND2 3.5Å
201	L	96.4	Very high	94.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-41.9	179	-179.2	59.3	0	0	0	111.6	Y197 F198 D199 A205 Q258 L259 V262 L295 Y299	Y197-L201 VanDerWaalsContact O-CB 3.26Å; Y197-L201 WeakPolarHBondContact O-CB 3.24Å; Y197-L201 PolarHBondContact O-N 3.23Å; F198-L201 WeakPolarHBondContact O-CB 3.42Å; F198-L201 PolarHBondContact O-N 3.46Å; D199-L201 VanDerWaalsContact C-N 3.32Å; D199-L201 PolarHBondContact O-N 2.93Å; L201-A205 PolarHBondContact O-N 3.27Å; L201-A205 VanDerWaalsContact O-N 3.1Å; L201-Q258 HydrophobicContact CD1-CB 3.66Å; L201-L259 HydrophobicContact CD1-CB 4.38Å; L201-L259 HydrophobicContact CD2-CB 4.38Å; L201-L259 HydrophobicContact CD2-CD1 3.69Å; L201-V262 HydrophobicContact CB-CG2 4.25Å; L201-V262 HydrophobicContact CD1-CG2 4.31Å; L201-L295 HydrophobicContact CD2-CD1 4.2Å; L201-Y299 HydrophobicContact CD1-CD2 4.37Å; L201-Y299 HydrophobicContact CD1-CE1 4.47Å; L201-Y299 HydrophobicContact CD1-CE2 3.95Å; L201-Y299 HydrophobicContact CD2-CD1 4Å; L201-Y299 HydrophobicContact CD2-CD2 3.58Å; L201-Y299 HydrophobicContact CD2-CE1 4.4Å; L201-Y299 HydrophobicContact CD2-CE2 4.03Å; L201-Y299 HydrophobicContact CD2-CG 3.54Å; L201-Y299 HydrophobicContact CG-CD2 3.52Å; L201-Y299 HydrophobicContact CG-CE2 3.53Å; L201-Y299 HydrophobicContact CG-CG 4.01Å
202	C	97.2	Very high	94.1	Very high	12 Å²	12	45.7 Å²	45.7	8%	0.081	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-43.2	175.7	-67.6	0	0	0	0	111.8	F198 D199 I200 A205 V206 F302	F198-C202 WeakPolarHBondContact CZ-SG 3.24Å; F198-C202 PolarHBondContact O-N 3.34Å; F198-C202 PolarHBondContact O-SG 3.02Å; D199-C202 PolarHBondContact O-N 3.41Å; I200-C202 VanDerWaalsContact C-N 3.31Å; I200-C202 PolarHBondContact O-N 3.22Å; C202-A205 PolarHBondContact O-N 3.38Å; C202-V206 WeakPolarHBondContact O-CG2 3.49Å; C202-V206 PolarHBondContact O-N 2.99Å; C202-V206 VanDerWaalsContact O-N 3.1Å; C202-F302 HydrophobicContact CB-CD1 4.08Å; C202-F302 HydrophobicContact CB-CD2 4.26Å; C202-F302 HydrophobicContact CB-CE1 3.8Å; C202-F302 HydrophobicContact CB-CE2 3.99Å; C202-F302 HydrophobicContact CB-CG 4.3Å; C202-F302 HydrophobicContact CB-CZ 3.75Å; C202-F302 VanDerWaalsContact SG-CG 3.57Å
203	Q	96.2	Very high	94	Very high	119 Å²	119	50 Å²	50	56%	0.556	25%	0.246	S	C	*	.	H	α-helix	trans	-60.6	-48.2	176.4	-71.2	175.7	17.3	0	0	111.7	D199 I200 A205 V206 E207	D199-Q203 WeakPolarHBondContact O-CG 3.29Å; D199-Q203 PolarHBondContact O-N 2.97Å; I200-Q203 PolarHBondContact O-N 2.99Å; Q203-A205 VanDerWaalsContact C-N 3.26Å; Q203-A205 PolarHBondContact O-N 3.36Å; Q203-V206 PolarHBondContact O-N 3.44Å; Q203-V206 VanDerWaalsContact O-N 3.07Å; Q203-E207 PolarHBondContact O-N 3.28Å
204	N	96.2	Very high	93.9	Very high	50 Å²	50	55.8 Å²	55.8	27%	0.267	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-34.5	177.6	-68.4	-25.1	0	0	0	112.8	I200 S208 Q258	I200-N204 WeakPolarHBondContact CG2-ND2 3.24Å; I200-N204 WeakPolarHBondContact O-CB 3.47Å; I200-N204 PolarHBondContact O-N 3.32Å; I200-N204 PolarHBondContact O-ND2 3.5Å; N204-S208 PolarHBondContact O-N 3.03Å; N204-S208 PolarHBondContact O-OG 3.27Å; N204-Q258 HydrophobicContact CB-CG 4.28Å; N204-Q258 PolarHBondContact O-NE2 3.49Å
205	A	96.5	Very high	93.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-42.9	174.7	0	0	0	0	0	111.8	L201 C202 Q203 E207 S208 F209 L255 Y299 F302 L303	L201-A205 PolarHBondContact O-N 3.27Å; L201-A205 VanDerWaalsContact O-N 3.1Å; C202-A205 PolarHBondContact O-N 3.38Å; Q203-A205 VanDerWaalsContact C-N 3.26Å; Q203-A205 PolarHBondContact O-N 3.36Å; A205-E207 VanDerWaalsContact C-N 3.34Å; A205-E207 PolarHBondContact O-N 2.92Å; A205-S208 WeakPolarHBondContact O-CB 3.21Å; A205-S208 PolarHBondContact O-N 2.88Å; A205-F209 WeakPolarHBondContact O-CD2 3.21Å; A205-F209 PolarHBondContact O-N 3.21Å; A205-F209 VanDerWaalsContact O-N 3.07Å; A205-L255 HydrophobicContact CB-CD2 3.75Å; A205-Y299 HydrophobicContact CB-CE2 3.85Å; A205-F302 HydrophobicContact CB-CE1 4.22Å; A205-L303 HydrophobicContact CB-CD2 3.92Å
206	V	95.3	Very high	93.3	Very high	51 Å²	51	56.8 Å²	56.8	31%	0.309	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-40.6	175.4	176.1	0	0	0	0	111.5	C202 Q203 S208 F209 T210 F302 F306	C202-V206 WeakPolarHBondContact O-CG2 3.49Å; C202-V206 PolarHBondContact O-N 2.99Å; C202-V206 VanDerWaalsContact O-N 3.1Å; Q203-V206 PolarHBondContact O-N 3.44Å; Q203-V206 VanDerWaalsContact O-N 3.07Å; V206-S208 VanDerWaalsContact C-N 3.32Å; V206-S208 PolarHBondContact O-N 3.34Å; V206-F209 PolarHBondContact O-N 2.92Å; V206-T210 PolarHBondContact O-N 2.8Å; V206-T210 PolarHBondContact O-OG1 3.02Å; V206-F302 HydrophobicContact CG2-CE1 4.4Å; V206-F302 HydrophobicContact CG2-CZ 3.8Å; V206-F306 HydrophobicContact CG1-CE2 4.43Å; V206-F306 HydrophobicContact CG2-CD2 4.26Å; V206-F306 HydrophobicContact CG2-CE2 3.89Å; V206-F306 HydrophobicContact CG2-CZ 4.41Å
207	E	94.8	Very high	92.7	Very high	112 Å²	112	55.1 Å²	55.1	52%	0.523	27%	0.274	S	S	.	.	H	α-helix	trans	-60.7	-42.5	172.8	-71	-179.9	-178.5	0	0	111.3	Q203 A205 F209 T210 D211	Q203-E207 PolarHBondContact O-N 3.28Å; A205-E207 VanDerWaalsContact C-N 3.34Å; A205-E207 PolarHBondContact O-N 2.92Å; E207-F209 VanDerWaalsContact C-N 3.32Å; E207-F209 PolarHBondContact O-N 2.76Å; E207-T210 CarbonylContact O-C 3.43Å; E207-T210 WeakPolarHBondContact O-CA 3.17Å; E207-T210 WeakPolarHBondContact O-CB 3.12Å; E207-T210 PolarHBondContact O-N 3.02Å; E207-D211 PolarHBondContact O-N 3.42Å
208	S	95.3	Very high	91.8	Very high	12 Å²	12	57.4 Å²	57.4	8%	0.084	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-38.2	177.1	-57.1	0	0	0	0	112.8	N204 A205 V206 L212 S254 Q258	N204-S208 PolarHBondContact O-N 3.03Å; N204-S208 PolarHBondContact O-OG 3.27Å; A205-S208 WeakPolarHBondContact O-CB 3.21Å; A205-S208 PolarHBondContact O-N 2.88Å; V206-S208 VanDerWaalsContact C-N 3.32Å; V206-S208 PolarHBondContact O-N 3.34Å; S208-L212 PolarHBondContact O-N 2.87Å; S208-S254 PolarHBondContact OG-OG 3.15Å; S208-Q258 PolarHBondContact OG-NE2 3.15Å
209	F	93.5	Very high	90.2	Very high	15 Å²	15	60.1 Å²	60.1	7%	0.066	31%	0.309	C	S	.	.	H	α-helix	trans	-69.7	-35	173.3	-65.3	-55.9	0	0	0	112.3	A205 V206 E207 L212 R213 L251 L255 L303 F306 L307 L326 L329	A205-F209 WeakPolarHBondContact O-CD2 3.21Å; A205-F209 PolarHBondContact O-N 3.21Å; A205-F209 VanDerWaalsContact O-N 3.07Å; V206-F209 PolarHBondContact O-N 2.92Å; E207-F209 VanDerWaalsContact C-N 3.32Å; E207-F209 PolarHBondContact O-N 2.76Å; F209-L212 PolarHBondContact O-N 3.26Å; F209-R213 PolarHBondContact O-N 3.14Å; F209-R213 VanDerWaalsContact O-N 3.09Å; F209-L251 HydrophobicContact CD1-CD1 4.21Å; F209-L251 HydrophobicContact CD1-CD2 4.04Å; F209-L251 HydrophobicContact CE1-CD1 4.3Å; F209-L251 HydrophobicContact CE1-CD2 3.96Å; F209-L255 HydrophobicContact CE1-CD1 4.37Å; F209-L255 HydrophobicContact CZ-CD1 4.2Å; F209-L303 HydrophobicContact CE2-CD2 3.93Å; F209-L303 HydrophobicContact CZ-CD2 4.01Å; F209-F306 HydrophobicContact CB-CE1 4.11Å; F209-F306 HydrophobicContact CB-CZ 4.42Å; F209-F306 AromaticContact CD2-CD1 3.65Å; F209-F306 HydrophobicContact CD2-CD1 3.65Å; F209-F306 AromaticContact CD2-CE1 3.2Å; F209-F306 HydrophobicContact CD2-CE1 3.2Å; F209-F306 AromaticContact CD2-CZ 3.91Å; F209-F306 HydrophobicContact CD2-CZ 3.91Å; F209-F306 AromaticContact CE2-CD1 3.58Å; F209-F306 HydrophobicContact CE2-CD1 3.58Å; F209-F306 AromaticContact CE2-CE1 3.67Å; F209-F306 HydrophobicContact CE2-CE1 3.67Å; F209-F306 HydrophobicContact CG-CD1 4.47Å; F209-F306 AromaticContact CG-CE1 3.74Å; F209-F306 HydrophobicContact CG-CE1 3.74Å; F209-F306 HydrophobicContact CG-CZ 4.46Å; F209-F306 HydrophobicContact CZ-CD1 4.35Å; F209-L307 HydrophobicContact CE1-CD2 3.93Å; F209-L307 HydrophobicContact CZ-CD1 4.45Å; F209-L307 HydrophobicContact CZ-CD2 3.93Å; F209-L307 HydrophobicContact CZ-CG 4.32Å; F209-L326 HydrophobicContact CD1-CD2 3.71Å; F209-L326 HydrophobicContact CE1-CD2 3.59Å; F209-L329 HydrophobicContact CE1-CD2 4.44Å
210	T	91.9	Very high	88.2	Confident	61 Å²	61	58.8 Å²	58.8	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-67.7	-41	175.8	-58	0	0	0	0	110.9	V206 E207 R213 H214	V206-T210 PolarHBondContact O-N 2.8Å; V206-T210 PolarHBondContact O-OG1 3.02Å; E207-T210 CarbonylContact O-C 3.43Å; E207-T210 WeakPolarHBondContact O-CA 3.17Å; E207-T210 WeakPolarHBondContact O-CB 3.12Å; E207-T210 PolarHBondContact O-N 3.02Å; T210-R213 WeakPolarHBondContact O-CB 3.14Å; T210-R213 PolarHBondContact O-N 3.3Å; T210-R213 VanDerWaalsContact O-N 3.15Å; T210-H214 PolarHBondContact O-CD2 3.18Å; T210-H214 PolarHBondContact O-N 3.39Å
211	D	92.6	Very high	86.4	Confident	83 Å²	83	58 Å²	58	44%	0.444	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-42.9	172.8	-81.6	-7.4	0	0	0	112.4	E207 R213 H214 K215	E207-D211 PolarHBondContact O-N 3.42Å; D211-R213 VanDerWaalsContact C-N 3.27Å; D211-R213 PolarHBondContact O-N 3.12Å; D211-H214 PolarHBondContact O-N 3.34Å; D211-K215 WeakPolarHBondContact O-CB 3.44Å; D211-K215 VanDerWaalsContact O-CG 3.29Å; D211-K215 WeakPolarHBondContact O-CG 3.5Å; D211-K215 PolarHBondContact O-N 3.31Å
212	L	91	Very high	84.2	Confident	8 Å²	8	63.2 Å²	63.2	4%	0.042	34%	0.335	C	S	.	.	H	α-helix	trans	-56.1	-46.1	172.9	175.3	67.9	0	0	0	110.3	S208 F209 K215 L216 L247 L251 T325 L326	S208-L212 PolarHBondContact O-N 2.87Å; F209-L212 PolarHBondContact O-N 3.26Å; L212-K215 PolarHBondContact O-N 2.85Å; L212-L216 HydrophobicContact CD1-CD1 3.82Å; L212-L216 HydrophobicContact CD1-CG 4.25Å; L212-L216 HydrophobicContact CD2-CD1 4.48Å; L212-L216 HydrophobicContact CG-CD1 3.89Å; L212-L216 WeakPolarHBondContact O-CB 3.37Å; L212-L216 WeakPolarHBondContact O-CG 3.3Å; L212-L216 PolarHBondContact O-N 2.94Å; L212-L247 HydrophobicContact CD1-CB 3.96Å; L212-L247 HydrophobicContact CD1-CD1 4.38Å; L212-L251 HydrophobicContact CD2-CD2 3.85Å; L212-T325 HydrophobicContact CD1-CG2 4.46Å; L212-T325 HydrophobicContact CD2-CG2 4.21Å; L212-L326 HydrophobicContact CD2-CD2 3.99Å; L212-L326 HydrophobicContact CD2-CG 4.35Å
213	R	89.6	Confident	81.8	Confident	149 Å²	149	65.6 Å²	65.6	56%	0.562	35%	0.349	S	S	*	.	H	α-helix	trans	-61.5	-43.9	177.6	178.8	180	177.4	176.9	0	111.9	F209 T210 D211 L216 A217 I322	F209-R213 PolarHBondContact O-N 3.14Å; F209-R213 VanDerWaalsContact O-N 3.09Å; T210-R213 WeakPolarHBondContact O-CB 3.14Å; T210-R213 PolarHBondContact O-N 3.3Å; T210-R213 VanDerWaalsContact O-N 3.15Å; D211-R213 VanDerWaalsContact C-N 3.27Å; D211-R213 PolarHBondContact O-N 3.12Å; R213-L216 PolarHBondContact O-N 3.23Å; R213-A217 WeakPolarHBondContact O-CB 3.21Å; R213-A217 PolarHBondContact O-N 2.97Å; R213-I322 HydrophobicContact CB-CD1 3.87Å; R213-I322 HydrophobicContact CG-CD1 3.8Å
214	H	89	Confident	79.2	Confident	123 Å²	123	63.8 Å²	63.8	57%	0.569	35%	0.35	S	S	*	.	H	α-helix	trans	-64.2	-44.6	177.4	-79.8	-67.4	0	0	0	112.4	T210 D211 L216 A217 S218	T210-H214 PolarHBondContact O-CD2 3.18Å; T210-H214 PolarHBondContact O-N 3.39Å; D211-H214 PolarHBondContact O-N 3.34Å; H214-L216 PolarHBondContact O-N 3.49Å; H214-A217 PolarHBondContact O-N 2.92Å; H214-S218 PolarHBondContact O-N 3.16Å; H214-S218 PolarHBondContact O-OG 3.12Å
215	K	88.2	Confident	76.4	Confident	91 Å²	91	68.7 Å²	68.7	40%	0.396	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-45.2	176.1	-70.9	170.2	-174.6	171	0	110.9	D211 L212 A217 S218 H219 L247	D211-K215 WeakPolarHBondContact O-CB 3.44Å; D211-K215 VanDerWaalsContact O-CG 3.29Å; D211-K215 WeakPolarHBondContact O-CG 3.5Å; D211-K215 PolarHBondContact O-N 3.31Å; L212-K215 PolarHBondContact O-N 2.85Å; K215-A217 VanDerWaalsContact C-N 3.3Å; K215-A217 PolarHBondContact O-N 3.12Å; K215-S218 PolarHBondContact O-N 2.86Å; K215-S218 PolarHBondContact O-OG 3.09Å; K215-H219 WeakPolarHBondContact O-CB 3.44Å; K215-H219 PolarHBondContact O-CD2 2.92Å; K215-H219 PolarHBondContact O-N 2.74Å; K215-H219 VanDerWaalsContact O-N 3.15Å; K215-L247 HydrophobicContact CB-CD2 4.04Å; K215-L247 HydrophobicContact CD-CD2 3.72Å; K215-L247 HydrophobicContact CG-CD2 4.44Å
216	L	84.7	Confident	73.7	Confident	7 Å²	7	73.2 Å²	73.2	4%	0.037	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-30.6	178.3	-73.5	169.4	0	0	0	113.2	L212 R213 H214 L221 L244 L247 P321 I322	L212-L216 HydrophobicContact CD1-CD1 3.82Å; L212-L216 HydrophobicContact CD1-CG 4.25Å; L212-L216 HydrophobicContact CD2-CD1 4.48Å; L212-L216 HydrophobicContact CG-CD1 3.89Å; L212-L216 WeakPolarHBondContact O-CB 3.37Å; L212-L216 WeakPolarHBondContact O-CG 3.3Å; L212-L216 PolarHBondContact O-N 2.94Å; R213-L216 PolarHBondContact O-N 3.23Å; H214-L216 PolarHBondContact O-N 3.49Å; L216-L221 HydrophobicContact CD2-CD1 3.89Å; L216-L244 HydrophobicContact CD2-CD1 3.53Å; L216-L247 HydrophobicContact CD2-CD1 3.65Å; L216-L247 HydrophobicContact CG-CD1 4.04Å; L216-P321 HydrophobicContact CD1-CB 4.46Å; L216-P321 HydrophobicContact CD2-CB 4.35Å; L216-I322 HydrophobicContact CD1-CB 4.4Å; L216-I322 HydrophobicContact CD1-CD1 4.48Å; L216-I322 HydrophobicContact CD1-CG1 3.42Å; L216-I322 VanDerWaalsContact CD1-CG1 3.42Å
217	A	79.4	Confident	71.1	Confident	48 Å²	48	75 Å²	75	40%	0.397	41%	0.411	S	S	.	.	H	α-helix	trans	-71.4	-39.8	174	0	0	0	0	0	112.7	R213 H214 K215	R213-A217 WeakPolarHBondContact O-CB 3.21Å; R213-A217 PolarHBondContact O-N 2.97Å; H214-A217 PolarHBondContact O-N 2.92Å; K215-A217 VanDerWaalsContact C-N 3.3Å; K215-A217 PolarHBondContact O-N 3.12Å
218	S	74.9	Confident	68.5	Low	92 Å²	92	76.5 Å²	76.5	64%	0.643	42%	0.422	S	S	*	.	H	α-helix	trans	-72.1	-29.6	-179.6	64.3	0	0	0	0	113.2	H214 K215 G220	H214-S218 PolarHBondContact O-N 3.16Å; H214-S218 PolarHBondContact O-OG 3.12Å; K215-S218 PolarHBondContact O-N 2.86Å; K215-S218 PolarHBondContact O-OG 3.09Å; S218-G220 VanDerWaalsContact C-N 3.3Å; S218-G220 PolarHBondContact O-N 2.97Å
219	H	61.7	Low	66	Low	103 Å²	103	84 Å²	84	48%	0.477	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	10.6	-176.5	-73.6	-66.5	0	0	0	115.2	K215 L221 Q243	K215-H219 WeakPolarHBondContact O-CB 3.44Å; K215-H219 PolarHBondContact O-CD2 2.92Å; K215-H219 PolarHBondContact O-N 2.74Å; K215-H219 VanDerWaalsContact O-N 3.15Å; H219-L221 PolarHBondContact O-N 3.01Å; H219-L221 VanDerWaalsContact O-N 3.08Å; H219-Q243 PolarHBondContact CD2-NE2 3.24Å
220	G	54.5	Low	63.8	Low	53 Å²	53	88 Å²	88	55%	0.546	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	14.2	168.9	0	0	0	0	0	115.8	S218 Q222	S218-G220 VanDerWaalsContact C-N 3.3Å; S218-G220 PolarHBondContact O-N 2.97Å; G220-Q222 PolarHBondContact O-N 2.76Å; G220-Q222 VanDerWaalsContact O-N 3.13Å
221	L	55.6	Low	61.6	Low	29 Å²	29	88.5 Å²	88.5	15%	0.152	48%	0.478	C	S	.	.			trans	-70.7	1.7	173	-83	152.9	0	0	0	113.1	L216 H219 T223 L244 P321 Q441	L216-L221 HydrophobicContact CD2-CD1 3.89Å; H219-L221 PolarHBondContact O-N 3.01Å; H219-L221 VanDerWaalsContact O-N 3.08Å; L221-T223 PolarHBondContact O-N 2.78Å; L221-T223 VanDerWaalsContact O-N 3.11Å; L221-L244 HydrophobicContact CD1-CD1 3.91Å; L221-P321 HydrophobicContact CB-CG 4.5Å; L221-Q441 HydrophobicContact CD2-CG 4.19Å
222	Q	50.7	Low	59.1	Low	109 Å²	109	90.7 Å²	90.7	51%	0.509	49%	0.49	S	S	.	.			trans	-73.9	100.6	171.6	-66	-174.6	4.2	0	0	109	G220 S224	G220-Q222 PolarHBondContact O-N 2.76Å; G220-Q222 VanDerWaalsContact O-N 3.13Å; Q222-S224 PolarHBondContact O-N 3.22Å
223	T	46.6	Very low	56.8	Low	62 Å²	62	98.6 Å²	98.6	38%	0.38	52%	0.524	S	S	.	.			trans	-67.7	71.9	175.8	50.8	0	0	0	0	110.9	L221	L221-T223 PolarHBondContact O-N 2.78Å; L221-T223 VanDerWaalsContact O-N 3.11Å
224	S	40.9	Very low	54.7	Low	81 Å²	81	94.9 Å²	94.9	57%	0.566	52%	0.518	S	S	*	.	S	Bend	trans	-163.2	106.3	162.5	60.5	0	0	0	0	109.1	Q222	Q222-S224 PolarHBondContact O-N 3.22Å
225	N	38	Very low	52.3	Low	154 Å²	154	95.4 Å²	95.4	82%	0.824	53%	0.525	S	S	*	.			trans	106.4	30.3	169.9	-50.7	-19	0	0	0	118.5	T227	N225-T227 PolarHBondContact O-N 3.4Å
226	L	40.4	Very low	49.9	Very low	95 Å²	95	100.4 Å²	100.4	50%	0.497	55%	0.546	S	S	.	.			trans	-72.9	114.7	160.8	-68.1	170.3	0	0	0	109	E230	L226-E230 HydrophobicContact CD2-CB 4.15Å; L226-E230 WeakPolarHBondContact CD2-OE2 3.44Å
227	T	39.5	Very low	47.6	Very low	88 Å²	88	106 Å²	106	54%	0.54	57%	0.574	S	S	.	*			trans	-69.5	151.1	167.4	54	0	0	0	0	109.1	N225 E229 E230	N225-T227 PolarHBondContact O-N 3.4Å; T227-E229 PolarHBondContact O-N 3.05Å; T227-E230 PolarHBondContact O-N 2.97Å
228	N	40.9	Very low	45.8	Very low	143 Å²	143	106.9 Å²	106.9	77%	0.765	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-10.1	-177.1	-72.8	-17.6	0	0	0	114.8
229	E	43.5	Very low	44.5	Very low	169 Å²	169	108.9 Å²	108.9	79%	0.79	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-20.3	176.5	-70	-169.5	147.9	0	0	114.1	T227	T227-E229 PolarHBondContact O-N 3.05Å
230	E	45.5	Very low	44.3	Very low	101 Å²	101	107.3 Å²	107.3	47%	0.472	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	-26.2	-179.8	-66.6	-171.4	147.7	0	0	113.1	L226 T227 N232 K233 V234	L226-E230 HydrophobicContact CD2-CB 4.15Å; L226-E230 WeakPolarHBondContact CD2-OE2 3.44Å; T227-E230 PolarHBondContact O-N 2.97Å; E230-N232 PolarHBondContact O-N 3.4Å; E230-N232 VanDerWaalsContact O-N 3.16Å; E230-K233 PolarHBondContact O-N 2.62Å; E230-V234 WeakPolarHBondContact O-CG2 3.34Å; E230-V234 PolarHBondContact O-N 2.89Å
231	V	46.3	Very low	44.6	Very low	71 Å²	71	109.9 Å²	109.9	43%	0.43	59%	0.587	S	S	.	*	H	α-helix	trans	-58.9	-30.5	177.5	-178.4	0	0	0	0	112
232	N	40.4	Very low	45.4	Very low	129 Å²	129	114.9 Å²	114.9	69%	0.69	61%	0.61	S	S	*	*	H	α-helix	trans	-85	-10.8	178.2	-75.2	-31.1	0	0	0	114.6	E230	E230-N232 PolarHBondContact O-N 3.4Å; E230-N232 VanDerWaalsContact O-N 3.16Å
233	K	43.6	Very low	47	Very low	173 Å²	173	110.9 Å²	110.9	75%	0.752	59%	0.591	S	S	*	*	H	α-helix	trans	-93.7	-26.4	171.4	-85	179.1	179	174	0	112.9	E230 N235 K236	E230-K233 PolarHBondContact O-N 2.62Å; K233-N235 VanDerWaalsContact C-N 3.26Å; K233-N235 PolarHBondContact O-N 3.19Å; K233-K236 PolarHBondContact O-N 2.96Å
234	V	43.7	Very low	49.1	Very low	72 Å²	72	108 Å²	108	44%	0.436	57%	0.573	S	S	.	*	H	α-helix	trans	-64.7	-28.7	179.1	173.6	0	0	0	0	112.5	E230 K236	E230-V234 WeakPolarHBondContact O-CG2 3.34Å; E230-V234 PolarHBondContact O-N 2.89Å; V234-K236 PolarHBondContact O-N 2.82Å; V234-K236 VanDerWaalsContact O-N 3.08Å
235	N	40.5	Very low	51.4	Low	134 Å²	134	105.9 Å²	105.9	72%	0.717	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	4.2	-180	-69.8	-24.2	0	0	0	115.4	K233	K233-N235 VanDerWaalsContact C-N 3.26Å; K233-N235 PolarHBondContact O-N 3.19Å
236	K	37.9	Very low	54	Low	195 Å²	195	101.7 Å²	101.7	85%	0.848	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	4.3	178.4	-85.9	-175	176.3	179.4	0	115.5	K233 V234	K233-K236 PolarHBondContact O-N 2.96Å; V234-K236 PolarHBondContact O-N 2.82Å; V234-K236 VanDerWaalsContact O-N 3.08Å
237	M	35.3	Very low	56.5	Low	125 Å²	125	98 Å²	98	62%	0.616	52%	0.522	S	S	*	.			trans	-121.8	93.1	175.8	-158.2	90.8	82.9	0	0	109.8	N239	M237-N239 HydrophobicContact CG-CB 4.18Å; M237-N239 PolarHBondContact O-N 2.83Å
238	G	42.4	Very low	59.1	Low	66 Å²	66	94 Å²	94	68%	0.68	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	2.3	178.3	0	0	0	0	0	115.6
239	N	47.3	Very low	61.6	Low	135 Å²	135	91.3 Å²	91.3	72%	0.722	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-20	-177.6	-109.5	0.3	0	0	0	114.4	M237 N241	M237-N239 HydrophobicContact CG-CB 4.18Å; M237-N239 PolarHBondContact O-N 2.83Å; N239-N241 VanDerWaalsContact C-N 3.28Å; N239-N241 PolarHBondContact O-N 2.78Å
240	N	57.8	Low	64	Low	70 Å²	70	85.5 Å²	85.5	37%	0.374	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-77.5	-12.8	-172.3	-67.6	3.7	0	0	0	113.7	H242 Q444	N240-H242 VanDerWaalsContact C-N 3.3Å; N240-H242 PolarHBondContact O-N 2.96Å; N240-Q444 PolarHBondContact O-NE2 3.21Å; N240-Q444 VanDerWaalsContact O-NE2 3.08Å
241	N	60.5	Low	66.4	Low	106 Å²	106	81.1 Å²	81.1	57%	0.567	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-75.1	-14.9	-173.7	-70.9	-9.8	0	0	0	114.3	N239 Q444	N239-N241 VanDerWaalsContact C-N 3.28Å; N239-N241 PolarHBondContact O-N 2.78Å; N241-Q444 WeakPolarHBondContact O-CG 3.37Å
242	H	71.4	Confident	68.8	Low	135 Å²	135	78.5 Å²	78.5	63%	0.625	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-122.5	13.4	-178.8	-62.9	-61.2	0	0	0	113.5	N240 L244 S245 S246	N240-H242 VanDerWaalsContact C-N 3.3Å; N240-H242 PolarHBondContact O-N 2.96Å; H242-L244 PolarHBondContact O-N 3.05Å; H242-S245 PolarHBondContact O-N 3.15Å; H242-S246 PolarHBondContact O-N 3.3Å; H242-S246 PolarHBondContact O-OG 2.87Å
243	Q	85.7	Confident	71.4	Confident	25 Å²	25	75.7 Å²	75.7	12%	0.117	42%	0.419	C	S	.	.	H	α-helix	trans	-66.5	-40.8	-172.3	-165.1	-165.5	-48.2	0	0	112.6	H219 S246 L247	H219-Q243 PolarHBondContact CD2-NE2 3.24Å; Q243-S246 PolarHBondContact O-OG 2.95Å; Q243-L247 HydrophobicContact CG-CD1 4.38Å; Q243-L247 WeakPolarHBondContact O-CB 3.32Å; Q243-L247 VanDerWaalsContact O-CG 3.24Å; Q243-L247 WeakPolarHBondContact O-CG 3.45Å; Q243-L247 PolarHBondContact O-N 3.47Å; Q243-L247 VanDerWaalsContact O-N 3.1Å
244	L	89.3	Confident	73.9	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-68.8	-38.2	178.4	-123.8	68.5	0	0	0	111.7	L216 L221 H242 L247 L248 P321 L324 T325 Q444 L445	L216-L244 HydrophobicContact CD2-CD1 3.53Å; L221-L244 HydrophobicContact CD1-CD1 3.91Å; H242-L244 PolarHBondContact O-N 3.05Å; L244-L247 PolarHBondContact O-N 3.5Å; L244-L248 WeakPolarHBondContact O-CB 3.49Å; L244-L248 PolarHBondContact O-N 3.01Å; L244-P321 HydrophobicContact CD1-CB 4.15Å; L244-P321 HydrophobicContact CD2-CB 4.38Å; L244-L324 HydrophobicContact CD2-CD2 4Å; L244-T325 WeakPolarHBondContact CG-OG1 3.36Å; L244-Q444 HydrophobicContact CB-CB 4.08Å; L244-L445 HydrophobicContact CB-CD1 4.33Å; L244-L445 HydrophobicContact CB-CD2 4.13Å; L244-L445 HydrophobicContact CB-CG 4.12Å; L244-L445 HydrophobicContact CD2-CD1 3.65Å; L244-L445 HydrophobicContact CD2-CG 4.11Å; L244-L445 HydrophobicContact CG-CD1 4.17Å; L244-L445 HydrophobicContact CG-CG 4.49Å
245	S	90.4	Very high	76.5	Confident	37 Å²	37	66.1 Å²	66.1	26%	0.259	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-44	176.5	-168.5	0	0	0	0	111.7	H242 L247 L248 D249	H242-S245 PolarHBondContact O-N 3.15Å; S245-L247 PolarHBondContact O-N 3.38Å; S245-L248 WeakPolarHBondContact O-CB 3.48Å; S245-L248 PolarHBondContact O-N 3.15Å; S245-D249 PolarHBondContact O-N 3.41Å
246	S	91.4	Very high	79.1	Confident	66 Å²	66	61 Å²	61	46%	0.462	35%	0.35	S	S	.	.	H	α-helix	trans	-68	-36.4	179.2	65.3	0	0	0	0	112.4	H242 Q243 D249 A250	H242-S246 PolarHBondContact O-N 3.3Å; H242-S246 PolarHBondContact O-OG 2.87Å; Q243-S246 PolarHBondContact O-OG 2.95Å; S246-D249 PolarHBondContact O-N 3.29Å; S246-A250 VanDerWaalsContact O-CB 3.29Å; S246-A250 WeakPolarHBondContact O-CB 3.43Å; S246-A250 PolarHBondContact O-N 3.11Å
247	L	93	Very high	81.9	Confident	18 Å²	18	54.3 Å²	54.3	9%	0.094	33%	0.328	C	S	.	.	H	α-helix	trans	-65.7	-38	173	-71.9	173.9	0	0	0	112	L212 K215 L216 Q243 L244 S245 L251	L212-L247 HydrophobicContact CD1-CB 3.96Å; L212-L247 HydrophobicContact CD1-CD1 4.38Å; K215-L247 HydrophobicContact CB-CD2 4.04Å; K215-L247 HydrophobicContact CD-CD2 3.72Å; K215-L247 HydrophobicContact CG-CD2 4.44Å; L216-L247 HydrophobicContact CD2-CD1 3.65Å; L216-L247 HydrophobicContact CG-CD1 4.04Å; Q243-L247 HydrophobicContact CG-CD1 4.38Å; Q243-L247 WeakPolarHBondContact O-CB 3.32Å; Q243-L247 VanDerWaalsContact O-CG 3.24Å; Q243-L247 WeakPolarHBondContact O-CG 3.45Å; Q243-L247 PolarHBondContact O-N 3.47Å; Q243-L247 VanDerWaalsContact O-N 3.1Å; L244-L247 PolarHBondContact O-N 3.5Å; S245-L247 PolarHBondContact O-N 3.38Å; L247-L251 WeakPolarHBondContact O-CB 3.28Å; L247-L251 PolarHBondContact O-N 3.12Å
248	L	94.2	Very high	84.7	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-49.2	173.5	173.2	63.9	0	0	0	111.4	L244 S245 A250 L251 S252 T325 K328 L329 L445	L244-L248 WeakPolarHBondContact O-CB 3.49Å; L244-L248 PolarHBondContact O-N 3.01Å; S245-L248 WeakPolarHBondContact O-CB 3.48Å; S245-L248 PolarHBondContact O-N 3.15Å; L248-A250 VanDerWaalsContact C-N 3.35Å; L248-A250 PolarHBondContact O-N 2.89Å; L248-L251 PolarHBondContact O-N 2.93Å; L248-S252 WeakPolarHBondContact O-CB 3.44Å; L248-S252 PolarHBondContact O-N 3.27Å; L248-T325 HydrophobicContact CB-CG2 4.04Å; L248-T325 HydrophobicContact CD1-CG2 4.19Å; L248-K328 HydrophobicContact CD2-CB 4.16Å; L248-K328 HydrophobicContact CD2-CG 3.45Å; L248-K328 VanDerWaalsContact CD2-CG 3.45Å; L248-L329 HydrophobicContact CD1-CB 3.56Å; L248-L329 HydrophobicContact CD1-CD1 3.89Å; L248-L329 HydrophobicContact CD1-CG 4.31Å; L248-L445 HydrophobicContact CB-CD2 4.38Å; L248-L445 HydrophobicContact CD2-CD2 3.94Å
249	D	93.7	Very high	87.3	Confident	86 Å²	86	46.6 Å²	46.6	46%	0.46	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-41.2	-179.9	-66.5	-30.2	0	0	0	111.4	S245 S246 S252 S253	S245-D249 PolarHBondContact O-N 3.41Å; S246-D249 PolarHBondContact O-N 3.29Å; D249-S252 PolarHBondContact O-N 3.45Å; D249-S253 WeakPolarHBondContact O-CB 3.48Å; D249-S253 PolarHBondContact O-N 3.02Å; D249-S253 PolarHBondContact O-OG 2.96Å
250	A	94.2	Very high	89.5	Confident	46 Å²	46	43.9 Å²	43.9	38%	0.38	25%	0.252	S	S	.	.	H	α-helix	trans	-63	-42.1	175.2	0	0	0	0	0	112.1	S246 L248 S253 S254	S246-A250 VanDerWaalsContact O-CB 3.29Å; S246-A250 WeakPolarHBondContact O-CB 3.43Å; S246-A250 PolarHBondContact O-N 3.11Å; L248-A250 VanDerWaalsContact C-N 3.35Å; L248-A250 PolarHBondContact O-N 2.89Å; A250-S253 WeakPolarHBondContact CA-OG 3.33Å; A250-S253 PolarHBondContact O-OG 2.93Å; A250-S254 VanDerWaalsContact O-CB 3.28Å; A250-S254 WeakPolarHBondContact O-CB 3.41Å; A250-S254 PolarHBondContact O-N 3.26Å
251	L	96	Very high	91.2	Very high	9 Å²	9	44.7 Å²	44.7	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-47.7	176.5	178.2	61.5	0	0	0	111.1	F209 L212 L247 L248 S253 S254 L255 L326 L329	F209-L251 HydrophobicContact CD1-CD1 4.21Å; F209-L251 HydrophobicContact CD1-CD2 4.04Å; F209-L251 HydrophobicContact CE1-CD1 4.3Å; F209-L251 HydrophobicContact CE1-CD2 3.96Å; L212-L251 HydrophobicContact CD2-CD2 3.85Å; L247-L251 WeakPolarHBondContact O-CB 3.28Å; L247-L251 PolarHBondContact O-N 3.12Å; L248-L251 PolarHBondContact O-N 2.93Å; L251-S253 VanDerWaalsContact C-N 3.35Å; L251-S253 PolarHBondContact O-N 3.22Å; L251-S254 WeakPolarHBondContact O-CB 3.39Å; L251-S254 PolarHBondContact O-N 2.96Å; L251-L255 HydrophobicContact CD1-CD1 4.12Å; L251-L255 HydrophobicContact CD1-CG 4.14Å; L251-L255 HydrophobicContact CG-CD1 4.1Å; L251-L255 WeakPolarHBondContact O-CG 3.4Å; L251-L255 PolarHBondContact O-N 3.48Å; L251-L326 HydrophobicContact CD2-CD2 3.75Å; L251-L329 HydrophobicContact CD2-CD2 3.88Å; L251-L329 HydrophobicContact CG-CD2 4.25Å
252	S	96.3	Very high	92.8	Very high	16 Å²	16	40.1 Å²	40.1	11%	0.112	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-45.7	178.9	-176.2	0	0	0	0	111.8	L248 D249 V256 M332 W333	L248-S252 WeakPolarHBondContact O-CB 3.44Å; L248-S252 PolarHBondContact O-N 3.27Å; D249-S252 PolarHBondContact O-N 3.45Å; S252-V256 WeakPolarHBondContact O-CG2 3.4Å; S252-V256 PolarHBondContact O-N 3.28Å; S252-V256 VanDerWaalsContact O-N 3.11Å; S252-M332 WeakPolarHBondContact OG-CE 3.47Å; S252-W333 PolarHBondContact OG-NE1 2.96Å
253	S	95.6	Very high	93.8	Very high	71 Å²	71	34 Å²	34	50%	0.497	20%	0.204	S	C	.	.	H	α-helix	trans	-66	-38.5	177.5	53.4	0	0	0	0	112.2	D249 A250 L251 S257	D249-S253 WeakPolarHBondContact O-CB 3.48Å; D249-S253 PolarHBondContact O-N 3.02Å; D249-S253 PolarHBondContact O-OG 2.96Å; A250-S253 WeakPolarHBondContact CA-OG 3.33Å; A250-S253 PolarHBondContact O-OG 2.93Å; L251-S253 VanDerWaalsContact C-N 3.35Å; L251-S253 PolarHBondContact O-N 3.22Å; S253-S257 WeakPolarHBondContact O-CB 3.33Å; S253-S257 PolarHBondContact O-N 2.9Å
254	S	96	Very high	93.9	Very high	43 Å²	43	39 Å²	39	30%	0.301	23%	0.226	S	C	.	.	H	α-helix	trans	-58.9	-53.4	174.1	-171	0	0	0	0	111.7	S208 A250 L251 V256 S257 Q258	S208-S254 PolarHBondContact OG-OG 3.15Å; A250-S254 VanDerWaalsContact O-CB 3.28Å; A250-S254 WeakPolarHBondContact O-CB 3.41Å; A250-S254 PolarHBondContact O-N 3.26Å; L251-S254 WeakPolarHBondContact O-CB 3.39Å; L251-S254 PolarHBondContact O-N 2.96Å; S254-V256 PolarHBondContact O-N 3.12Å; S254-S257 PolarHBondContact O-N 3.04Å; S254-Q258 VanDerWaalsContact O-CG 3.26Å; S254-Q258 WeakPolarHBondContact O-CG 3.09Å; S254-Q258 PolarHBondContact O-N 3.43Å; S254-Q258 PolarHBondContact OG-NE2 3.42Å; S254-Q258 VanDerWaalsContact OG-NE2 3.1Å
255	L	97.2	Very high	93.8	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-42.9	-178.6	-65.1	171.9	0	0	0	112	A205 F209 L251 L259 Y299 L303 L329 W333	A205-L255 HydrophobicContact CB-CD2 3.75Å; F209-L255 HydrophobicContact CE1-CD1 4.37Å; F209-L255 HydrophobicContact CZ-CD1 4.2Å; L251-L255 HydrophobicContact CD1-CD1 4.12Å; L251-L255 HydrophobicContact CD1-CG 4.14Å; L251-L255 HydrophobicContact CG-CD1 4.1Å; L251-L255 WeakPolarHBondContact O-CG 3.4Å; L251-L255 PolarHBondContact O-N 3.48Å; L255-L259 PolarHBondContact O-N 3.4Å; L255-Y299 WeakPolarHBondContact CD2-OH 3.48Å; L255-L303 HydrophobicContact CD2-CD2 4.23Å; L255-L329 HydrophobicContact CD1-CD2 3.95Å; L255-W333 HydrophobicContact CB-CH2 3.96Å; L255-W333 HydrophobicContact CB-CZ2 4Å; L255-W333 HydrophobicContact CD1-CH2 4.44Å; L255-W333 HydrophobicContact CD1-CZ2 4.33Å
256	V	96.2	Very high	93.7	Very high	25 Å²	25	38.8 Å²	38.8	15%	0.152	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-41.6	176.2	171.1	0	0	0	0	111.5	S252 S254 L259 R260 W333 T338 L342	S252-V256 WeakPolarHBondContact O-CG2 3.4Å; S252-V256 PolarHBondContact O-N 3.28Å; S252-V256 VanDerWaalsContact O-N 3.11Å; S254-V256 PolarHBondContact O-N 3.12Å; V256-L259 PolarHBondContact O-N 2.95Å; V256-R260 HydrophobicContact CG1-CG 4.5Å; V256-R260 WeakPolarHBondContact O-CG 3.45Å; V256-R260 PolarHBondContact O-N 3.48Å; V256-W333 HydrophobicContact CG2-CH2 4.25Å; V256-W333 HydrophobicContact CG2-CZ2 3.78Å; V256-T338 HydrophobicContact CG2-CG2 4.38Å; V256-L342 HydrophobicContact CG1-CD2 4.07Å; V256-L342 HydrophobicContact CG2-CD1 4.42Å; V256-L342 HydrophobicContact CG2-CD2 4.32Å
257	S	95.5	Very high	93.5	Very high	55 Å²	55	39.4 Å²	39.4	39%	0.385	22%	0.221	S	C	.	.	H	α-helix	trans	-65	-42.7	-179.8	-174.4	0	0	0	0	111.7	S253 S254 L259 R260 N261	S253-S257 WeakPolarHBondContact O-CB 3.33Å; S253-S257 PolarHBondContact O-N 2.9Å; S254-S257 PolarHBondContact O-N 3.04Å; S257-L259 PolarHBondContact O-N 3.5Å; S257-R260 PolarHBondContact O-N 3.37Å; S257-N261 PolarHBondContact O-N 3.42Å; S257-N261 PolarHBondContact O-ND2 2.63Å
258	Q	95.3	Very high	93.1	Very high	29 Å²	29	39.4 Å²	39.4	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-48.6	176.4	-71.8	167.5	12	0	0	111.7	L201 N204 S208 S254 R260 N261 V262	L201-Q258 HydrophobicContact CD1-CB 3.66Å; N204-Q258 HydrophobicContact CB-CG 4.28Å; N204-Q258 PolarHBondContact O-NE2 3.49Å; S208-Q258 PolarHBondContact OG-NE2 3.15Å; S254-Q258 VanDerWaalsContact O-CG 3.26Å; S254-Q258 WeakPolarHBondContact O-CG 3.09Å; S254-Q258 PolarHBondContact O-N 3.43Å; S254-Q258 PolarHBondContact OG-NE2 3.42Å; S254-Q258 VanDerWaalsContact OG-NE2 3.1Å; Q258-R260 PolarHBondContact O-N 3.26Å; Q258-N261 PolarHBondContact O-N 3.08Å; Q258-V262 PolarHBondContact O-N 3.31Å; Q258-V262 VanDerWaalsContact O-N 3.09Å
259	L	96	Very high	92.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-44.8	176	174.7	61.5	0	0	0	111.4	L201 L255 V256 S257 N261 V262 L263 L295 I296 Y299 L342	L201-L259 HydrophobicContact CD1-CB 4.38Å; L201-L259 HydrophobicContact CD2-CB 4.38Å; L201-L259 HydrophobicContact CD2-CD1 3.69Å; L255-L259 PolarHBondContact O-N 3.4Å; V256-L259 PolarHBondContact O-N 2.95Å; S257-L259 PolarHBondContact O-N 3.5Å; L259-N261 VanDerWaalsContact C-N 3.32Å; L259-N261 PolarHBondContact O-N 3.15Å; L259-V262 PolarHBondContact O-N 3.26Å; L259-L263 HydrophobicContact CD1-CD1 4.18Å; L259-L263 HydrophobicContact CD1-CG 4.17Å; L259-L263 HydrophobicContact CG-CD1 4.03Å; L259-L263 HydrophobicContact CG-CG 4.46Å; L259-L263 WeakPolarHBondContact O-CG 3.48Å; L259-L263 PolarHBondContact O-N 2.89Å; L259-L295 HydrophobicContact CD1-CG 4.5Å; L259-I296 HydrophobicContact CD1-CG1 4.25Å; L259-I296 HydrophobicContact CD2-CG2 4.5Å; L259-Y299 HydrophobicContact CB-CD1 4.37Å; L259-Y299 HydrophobicContact CB-CE1 4.21Å; L259-Y299 HydrophobicContact CD1-CD1 4.43Å; L259-Y299 HydrophobicContact CD2-CD1 4.19Å; L259-L342 HydrophobicContact CD2-CB 4.45Å; L259-L342 HydrophobicContact CD2-CD1 4.35Å; L259-L342 HydrophobicContact CD2-CD2 4.13Å
260	R	94.9	Very high	92.2	Very high	78 Å²	78	35.6 Å²	35.6	29%	0.294	20%	0.204	S	C	.	.	H	α-helix	trans	-62	-37.9	178	-73.3	178.4	-176.6	-70.6	-12.1	112.9	V256 S257 Q258 L263 K264 H341 L345	V256-R260 HydrophobicContact CG1-CG 4.5Å; V256-R260 WeakPolarHBondContact O-CG 3.45Å; V256-R260 PolarHBondContact O-N 3.48Å; S257-R260 PolarHBondContact O-N 3.37Å; Q258-R260 PolarHBondContact O-N 3.26Å; R260-L263 PolarHBondContact O-N 3.4Å; R260-K264 WeakPolarHBondContact O-CG 3.44Å; R260-K264 PolarHBondContact O-N 3.17Å; R260-H341 PolarHBondContact NH2-CD2 3.17Å; R260-H341 VanDerWaalsContact NH2-CD2 3.28Å; R260-H341 PolarHBondContact NH2-NE2 3.39Å; R260-L345 HydrophobicContact CG-CD1 4.36Å
261	N	93.1	Very high	91.3	Very high	87 Å²	87	35.3 Å²	35.3	47%	0.465	20%	0.199	S	C	.	.	H	α-helix	trans	-68.5	-39.3	179.1	-68.3	-21.7	0	0	0	111.5	S257 Q258 L259 K264 A265	S257-N261 PolarHBondContact O-N 3.42Å; S257-N261 PolarHBondContact O-ND2 2.63Å; Q258-N261 PolarHBondContact O-N 3.08Å; L259-N261 VanDerWaalsContact C-N 3.32Å; L259-N261 PolarHBondContact O-N 3.15Å; N261-K264 PolarHBondContact O-N 3.05Å; N261-A265 PolarHBondContact O-N 3.21Å
262	V	93	Very high	89.8	Confident	11 Å²	11	41.3 Å²	41.3	7%	0.067	24%	0.236	C	C	.	.	H	α-helix	trans	-65.3	-45.4	173.9	169.8	0	0	0	0	111.2	Y197 L201 Q258 L259 K264 A265 E266 L295	Y197-V262 HydrophobicContact CD1-CG1 4.35Å; Y197-V262 HydrophobicContact CG-CG1 4.16Å; L201-V262 HydrophobicContact CB-CG2 4.25Å; L201-V262 HydrophobicContact CD1-CG2 4.31Å; Q258-V262 PolarHBondContact O-N 3.31Å; Q258-V262 VanDerWaalsContact O-N 3.09Å; L259-V262 PolarHBondContact O-N 3.26Å; V262-K264 VanDerWaalsContact C-N 3.29Å; V262-K264 PolarHBondContact O-N 3.25Å; V262-A265 WeakPolarHBondContact O-CB 3.39Å; V262-A265 PolarHBondContact O-N 3.25Å; V262-E266 PolarHBondContact O-N 3.41Å; V262-E266 VanDerWaalsContact O-N 3.12Å; V262-L295 HydrophobicContact CG1-CD1 4.06Å; V262-L295 HydrophobicContact CG1-CD2 3.95Å
263	L	92.5	Very high	88.6	Confident	5 Å²	5	47 Å²	47	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-56.7	-43.2	175.9	-73.7	172.6	0	0	0	111.7	L259 R260 A265 E266 E267 I291 L295 I296 L345 F349	L259-L263 HydrophobicContact CD1-CD1 4.18Å; L259-L263 HydrophobicContact CD1-CG 4.17Å; L259-L263 HydrophobicContact CG-CD1 4.03Å; L259-L263 HydrophobicContact CG-CG 4.46Å; L259-L263 WeakPolarHBondContact O-CG 3.48Å; L259-L263 PolarHBondContact O-N 2.89Å; R260-L263 PolarHBondContact O-N 3.4Å; L263-A265 VanDerWaalsContact C-N 3.28Å; L263-A265 PolarHBondContact O-N 2.91Å; L263-E266 CarbonylContact O-C 3.55Å; L263-E266 PolarHBondContact O-N 3.03Å; L263-E266 VanDerWaalsContact O-N 3.11Å; L263-E267 WeakPolarHBondContact O-CG 3.29Å; L263-E267 PolarHBondContact O-N 3.35Å; L263-I291 HydrophobicContact CD2-CG2 3.79Å; L263-L295 HydrophobicContact CD2-CD2 3.69Å; L263-L295 HydrophobicContact CG-CD2 4.44Å; L263-I296 HydrophobicContact CD1-CD1 4.27Å; L263-I296 HydrophobicContact CD1-CG1 4.37Å; L263-I296 HydrophobicContact CD2-CD1 4.11Å; L263-I296 HydrophobicContact CD2-CG1 4.15Å; L263-L345 HydrophobicContact CD1-CB 4.16Å; L263-L345 HydrophobicContact CD1-CD1 3.8Å; L263-F349 HydrophobicContact CB-CE2 4.12Å; L263-F349 HydrophobicContact CB-CZ 3.84Å; L263-F349 HydrophobicContact CD2-CE2 3.98Å; L263-F349 HydrophobicContact CD2-CZ 3.89Å; L263-F349 HydrophobicContact CG-CE2 4.45Å; L263-F349 HydrophobicContact CG-CZ 4.42Å; L263-F349 WeakPolarHBondContact O-CZ 3.46Å
264	K	89.1	Confident	87.7	Confident	132 Å²	132	44 Å²	44	57%	0.574	25%	0.245	S	C	*	.	H	α-helix	trans	-60.9	-32.9	175.1	-74.8	174.2	-179.4	179.9	0	114	R260 N261 V262	R260-K264 WeakPolarHBondContact O-CG 3.44Å; R260-K264 PolarHBondContact O-N 3.17Å; N261-K264 PolarHBondContact O-N 3.05Å; V262-K264 VanDerWaalsContact C-N 3.29Å; V262-K264 PolarHBondContact O-N 3.25Å
265	A	87.3	Confident	86.9	Confident	32 Å²	32	44.7 Å²	44.7	26%	0.264	25%	0.247	S	C	.	.	H	α-helix	trans	-69.6	-38.1	175.5	0	0	0	0	0	111.1	Y197 N261 V262 L263 A268	Y197-A265 HydrophobicContact CE1-CB 4.05Å; Y197-A265 HydrophobicContact CE2-CB 4.27Å; N261-A265 PolarHBondContact O-N 3.21Å; V262-A265 WeakPolarHBondContact O-CB 3.39Å; V262-A265 PolarHBondContact O-N 3.25Å; L263-A265 VanDerWaalsContact C-N 3.28Å; L263-A265 PolarHBondContact O-N 2.91Å; A265-A268 WeakPolarHBondContact O-CB 3.37Å
266	E	87.5	Confident	86.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-73.6	-22.7	177.6	-71.1	-69.6	174.6	0	0	113.9	T194 Y197 V262 L263 A268 F269 F286 I291	T194-E266 WeakPolarHBondContact CA-OE1 3.5Å; T194-E266 PolarHBondContact N-OE1 2.97Å; T194-E266 PolarHBondContact OG1-OE1 3.4Å; Y197-E266 HydrophobicContact CD2-CG 4.35Å; Y197-E266 WeakPolarHBondContact CD2-OE1 3.43Å; V262-E266 PolarHBondContact O-N 3.41Å; V262-E266 VanDerWaalsContact O-N 3.12Å; L263-E266 CarbonylContact O-C 3.55Å; L263-E266 PolarHBondContact O-N 3.03Å; L263-E266 VanDerWaalsContact O-N 3.11Å; E266-A268 PolarHBondContact O-N 3.02Å; E266-F269 PolarHBondContact O-N 3.25Å; E266-F269 VanDerWaalsContact O-N 3.12Å; E266-F269 VanDerWaalsContact OE2-CD2 3.3Å; E266-F269 WeakPolarHBondContact OE2-CD2 3.26Å; E266-F269 WeakPolarHBondContact OE2-CE2 3.47Å; E266-F286 HydrophobicContact CB-CZ 4.46Å; E266-I291 HydrophobicContact CB-CD1 3.94Å; E266-I291 HydrophobicContact CG-CD1 4.18Å
267	E	87.3	Confident	85.5	Confident	78 Å²	78	44 Å²	44	36%	0.364	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-54.6	-24.3	173.7	-75.9	172.6	-158.7	0	0	112.6	L263 F269 L270 S271 F349	L263-E267 WeakPolarHBondContact O-CG 3.29Å; L263-E267 PolarHBondContact O-N 3.35Å; E267-F269 VanDerWaalsContact C-N 3.27Å; E267-F269 PolarHBondContact O-N 3.42Å; E267-L270 PolarHBondContact O-N 2.96Å; E267-S271 PolarHBondContact O-N 3.04Å; E267-F349 HydrophobicContact CG-CE1 3.79Å; E267-F349 HydrophobicContact CG-CE2 4.44Å; E267-F349 HydrophobicContact CG-CZ 3.6Å
268	A	85.1	Confident	84.8	Confident	19 Å²	19	46 Å²	46	16%	0.157	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.3	-37.1	177.8	0	0	0	0	0	112.7	V122 I126 A265 E266 L270 S271	V122-A268 HydrophobicContact CG1-CB 4.01Å; I126-A268 HydrophobicContact CD1-CB 3.46Å; I126-A268 VanDerWaalsContact CD1-CB 3.46Å; I126-A268 WeakPolarHBondContact CD1-O 3.41Å; A265-A268 WeakPolarHBondContact O-CB 3.37Å; E266-A268 PolarHBondContact O-N 3.02Å; A268-L270 PolarHBondContact O-N 3.34Å; A268-S271 WeakPolarHBondContact O-CB 3.5Å; A268-S271 PolarHBondContact O-N 3.46Å; A268-S271 PolarHBondContact O-OG 2.94Å
269	F	84.7	Confident	84.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-65.1	-24.7	177.9	-79	-80.2	0	0	0	113	V122 I126 L129 A190 Q193 E266 E267 F282 F286	V122-F269 HydrophobicContact CG1-CE2 4.16Å; I126-F269 HydrophobicContact CD1-CD1 4.15Å; I126-F269 HydrophobicContact CD1-CD2 4.29Å; I126-F269 HydrophobicContact CD1-CE1 4.44Å; I126-F269 HydrophobicContact CD1-CG 4.07Å; I126-F269 HydrophobicContact CG1-CD1 3.84Å; I126-F269 HydrophobicContact CG1-CE1 3.88Å; I126-F269 HydrophobicContact CG1-CG 4.28Å; I126-F269 HydrophobicContact CG1-CZ 4.34Å; L129-F269 HydrophobicContact CD1-CE1 4.28Å; A190-F269 HydrophobicContact CB-CD1 4.13Å; A190-F269 HydrophobicContact CB-CE1 3.9Å; A190-F269 HydrophobicContact CB-CZ 4.2Å; Q193-F269 HydrophobicContact CB-CE2 4.09Å; Q193-F269 HydrophobicContact CB-CZ 4.1Å; Q193-F269 HydrophobicContact CG-CE2 3.98Å; Q193-F269 HydrophobicContact CG-CZ 4.28Å; E266-F269 PolarHBondContact O-N 3.25Å; E266-F269 VanDerWaalsContact O-N 3.12Å; E266-F269 VanDerWaalsContact OE2-CD2 3.3Å; E266-F269 WeakPolarHBondContact OE2-CD2 3.26Å; E266-F269 WeakPolarHBondContact OE2-CE2 3.47Å; E267-F269 VanDerWaalsContact C-N 3.27Å; E267-F269 PolarHBondContact O-N 3.42Å; F269-F282 HydrophobicContact CB-CZ 4.41Å; F269-F282 HydrophobicContact CD1-CZ 4.43Å; F269-F286 HydrophobicContact CB-CE1 3.96Å; F269-F286 HydrophobicContact CB-CE2 4.12Å; F269-F286 HydrophobicContact CB-CZ 3.64Å; F269-F286 HydrophobicContact CD2-CE2 4.12Å; F269-F286 AromaticContact CD2-CZ 3.97Å; F269-F286 HydrophobicContact CD2-CZ 3.97Å; F269-F286 HydrophobicContact CG-CE2 4.14Å; F269-F286 HydrophobicContact CG-CZ 4.03Å
270	L	82.6	Confident	83.7	Confident	11 Å²	11	52.6 Å²	52.6	6%	0.058	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-93.3	6.6	175.7	-64	-180	0	0	0	113	E267 A268 T272 S277 F286 F349 F352	E267-L270 PolarHBondContact O-N 2.96Å; A268-L270 PolarHBondContact O-N 3.34Å; L270-T272 PolarHBondContact O-N 2.85Å; L270-S277 WeakPolarHBondContact CA-OG 3.33Å; L270-S277 PolarHBondContact O-OG 2.92Å; L270-F286 HydrophobicContact CD1-CE1 4.37Å; L270-F286 HydrophobicContact CD2-CD1 3.98Å; L270-F286 HydrophobicContact CD2-CE1 4.31Å; L270-F286 HydrophobicContact CG-CD1 4.15Å; L270-F286 HydrophobicContact CG-CE1 3.98Å; L270-F349 HydrophobicContact CD1-CB 3.98Å; L270-F349 HydrophobicContact CD1-CD1 3.5Å; L270-F349 HydrophobicContact CD1-CE1 4.4Å; L270-F349 HydrophobicContact CD1-CG 4.12Å; L270-F352 HydrophobicContact CD1-CB 4.3Å
271	S	75.2	Confident	83.2	Confident	39 Å²	39	54.3 Å²	54.3	27%	0.273	31%	0.305	S	S	.	.			trans	-54	137.5	177.9	60	0	0	0	0	111.6	E267 A268 N273 S274	E267-S271 PolarHBondContact O-N 3.04Å; A268-S271 WeakPolarHBondContact O-CB 3.5Å; A268-S271 PolarHBondContact O-N 3.46Å; A268-S271 PolarHBondContact O-OG 2.94Å; S271-N273 PolarHBondContact O-N 2.84Å; S271-S274 PolarHBondContact O-N 3.36Å; S271-S274 VanDerWaalsContact O-N 3.14Å; S271-S274 PolarHBondContact OG-OG 3.23Å
272	T	65.6	Low	83	Confident	135 Å²	135	50.1 Å²	50.1	83%	0.828	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.8	-178.8	51.1	0	0	0	0	113.9	L270 S274	L270-T272 PolarHBondContact O-N 2.85Å; T272-S274 VanDerWaalsContact C-N 3.34Å
273	N	70.4	Confident	82.7	Confident	136 Å²	136	51.3 Å²	51.3	73%	0.727	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-16.4	-179.3	-62.6	-20.1	0	0	0	112.5	S271	S271-N273 PolarHBondContact O-N 2.84Å
274	S	76.5	Confident	82.4	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.063	30%	0.298	C	S	.	.			trans	-91.3	119.3	-175.9	-54.8	0	0	0	0	110.4	I126 S271 T272 F276 S277	I126-S274 WeakPolarHBondContact CG2-OG 3.45Å; S271-S274 PolarHBondContact O-N 3.36Å; S271-S274 VanDerWaalsContact O-N 3.14Å; S271-S274 PolarHBondContact OG-OG 3.23Å; T272-S274 VanDerWaalsContact C-N 3.34Å; S274-F276 VanDerWaalsContact C-N 3.27Å; S274-F276 PolarHBondContact O-N 3.47Å; S274-S277 WeakPolarHBondContact O-CB 3.45Å; S274-S277 PolarHBondContact O-N 3.21Å
275	T	79.9	Confident	82.4	Confident	57 Å²	57	48.6 Å²	48.6	35%	0.35	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-61	-35.1	-179.9	59.8	0	0	0	0	112.7	D130 H133 C134 S277 S278	D130-T275 WeakPolarHBondContact OD1-CB 3.38Å; D130-T275 PolarHBondContact OD1-N 3.45Å; D130-T275 PolarHBondContact OD1-OG1 3.27Å; H133-T275 PolarHBondContact ND1-OG1 3.36Å; C134-T275 WeakPolarHBondContact SG-CG2 3.41Å; C134-T275 PolarHBondContact SG-OG1 2.93Å; C134-T275 VanDerWaalsContact SG-OG1 3.33Å; T275-S277 VanDerWaalsContact C-N 3.35Å; T275-S277 PolarHBondContact O-N 3.49Å; T275-S278 PolarHBondContact O-OG 3.33Å
276	F	83.6	Confident	82.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-71.2	-26.3	178.5	64.8	-100.3	0	0	0	113.5	I126 L129 D130 L183 I186 S274 S278 K279 F282	I126-F276 HydrophobicContact CG2-CE1 4.4Å; I126-F276 HydrophobicContact CG2-CZ 4.09Å; L129-F276 HydrophobicContact CB-CE1 4.24Å; D130-F276 HydrophobicContact CB-CD1 4.17Å; D130-F276 HydrophobicContact CB-CE1 3.94Å; L183-F276 HydrophobicContact CD2-CB 4.18Å; I186-F276 HydrophobicContact CD1-CB 3.72Å; I186-F276 HydrophobicContact CD1-CD1 3.87Å; I186-F276 HydrophobicContact CD1-CD2 4.41Å; I186-F276 HydrophobicContact CD1-CG 3.76Å; I186-F276 HydrophobicContact CG2-CD2 3.7Å; I186-F276 HydrophobicContact CG2-CE2 3.78Å; I186-F276 HydrophobicContact CG2-CG 4.13Å; I186-F276 HydrophobicContact CG2-CZ 4.25Å; S274-F276 VanDerWaalsContact C-N 3.27Å; S274-F276 PolarHBondContact O-N 3.47Å; F276-S278 PolarHBondContact O-N 3.02Å; F276-K279 WeakPolarHBondContact O-CB 3.28Å; F276-K279 PolarHBondContact O-N 3.31Å; F276-F282 AromaticContact CD2-CD1 3.75Å; F276-F282 HydrophobicContact CD2-CD1 3.75Å; F276-F282 AromaticContact CD2-CE1 3.66Å; F276-F282 HydrophobicContact CD2-CE1 3.66Å; F276-F282 HydrophobicContact CD2-CE2 4.45Å; F276-F282 HydrophobicContact CD2-CG 4.18Å; F276-F282 HydrophobicContact CD2-CZ 4.04Å; F276-F282 HydrophobicContact CE2-CD1 4.21Å; F276-F282 AromaticContact CE2-CE1 3.63Å; F276-F282 HydrophobicContact CE2-CE1 3.63Å; F276-F282 HydrophobicContact CE2-CE2 4.43Å; F276-F282 AromaticContact CE2-CZ 3.76Å; F276-F282 HydrophobicContact CE2-CZ 3.76Å
277	S	81.5	Confident	82.7	Confident	12 Å²	12	47.1 Å²	47.1	8%	0.084	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-60.3	-30.3	179.8	176.6	0	0	0	0	112	L270 S274 T275 K279	L270-S277 WeakPolarHBondContact CA-OG 3.33Å; L270-S277 PolarHBondContact O-OG 2.92Å; S274-S277 WeakPolarHBondContact O-CB 3.45Å; S274-S277 PolarHBondContact O-N 3.21Å; T275-S277 VanDerWaalsContact C-N 3.35Å; T275-S277 PolarHBondContact O-N 3.49Å; S277-K279 VanDerWaalsContact C-N 3.27Å; S277-K279 PolarHBondContact O-N 3.09Å
278	S	79	Confident	82.8	Confident	95 Å²	95	45.4 Å²	45.4	66%	0.664	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-71.2	-16.4	176.5	71.1	0	0	0	0	114.3	T275 F276	T275-S278 PolarHBondContact O-OG 3.33Å; F276-S278 PolarHBondContact O-N 3.02Å
279	K	84.5	Confident	83.1	Confident	82 Å²	82	47.6 Å²	47.6	36%	0.357	27%	0.27	S	S	.	.			trans	-77.8	125.4	-175.8	-65.2	-69.3	-172.2	171.6	0	110.3	L183 F276 S277 Q281 F282 R283	L183-K279 HydrophobicContact CD2-CB 4.29Å; L183-K279 HydrophobicContact CD2-CG 4.27Å; F276-K279 WeakPolarHBondContact O-CB 3.28Å; F276-K279 PolarHBondContact O-N 3.31Å; S277-K279 VanDerWaalsContact C-N 3.27Å; S277-K279 PolarHBondContact O-N 3.09Å; K279-Q281 VanDerWaalsContact C-N 3.26Å; K279-Q281 PolarHBondContact O-N 3.44Å; K279-F282 PolarHBondContact O-N 3.04Å; K279-R283 PolarHBondContact O-N 3.4Å
280	P	84.5	Confident	83.4	Confident	86 Å²	86	48.2 Å²	48.2	56%	0.558	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-32.3	-176.3	24.8	-34	0	0	0	112.8	R283 N284	P280-R283 PolarHBondContact O-N 3.25Å; P280-N284 VanDerWaalsContact O-CB 3.31Å; P280-N284 WeakPolarHBondContact O-CB 3.09Å; P280-N284 PolarHBondContact O-N 3.43Å; P280-N284 PolarHBondContact O-ND2 2.93Å
281	Q	85.1	Confident	84	Confident	114 Å²	114	47.7 Å²	47.7	53%	0.533	27%	0.27	S	S	.	.	H	α-helix	trans	-61.3	-50.1	177.5	-69.7	173.4	-15.5	0	0	112.1	K279 S285	K279-Q281 VanDerWaalsContact C-N 3.26Å; K279-Q281 PolarHBondContact O-N 3.44Å; Q281-S285 WeakPolarHBondContact O-CB 3.32Å; Q281-S285 PolarHBondContact O-N 3.26Å
282	F	88.4	Confident	84.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-48.5	176	172.1	-103.4	0	0	0	110.8	L183 I186 N187 A190 F269 F276 K279 N284 S285 F286	L183-F282 HydrophobicContact CD2-CB 4.21Å; I186-F282 HydrophobicContact CG2-CD2 3.73Å; I186-F282 HydrophobicContact CG2-CE2 3.5Å; I186-F282 VanDerWaalsContact CG2-CE2 3.5Å; I186-F282 HydrophobicContact CG2-CZ 4.12Å; N187-F282 WeakPolarHBondContact OD1-CD2 3.29Å; A190-F282 HydrophobicContact CB-CE2 4.13Å; A190-F282 HydrophobicContact CB-CZ 4.47Å; F269-F282 HydrophobicContact CB-CZ 4.41Å; F269-F282 HydrophobicContact CD1-CZ 4.43Å; F276-F282 AromaticContact CD2-CD1 3.75Å; F276-F282 HydrophobicContact CD2-CD1 3.75Å; F276-F282 AromaticContact CD2-CE1 3.66Å; F276-F282 HydrophobicContact CD2-CE1 3.66Å; F276-F282 HydrophobicContact CD2-CE2 4.45Å; F276-F282 HydrophobicContact CD2-CG 4.18Å; F276-F282 HydrophobicContact CD2-CZ 4.04Å; F276-F282 HydrophobicContact CE2-CD1 4.21Å; F276-F282 AromaticContact CE2-CE1 3.63Å; F276-F282 HydrophobicContact CE2-CE1 3.63Å; F276-F282 HydrophobicContact CE2-CE2 4.43Å; F276-F282 AromaticContact CE2-CZ 3.76Å; F276-F282 HydrophobicContact CE2-CZ 3.76Å; K279-F282 PolarHBondContact O-N 3.04Å; F282-N284 PolarHBondContact O-N 3.1Å; F282-S285 PolarHBondContact O-N 2.95Å; F282-F286 HydrophobicContact CE1-CB 4.25Å; F282-F286 HydrophobicContact CE1-CG 4.39Å; F282-F286 HydrophobicContact CE2-CB 4.13Å; F282-F286 HydrophobicContact CE2-CD2 4.42Å; F282-F286 HydrophobicContact CE2-CG 4.43Å; F282-F286 HydrophobicContact CZ-CB 3.97Å; F282-F286 HydrophobicContact CZ-CD2 4.1Å; F282-F286 AromaticContact CZ-CG 3.95Å; F282-F286 HydrophobicContact CZ-CG 3.95Å; F282-F286 VanDerWaalsContact O-CB 3.28Å; F282-F286 WeakPolarHBondContact O-CB 3.44Å; F282-F286 PolarHBondContact O-N 2.9Å
283	R	86.5	Confident	86.2	Confident	36 Å²	36	42.8 Å²	42.8	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-43.2	-176.5	-171	172.4	176.4	-168	-3.4	113	K279 P280 C287 M350 F352 S354	K279-R283 PolarHBondContact O-N 3.4Å; P280-R283 PolarHBondContact O-N 3.25Å; R283-C287 VanDerWaalsContact O-CB 3.24Å; R283-C287 WeakPolarHBondContact O-CB 3.41Å; R283-C287 PolarHBondContact O-N 3.5Å; R283-C287 PolarHBondContact O-SG 2.9Å; R283-C287 VanDerWaalsContact O-SG 3.36Å; R283-M350 PolarHBondContact NH2-O 2.87Å; R283-F352 PolarHBondContact NE-O 3.32Å; R283-F352 VanDerWaalsContact NH2-C 3.32Å; R283-F352 PolarHBondContact NH2-O 3.3Å; R283-S354 PolarHBondContact NH1-OG 3.25Å; R283-S354 PolarHBondContact NH2-OG 3.1Å
284	N	86.3	Confident	87.3	Confident	50 Å²	50	38 Å²	38	27%	0.267	22%	0.216	S	C	.	.	H	α-helix	trans	-65.3	-47.5	177.9	-71	-18.4	0	0	0	111.4	P280 F282 I288	P280-N284 VanDerWaalsContact O-CB 3.31Å; P280-N284 WeakPolarHBondContact O-CB 3.09Å; P280-N284 PolarHBondContact O-N 3.43Å; P280-N284 PolarHBondContact O-ND2 2.93Å; F282-N284 PolarHBondContact O-N 3.1Å; N284-I288 WeakPolarHBondContact O-CB 3.32Å; N284-I288 WeakPolarHBondContact O-CG1 3.31Å; N284-I288 PolarHBondContact O-N 3.38Å
285	S	89.2	Confident	88.2	Confident	30 Å²	30	37.6 Å²	37.6	21%	0.21	21%	0.213	C	C	.	.	I	π-helix	trans	-59.5	-50.9	176.9	165.7	0	0	0	0	111.5	N187 Q281 F282 D289 Q290	N187-S285 VanDerWaalsContact OD1-CB 3.28Å; N187-S285 WeakPolarHBondContact OD1-CB 3.49Å; N187-S285 PolarHBondContact OD1-OG 3.36Å; Q281-S285 WeakPolarHBondContact O-CB 3.32Å; Q281-S285 PolarHBondContact O-N 3.26Å; F282-S285 PolarHBondContact O-N 2.95Å; S285-D289 WeakPolarHBondContact O-CA 3.28Å; S285-D289 VanDerWaalsContact O-CB 3.29Å; S285-D289 WeakPolarHBondContact O-CB 3.4Å; S285-D289 PolarHBondContact O-N 2.87Å; S285-Q290 PolarHBondContact O-N 3.27Å
286	F	91.1	Very high	88.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.	I	π-helix	trans	-63.6	-55.2	-178.7	-175.5	-106.9	0	0	0	112	A190 E266 F269 L270 F282 Q290 I291	A190-F286 HydrophobicContact CB-CD2 3.82Å; A190-F286 HydrophobicContact CB-CE2 3.93Å; E266-F286 HydrophobicContact CB-CZ 4.46Å; F269-F286 HydrophobicContact CB-CE1 3.96Å; F269-F286 HydrophobicContact CB-CE2 4.12Å; F269-F286 HydrophobicContact CB-CZ 3.64Å; F269-F286 HydrophobicContact CD2-CE2 4.12Å; F269-F286 AromaticContact CD2-CZ 3.97Å; F269-F286 HydrophobicContact CD2-CZ 3.97Å; F269-F286 HydrophobicContact CG-CE2 4.14Å; F269-F286 HydrophobicContact CG-CZ 4.03Å; L270-F286 HydrophobicContact CD1-CE1 4.37Å; L270-F286 HydrophobicContact CD2-CD1 3.98Å; L270-F286 HydrophobicContact CD2-CE1 4.31Å; L270-F286 HydrophobicContact CG-CD1 4.15Å; L270-F286 HydrophobicContact CG-CE1 3.98Å; F282-F286 HydrophobicContact CE1-CB 4.25Å; F282-F286 HydrophobicContact CE1-CG 4.39Å; F282-F286 HydrophobicContact CE2-CB 4.13Å; F282-F286 HydrophobicContact CE2-CD2 4.42Å; F282-F286 HydrophobicContact CE2-CG 4.43Å; F282-F286 HydrophobicContact CZ-CB 3.97Å; F282-F286 HydrophobicContact CZ-CD2 4.1Å; F282-F286 AromaticContact CZ-CG 3.95Å; F282-F286 HydrophobicContact CZ-CG 3.95Å; F282-F286 VanDerWaalsContact O-CB 3.28Å; F282-F286 WeakPolarHBondContact O-CB 3.44Å; F282-F286 PolarHBondContact O-N 2.9Å; F286-Q290 HydrophobicContact CD2-CB 4.36Å; F286-Q290 WeakPolarHBondContact O-CA 3.33Å; F286-Q290 VanDerWaalsContact O-CB 3.29Å; F286-Q290 WeakPolarHBondContact O-CB 3.3Å; F286-Q290 PolarHBondContact O-N 3.17Å; F286-I291 HydrophobicContact CD1-CG1 4.09Å; F286-I291 HydrophobicContact CE1-CD1 4.02Å; F286-I291 HydrophobicContact CE1-CG1 3.76Å; F286-I291 HydrophobicContact CE2-CD1 4.27Å; F286-I291 HydrophobicContact CE2-CG1 4.45Å; F286-I291 HydrophobicContact CZ-CD1 3.75Å; F286-I291 HydrophobicContact CZ-CG1 3.96Å; F286-I291 PolarHBondContact O-N 3.44Å
287	C	90.3	Very high	89.5	Confident	1 Å²	1	35 Å²	35	1%	0.007	20%	0.196	C	C	.	.	I	π-helix	trans	-70.6	-40	-174.2	-64.9	0	0	0	0	112.9	R283 R292 M350	R283-C287 VanDerWaalsContact O-CB 3.24Å; R283-C287 WeakPolarHBondContact O-CB 3.41Å; R283-C287 PolarHBondContact O-N 3.5Å; R283-C287 PolarHBondContact O-SG 2.9Å; R283-C287 VanDerWaalsContact O-SG 3.36Å; C287-R292 WeakPolarHBondContact O-CB 3.4Å; C287-R292 PolarHBondContact O-N 2.89Å; C287-M350 HydrophobicContact CB-CG 3.91Å; C287-M350 HydrophobicContact CB-SD 3.24Å; C287-M350 WeakPolarHBondContact CB-SD 3.32Å
288	I	89.6	Confident	90.2	Very high	42 Å²	42	35.2 Å²	35.2	22%	0.215	20%	0.2	C	C	.	.	I	π-helix	trans	-84.2	-56.1	-176.1	-59.7	174.2	0	0	0	111.1	N284 R292 E293 M350 L373	N284-I288 WeakPolarHBondContact O-CB 3.32Å; N284-I288 WeakPolarHBondContact O-CG1 3.31Å; N284-I288 PolarHBondContact O-N 3.38Å; I288-R292 WeakPolarHBondContact O-CB 3.48Å; I288-E293 PolarHBondContact O-N 3.33Å; I288-M350 HydrophobicContact CD1-CE 4.11Å; I288-M350 HydrophobicContact CG1-CE 4.18Å; I288-M350 HydrophobicContact CG1-SD 4.18Å; I288-L373 HydrophobicContact CG2-CD2 3.65Å
289	D	90.9	Very high	91.1	Very high	64 Å²	64	30.7 Å²	30.7	34%	0.342	17%	0.169	S	C	.	.	I	π-helix	trans	-79.3	-41.3	-171.8	-64.3	-39.8	0	0	0	111.6	S285 G294 R371	S285-D289 WeakPolarHBondContact O-CA 3.28Å; S285-D289 VanDerWaalsContact O-CB 3.29Å; S285-D289 WeakPolarHBondContact O-CB 3.4Å; S285-D289 PolarHBondContact O-N 2.87Å; D289-G294 PolarHBondContact O-N 3.21Å; D289-R371 IonicContact OD1-CZ 3.01Å; D289-R371 IonicContact OD1-NH1 2.86Å; D289-R371 PolarHBondContact OD1-NH1 2.94Å; D289-R371 IonicContact OD2-NH1 3.67Å
290	Q	91.9	Very high	91.7	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.061	15%	0.152	C	C	.	.	I	π-helix	trans	-89	-53.2	-173.5	-48.7	-177.8	21.9	0	0	111.9	N187 R191 T194 S285 F286 G294 L295	N187-Q290 PolarHBondContact O-NE2 3.48Å; N187-Q290 VanDerWaalsContact O-NE2 3.16Å; R191-Q290 VanDerWaalsContact CA-OE1 3.24Å; T194-Q290 HydrophobicContact CG2-CB 4.3Å; S285-Q290 PolarHBondContact O-N 3.27Å; F286-Q290 HydrophobicContact CD2-CB 4.36Å; F286-Q290 WeakPolarHBondContact O-CA 3.33Å; F286-Q290 VanDerWaalsContact O-CB 3.29Å; F286-Q290 WeakPolarHBondContact O-CB 3.3Å; F286-Q290 PolarHBondContact O-N 3.17Å; Q290-G294 CarbonylContact O-C 3.57Å; Q290-G294 VanDerWaalsContact O-CA 3.24Å; Q290-G294 WeakPolarHBondContact O-CA 3.4Å; Q290-G294 PolarHBondContact O-N 2.91Å; Q290-L295 PolarHBondContact O-N 3.33Å
291	I	93.8	Very high	92.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	I	π-helix	trans	-77.2	-56.8	-177.3	-59.6	-59.5	0	0	0	111.9	L263 E266 F286 L295 I296 F349	L263-I291 HydrophobicContact CD2-CG2 3.79Å; E266-I291 HydrophobicContact CB-CD1 3.94Å; E266-I291 HydrophobicContact CG-CD1 4.18Å; F286-I291 HydrophobicContact CD1-CG1 4.09Å; F286-I291 HydrophobicContact CE1-CD1 4.02Å; F286-I291 HydrophobicContact CE1-CG1 3.76Å; F286-I291 HydrophobicContact CE2-CD1 4.27Å; F286-I291 HydrophobicContact CE2-CG1 4.45Å; F286-I291 HydrophobicContact CZ-CD1 3.75Å; F286-I291 HydrophobicContact CZ-CG1 3.96Å; F286-I291 PolarHBondContact O-N 3.44Å; I291-L295 HydrophobicContact CD1-CD2 4.25Å; I291-L295 WeakPolarHBondContact O-CB 3.34Å; I291-L295 PolarHBondContact O-N 3.43Å; I291-I296 HydrophobicContact CG2-CD1 4.05Å; I291-I296 PolarHBondContact O-N 3.36Å; I291-F349 HydrophobicContact CG1-CD1 4.27Å; I291-F349 HydrophobicContact CG2-CD1 4.24Å; I291-F349 HydrophobicContact CG2-CD2 4.4Å; I291-F349 HydrophobicContact CG2-CG 4.2Å
292	R	93.5	Very high	93	Very high	32 Å²	32	22.1 Å²	22.1	12%	0.121	12%	0.123	C	C	.	.	I	π-helix	trans	-69.2	-58.7	-174.2	-168.7	-176.5	170.7	-69.7	-2.1	112.1	C287 I288 V297 A346 L373 T374	C287-R292 WeakPolarHBondContact O-CB 3.4Å; C287-R292 PolarHBondContact O-N 2.89Å; I288-R292 WeakPolarHBondContact O-CB 3.48Å; R292-V297 WeakPolarHBondContact O-CB 3.49Å; R292-V297 VanDerWaalsContact O-CG2 3.28Å; R292-V297 WeakPolarHBondContact O-CG2 3.36Å; R292-V297 PolarHBondContact O-N 3.48Å; R292-A346 HydrophobicContact CB-CB 3.6Å; R292-A346 HydrophobicContact CG-CB 3.62Å; R292-L373 VanDerWaalsContact NH1-CD2 3.26Å; R292-T374 PolarHBondContact NH2-O 2.97Å
293	E	93.4	Very high	93.4	Very high	40 Å²	40	22.2 Å²	22.2	19%	0.187	12%	0.124	C	C	.	.	I	π-helix	trans	-81.7	-45.8	-176.8	-69.3	-67.4	164.3	0	0	112.7	I288 G298 L373 T374	I288-E293 PolarHBondContact O-N 3.33Å; E293-G298 PolarHBondContact O-N 3.15Å; E293-L373 WeakPolarHBondContact OE1-CA 3.36Å; E293-T374 PolarHBondContact OE1-N 2.94Å; E293-T374 PolarHBondContact OE1-OG1 3.47Å; E293-T374 WeakPolarHBondContact OE2-CB 3.44Å; E293-T374 PolarHBondContact OE2-OG1 3.17Å
294	G	93.1	Very high	93.9	Very high	36 Å²	36	21.1 Å²	21.1	37%	0.371	12%	0.121	S	C	.	.	I	π-helix	trans	-69.4	-52.7	-176.7	0	0	0	0	0	113.9	D289 Q290 G298	D289-G294 PolarHBondContact O-N 3.21Å; Q290-G294 CarbonylContact O-C 3.57Å; Q290-G294 VanDerWaalsContact O-CA 3.24Å; Q290-G294 WeakPolarHBondContact O-CA 3.4Å; Q290-G294 PolarHBondContact O-N 2.91Å; G294-G298 WeakPolarHBondContact O-CA 3.43Å
295	L	95.5	Very high	94.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-89.9	-60	-173.2	-177	66.5	0	0	0	112.2	T194 F198 L201 L259 V262 L263 Q290 I291 Y299	T194-L295 HydrophobicContact CG2-CB 3.85Å; T194-L295 HydrophobicContact CG2-CD1 4.47Å; T194-L295 HydrophobicContact CG2-CD2 4.45Å; T194-L295 HydrophobicContact CG2-CG 4.48Å; F198-L295 HydrophobicContact CB-CD1 3.87Å; F198-L295 HydrophobicContact CD2-CD1 4.32Å; L201-L295 HydrophobicContact CD2-CD1 4.2Å; L259-L295 HydrophobicContact CD1-CG 4.5Å; V262-L295 HydrophobicContact CG1-CD1 4.06Å; V262-L295 HydrophobicContact CG1-CD2 3.95Å; L263-L295 HydrophobicContact CD2-CD2 3.69Å; L263-L295 HydrophobicContact CG-CD2 4.44Å; Q290-L295 PolarHBondContact O-N 3.33Å; I291-L295 HydrophobicContact CD1-CD2 4.25Å; I291-L295 WeakPolarHBondContact O-CB 3.34Å; I291-L295 PolarHBondContact O-N 3.43Å; L295-Y299 WeakPolarHBondContact O-CB 3.42Å; L295-Y299 PolarHBondContact O-N 2.96Å
296	I	96	Very high	94.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-70.4	-58.8	-173.4	-64.5	164.1	0	0	0	110.8	L259 L263 I291 G298 Y299 L300 I343 L345 A346	L259-I296 HydrophobicContact CD1-CG1 4.25Å; L259-I296 HydrophobicContact CD2-CG2 4.5Å; L263-I296 HydrophobicContact CD1-CD1 4.27Å; L263-I296 HydrophobicContact CD1-CG1 4.37Å; L263-I296 HydrophobicContact CD2-CD1 4.11Å; L263-I296 HydrophobicContact CD2-CG1 4.15Å; I291-I296 HydrophobicContact CG2-CD1 4.05Å; I291-I296 PolarHBondContact O-N 3.36Å; I296-G298 VanDerWaalsContact C-N 3.34Å; I296-Y299 PolarHBondContact O-N 3.39Å; I296-L300 HydrophobicContact CG2-CD1 4.23Å; I296-L300 VanDerWaalsContact O-CG 3.3Å; I296-L300 WeakPolarHBondContact O-CG 3.42Å; I296-L300 PolarHBondContact O-N 3.08Å; I296-I343 HydrophobicContact CG2-CG1 4.24Å; I296-L345 HydrophobicContact CD1-CB 4.45Å; I296-A346 HydrophobicContact CD1-CB 3.94Å
297	V	95.9	Very high	94.9	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.133	C	C	.	.	I	π-helix	trans	-65.9	-39.5	179.7	170	0	0	0	0	110.7	R292 Y299 L300 N301 I343 T374	R292-V297 WeakPolarHBondContact O-CB 3.49Å; R292-V297 VanDerWaalsContact O-CG2 3.28Å; R292-V297 WeakPolarHBondContact O-CG2 3.36Å; R292-V297 PolarHBondContact O-N 3.48Å; V297-Y299 VanDerWaalsContact C-N 3.32Å; V297-Y299 PolarHBondContact O-N 3.12Å; V297-L300 PolarHBondContact O-N 2.94Å; V297-N301 WeakPolarHBondContact CG1-ND2 3.46Å; V297-N301 WeakPolarHBondContact O-CB 3.43Å; V297-N301 VanDerWaalsContact O-CG 3.26Å; V297-N301 PolarHBondContact O-N 2.89Å; V297-N301 PolarHBondContact O-ND2 3.39Å; V297-N301 VanDerWaalsContact O-ND2 3.15Å; V297-I343 HydrophobicContact CG2-CG1 4.44Å; V297-T374 HydrophobicContact CG1-CG2 3.89Å; V297-T374 HydrophobicContact CG2-CG2 4.48Å
298	G	96.3	Very high	95.1	Very high	17 Å²	17	25.2 Å²	25.2	18%	0.175	14%	0.136	C	C	.	.	H	α-helix	trans	-53.2	-47.9	171.3	0	0	0	0	0	112.3	F198 E293 G294 I296 N301 F302	F198-G298 VanDerWaalsContact CE2-C 3.49Å; E293-G298 PolarHBondContact O-N 3.15Å; G294-G298 WeakPolarHBondContact O-CA 3.43Å; I296-G298 VanDerWaalsContact C-N 3.34Å; G298-N301 PolarHBondContact O-N 3.3Å; G298-F302 PolarHBondContact O-N 2.9Å
299	Y	97.9	Very high	95.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.7	-43	-179.2	175.1	-117	0	0	0	112	L201 A205 L255 L259 L295 I296 V297 N301 F302 L303	L201-Y299 HydrophobicContact CD1-CD2 4.37Å; L201-Y299 HydrophobicContact CD1-CE1 4.47Å; L201-Y299 HydrophobicContact CD1-CE2 3.95Å; L201-Y299 HydrophobicContact CD2-CD1 4Å; L201-Y299 HydrophobicContact CD2-CD2 3.58Å; L201-Y299 HydrophobicContact CD2-CE1 4.4Å; L201-Y299 HydrophobicContact CD2-CE2 4.03Å; L201-Y299 HydrophobicContact CD2-CG 3.54Å; L201-Y299 HydrophobicContact CG-CD2 3.52Å; L201-Y299 HydrophobicContact CG-CE2 3.53Å; L201-Y299 HydrophobicContact CG-CG 4.01Å; A205-Y299 HydrophobicContact CB-CE2 3.85Å; L255-Y299 WeakPolarHBondContact CD2-OH 3.48Å; L259-Y299 HydrophobicContact CB-CD1 4.37Å; L259-Y299 HydrophobicContact CB-CE1 4.21Å; L259-Y299 HydrophobicContact CD1-CD1 4.43Å; L259-Y299 HydrophobicContact CD2-CD1 4.19Å; L295-Y299 WeakPolarHBondContact O-CB 3.42Å; L295-Y299 PolarHBondContact O-N 2.96Å; I296-Y299 PolarHBondContact O-N 3.39Å; V297-Y299 VanDerWaalsContact C-N 3.32Å; V297-Y299 PolarHBondContact O-N 3.12Å; Y299-N301 VanDerWaalsContact C-N 3.3Å; Y299-N301 PolarHBondContact O-N 3.21Å; Y299-F302 HydrophobicContact CD2-CD1 4.39Å; Y299-F302 WeakPolarHBondContact O-CB 3.45Å; Y299-F302 PolarHBondContact O-N 3.44Å; Y299-L303 HydrophobicContact CD1-CD1 4.13Å; Y299-L303 HydrophobicContact CD2-CG 4.43Å; Y299-L303 HydrophobicContact CE1-CD1 3.62Å; Y299-L303 HydrophobicContact CE1-CG 4.26Å; Y299-L303 HydrophobicContact CE2-CD1 4.31Å; Y299-L303 HydrophobicContact CE2-CD2 4.04Å; Y299-L303 HydrophobicContact CE2-CG 4.08Å; Y299-L303 WeakPolarHBondContact O-CG 3.35Å; Y299-L303 PolarHBondContact O-N 3.03Å
300	L	97.5	Very high	95.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-40.6	175.8	-66	175.5	0	0	0	111.6	I296 V297 L303 V304 W333 V339 L342 I343 V379 F383	I296-L300 HydrophobicContact CG2-CD1 4.23Å; I296-L300 VanDerWaalsContact O-CG 3.3Å; I296-L300 WeakPolarHBondContact O-CG 3.42Å; I296-L300 PolarHBondContact O-N 3.08Å; V297-L300 PolarHBondContact O-N 2.94Å; L300-L303 PolarHBondContact O-N 3.07Å; L300-V304 WeakPolarHBondContact O-CG2 3.32Å; L300-V304 PolarHBondContact O-N 3.39Å; L300-W333 HydrophobicContact CD2-CE3 4.22Å; L300-W333 HydrophobicContact CD2-CZ3 3.7Å; L300-V339 HydrophobicContact CD1-CG1 4.38Å; L300-L342 HydrophobicContact CD2-CD1 3.94Å; L300-I343 HydrophobicContact CD1-CD1 4.27Å; L300-I343 HydrophobicContact CD1-CG1 4Å; L300-V379 HydrophobicContact CB-CG1 3.84Å; L300-V379 HydrophobicContact CD1-CG1 3.96Å; L300-V379 HydrophobicContact CG-CG1 4.46Å; L300-F383 HydrophobicContact CB-CE2 4.17Å; L300-F383 HydrophobicContact CD2-CE2 4.03Å; L300-F383 HydrophobicContact CD2-CZ 4.15Å
301	N	97.1	Very high	95.2	Very high	46 Å²	46	25 Å²	25	25%	0.246	14%	0.137	C	C	.	.	H	α-helix	trans	-66.8	-39.4	175	-72.4	-33.6	0	0	0	112.2	V297 G298 Y299 V304 Q305 R382	V297-N301 WeakPolarHBondContact CG1-ND2 3.46Å; V297-N301 WeakPolarHBondContact O-CB 3.43Å; V297-N301 VanDerWaalsContact O-CG 3.26Å; V297-N301 PolarHBondContact O-N 2.89Å; V297-N301 PolarHBondContact O-ND2 3.39Å; V297-N301 VanDerWaalsContact O-ND2 3.15Å; G298-N301 PolarHBondContact O-N 3.3Å; Y299-N301 VanDerWaalsContact C-N 3.3Å; Y299-N301 PolarHBondContact O-N 3.21Å; N301-V304 PolarHBondContact O-N 2.93Å; N301-Q305 VanDerWaalsContact O-CB 3.32Å; N301-Q305 WeakPolarHBondContact O-CB 3.32Å; N301-Q305 PolarHBondContact O-N 2.83Å; N301-R382 PolarHBondContact OD1-NH1 3.45Å
302	F	97.8	Very high	95	Very high	56 Å²	56	31 Å²	31	25%	0.246	16%	0.163	C	C	.	.	H	α-helix	trans	-57.7	-48.8	172.6	167.6	-96.6	0	0	0	111.2	F198 C202 A205 V206 G298 Y299 V304 Q305 F306	F198-F302 HydrophobicContact CZ-CB 4.42Å; C202-F302 HydrophobicContact CB-CD1 4.08Å; C202-F302 HydrophobicContact CB-CD2 4.26Å; C202-F302 HydrophobicContact CB-CE1 3.8Å; C202-F302 HydrophobicContact CB-CE2 3.99Å; C202-F302 HydrophobicContact CB-CG 4.3Å; C202-F302 HydrophobicContact CB-CZ 3.75Å; C202-F302 VanDerWaalsContact SG-CG 3.57Å; A205-F302 HydrophobicContact CB-CE1 4.22Å; V206-F302 HydrophobicContact CG2-CE1 4.4Å; V206-F302 HydrophobicContact CG2-CZ 3.8Å; G298-F302 PolarHBondContact O-N 2.9Å; Y299-F302 HydrophobicContact CD2-CD1 4.39Å; Y299-F302 WeakPolarHBondContact O-CB 3.45Å; Y299-F302 PolarHBondContact O-N 3.44Å; F302-V304 PolarHBondContact O-N 3.39Å; F302-Q305 PolarHBondContact O-N 3.48Å; F302-F306 HydrophobicContact CZ-CD2 4.47Å; F302-F306 VanDerWaalsContact O-CB 3.28Å; F302-F306 WeakPolarHBondContact O-CB 3.46Å; F302-F306 PolarHBondContact O-N 2.92Å
303	L	97.7	Very high	94.7	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-59.4	-47.9	177.9	-68.2	178.3	0	0	0	111.7	A205 F209 L255 Y299 L300 Q305 F306 L307 W333 F383	A205-L303 HydrophobicContact CB-CD2 3.92Å; F209-L303 HydrophobicContact CE2-CD2 3.93Å; F209-L303 HydrophobicContact CZ-CD2 4.01Å; L255-L303 HydrophobicContact CD2-CD2 4.23Å; Y299-L303 HydrophobicContact CD1-CD1 4.13Å; Y299-L303 HydrophobicContact CD2-CG 4.43Å; Y299-L303 HydrophobicContact CE1-CD1 3.62Å; Y299-L303 HydrophobicContact CE1-CG 4.26Å; Y299-L303 HydrophobicContact CE2-CD1 4.31Å; Y299-L303 HydrophobicContact CE2-CD2 4.04Å; Y299-L303 HydrophobicContact CE2-CG 4.08Å; Y299-L303 WeakPolarHBondContact O-CG 3.35Å; Y299-L303 PolarHBondContact O-N 3.03Å; L300-L303 PolarHBondContact O-N 3.07Å; L303-Q305 VanDerWaalsContact C-N 3.34Å; L303-Q305 PolarHBondContact O-N 3.16Å; L303-F306 PolarHBondContact O-N 3.44Å; L303-L307 VanDerWaalsContact O-CB 3.3Å; L303-L307 WeakPolarHBondContact O-CB 3.38Å; L303-L307 WeakPolarHBondContact O-CG 3.41Å; L303-L307 PolarHBondContact O-N 3.42Å; L303-W333 HydrophobicContact CD1-CH2 3.93Å; L303-W333 HydrophobicContact CD1-CZ3 3.71Å; L303-F383 HydrophobicContact CB-CE1 4.44Å; L303-F383 HydrophobicContact CB-CZ 4.2Å; L303-F383 HydrophobicContact CD1-CZ 4.49Å
304	V	97.3	Very high	93.7	Very high	13 Å²	13	31.7 Å²	31.7	8%	0.079	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-48	176.6	166.1	0	0	0	0	111	L300 N301 F302 L307 S308 R382 F383 T386	L300-V304 WeakPolarHBondContact O-CG2 3.32Å; L300-V304 PolarHBondContact O-N 3.39Å; N301-V304 PolarHBondContact O-N 2.93Å; F302-V304 PolarHBondContact O-N 3.39Å; V304-L307 PolarHBondContact O-N 2.97Å; V304-S308 WeakPolarHBondContact O-CB 3.45Å; V304-S308 PolarHBondContact O-N 3.32Å; V304-R382 HydrophobicContact CG1-CB 3.97Å; V304-R382 HydrophobicContact CG2-CB 4.3Å; V304-F383 HydrophobicContact CG2-CD1 3.94Å; V304-F383 HydrophobicContact CG2-CD2 3.7Å; V304-F383 HydrophobicContact CG2-CE1 3.93Å; V304-F383 HydrophobicContact CG2-CE2 3.67Å; V304-F383 HydrophobicContact CG2-CG 3.83Å; V304-F383 HydrophobicContact CG2-CZ 3.79Å; V304-T386 WeakPolarHBondContact CG1-OG1 3.34Å
305	Q	96.6	Very high	92.3	Very high	99 Å²	99	35.7 Å²	35.7	46%	0.463	19%	0.191	S	C	.	.	H	α-helix	trans	-64.6	-48	-178.3	-176.2	58.8	45.2	0	0	111.3	N301 F302 L303 L307 S308 D309	N301-Q305 VanDerWaalsContact O-CB 3.32Å; N301-Q305 WeakPolarHBondContact O-CB 3.32Å; N301-Q305 PolarHBondContact O-N 2.83Å; F302-Q305 PolarHBondContact O-N 3.48Å; L303-Q305 VanDerWaalsContact C-N 3.34Å; L303-Q305 PolarHBondContact O-N 3.16Å; Q305-L307 VanDerWaalsContact C-N 3.31Å; Q305-L307 PolarHBondContact O-N 3.01Å; Q305-S308 PolarHBondContact O-N 3.43Å; Q305-D309 PolarHBondContact NE2-OD1 3.45Å; Q305-D309 PolarHBondContact NE2-OD2 2.89Å; Q305-D309 PolarHBondContact O-N 3.45Å
306	F	95.6	Very high	90.8	Very high	56 Å²	56	41 Å²	41	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-55.6	-46.2	176.9	179.8	-92.5	0	0	0	111.6	V206 F209 F302 L303 D309 L310	V206-F306 HydrophobicContact CG1-CE2 4.43Å; V206-F306 HydrophobicContact CG2-CD2 4.26Å; V206-F306 HydrophobicContact CG2-CE2 3.89Å; V206-F306 HydrophobicContact CG2-CZ 4.41Å; F209-F306 HydrophobicContact CB-CE1 4.11Å; F209-F306 HydrophobicContact CB-CZ 4.42Å; F209-F306 AromaticContact CD2-CD1 3.65Å; F209-F306 HydrophobicContact CD2-CD1 3.65Å; F209-F306 AromaticContact CD2-CE1 3.2Å; F209-F306 HydrophobicContact CD2-CE1 3.2Å; F209-F306 AromaticContact CD2-CZ 3.91Å; F209-F306 HydrophobicContact CD2-CZ 3.91Å; F209-F306 AromaticContact CE2-CD1 3.58Å; F209-F306 HydrophobicContact CE2-CD1 3.58Å; F209-F306 AromaticContact CE2-CE1 3.67Å; F209-F306 HydrophobicContact CE2-CE1 3.67Å; F209-F306 HydrophobicContact CG-CD1 4.47Å; F209-F306 AromaticContact CG-CE1 3.74Å; F209-F306 HydrophobicContact CG-CE1 3.74Å; F209-F306 HydrophobicContact CG-CZ 4.46Å; F209-F306 HydrophobicContact CZ-CD1 4.35Å; F302-F306 HydrophobicContact CZ-CD2 4.47Å; F302-F306 VanDerWaalsContact O-CB 3.28Å; F302-F306 WeakPolarHBondContact O-CB 3.46Å; F302-F306 PolarHBondContact O-N 2.92Å; L303-F306 PolarHBondContact O-N 3.44Å; F306-D309 PolarHBondContact O-N 3.26Å; F306-L310 WeakPolarHBondContact O-CB 3.44Å; F306-L310 PolarHBondContact O-N 3.06Å
307	L	95.5	Very high	89.8	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-70.4	-35.3	-179.7	-68.6	175.3	0	0	0	112.9	F209 L303 V304 Q305 L310 A311 L326 C330 T386 L390	F209-L307 HydrophobicContact CE1-CD2 3.93Å; F209-L307 HydrophobicContact CZ-CD1 4.45Å; F209-L307 HydrophobicContact CZ-CD2 3.93Å; F209-L307 HydrophobicContact CZ-CG 4.32Å; L303-L307 VanDerWaalsContact O-CB 3.3Å; L303-L307 WeakPolarHBondContact O-CB 3.38Å; L303-L307 WeakPolarHBondContact O-CG 3.41Å; L303-L307 PolarHBondContact O-N 3.42Å; V304-L307 PolarHBondContact O-N 2.97Å; Q305-L307 VanDerWaalsContact C-N 3.31Å; Q305-L307 PolarHBondContact O-N 3.01Å; L307-L310 WeakPolarHBondContact O-CB 3.31Å; L307-L310 PolarHBondContact O-N 3.49Å; L307-A311 PolarHBondContact O-N 2.88Å; L307-L326 HydrophobicContact CD2-CB 4.16Å; L307-L326 HydrophobicContact CD2-CD1 3.84Å; L307-L326 HydrophobicContact CD2-CD2 4Å; L307-L326 HydrophobicContact CD2-CG 4.22Å; L307-C330 WeakPolarHBondContact CD1-SG 3.37Å; L307-T386 HydrophobicContact CB-CG2 3.64Å; L307-L390 HydrophobicContact CB-CD1 4.24Å
308	S	95.1	Very high	89.2	Confident	11 Å²	11	50 Å²	50	8%	0.077	27%	0.267	C	S	.	.	H	α-helix	trans	-67.2	-40.7	173.6	-177.2	0	0	0	0	111.5	V304 Q305 L310 A311 K312 E389	V304-S308 WeakPolarHBondContact O-CB 3.45Å; V304-S308 PolarHBondContact O-N 3.32Å; Q305-S308 PolarHBondContact O-N 3.43Å; S308-L310 VanDerWaalsContact C-N 3.29Å; S308-L310 PolarHBondContact O-N 3.47Å; S308-A311 WeakPolarHBondContact O-CB 3.3Å; S308-A311 PolarHBondContact O-N 3.21Å; S308-A311 VanDerWaalsContact O-N 3.16Å; S308-K312 WeakPolarHBondContact O-CG 3.4Å; S308-K312 PolarHBondContact O-N 3.2Å; S308-K312 VanDerWaalsContact OG-CE 3.31Å; S308-K312 WeakPolarHBondContact OG-CE 3.27Å; S308-K312 PolarHBondContact OG-NZ 3.14Å; S308-E389 PolarHBondContact OG-OE2 3.32Å
309	D	93.6	Very high	88.8	Confident	66 Å²	66	51.1 Å²	51.1	35%	0.353	27%	0.271	S	S	.	.	H	α-helix	trans	-68.1	-33	176.9	-66.9	-22.9	0	0	0	112	Q305 F306 K312 T313	Q305-D309 PolarHBondContact NE2-OD1 3.45Å; Q305-D309 PolarHBondContact NE2-OD2 2.89Å; Q305-D309 PolarHBondContact O-N 3.45Å; F306-D309 PolarHBondContact O-N 3.26Å; D309-K312 PolarHBondContact O-N 3.33Å; D309-K312 IonicContact OD1-NZ 2.67Å; D309-K312 PolarHBondContact OD1-NZ 2.91Å; D309-T313 WeakPolarHBondContact O-CG2 3.42Å; D309-T313 PolarHBondContact O-N 2.99Å; D309-T313 VanDerWaalsContact O-N 3.09Å; D309-T313 PolarHBondContact O-OG1 3.07Å
310	L	90.7	Very high	88.4	Confident	37 Å²	37	51.3 Å²	51.3	19%	0.194	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-43.6	169.5	-163.9	72.9	0	0	0	111.8	F306 L307 S308 K312 T313 A314 I318 L326	F306-L310 WeakPolarHBondContact O-CB 3.44Å; F306-L310 PolarHBondContact O-N 3.06Å; L307-L310 WeakPolarHBondContact O-CB 3.31Å; L307-L310 PolarHBondContact O-N 3.49Å; S308-L310 VanDerWaalsContact C-N 3.29Å; S308-L310 PolarHBondContact O-N 3.47Å; L310-K312 VanDerWaalsContact C-N 3.34Å; L310-K312 PolarHBondContact O-N 3.09Å; L310-T313 PolarHBondContact O-N 3.07Å; L310-T313 PolarHBondContact O-OG1 3.5Å; L310-T313 VanDerWaalsContact O-OG1 3.14Å; L310-A314 PolarHBondContact O-N 3.18Å; L310-I318 HydrophobicContact CD1-CD1 3.32Å; L310-I318 HydrophobicContact CD1-CG1 4.38Å; L310-I318 HydrophobicContact CD2-CD1 4.46Å; L310-I318 HydrophobicContact CG-CD1 3.48Å; L310-I318 VanDerWaalsContact CG-CD1 3.48Å; L310-I318 VanDerWaalsContact O-CD1 3.27Å; L310-I318 WeakPolarHBondContact O-CD1 3.14Å; L310-L326 HydrophobicContact CD2-CD1 3.22Å
311	A	90	Very high	88.1	Confident	12 Å²	12	51.7 Å²	51.7	10%	0.099	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-40.4	176.1	0	0	0	0	0	112.4	L307 S308 A314 E389 L390 A393	L307-A311 PolarHBondContact O-N 2.88Å; S308-A311 WeakPolarHBondContact O-CB 3.3Å; S308-A311 PolarHBondContact O-N 3.21Å; S308-A311 VanDerWaalsContact O-N 3.16Å; A311-A314 VanDerWaalsContact O-CB 3.31Å; A311-A314 WeakPolarHBondContact O-CB 3.36Å; A311-A314 PolarHBondContact O-N 3.3Å; A311-E389 HydrophobicContact CB-CB 4.14Å; A311-L390 HydrophobicContact CB-CD2 3.75Å; A311-L390 HydrophobicContact CB-CG 4.01Å; A311-A393 HydrophobicContact CB-CB 4.47Å
312	K	89.8	Confident	87.9	Confident	125 Å²	125	50 Å²	50	54%	0.543	27%	0.266	S	S	.	.	H	α-helix	trans	-68.4	-33.2	178.6	-66.3	167.5	-158.6	152.4	0	112.9	S308 D309 L310	S308-K312 WeakPolarHBondContact O-CG 3.4Å; S308-K312 PolarHBondContact O-N 3.2Å; S308-K312 VanDerWaalsContact OG-CE 3.31Å; S308-K312 WeakPolarHBondContact OG-CE 3.27Å; S308-K312 PolarHBondContact OG-NZ 3.14Å; D309-K312 PolarHBondContact O-N 3.33Å; D309-K312 IonicContact OD1-NZ 2.67Å; D309-K312 PolarHBondContact OD1-NZ 2.91Å; L310-K312 VanDerWaalsContact C-N 3.34Å; L310-K312 PolarHBondContact O-N 3.09Å
313	T	86.2	Confident	87.7	Confident	84 Å²	84	47.3 Å²	47.3	52%	0.515	25%	0.254	S	S	.	.	H	α-helix	trans	-87.5	-4.8	-178.9	53.7	0	0	0	0	114	D309 L310 V315	D309-T313 WeakPolarHBondContact O-CG2 3.42Å; D309-T313 PolarHBondContact O-N 2.99Å; D309-T313 VanDerWaalsContact O-N 3.09Å; D309-T313 PolarHBondContact O-OG1 3.07Å; L310-T313 PolarHBondContact O-N 3.07Å; L310-T313 PolarHBondContact O-OG1 3.5Å; L310-T313 VanDerWaalsContact O-OG1 3.14Å; T313-V315 PolarHBondContact O-N 3.1Å
314	A	72.2	Confident	87.4	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-16.4	-171	0	0	0	0	0	116.3	L310 A311 C316 I318 L323 A393	L310-A314 PolarHBondContact O-N 3.18Å; A311-A314 VanDerWaalsContact O-CB 3.31Å; A311-A314 WeakPolarHBondContact O-CB 3.36Å; A311-A314 PolarHBondContact O-N 3.3Å; A314-C316 PolarHBondContact O-N 3.27Å; A314-I318 HydrophobicContact CB-CD1 4.15Å; A314-L323 HydrophobicContact CB-CD1 3.91Å; A314-L323 HydrophobicContact CB-CD2 3.88Å; A314-A393 HydrophobicContact CB-CB 3.9Å
315	V	63.8	Low	87.3	Confident	119 Å²	119	46.6 Å²	46.6	72%	0.721	25%	0.25	S	S	*	.	H	α-helix	trans	-50.3	-28.2	-164.1	-177.2	0	0	0	0	114.5	T313	T313-V315 PolarHBondContact O-N 3.1Å
316	C	63.7	Low	87.2	Confident	113 Å²	113	42 Å²	42	76%	0.764	23%	0.229	S	C	*	.	H	α-helix	trans	-148.1	-1.8	172.6	-58.3	0	0	0	0	116.4	A314	A314-C316 PolarHBondContact O-N 3.27Å
317	K	76.3	Confident	87.2	Confident	170 Å²	170	39.3 Å²	39.3	74%	0.739	22%	0.217	S	C	*	.	H	α-helix	trans	-107.6	-15.6	-164.7	-67	-176.2	-179.9	179.1	0	114.6
318	I	82.6	Confident	87.2	Confident	18 Å²	18	42 Å²	42	9%	0.092	23%	0.228	C	C	.	.	S	Bend	trans	-118.3	118.2	-166.2	-50.7	-179.7	0	0	0	108.4	L310 A314 I322 L323 L397	L310-I318 HydrophobicContact CD1-CD1 3.32Å; L310-I318 HydrophobicContact CD1-CG1 4.38Å; L310-I318 HydrophobicContact CD2-CD1 4.46Å; L310-I318 HydrophobicContact CG-CD1 3.48Å; L310-I318 VanDerWaalsContact CG-CD1 3.48Å; L310-I318 VanDerWaalsContact O-CD1 3.27Å; L310-I318 WeakPolarHBondContact O-CD1 3.14Å; A314-I318 HydrophobicContact CB-CD1 4.15Å; I318-I322 HydrophobicContact CG2-CB 3.99Å; I318-I322 HydrophobicContact CG2-CG2 3.88Å; I318-L323 HydrophobicContact CB-CD2 4.28Å; I318-L323 HydrophobicContact CB-CG 4.37Å; I318-L323 HydrophobicContact CD1-CD2 4.37Å; I318-L323 HydrophobicContact CG2-CD2 3.84Å; I318-L323 HydrophobicContact CG2-CG 3.9Å; I318-L397 WeakPolarHBondContact O-CD2 3.21Å
319	P	87.2	Confident	87.2	Confident	42 Å²	42	41.6 Å²	41.6	27%	0.273	23%	0.225	S	C	.	.			trans	-51.6	137.5	173.7	-29.3	32	0	0	0	113.3	P321 I322 L323	P319-P321 VanDerWaalsContact C-CD 3.48Å; P319-P321 VanDerWaalsContact C-N 3.35Å; P319-I322 HydrophobicContact CB-CD1 4.2Å; P319-I322 HydrophobicContact CB-CG1 4.39Å; P319-I322 HydrophobicContact CG-CD1 4.01Å; P319-I322 WeakPolarHBondContact O-CB 3.05Å; P319-I322 PolarHBondContact O-N 2.85Å; P319-L323 PolarHBondContact O-N 2.9Å
320	G	90.4	Very high	87.4	Confident	3 Å²	3	38.4 Å²	38.4	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-50.1	-44	177.8	0	0	0	0	0	114.7	I322 L323 L324 F394 E398	G320-I322 PolarHBondContact O-N 3.44Å; G320-L323 PolarHBondContact O-N 2.96Å; G320-L323 VanDerWaalsContact O-N 3.15Å; G320-L324 WeakPolarHBondContact O-CB 3.26Å; G320-L324 PolarHBondContact O-N 3.49Å; G320-F394 WeakPolarHBondContact O-CD2 3.1Å; G320-E398 WeakPolarHBondContact CA-OE1 3.38Å
321	P	91.4	Very high	87.6	Confident	8 Å²	8	37.2 Å²	37.2	5%	0.052	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-31.9	177.4	-27.5	35	0	0	0	114.2	L216 L221 L244 P319 T325	L216-P321 HydrophobicContact CD1-CB 4.46Å; L216-P321 HydrophobicContact CD2-CB 4.35Å; L221-P321 HydrophobicContact CB-CG 4.5Å; L244-P321 HydrophobicContact CD1-CB 4.15Å; L244-P321 HydrophobicContact CD2-CB 4.38Å; P319-P321 VanDerWaalsContact C-CD 3.48Å; P319-P321 VanDerWaalsContact C-N 3.35Å; P321-T325 WeakPolarHBondContact O-CB 3.38Å; P321-T325 PolarHBondContact O-N 2.62Å; P321-T325 PolarHBondContact O-OG1 3.32Å
322	I	92.3	Very high	87.9	Confident	11 Å²	11	38.9 Å²	38.9	6%	0.056	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-49.8	176.6	-66.8	172.6	0	0	0	109.7	R213 L216 I318 P319 G320 L324 T325 L326	R213-I322 HydrophobicContact CB-CD1 3.87Å; R213-I322 HydrophobicContact CG-CD1 3.8Å; L216-I322 HydrophobicContact CD1-CB 4.4Å; L216-I322 HydrophobicContact CD1-CD1 4.48Å; L216-I322 HydrophobicContact CD1-CG1 3.42Å; L216-I322 VanDerWaalsContact CD1-CG1 3.42Å; I318-I322 HydrophobicContact CG2-CB 3.99Å; I318-I322 HydrophobicContact CG2-CG2 3.88Å; P319-I322 HydrophobicContact CB-CD1 4.2Å; P319-I322 HydrophobicContact CB-CG1 4.39Å; P319-I322 HydrophobicContact CG-CD1 4.01Å; P319-I322 WeakPolarHBondContact O-CB 3.05Å; P319-I322 PolarHBondContact O-N 2.85Å; G320-I322 PolarHBondContact O-N 3.44Å; I322-L324 VanDerWaalsContact C-N 3.28Å; I322-L324 PolarHBondContact O-N 2.98Å; I322-T325 PolarHBondContact O-N 3.39Å; I322-L326 HydrophobicContact CG2-CD1 3.61Å; I322-L326 HydrophobicContact CG2-CG 4.21Å; I322-L326 WeakPolarHBondContact O-CB 3.34Å; I322-L326 VanDerWaalsContact O-CG 3.25Å; I322-L326 WeakPolarHBondContact O-CG 3.36Å; I322-L326 PolarHBondContact O-N 3.01Å
323	L	93	Very high	88.2	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.3	-42.4	179.5	-63.3	171.9	0	0	0	111.3	A314 I318 P319 G320 G327 L390 A393 F394 L397	A314-L323 HydrophobicContact CB-CD1 3.91Å; A314-L323 HydrophobicContact CB-CD2 3.88Å; I318-L323 HydrophobicContact CB-CD2 4.28Å; I318-L323 HydrophobicContact CB-CG 4.37Å; I318-L323 HydrophobicContact CD1-CD2 4.37Å; I318-L323 HydrophobicContact CG2-CD2 3.84Å; I318-L323 HydrophobicContact CG2-CG 3.9Å; P319-L323 PolarHBondContact O-N 2.9Å; G320-L323 PolarHBondContact O-N 2.96Å; G320-L323 VanDerWaalsContact O-N 3.15Å; L323-G327 PolarHBondContact O-N 3.3Å; L323-L390 HydrophobicContact CD2-CD2 3.93Å; L323-A393 HydrophobicContact CD1-CB 4.4Å; L323-F394 HydrophobicContact CB-CB 3.92Å; L323-F394 HydrophobicContact CD1-CB 4.44Å; L323-L397 HydrophobicContact CD1-CD2 3.98Å
324	L	93.1	Very high	88.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-46.1	177.5	-171.3	74	0	0	0	111.9	L244 G320 I322 G327 K328 L391 F394 V442 L445 F446 L520	L244-L324 HydrophobicContact CD2-CD2 4Å; G320-L324 WeakPolarHBondContact O-CB 3.26Å; G320-L324 PolarHBondContact O-N 3.49Å; I322-L324 VanDerWaalsContact C-N 3.28Å; I322-L324 PolarHBondContact O-N 2.98Å; L324-G327 PolarHBondContact O-N 3.37Å; L324-K328 WeakPolarHBondContact O-CB 3.39Å; L324-K328 PolarHBondContact O-N 3.29Å; L324-L391 HydrophobicContact CD1-CD2 4.05Å; L324-F394 HydrophobicContact CB-CD2 4.11Å; L324-F394 HydrophobicContact CB-CE2 4.15Å; L324-F394 HydrophobicContact CD1-CD1 4.09Å; L324-F394 HydrophobicContact CD1-CE1 3.91Å; L324-F394 HydrophobicContact CD1-CE2 4.41Å; L324-F394 HydrophobicContact CD1-CG 4.42Å; L324-F394 HydrophobicContact CD1-CZ 4.04Å; L324-F394 HydrophobicContact CD2-CZ 4.49Å; L324-V442 HydrophobicContact CD1-CG2 4.29Å; L324-V442 HydrophobicContact CD2-CG2 4.14Å; L324-L445 HydrophobicContact CD2-CD1 4.03Å; L324-L445 HydrophobicContact CG-CD1 3.91Å; L324-F446 HydrophobicContact CD1-CD2 4Å; L324-F446 HydrophobicContact CD1-CE2 3.6Å; L324-F446 HydrophobicContact CG-CE2 4.13Å; L324-L520 HydrophobicContact CD1-CD1 4.13Å
325	T	93.2	Very high	89.6	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-46	179	-55.2	0	0	0	0	111.4	L212 L244 L248 P321 I322 K328 L329	L212-T325 HydrophobicContact CD1-CG2 4.46Å; L212-T325 HydrophobicContact CD2-CG2 4.21Å; L244-T325 WeakPolarHBondContact CG-OG1 3.36Å; L248-T325 HydrophobicContact CB-CG2 4.04Å; L248-T325 HydrophobicContact CD1-CG2 4.19Å; P321-T325 WeakPolarHBondContact O-CB 3.38Å; P321-T325 PolarHBondContact O-N 2.62Å; P321-T325 PolarHBondContact O-OG1 3.32Å; I322-T325 PolarHBondContact O-N 3.39Å; T325-K328 PolarHBondContact O-N 2.93Å; T325-L329 PolarHBondContact O-N 3.22Å
326	L	95	Very high	91	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-70.7	-37.8	-179.8	-63.9	177.6	0	0	0	112.1	F209 L212 L251 L307 L310 I322 K328 L329 C330 L390	F209-L326 HydrophobicContact CD1-CD2 3.71Å; F209-L326 HydrophobicContact CE1-CD2 3.59Å; L212-L326 HydrophobicContact CD2-CD2 3.99Å; L212-L326 HydrophobicContact CD2-CG 4.35Å; L251-L326 HydrophobicContact CD2-CD2 3.75Å; L307-L326 HydrophobicContact CD2-CB 4.16Å; L307-L326 HydrophobicContact CD2-CD1 3.84Å; L307-L326 HydrophobicContact CD2-CD2 4Å; L307-L326 HydrophobicContact CD2-CG 4.22Å; L310-L326 HydrophobicContact CD2-CD1 3.22Å; I322-L326 HydrophobicContact CG2-CD1 3.61Å; I322-L326 HydrophobicContact CG2-CG 4.21Å; I322-L326 WeakPolarHBondContact O-CB 3.34Å; I322-L326 VanDerWaalsContact O-CG 3.25Å; I322-L326 WeakPolarHBondContact O-CG 3.36Å; I322-L326 PolarHBondContact O-N 3.01Å; L326-K328 VanDerWaalsContact C-N 3.29Å; L326-K328 PolarHBondContact O-N 3.43Å; L326-L329 HydrophobicContact CD2-CD2 4.36Å; L326-L329 WeakPolarHBondContact O-CB 3.5Å; L326-L329 PolarHBondContact O-N 3.02Å; L326-C330 PolarHBondContact O-N 2.72Å; L326-C330 PolarHBondContact O-SG 3.28Å; L326-L390 HydrophobicContact CB-CD1 3.86Å
327	G	95.2	Very high	92.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-43	172.2	0	0	0	0	0	111.3	L323 L324 L331	L323-G327 PolarHBondContact O-N 3.3Å; L324-G327 PolarHBondContact O-N 3.37Å; G327-L331 WeakPolarHBondContact O-CG 3.48Å; G327-L331 PolarHBondContact O-N 2.9Å
328	K	95.6	Very high	93.2	Very high	57 Å²	57	21.8 Å²	21.8	25%	0.248	13%	0.133	C	C	.	.	H	α-helix	trans	-66.1	-41	174.8	-176.4	67.4	-175.5	-161.2	0	112.8	L248 L324 T325 L326 C330 L331 M332 L445 F446	L248-K328 HydrophobicContact CD2-CB 4.16Å; L248-K328 HydrophobicContact CD2-CG 3.45Å; L248-K328 VanDerWaalsContact CD2-CG 3.45Å; L324-K328 WeakPolarHBondContact O-CB 3.39Å; L324-K328 PolarHBondContact O-N 3.29Å; T325-K328 PolarHBondContact O-N 2.93Å; L326-K328 VanDerWaalsContact C-N 3.29Å; L326-K328 PolarHBondContact O-N 3.43Å; K328-C330 PolarHBondContact O-N 3.12Å; K328-L331 PolarHBondContact O-N 2.88Å; K328-M332 VanDerWaalsContact O-CB 3.27Å; K328-M332 WeakPolarHBondContact O-CB 3.33Å; K328-M332 PolarHBondContact O-N 3.3Å; K328-L445 HydrophobicContact CB-CB 4.39Å; K328-L445 HydrophobicContact CB-CD1 4.15Å; K328-L445 HydrophobicContact CD-CB 4.47Å; K328-L445 WeakPolarHBondContact CD-O 3.29Å; K328-L445 WeakPolarHBondContact CE-O 3.22Å; K328-L445 HydrophobicContact CG-CB 4.16Å; K328-L445 HydrophobicContact CG-CD2 4.45Å; K328-L445 PolarHBondContact NZ-O 3.33Å; K328-F446 HydrophobicContact CB-CE2 4.13Å; K328-F446 HydrophobicContact CB-CZ 3.89Å; K328-F446 HydrophobicContact CD-CD1 4.3Å; K328-F446 HydrophobicContact CD-CE1 3.76Å; K328-F446 HydrophobicContact CD-CE2 4.23Å; K328-F446 HydrophobicContact CD-CZ 3.72Å; K328-F446 HydrophobicContact CG-CZ 4.37Å
329	L	96.3	Very high	93.8	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-56	-50.6	175.5	178.9	68.4	0	0	0	111.3	F209 L248 L251 L255 T325 L326 L331 M332 W333	F209-L329 HydrophobicContact CE1-CD2 4.44Å; L248-L329 HydrophobicContact CD1-CB 3.56Å; L248-L329 HydrophobicContact CD1-CD1 3.89Å; L248-L329 HydrophobicContact CD1-CG 4.31Å; L251-L329 HydrophobicContact CD2-CD2 3.88Å; L251-L329 HydrophobicContact CG-CD2 4.25Å; L255-L329 HydrophobicContact CD1-CD2 3.95Å; T325-L329 PolarHBondContact O-N 3.22Å; L326-L329 HydrophobicContact CD2-CD2 4.36Å; L326-L329 WeakPolarHBondContact O-CB 3.5Å; L326-L329 PolarHBondContact O-N 3.02Å; L329-L331 PolarHBondContact O-N 3.27Å; L329-M332 HydrophobicContact CD1-CE 3.97Å; L329-M332 PolarHBondContact O-N 3.33Å; L329-W333 PolarHBondContact O-N 3.04Å
330	C	96.9	Very high	94.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-56.8	-48.2	178.5	-77.6	0	0	0	0	112.4	L307 L326 K328 W333 A334 F383 G387	L307-C330 WeakPolarHBondContact CD1-SG 3.37Å; L326-C330 PolarHBondContact O-N 2.72Å; L326-C330 PolarHBondContact O-SG 3.28Å; K328-C330 PolarHBondContact O-N 3.12Å; C330-W333 PolarHBondContact O-N 3.37Å; C330-A334 WeakPolarHBondContact O-CB 3.45Å; C330-A334 PolarHBondContact O-N 3.4Å; C330-F383 HydrophobicContact CB-CD1 4.31Å; C330-F383 WeakPolarHBondContact CB-O 3.41Å; C330-G387 VanDerWaalsContact CB-CA 3.43Å
331	L	95.6	Very high	94.3	Very high	11 Å²	11	24.7 Å²	24.7	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-66.8	-42	179.1	-66.8	173.7	0	0	0	111.7	G327 K328 L329 W333 A334 D335 R384 L391 F446 A515	G327-L331 WeakPolarHBondContact O-CG 3.48Å; G327-L331 PolarHBondContact O-N 2.9Å; K328-L331 PolarHBondContact O-N 2.88Å; L329-L331 PolarHBondContact O-N 3.27Å; L331-W333 PolarHBondContact O-N 3.46Å; L331-A334 PolarHBondContact O-N 2.8Å; L331-D335 WeakPolarHBondContact O-CB 3.44Å; L331-D335 PolarHBondContact O-N 3.36Å; L331-R384 HydrophobicContact CD2-CG 3.97Å; L331-L391 HydrophobicContact CD1-CD1 3.73Å; L331-F446 HydrophobicContact CD1-CE1 4.19Å; L331-F446 HydrophobicContact CD1-CZ 4.47Å; L331-A515 HydrophobicContact CD1-CB 3.38Å
332	M	95.1	Very high	94.4	Very high	47 Å²	47	24.4 Å²	24.4	23%	0.232	15%	0.147	C	C	.	.	H	α-helix	trans	-57.1	-49.3	175.8	-177.1	-178.9	72.5	0	0	110.8	S252 K328 L329 A334 D335 S336	S252-M332 WeakPolarHBondContact OG-CE 3.47Å; K328-M332 VanDerWaalsContact O-CB 3.27Å; K328-M332 WeakPolarHBondContact O-CB 3.33Å; K328-M332 PolarHBondContact O-N 3.3Å; L329-M332 HydrophobicContact CD1-CE 3.97Å; L329-M332 PolarHBondContact O-N 3.33Å; M332-A334 VanDerWaalsContact C-N 3.32Å; M332-A334 PolarHBondContact O-N 3.2Å; M332-D335 PolarHBondContact O-N 3.44Å; M332-S336 WeakPolarHBondContact O-CB 3.44Å; M332-S336 PolarHBondContact O-N 2.9Å; M332-S336 PolarHBondContact O-OG 3.17Å
333	W	96.7	Very high	94.5	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-35.2	178.8	-81.8	32.5	0	0	0	113.1	S252 L255 V256 L300 L303 L329 C330 L331 T338 V339 L342 F383	S252-W333 PolarHBondContact OG-NE1 2.96Å; L255-W333 HydrophobicContact CB-CH2 3.96Å; L255-W333 HydrophobicContact CB-CZ2 4Å; L255-W333 HydrophobicContact CD1-CH2 4.44Å; L255-W333 HydrophobicContact CD1-CZ2 4.33Å; V256-W333 HydrophobicContact CG2-CH2 4.25Å; V256-W333 HydrophobicContact CG2-CZ2 3.78Å; L300-W333 HydrophobicContact CD2-CE3 4.22Å; L300-W333 HydrophobicContact CD2-CZ3 3.7Å; L303-W333 HydrophobicContact CD1-CH2 3.93Å; L303-W333 HydrophobicContact CD1-CZ3 3.71Å; L329-W333 PolarHBondContact O-N 3.04Å; C330-W333 PolarHBondContact O-N 3.37Å; L331-W333 PolarHBondContact O-N 3.46Å; W333-T338 HydrophobicContact CD2-CG2 4.06Å; W333-T338 HydrophobicContact CG-CG2 4.16Å; W333-V339 HydrophobicContact CB-CG2 4.26Å; W333-V339 WeakPolarHBondContact O-CG2 3.11Å; W333-L342 HydrophobicContact CE3-CD1 4.48Å; W333-L342 HydrophobicContact CH2-CD1 4.14Å; W333-L342 HydrophobicContact CZ3-CD1 3.95Å; W333-F383 AromaticContact CE3-CE1 3.93Å; W333-F383 HydrophobicContact CE3-CE1 3.93Å; W333-F383 HydrophobicContact CE3-CE2 4.21Å; W333-F383 AromaticContact CE3-CZ 3.64Å; W333-F383 HydrophobicContact CE3-CZ 3.64Å; W333-F383 HydrophobicContact CZ3-CZ 4.01Å
334	A	95.2	Very high	94.4	Very high	9 Å²	9	26 Å²	26	7%	0.074	16%	0.158	C	C	.	.	H	α-helix	trans	-68.9	-35.1	176.4	0	0	0	0	0	113	C330 L331 M332 S380 F383 R384	C330-A334 WeakPolarHBondContact O-CB 3.45Å; C330-A334 PolarHBondContact O-N 3.4Å; L331-A334 PolarHBondContact O-N 2.8Å; M332-A334 VanDerWaalsContact C-N 3.32Å; M332-A334 PolarHBondContact O-N 3.2Å; A334-S380 VanDerWaalsContact CB-O 3.32Å; A334-S380 WeakPolarHBondContact CB-O 3.38Å; A334-F383 HydrophobicContact CB-CB 4.11Å; A334-R384 HydrophobicContact CB-CB 4.12Å
335	D	93.3	Very high	94.3	Very high	101 Å²	101	26.5 Å²	26.5	54%	0.54	16%	0.161	S	C	.	.	H	α-helix	trans	-96.9	-31.1	-172.1	-72	-36.8	0	0	0	114.6	L331 M332 G337 R384	L331-D335 WeakPolarHBondContact O-CB 3.44Å; L331-D335 PolarHBondContact O-N 3.36Å; M332-D335 PolarHBondContact O-N 3.44Å; D335-G337 VanDerWaalsContact C-N 3.31Å; D335-G337 PolarHBondContact O-N 3.48Å; D335-R384 IonicContact OD1-CZ 3.69Å; D335-R384 IonicContact OD1-NH1 2.96Å; D335-R384 PolarHBondContact OD1-NH1 2.95Å; D335-R384 IonicContact OD1-NH2 3.72Å; D335-R384 PolarHBondContact OD1-NH2 3.48Å; D335-R384 IonicContact OD2-NH1 2.76Å; D335-R384 PolarHBondContact OD2-NH1 2.94Å
336	S	92.5	Very high	94	Very high	70 Å²	70	26.6 Å²	26.6	49%	0.49	16%	0.162	S	C	.	.	S	Bend	trans	-78.5	-10.2	-173	65.2	0	0	0	0	114.7	M332 T338	M332-S336 WeakPolarHBondContact O-CB 3.44Å; M332-S336 PolarHBondContact O-N 2.9Å; M332-S336 PolarHBondContact O-OG 3.17Å; S336-T338 VanDerWaalsContact C-N 3.3Å; S336-T338 WeakPolarHBondContact OG-CB 3.35Å; S336-T338 PolarHBondContact OG-N 3.46Å; S336-T338 VanDerWaalsContact OG-N 3.12Å; S336-T338 PolarHBondContact OG-OG1 3.03Å
337	G	92.6	Very high	93.4	Very high	41 Å²	41	30.6 Å²	30.6	42%	0.423	18%	0.183	S	C	.	.	S	Bend	trans	80.3	4	-168.2	0	0	0	0	0	114.4	D335 V339 G340 H341	D335-G337 VanDerWaalsContact C-N 3.31Å; D335-G337 PolarHBondContact O-N 3.48Å; G337-V339 VanDerWaalsContact C-N 3.32Å; G337-V339 PolarHBondContact O-N 3.29Å; G337-G340 PolarHBondContact O-N 3.28Å; G337-G340 VanDerWaalsContact O-N 3.08Å; G337-H341 PolarHBondContact O-N 2.86Å
338	T	94.4	Very high	92.8	Very high	33 Å²	33	34.6 Å²	34.6	20%	0.202	21%	0.205	C	C	.	.	H	α-helix	trans	-54.8	-45.2	177.7	-64.5	0	0	0	0	111.8	V256 W333 S336 G340 H341 L342	V256-T338 HydrophobicContact CG2-CG2 4.38Å; W333-T338 HydrophobicContact CD2-CG2 4.06Å; W333-T338 HydrophobicContact CG-CG2 4.16Å; S336-T338 VanDerWaalsContact C-N 3.3Å; S336-T338 WeakPolarHBondContact OG-CB 3.35Å; S336-T338 PolarHBondContact OG-N 3.46Å; S336-T338 VanDerWaalsContact OG-N 3.12Å; S336-T338 PolarHBondContact OG-OG1 3.03Å; T338-G340 VanDerWaalsContact C-N 3.32Å; T338-G340 PolarHBondContact O-N 2.99Å; T338-H341 PolarHBondContact O-N 2.93Å; T338-L342 HydrophobicContact CG2-CD1 4.11Å; T338-L342 HydrophobicContact CG2-CG 4.25Å; T338-L342 VanDerWaalsContact O-CG 3.32Å; T338-L342 WeakPolarHBondContact O-CG 3.48Å; T338-L342 PolarHBondContact O-N 3.5Å
339	V	95.1	Very high	92	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.8	-44.7	176.9	169.9	0	0	0	0	111.6	L300 W333 G337 L342 I343 V379 F383	L300-V339 HydrophobicContact CD1-CG1 4.38Å; W333-V339 HydrophobicContact CB-CG2 4.26Å; W333-V339 WeakPolarHBondContact O-CG2 3.11Å; G337-V339 VanDerWaalsContact C-N 3.32Å; G337-V339 PolarHBondContact O-N 3.29Å; V339-L342 PolarHBondContact O-N 2.93Å; V339-I343 HydrophobicContact CG1-CD1 3.95Å; V339-I343 WeakPolarHBondContact O-CG1 3.35Å; V339-I343 PolarHBondContact O-N 2.89Å; V339-I343 VanDerWaalsContact O-N 3.07Å; V339-V379 HydrophobicContact CG1-CB 3.71Å; V339-V379 HydrophobicContact CG1-CG1 3.63Å; V339-F383 HydrophobicContact CG2-CD2 3.79Å; V339-F383 HydrophobicContact CG2-CE2 4Å
340	G	94	Very high	90.9	Very high	25 Å²	25	34.7 Å²	34.7	26%	0.258	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-44.7	176.9	0	0	0	0	0	112.1	G337 T338 L342 I343 S344	G337-G340 PolarHBondContact O-N 3.28Å; G337-G340 VanDerWaalsContact O-N 3.08Å; T338-G340 VanDerWaalsContact C-N 3.32Å; T338-G340 PolarHBondContact O-N 2.99Å; G340-L342 PolarHBondContact O-N 3.11Å; G340-I343 PolarHBondContact O-N 3.43Å; G340-S344 PolarHBondContact O-N 3.24Å; G340-S344 PolarHBondContact O-OG 2.95Å
341	H	93.9	Very high	89.6	Confident	100 Å²	100	40.3 Å²	40.3	46%	0.463	24%	0.236	S	C	.	.	H	α-helix	trans	-61.9	-40.8	176.7	-177.2	55.9	0	0	0	112.9	R260 G337 T338 S344 L345	R260-H341 PolarHBondContact NH2-CD2 3.17Å; R260-H341 VanDerWaalsContact NH2-CD2 3.28Å; R260-H341 PolarHBondContact NH2-NE2 3.39Å; G337-H341 PolarHBondContact O-N 2.86Å; T338-H341 PolarHBondContact O-N 2.93Å; H341-S344 WeakPolarHBondContact CA-OG 3.46Å; H341-S344 PolarHBondContact O-N 3.45Å; H341-S344 PolarHBondContact O-OG 3.43Å; H341-L345 WeakPolarHBondContact O-CG 3.25Å; H341-L345 PolarHBondContact O-N 3.04Å
342	L	94.2	Very high	87.9	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-40.6	177.7	-67.7	-179.2	0	0	0	111.7	V256 L259 L300 W333 T338 V339 G340 L345	V256-L342 HydrophobicContact CG1-CD2 4.07Å; V256-L342 HydrophobicContact CG2-CD1 4.42Å; V256-L342 HydrophobicContact CG2-CD2 4.32Å; L259-L342 HydrophobicContact CD2-CB 4.45Å; L259-L342 HydrophobicContact CD2-CD1 4.35Å; L259-L342 HydrophobicContact CD2-CD2 4.13Å; L300-L342 HydrophobicContact CD2-CD1 3.94Å; W333-L342 HydrophobicContact CE3-CD1 4.48Å; W333-L342 HydrophobicContact CH2-CD1 4.14Å; W333-L342 HydrophobicContact CZ3-CD1 3.95Å; T338-L342 HydrophobicContact CG2-CD1 4.11Å; T338-L342 HydrophobicContact CG2-CG 4.25Å; T338-L342 VanDerWaalsContact O-CG 3.32Å; T338-L342 WeakPolarHBondContact O-CG 3.48Å; T338-L342 PolarHBondContact O-N 3.5Å; V339-L342 PolarHBondContact O-N 2.93Å; G340-L342 PolarHBondContact O-N 3.11Å; L342-L345 HydrophobicContact CD2-CD1 4.07Å; L342-L345 WeakPolarHBondContact O-CB 3.28Å; L342-L345 PolarHBondContact O-N 3.06Å
343	I	93.2	Very high	85.8	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-38.6	176.3	-67.1	167.3	0	0	0	110.9	I296 V297 L300 V339 G340 L345 A346 P376 V379	I296-I343 HydrophobicContact CG2-CG1 4.24Å; V297-I343 HydrophobicContact CG2-CG1 4.44Å; L300-I343 HydrophobicContact CD1-CD1 4.27Å; L300-I343 HydrophobicContact CD1-CG1 4Å; V339-I343 HydrophobicContact CG1-CD1 3.95Å; V339-I343 WeakPolarHBondContact O-CG1 3.35Å; V339-I343 PolarHBondContact O-N 2.89Å; V339-I343 VanDerWaalsContact O-N 3.07Å; G340-I343 PolarHBondContact O-N 3.43Å; I343-L345 PolarHBondContact O-N 2.83Å; I343-A346 WeakPolarHBondContact O-CB 3.34Å; I343-A346 PolarHBondContact O-N 2.8Å; I343-P376 HydrophobicContact CB-CG 4.47Å; I343-P376 HydrophobicContact CD1-CB 3.99Å; I343-P376 HydrophobicContact CD1-CG 4.02Å; I343-P376 HydrophobicContact CG2-CG 4.29Å; I343-V379 HydrophobicContact CD1-CG2 4.29Å
344	S	92.1	Very high	83.5	Confident	39 Å²	39	48.3 Å²	48.3	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-67.7	-14.1	177	64.5	0	0	0	0	113.4	G340 H341 A346 D347	G340-S344 PolarHBondContact O-N 3.24Å; G340-S344 PolarHBondContact O-OG 2.95Å; H341-S344 WeakPolarHBondContact CA-OG 3.46Å; H341-S344 PolarHBondContact O-N 3.45Å; H341-S344 PolarHBondContact O-OG 3.43Å; S344-A346 PolarHBondContact O-N 2.79Å; S344-D347 VanDerWaalsContact O-CB 3.29Å; S344-D347 WeakPolarHBondContact O-CB 3.38Å; S344-D347 PolarHBondContact O-N 3.18Å
345	L	89.9	Confident	80.8	Confident	11 Å²	11	57 Å²	57	6%	0.058	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-29.9	169	-61.8	177	0	0	0	111.2	R260 L263 I296 H341 L342 I343 D347 D348 F349	R260-L345 HydrophobicContact CG-CD1 4.36Å; L263-L345 HydrophobicContact CD1-CB 4.16Å; L263-L345 HydrophobicContact CD1-CD1 3.8Å; I296-L345 HydrophobicContact CD1-CB 4.45Å; H341-L345 WeakPolarHBondContact O-CG 3.25Å; H341-L345 PolarHBondContact O-N 3.04Å; L342-L345 HydrophobicContact CD2-CD1 4.07Å; L342-L345 WeakPolarHBondContact O-CB 3.28Å; L342-L345 PolarHBondContact O-N 3.06Å; I343-L345 PolarHBondContact O-N 2.83Å; L345-D347 VanDerWaalsContact C-N 3.25Å; L345-D347 PolarHBondContact O-N 2.91Å; L345-D348 WeakPolarHBondContact O-CB 3.4Å; L345-D348 PolarHBondContact O-N 2.75Å; L345-F349 VanDerWaalsContact O-CD2 3.28Å; L345-F349 WeakPolarHBondContact O-CD2 3.16Å
346	A	86.6	Confident	78	Confident	2 Å²	2	57 Å²	57	2%	0.017	34%	0.338	C	S	.	.	H	α-helix	trans	-66.1	-28.1	173.6	0	0	0	0	0	113.1	R292 I296 I343 S344 D348 F349 M350	R292-A346 HydrophobicContact CB-CB 3.6Å; R292-A346 HydrophobicContact CG-CB 3.62Å; I296-A346 HydrophobicContact CD1-CB 3.94Å; I343-A346 WeakPolarHBondContact O-CB 3.34Å; I343-A346 PolarHBondContact O-N 2.8Å; S344-A346 PolarHBondContact O-N 2.79Å; A346-D348 VanDerWaalsContact C-N 3.27Å; A346-D348 PolarHBondContact O-N 3.04Å; A346-F349 WeakPolarHBondContact O-CB 3.34Å; A346-F349 PolarHBondContact O-N 3.09Å; A346-M350 PolarHBondContact O-N 3.34Å
347	D	83.9	Confident	75.2	Confident	86 Å²	86	64.2 Å²	64.2	46%	0.46	36%	0.36	S	S	.	.	H	α-helix	trans	-67.5	-33.5	177.4	-58.5	-30.1	0	0	0	110.3	S344 L345 F349 M350 L351	S344-D347 VanDerWaalsContact O-CB 3.29Å; S344-D347 WeakPolarHBondContact O-CB 3.38Å; S344-D347 PolarHBondContact O-N 3.18Å; L345-D347 VanDerWaalsContact C-N 3.25Å; L345-D347 PolarHBondContact O-N 2.91Å; D347-F349 PolarHBondContact O-N 3.33Å; D347-M350 CarbonylContact O-C 3.6Å; D347-M350 WeakPolarHBondContact O-CB 3.27Å; D347-M350 PolarHBondContact O-N 3.26Å; D347-M350 VanDerWaalsContact O-N 3.15Å; D347-L351 WeakPolarHBondContact O-CG 3.3Å; D347-L351 PolarHBondContact O-N 3.28Å
348	D	81.2	Confident	72.6	Confident	84 Å²	84	70.7 Å²	70.7	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-43	173.3	-63.7	-27.9	0	0	0	110.7	L345 A346 M350 L351 F352	L345-D348 WeakPolarHBondContact O-CB 3.4Å; L345-D348 PolarHBondContact O-N 2.75Å; A346-D348 VanDerWaalsContact C-N 3.27Å; A346-D348 PolarHBondContact O-N 3.04Å; D348-M350 VanDerWaalsContact C-N 3.28Å; D348-M350 PolarHBondContact O-N 2.58Å; D348-L351 WeakPolarHBondContact O-CB 3.48Å; D348-L351 PolarHBondContact O-N 3.2Å; D348-F352 WeakPolarHBondContact O-CD2 3.44Å; D348-F352 PolarHBondContact O-N 2.85Å; D348-F352 VanDerWaalsContact O-N 3.15Å
349	F	78.7	Confident	69.7	Low	6 Å²	6	75.2 Å²	75.2	3%	0.026	41%	0.407	C	S	.	.	H	α-helix	trans	-59.7	-38	173	-77.7	-108.8	0	0	0	111.9	L263 E267 L270 I291 L345 A346 D347 L351 F352	L263-F349 HydrophobicContact CB-CE2 4.12Å; L263-F349 HydrophobicContact CB-CZ 3.84Å; L263-F349 HydrophobicContact CD2-CE2 3.98Å; L263-F349 HydrophobicContact CD2-CZ 3.89Å; L263-F349 HydrophobicContact CG-CE2 4.45Å; L263-F349 HydrophobicContact CG-CZ 4.42Å; L263-F349 WeakPolarHBondContact O-CZ 3.46Å; E267-F349 HydrophobicContact CG-CE1 3.79Å; E267-F349 HydrophobicContact CG-CE2 4.44Å; E267-F349 HydrophobicContact CG-CZ 3.6Å; L270-F349 HydrophobicContact CD1-CB 3.98Å; L270-F349 HydrophobicContact CD1-CD1 3.5Å; L270-F349 HydrophobicContact CD1-CE1 4.4Å; L270-F349 HydrophobicContact CD1-CG 4.12Å; I291-F349 HydrophobicContact CG1-CD1 4.27Å; I291-F349 HydrophobicContact CG2-CD1 4.24Å; I291-F349 HydrophobicContact CG2-CD2 4.4Å; I291-F349 HydrophobicContact CG2-CG 4.2Å; L345-F349 VanDerWaalsContact O-CD2 3.28Å; L345-F349 WeakPolarHBondContact O-CD2 3.16Å; A346-F349 WeakPolarHBondContact O-CB 3.34Å; A346-F349 PolarHBondContact O-N 3.09Å; D347-F349 PolarHBondContact O-N 3.33Å; F349-L351 VanDerWaalsContact C-N 3.26Å; F349-L351 PolarHBondContact O-N 3.3Å; F349-F352 PolarHBondContact O-N 2.88Å
350	M	72.9	Confident	66.7	Low	55 Å²	55	83.5 Å²	83.5	27%	0.271	44%	0.443	S	S	.	.	H	α-helix	trans	-70.5	-18.1	174.1	-71	-68.6	-78.7	0	0	113.4	R283 C287 I288 A346 D347 D348	R283-M350 PolarHBondContact NH2-O 2.87Å; C287-M350 HydrophobicContact CB-CG 3.91Å; C287-M350 HydrophobicContact CB-SD 3.24Å; C287-M350 WeakPolarHBondContact CB-SD 3.32Å; I288-M350 HydrophobicContact CD1-CE 4.11Å; I288-M350 HydrophobicContact CG1-CE 4.18Å; I288-M350 HydrophobicContact CG1-SD 4.18Å; A346-M350 PolarHBondContact O-N 3.34Å; D347-M350 CarbonylContact O-C 3.6Å; D347-M350 WeakPolarHBondContact O-CB 3.27Å; D347-M350 PolarHBondContact O-N 3.26Å; D347-M350 VanDerWaalsContact O-N 3.15Å; D348-M350 VanDerWaalsContact C-N 3.28Å; D348-M350 PolarHBondContact O-N 2.58Å
351	L	69.7	Low	64	Low	118 Å²	118	92.6 Å²	92.6	62%	0.618	48%	0.476	S	S	*	.	H	α-helix	trans	-90.5	-24.5	176.7	-71	170	0	0	0	113.2	D347 D348 F349 G353 S354	D347-L351 WeakPolarHBondContact O-CG 3.3Å; D347-L351 PolarHBondContact O-N 3.28Å; D348-L351 WeakPolarHBondContact O-CB 3.48Å; D348-L351 PolarHBondContact O-N 3.2Å; F349-L351 VanDerWaalsContact C-N 3.26Å; F349-L351 PolarHBondContact O-N 3.3Å; L351-G353 PolarHBondContact O-N 3.44Å; L351-S354 PolarHBondContact O-N 3.33Å
352	F	61	Low	61.1	Low	101 Å²	101	95.2 Å²	95.2	44%	0.443	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	103.9	174	-81.7	-77.2	0	0	0	111.2	L270 R283 D348 F349	L270-F352 HydrophobicContact CD1-CB 4.3Å; R283-F352 PolarHBondContact NE-O 3.32Å; R283-F352 VanDerWaalsContact NH2-C 3.32Å; R283-F352 PolarHBondContact NH2-O 3.3Å; D348-F352 WeakPolarHBondContact O-CD2 3.44Å; D348-F352 PolarHBondContact O-N 2.85Å; D348-F352 VanDerWaalsContact O-N 3.15Å; F349-F352 PolarHBondContact O-N 2.88Å
353	G	50.3	Low	58.2	Low	62 Å²	62	101.7 Å²	101.7	64%	0.639	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.4	-5	177.1	0	0	0	0	0	116	L351 Q355	L351-G353 PolarHBondContact O-N 3.44Å; G353-Q355 PolarHBondContact O-N 3.36Å
354	S	48.6	Very low	55.7	Low	64 Å²	64	109 Å²	109	45%	0.448	56%	0.555	S	S	.	*			trans	-88.6	78	176.4	-54.9	0	0	0	0	111.2	R283 L351 T356	R283-S354 PolarHBondContact NH1-OG 3.25Å; R283-S354 PolarHBondContact NH2-OG 3.1Å; L351-S354 PolarHBondContact O-N 3.33Å; S354-T356 PolarHBondContact O-N 2.98Å
355	Q	38.8	Very low	52.9	Low	191 Å²	191	113.6 Å²	113.6	89%	0.893	58%	0.576	S	S	*	*			trans	-77.8	64.8	166.9	-70.9	-157.2	31.4	0	0	111.3	G353	G353-Q355 PolarHBondContact O-N 3.36Å
356	T	35.3	Very low	50.5	Low	102 Å²	102	117.5 Å²	117.5	63%	0.626	60%	0.601	S	S	*	*			trans	-165.2	116.4	156.7	34.3	0	0	0	0	109	S354 E358	S354-T356 PolarHBondContact O-N 2.98Å; T356-E358 PolarHBondContact O-N 3.44Å
357	K	33.5	Very low	48.2	Very low	221 Å²	221	126.7 Å²	126.7	96%	0.961	64%	0.643	S	S	*	*	S	Bend	trans	-69.7	25.4	176.7	-76.8	-179.6	171.4	177	0	113.9
358	E	36.8	Very low	46	Very low	177 Å²	177	129.1 Å²	129.1	83%	0.827	66%	0.656	S	S	*	*			trans	-136.2	32.9	-168.3	-66.5	-166.5	163.6	0	0	114.9	T356	T356-E358 PolarHBondContact O-N 3.44Å
359	T	34.4	Very low	43.9	Very low	128 Å²	128	128.7 Å²	128.7	79%	0.785	67%	0.671	S	S	*	*			trans	-112.8	88.1	156.9	13.1	0	0	0	0	108.3
360	K	31.9	Very low	42.3	Very low	175 Å²	175	136.4 Å²	136.4	76%	0.761	71%	0.713	S	S	*	*			trans	-49.4	149	161.4	-76	174.5	176.4	172.3	0	109.1	E362	K360-E362 PolarHBondContact O-N 2.84Å
361	K	37.4	Very low	41.6	Very low	216 Å²	216	142.6 Å²	142.6	94%	0.939	73%	0.733	S	S	*	*	S	Bend	trans	-45.4	79.8	165.2	-66.3	170.9	170.5	177.7	0	111.9
362	E	33.5	Very low	41.7	Very low	154 Å²	154	142.3 Å²	142.3	72%	0.72	74%	0.741	S	S	*	*			trans	-135.4	105.2	169.4	-68.5	-175.5	-176.8	0	0	105.9	K360	K360-E362 PolarHBondContact O-N 2.84Å
363	D	32.7	Very low	42.8	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	74%	0.742	S	S	*	*			trans	57.7	68.8	158.3	-52.2	-23.5	0	0	0	119.1	N365	D363-N365 PolarHBondContact O-N 2.9Å
364	F	40	Very low	44.7	Very low	160 Å²	160	140 Å²	140	70%	0.702	72%	0.719	S	S	*	*			trans	-80.8	56.9	140.9	-85.3	-83.3	0	0	0	109.6	T366	F364-T366 PolarHBondContact O-N 2.71Å
365	N	33	Very low	46.7	Very low	134 Å²	134	139.7 Å²	139.7	72%	0.717	72%	0.715	S	S	*	*			trans	-80.2	85.3	152.4	-85.6	-24.8	0	0	0	105.7	D363 E367	D363-N365 PolarHBondContact O-N 2.9Å; N365-E367 PolarHBondContact O-N 3.26Å
366	T	39.8	Very low	49.3	Very low	94 Å²	94	133 Å²	133	58%	0.577	69%	0.688	S	S	*	*			trans	-53.5	124.2	167.7	-38.7	0	0	0	0	107.3	F364 N368	F364-T366 PolarHBondContact O-N 2.71Å; T366-N368 PolarHBondContact O-N 3.38Å
367	E	39.6	Very low	52	Low	194 Å²	194	135.2 Å²	135.2	91%	0.907	69%	0.689	S	S	*	*	S	Bend	trans	-65.2	29.9	178.3	-64.1	-179.5	144	0	0	113.8	N365	N365-E367 PolarHBondContact O-N 3.26Å
368	N	36.8	Very low	54.9	Low	137 Å²	137	128.1 Å²	128.1	73%	0.733	66%	0.662	S	S	*	*			trans	-114.3	77.3	163.4	-80.5	-19.7	0	0	0	108.5	T366 N370	T366-N368 PolarHBondContact O-N 3.38Å; N368-N370 VanDerWaalsContact C-N 3.27Å; N368-N370 PolarHBondContact O-N 3.33Å
369	G	37.5	Very low	57.7	Low	75 Å²	75	119.7 Å²	119.7	77%	0.773	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	53	-168	0	0	0	0	0	117.5
370	N	45.6	Very low	60.7	Low	168 Å²	168	114.4 Å²	114.4	90%	0.898	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.6	7.3	169.9	-106.2	-12.6	0	0	0	117.5	N368	N368-N370 VanDerWaalsContact C-N 3.27Å; N368-N370 PolarHBondContact O-N 3.33Å
371	R	57.3	Low	63.8	Low	185 Å²	185	109.8 Å²	109.8	70%	0.698	57%	0.574	S	S	*	*			trans	-104.5	92.1	-178.3	-146.5	176.8	-168.1	-179.7	7.1	111.8	D289 L373	D289-R371 IonicContact OD1-CZ 3.01Å; D289-R371 IonicContact OD1-NH1 2.86Å; D289-R371 PolarHBondContact OD1-NH1 2.94Å; D289-R371 IonicContact OD2-NH1 3.67Å; R371-L373 PolarHBondContact O-N 3.37Å
372	S	72.2	Confident	66.6	Low	112 Å²	112	104 Å²	104	78%	0.783	55%	0.547	S	S	*	.			trans	-71.7	114.7	171.9	57.3	0	0	0	0	110.1	T374	S372-T374 PolarHBondContact O-N 2.84Å
373	L	84.1	Confident	69.6	Low	88 Å²	88	96.8 Å²	96.8	46%	0.461	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-55.4	135.7	172	-73.4	139.8	0	0	0	110.6	I288 R292 E293 R371 T375	I288-L373 HydrophobicContact CG2-CD2 3.65Å; R292-L373 VanDerWaalsContact NH1-CD2 3.26Å; E293-L373 WeakPolarHBondContact OE1-CA 3.36Å; R371-L373 PolarHBondContact O-N 3.37Å; L373-T375 PolarHBondContact O-N 3.38Å
374	T	89.4	Confident	72.7	Confident	26 Å²	26	94.3 Å²	94.3	16%	0.16	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-59.3	122.7	177.7	-58	0	0	0	0	109.5	R292 E293 V297 S372 V379	R292-T374 PolarHBondContact NH2-O 2.97Å; E293-T374 PolarHBondContact OE1-N 2.94Å; E293-T374 PolarHBondContact OE1-OG1 3.47Å; E293-T374 WeakPolarHBondContact OE2-CB 3.44Å; E293-T374 PolarHBondContact OE2-OG1 3.17Å; V297-T374 HydrophobicContact CG1-CG2 3.89Å; V297-T374 HydrophobicContact CG2-CG2 4.48Å; S372-T374 PolarHBondContact O-N 2.84Å; T374-V379 HydrophobicContact CG2-CG2 3.6Å
375	T	91.4	Very high	75.3	Confident	58 Å²	58	89.7 Å²	89.7	36%	0.356	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-81.8	148	-179.6	77.6	0	0	0	0	110.7	L373 K377 D378 V379	L373-T375 PolarHBondContact O-N 3.38Å; T375-K377 PolarHBondContact O-N 3.35Å; T375-K377 VanDerWaalsContact O-N 3.15Å; T375-D378 WeakPolarHBondContact CB-OD2 3.42Å; T375-D378 PolarHBondContact N-OD2 3.45Å; T375-D378 PolarHBondContact O-N 3.47Å; T375-D378 VanDerWaalsContact O-N 3.08Å; T375-D378 PolarHBondContact OG1-N 2.91Å; T375-D378 PolarHBondContact OG1-OD2 2.88Å; T375-V379 PolarHBondContact O-N 2.89Å
376	P	92.5	Very high	78.3	Confident	51 Å²	51	83.5 Å²	83.5	33%	0.331	45%	0.448	S	S	.	.	H	α-helix	trans	-55.8	-32.3	173.6	-26.6	34.7	0	0	0	113	I343 D378 V379 S380	I343-P376 HydrophobicContact CB-CG 4.47Å; I343-P376 HydrophobicContact CD1-CB 3.99Å; I343-P376 HydrophobicContact CD1-CG 4.02Å; I343-P376 HydrophobicContact CG2-CG 4.29Å; P376-D378 PolarHBondContact O-N 3.23Å; P376-V379 PolarHBondContact O-N 2.93Å; P376-S380 WeakPolarHBondContact O-CB 3.34Å; P376-S380 PolarHBondContact O-N 2.98Å; P376-S380 PolarHBondContact O-OG 2.9Å
377	K	93.9	Very high	81	Confident	148 Å²	148	79 Å²	79	64%	0.643	42%	0.42	S	S	*	.	H	α-helix	trans	-62.8	-41.2	177.8	-172.6	179.4	178.6	-177	0	111.9	T375 V379 S380 N381	T375-K377 PolarHBondContact O-N 3.35Å; T375-K377 VanDerWaalsContact O-N 3.15Å; K377-V379 VanDerWaalsContact C-N 3.34Å; K377-V379 PolarHBondContact O-N 3.36Å; K377-S380 PolarHBondContact O-N 2.85Å; K377-N381 WeakPolarHBondContact O-CB 3.24Å; K377-N381 PolarHBondContact O-N 3.29Å; K377-N381 PolarHBondContact O-ND2 2.65Å
378	D	94.5	Very high	83.6	Confident	72 Å²	72	72.6 Å²	72.6	39%	0.385	39%	0.392	S	S	.	.	H	α-helix	trans	-66.6	-38.2	-179.9	-59.7	-40	0	0	0	111.8	T375 P376 R382	T375-D378 WeakPolarHBondContact CB-OD2 3.42Å; T375-D378 PolarHBondContact N-OD2 3.45Å; T375-D378 PolarHBondContact O-N 3.47Å; T375-D378 VanDerWaalsContact O-N 3.08Å; T375-D378 PolarHBondContact OG1-N 2.91Å; T375-D378 PolarHBondContact OG1-OD2 2.88Å; P376-D378 PolarHBondContact O-N 3.23Å; D378-R382 WeakPolarHBondContact O-CG 3.48Å; D378-R382 PolarHBondContact O-N 2.99Å; D378-R382 PolarHBondContact O-NE 3.15Å
379	V	95.1	Very high	86.3	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-71.2	-45.2	176.4	-177.7	0	0	0	0	110.6	L300 V339 I343 T374 T375 P376 K377 N381 R382 F383	L300-V379 HydrophobicContact CB-CG1 3.84Å; L300-V379 HydrophobicContact CD1-CG1 3.96Å; L300-V379 HydrophobicContact CG-CG1 4.46Å; V339-V379 HydrophobicContact CG1-CB 3.71Å; V339-V379 HydrophobicContact CG1-CG1 3.63Å; I343-V379 HydrophobicContact CD1-CG2 4.29Å; T374-V379 HydrophobicContact CG2-CG2 3.6Å; T375-V379 PolarHBondContact O-N 2.89Å; P376-V379 PolarHBondContact O-N 2.93Å; K377-V379 VanDerWaalsContact C-N 3.34Å; K377-V379 PolarHBondContact O-N 3.36Å; V379-N381 VanDerWaalsContact C-N 3.31Å; V379-N381 PolarHBondContact O-N 3.49Å; V379-R382 WeakPolarHBondContact O-CB 3.14Å; V379-R382 PolarHBondContact O-N 2.97Å; V379-R382 VanDerWaalsContact O-N 3.15Å; V379-F383 HydrophobicContact CG1-CD2 3.88Å; V379-F383 HydrophobicContact CG1-CE2 3.81Å; V379-F383 WeakPolarHBondContact O-CD2 3.43Å; V379-F383 PolarHBondContact O-N 3.2Å
380	S	96.8	Very high	89	Confident	18 Å²	18	65.9 Å²	65.9	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-59.3	-39.1	174.8	-69.7	0	0	0	0	112.7	A334 P376 K377 F383 R384	A334-S380 VanDerWaalsContact CB-O 3.32Å; A334-S380 WeakPolarHBondContact CB-O 3.38Å; P376-S380 WeakPolarHBondContact O-CB 3.34Å; P376-S380 PolarHBondContact O-N 2.98Å; P376-S380 PolarHBondContact O-OG 2.9Å; K377-S380 PolarHBondContact O-N 2.85Å; S380-F383 PolarHBondContact O-N 3.02Å; S380-R384 WeakPolarHBondContact O-CB 3.47Å; S380-R384 PolarHBondContact O-N 2.75Å
381	N	96.3	Very high	91.3	Very high	78 Å²	78	57.9 Å²	57.9	42%	0.417	29%	0.294	S	S	.	.	H	α-helix	trans	-65	-39.7	176.1	-74.3	-20.9	0	0	0	112	K377 V379 R384 S385	K377-N381 WeakPolarHBondContact O-CB 3.24Å; K377-N381 PolarHBondContact O-N 3.29Å; K377-N381 PolarHBondContact O-ND2 2.65Å; V379-N381 VanDerWaalsContact C-N 3.31Å; V379-N381 PolarHBondContact O-N 3.49Å; N381-R384 PolarHBondContact O-N 2.99Å; N381-S385 PolarHBondContact O-N 3.45Å
382	R	96.6	Very high	93.1	Very high	95 Å²	95	51.1 Å²	51.1	36%	0.358	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-47.9	174.4	-80.2	-176.4	-94.9	-173.9	-6.4	111.6	N301 V304 D378 V379 R384 S385 T386	N301-R382 PolarHBondContact OD1-NH1 3.45Å; V304-R382 HydrophobicContact CG1-CB 3.97Å; V304-R382 HydrophobicContact CG2-CB 4.3Å; D378-R382 WeakPolarHBondContact O-CG 3.48Å; D378-R382 PolarHBondContact O-N 2.99Å; D378-R382 PolarHBondContact O-NE 3.15Å; V379-R382 WeakPolarHBondContact O-CB 3.14Å; V379-R382 PolarHBondContact O-N 2.97Å; V379-R382 VanDerWaalsContact O-N 3.15Å; R382-R384 VanDerWaalsContact C-N 3.31Å; R382-R384 PolarHBondContact O-N 3.12Å; R382-S385 PolarHBondContact O-N 3.4Å; R382-T386 PolarHBondContact O-N 3.49Å; R382-T386 PolarHBondContact O-OG1 2.93Å; R382-T386 VanDerWaalsContact O-OG1 3.12Å
383	F	97.3	Very high	94	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.009	24%	0.24	C	C	.	.	H	α-helix	trans	-55.6	-44.7	171.7	-88.3	-75.6	0	0	0	112	L300 L303 V304 C330 W333 A334 V339 V379 S380 S385 T386 G387	L300-F383 HydrophobicContact CB-CE2 4.17Å; L300-F383 HydrophobicContact CD2-CE2 4.03Å; L300-F383 HydrophobicContact CD2-CZ 4.15Å; L303-F383 HydrophobicContact CB-CE1 4.44Å; L303-F383 HydrophobicContact CB-CZ 4.2Å; L303-F383 HydrophobicContact CD1-CZ 4.49Å; V304-F383 HydrophobicContact CG2-CD1 3.94Å; V304-F383 HydrophobicContact CG2-CD2 3.7Å; V304-F383 HydrophobicContact CG2-CE1 3.93Å; V304-F383 HydrophobicContact CG2-CE2 3.67Å; V304-F383 HydrophobicContact CG2-CG 3.83Å; V304-F383 HydrophobicContact CG2-CZ 3.79Å; C330-F383 HydrophobicContact CB-CD1 4.31Å; C330-F383 WeakPolarHBondContact CB-O 3.41Å; W333-F383 AromaticContact CE3-CE1 3.93Å; W333-F383 HydrophobicContact CE3-CE1 3.93Å; W333-F383 HydrophobicContact CE3-CE2 4.21Å; W333-F383 AromaticContact CE3-CZ 3.64Å; W333-F383 HydrophobicContact CE3-CZ 3.64Å; W333-F383 HydrophobicContact CZ3-CZ 4.01Å; A334-F383 HydrophobicContact CB-CB 4.11Å; V339-F383 HydrophobicContact CG2-CD2 3.79Å; V339-F383 HydrophobicContact CG2-CE2 4Å; V379-F383 HydrophobicContact CG1-CD2 3.88Å; V379-F383 HydrophobicContact CG1-CE2 3.81Å; V379-F383 WeakPolarHBondContact O-CD2 3.43Å; V379-F383 PolarHBondContact O-N 3.2Å; S380-F383 PolarHBondContact O-N 3.02Å; F383-S385 PolarHBondContact O-N 3.15Å; F383-T386 PolarHBondContact O-N 3.23Å; F383-G387 PolarHBondContact O-N 3.39Å
384	R	96.7	Very high	94.5	Very high	85 Å²	85	42.2 Å²	42.2	32%	0.321	22%	0.218	S	C	.	.	H	α-helix	trans	-60.9	-45.3	177.3	-170.9	-178	-54	-73.9	-4.5	112.4	L331 A334 D335 S380 N381 R382 G387 N388	L331-R384 HydrophobicContact CD2-CG 3.97Å; A334-R384 HydrophobicContact CB-CB 4.12Å; D335-R384 IonicContact OD1-CZ 3.69Å; D335-R384 IonicContact OD1-NH1 2.96Å; D335-R384 PolarHBondContact OD1-NH1 2.95Å; D335-R384 IonicContact OD1-NH2 3.72Å; D335-R384 PolarHBondContact OD1-NH2 3.48Å; D335-R384 IonicContact OD2-NH1 2.76Å; D335-R384 PolarHBondContact OD2-NH1 2.94Å; S380-R384 WeakPolarHBondContact O-CB 3.47Å; S380-R384 PolarHBondContact O-N 2.75Å; N381-R384 PolarHBondContact O-N 2.99Å; R382-R384 VanDerWaalsContact C-N 3.31Å; R382-R384 PolarHBondContact O-N 3.12Å; R384-G387 PolarHBondContact O-N 2.65Å; R384-N388 PolarHBondContact O-N 2.93Å; R384-N388 PolarHBondContact O-ND2 3.33Å
385	S	95.7	Very high	94.7	Very high	63 Å²	63	41.3 Å²	41.3	44%	0.441	21%	0.213	S	C	.	.	H	α-helix	trans	-59.7	-50.8	177	-168.5	0	0	0	0	111.1	N381 R382 F383 G387 N388 E389	N381-S385 PolarHBondContact O-N 3.45Å; R382-S385 PolarHBondContact O-N 3.4Å; F383-S385 PolarHBondContact O-N 3.15Å; S385-G387 VanDerWaalsContact C-N 3.32Å; S385-G387 PolarHBondContact O-N 3.42Å; S385-N388 PolarHBondContact O-N 2.96Å; S385-N388 VanDerWaalsContact O-N 3.17Å; S385-E389 WeakPolarHBondContact O-CG 3.29Å; S385-E389 PolarHBondContact O-N 3.19Å; S385-E389 PolarHBondContact OG-OE1 2.87Å
386	T	96.2	Very high	94.8	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-63.2	-37.4	178.5	-57	0	0	0	0	112.4	V304 L307 R382 F383 E389 L390	V304-T386 WeakPolarHBondContact CG1-OG1 3.34Å; L307-T386 HydrophobicContact CB-CG2 3.64Å; R382-T386 PolarHBondContact O-N 3.49Å; R382-T386 PolarHBondContact O-OG1 2.93Å; R382-T386 VanDerWaalsContact O-OG1 3.12Å; F383-T386 PolarHBondContact O-N 3.23Å; T386-E389 WeakPolarHBondContact O-CB 3.35Å; T386-E389 PolarHBondContact O-N 3.23Å; T386-L390 HydrophobicContact CG2-CD1 4.32Å; T386-L390 WeakPolarHBondContact O-CG 3.48Å; T386-L390 PolarHBondContact O-N 2.99Å
387	G	95.7	Very high	94.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-46	173.1	0	0	0	0	0	112	C330 F383 R384 S385 L390 L391	C330-G387 VanDerWaalsContact CB-CA 3.43Å; F383-G387 PolarHBondContact O-N 3.39Å; R384-G387 PolarHBondContact O-N 2.65Å; S385-G387 VanDerWaalsContact C-N 3.32Å; S385-G387 PolarHBondContact O-N 3.42Å; G387-L390 PolarHBondContact O-N 3.23Å; G387-L391 WeakPolarHBondContact O-CG 3.34Å; G387-L391 PolarHBondContact O-N 3.42Å
388	N	94.3	Very high	94.8	Very high	58 Å²	58	37 Å²	37	31%	0.31	18%	0.182	S	C	.	.	H	α-helix	trans	-66.1	-39.2	175.3	-70.5	-31	0	0	0	112.4	R384 S385 L390 L391 V392	R384-N388 PolarHBondContact O-N 2.93Å; R384-N388 PolarHBondContact O-ND2 3.33Å; S385-N388 PolarHBondContact O-N 2.96Å; S385-N388 VanDerWaalsContact O-N 3.17Å; N388-L390 VanDerWaalsContact C-N 3.34Å; N388-L390 PolarHBondContact O-N 3.29Å; N388-L391 PolarHBondContact O-N 3.11Å; N388-V392 WeakPolarHBondContact O-CG2 3.46Å; N388-V392 PolarHBondContact O-N 3.39Å
389	E	93.8	Very high	94.7	Very high	72 Å²	72	33.6 Å²	33.6	34%	0.336	16%	0.164	S	C	.	.	H	α-helix	trans	-58.1	-44.8	173.7	-74.1	168.8	-152.4	0	0	111.9	S308 A311 S385 T386 V392 A393	S308-E389 PolarHBondContact OG-OE2 3.32Å; A311-E389 HydrophobicContact CB-CB 4.14Å; S385-E389 WeakPolarHBondContact O-CG 3.29Å; S385-E389 PolarHBondContact O-N 3.19Å; S385-E389 PolarHBondContact OG-OE1 2.87Å; T386-E389 WeakPolarHBondContact O-CB 3.35Å; T386-E389 PolarHBondContact O-N 3.23Å; E389-V392 PolarHBondContact O-N 3.27Å; E389-A393 WeakPolarHBondContact O-CB 3.44Å; E389-A393 PolarHBondContact O-N 3.17Å
390	L	94.3	Very high	94.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-42.2	176.2	-75.5	164.2	0	0	0	112.2	L307 A311 L323 L326 T386 G387 N388 A393 F394	L307-L390 HydrophobicContact CB-CD1 4.24Å; A311-L390 HydrophobicContact CB-CD2 3.75Å; A311-L390 HydrophobicContact CB-CG 4.01Å; L323-L390 HydrophobicContact CD2-CD2 3.93Å; L326-L390 HydrophobicContact CB-CD1 3.86Å; T386-L390 HydrophobicContact CG2-CD1 4.32Å; T386-L390 WeakPolarHBondContact O-CG 3.48Å; T386-L390 PolarHBondContact O-N 2.99Å; G387-L390 PolarHBondContact O-N 3.23Å; N388-L390 VanDerWaalsContact C-N 3.34Å; N388-L390 PolarHBondContact O-N 3.29Å; L390-A393 WeakPolarHBondContact O-CB 3.41Å; L390-A393 PolarHBondContact O-N 2.97Å; L390-F394 PolarHBondContact O-N 3.5Å
391	L	94.4	Very high	94.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.4	-38.8	176.3	-68.5	-177.7	0	0	0	112.3	L324 L331 G387 N388 A393 F394 V395 F446 A515 L520	L324-L391 HydrophobicContact CD1-CD2 4.05Å; L331-L391 HydrophobicContact CD1-CD1 3.73Å; G387-L391 WeakPolarHBondContact O-CG 3.34Å; G387-L391 PolarHBondContact O-N 3.42Å; N388-L391 PolarHBondContact O-N 3.11Å; L391-A393 VanDerWaalsContact C-N 3.34Å; L391-F394 WeakPolarHBondContact O-CB 3.41Å; L391-F394 PolarHBondContact O-N 2.79Å; L391-V395 WeakPolarHBondContact O-CG2 3.22Å; L391-V395 PolarHBondContact O-N 3.28Å; L391-F446 HydrophobicContact CD1-CE1 4.37Å; L391-F446 HydrophobicContact CD1-CZ 4.07Å; L391-F446 HydrophobicContact CD2-CE2 4.08Å; L391-F446 HydrophobicContact CD2-CZ 3.85Å; L391-A515 HydrophobicContact CD1-CB 3.8Å; L391-L520 HydrophobicContact CB-CD2 4.05Å; L391-L520 HydrophobicContact CD1-CD2 4.46Å; L391-L520 HydrophobicContact CD2-CD2 4.13Å; L391-L520 HydrophobicContact CG-CD2 4.44Å
392	V	93.2	Very high	94.4	Very high	43 Å²	43	36.1 Å²	36.1	26%	0.261	18%	0.178	S	C	.	.	H	α-helix	trans	-64.1	-41	172.7	169.8	0	0	0	0	110.9	N388 E389 V395 R396 V513	N388-V392 WeakPolarHBondContact O-CG2 3.46Å; N388-V392 PolarHBondContact O-N 3.39Å; E389-V392 PolarHBondContact O-N 3.27Å; V392-V395 PolarHBondContact O-N 3.36Å; V392-R396 HydrophobicContact CG1-CG 4.47Å; V392-R396 WeakPolarHBondContact O-CB 3.38Å; V392-R396 VanDerWaalsContact O-CG 3.3Å; V392-R396 WeakPolarHBondContact O-CG 3.31Å; V392-R396 PolarHBondContact O-N 2.92Å; V392-V513 HydrophobicContact CG2-CG2 4.35Å
393	A	92.6	Very high	94.4	Very high	12 Å²	12	32 Å²	32	10%	0.099	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-42.6	175.1	0	0	0	0	0	111.8	A311 A314 L323 E389 L390 L391 R396 L397	A311-A393 HydrophobicContact CB-CB 4.47Å; A314-A393 HydrophobicContact CB-CB 3.9Å; L323-A393 HydrophobicContact CD1-CB 4.4Å; E389-A393 WeakPolarHBondContact O-CB 3.44Å; E389-A393 PolarHBondContact O-N 3.17Å; L390-A393 WeakPolarHBondContact O-CB 3.41Å; L390-A393 PolarHBondContact O-N 2.97Å; L391-A393 VanDerWaalsContact C-N 3.34Å; A393-R396 PolarHBondContact O-N 3.2Å; A393-L397 WeakPolarHBondContact O-CB 3.29Å; A393-L397 PolarHBondContact O-N 2.97Å
394	F	93.6	Very high	94.3	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-51.8	172.7	166.6	-100.9	0	0	0	112	G320 L323 L324 L390 L391 R396 L397 E398 L438 V442 L520	G320-F394 WeakPolarHBondContact O-CD2 3.1Å; L323-F394 HydrophobicContact CB-CB 3.92Å; L323-F394 HydrophobicContact CD1-CB 4.44Å; L324-F394 HydrophobicContact CB-CD2 4.11Å; L324-F394 HydrophobicContact CB-CE2 4.15Å; L324-F394 HydrophobicContact CD1-CD1 4.09Å; L324-F394 HydrophobicContact CD1-CE1 3.91Å; L324-F394 HydrophobicContact CD1-CE2 4.41Å; L324-F394 HydrophobicContact CD1-CG 4.42Å; L324-F394 HydrophobicContact CD1-CZ 4.04Å; L324-F394 HydrophobicContact CD2-CZ 4.49Å; L390-F394 PolarHBondContact O-N 3.5Å; L391-F394 WeakPolarHBondContact O-CB 3.41Å; L391-F394 PolarHBondContact O-N 2.79Å; F394-R396 VanDerWaalsContact C-N 3.28Å; F394-R396 PolarHBondContact O-N 3.39Å; F394-L397 PolarHBondContact O-N 3.08Å; F394-E398 HydrophobicContact CD2-CG 4.01Å; F394-E398 HydrophobicContact CE2-CG 3.68Å; F394-E398 HydrophobicContact CZ-CG 4.11Å; F394-E398 PolarHBondContact O-N 3.49Å; F394-L438 HydrophobicContact CE2-CD1 4.03Å; F394-L438 HydrophobicContact CZ-CD1 3.56Å; F394-L438 HydrophobicContact CZ-CG 4.4Å; F394-V442 HydrophobicContact CE1-CG2 4.02Å; F394-V442 HydrophobicContact CZ-CG2 3.79Å; F394-L520 HydrophobicContact CD1-CD2 4.22Å
395	V	94	Very high	94.2	Very high	7 Å²	7	34.4 Å²	34.4	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-39.9	178.9	168.6	0	0	0	0	111.6	L391 V392 G399 V513 L520 G523 V524 I527	L391-V395 WeakPolarHBondContact O-CG2 3.22Å; L391-V395 PolarHBondContact O-N 3.28Å; V392-V395 PolarHBondContact O-N 3.36Å; V395-G399 WeakPolarHBondContact O-CA 3.4Å; V395-G399 PolarHBondContact O-N 3.29Å; V395-V513 HydrophobicContact CG2-CG1 4.13Å; V395-V513 HydrophobicContact CG2-CG2 4.35Å; V395-L520 HydrophobicContact CG2-CB 4.47Å; V395-L520 HydrophobicContact CG2-CD2 3.75Å; V395-G523 VanDerWaalsContact CG1-C 3.48Å; V395-V524 HydrophobicContact CB-CG2 4.45Å; V395-V524 HydrophobicContact CG1-CG2 4.21Å; V395-V524 HydrophobicContact CG2-CG2 4.47Å; V395-I527 HydrophobicContact CG1-CD1 4.05Å; V395-I527 WeakPolarHBondContact O-CD1 3.47Å
396	R	92.8	Very high	94.3	Very high	125 Å²	125	31.6 Å²	31.6	47%	0.472	16%	0.16	S	C	.	.	H	α-helix	trans	-65.7	-42.6	176.5	-75.6	176.9	176.6	-176	0.5	112.2	V392 A393 F394 T400 F510	V392-R396 HydrophobicContact CG1-CG 4.47Å; V392-R396 WeakPolarHBondContact O-CB 3.38Å; V392-R396 VanDerWaalsContact O-CG 3.3Å; V392-R396 WeakPolarHBondContact O-CG 3.31Å; V392-R396 PolarHBondContact O-N 2.92Å; A393-R396 PolarHBondContact O-N 3.2Å; F394-R396 VanDerWaalsContact C-N 3.28Å; F394-R396 PolarHBondContact O-N 3.39Å; R396-T400 VanDerWaalsContact O-CB 3.24Å; R396-T400 WeakPolarHBondContact O-CB 3.35Å; R396-T400 PolarHBondContact O-N 3.12Å; R396-T400 PolarHBondContact O-OG1 3.48Å; R396-F510 HydrophobicContact CG-CE1 4.28Å
397	L	92.8	Very high	94.3	Very high	22 Å²	22	36.3 Å²	36.3	12%	0.115	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-56.2	178.6	179	69.1	0	0	0	110.8	I318 L323 A393 F394 G399 T400 N401	I318-L397 WeakPolarHBondContact O-CD2 3.21Å; L323-L397 HydrophobicContact CD1-CD2 3.98Å; A393-L397 WeakPolarHBondContact O-CB 3.29Å; A393-L397 PolarHBondContact O-N 2.97Å; F394-L397 PolarHBondContact O-N 3.08Å; L397-G399 PolarHBondContact O-N 3.38Å; L397-T400 WeakPolarHBondContact O-CB 3.3Å; L397-T400 PolarHBondContact O-N 2.85Å; L397-T400 VanDerWaalsContact O-N 3.12Å; L397-N401 PolarHBondContact O-N 2.82Å
398	E	93.4	Very high	94.4	Very high	20 Å²	20	42.8 Å²	42.8	9%	0.093	21%	0.205	C	C	.	.	H	α-helix	trans	-69.4	-36.5	-177	-61.4	-60.7	169	0	0	112.1	G320 F394 T400 N401 L402 L438 V524	G320-E398 WeakPolarHBondContact CA-OE1 3.38Å; F394-E398 HydrophobicContact CD2-CG 4.01Å; F394-E398 HydrophobicContact CE2-CG 3.68Å; F394-E398 HydrophobicContact CZ-CG 4.11Å; F394-E398 PolarHBondContact O-N 3.49Å; E398-T400 VanDerWaalsContact C-N 3.29Å; E398-T400 PolarHBondContact O-N 3.32Å; E398-N401 PolarHBondContact O-N 3.03Å; E398-N401 PolarHBondContact OE2-ND2 3.5Å; E398-N401 VanDerWaalsContact OE2-ND2 3.11Å; E398-L402 PolarHBondContact O-N 3.43Å; E398-L438 HydrophobicContact CB-CD1 4.34Å; E398-L438 HydrophobicContact CB-CD2 4.28Å; E398-L438 HydrophobicContact CG-CD1 3.86Å; E398-V524 HydrophobicContact CB-CG1 4.3Å; E398-V524 HydrophobicContact CB-CG2 3.89Å
399	G	94.1	Very high	94.4	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-38.4	170.4	0	0	0	0	0	112.6	V395 L397 A403 I527	V395-G399 WeakPolarHBondContact O-CA 3.4Å; V395-G399 PolarHBondContact O-N 3.29Å; L397-G399 PolarHBondContact O-N 3.38Å; G399-A403 WeakPolarHBondContact O-CB 3.29Å; G399-A403 PolarHBondContact O-N 3.45Å; G399-I527 WeakPolarHBondContact O-CG2 3.4Å
400	T	92.9	Very high	94.5	Very high	66 Å²	66	37.6 Å²	37.6	41%	0.405	18%	0.182	S	C	.	.	H	α-helix	trans	-70.2	-40.5	176.4	-59.9	0	0	0	0	111.6	R396 L397 E398 L402 A403 Q404	R396-T400 VanDerWaalsContact O-CB 3.24Å; R396-T400 WeakPolarHBondContact O-CB 3.35Å; R396-T400 PolarHBondContact O-N 3.12Å; R396-T400 PolarHBondContact O-OG1 3.48Å; L397-T400 WeakPolarHBondContact O-CB 3.3Å; L397-T400 PolarHBondContact O-N 2.85Å; L397-T400 VanDerWaalsContact O-N 3.12Å; E398-T400 VanDerWaalsContact C-N 3.29Å; E398-T400 PolarHBondContact O-N 3.32Å; T400-L402 VanDerWaalsContact C-N 3.35Å; T400-L402 PolarHBondContact O-N 3.15Å; T400-A403 PolarHBondContact O-N 3.21Å; T400-Q404 HydrophobicContact CG2-CG 4.35Å; T400-Q404 WeakPolarHBondContact O-CB 3.43Å; T400-Q404 VanDerWaalsContact O-CG 3.29Å; T400-Q404 WeakPolarHBondContact O-CG 3.41Å; T400-Q404 PolarHBondContact O-N 3.25Å
401	N	93.6	Very high	94.6	Very high	72 Å²	72	42.8 Å²	42.8	39%	0.385	21%	0.206	S	C	.	.	H	α-helix	trans	-57.9	-48.9	174.2	-68	-22.4	0	0	0	110.9	L397 E398 Q404 L405	L397-N401 PolarHBondContact O-N 2.82Å; E398-N401 PolarHBondContact O-N 3.03Å; E398-N401 PolarHBondContact OE2-ND2 3.5Å; E398-N401 VanDerWaalsContact OE2-ND2 3.11Å; N401-Q404 PolarHBondContact O-N 3.38Å; N401-L405 PolarHBondContact O-N 2.98Å; N401-L405 VanDerWaalsContact O-N 3.08Å
402	L	95	Very high	94.6	Very high	11 Å²	11	47.2 Å²	47.2	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-43.5	177.5	-161.3	70.7	0	0	0	112	E398 T400 Q404 L405 L406 V431 L435 V524	E398-L402 PolarHBondContact O-N 3.43Å; T400-L402 VanDerWaalsContact C-N 3.35Å; T400-L402 PolarHBondContact O-N 3.15Å; L402-Q404 VanDerWaalsContact C-N 3.35Å; L402-Q404 PolarHBondContact O-N 3.19Å; L402-L405 PolarHBondContact O-N 3.07Å; L402-L406 PolarHBondContact O-N 3.45Å; L402-V431 HydrophobicContact CD1-CB 4.19Å; L402-V431 HydrophobicContact CD1-CG1 4.01Å; L402-V431 HydrophobicContact CD1-CG2 3.88Å; L402-V431 HydrophobicContact CG-CG2 4.48Å; L402-L435 HydrophobicContact CD2-CD2 4.24Å; L402-V524 HydrophobicContact CD2-CG1 4.07Å
403	A	95.5	Very high	94.6	Very high	8 Å²	8	49.6 Å²	49.6	7%	0.066	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-40.2	176.4	0	0	0	0	0	112.5	G399 T400 L406 R407 I527 T531	G399-A403 WeakPolarHBondContact O-CB 3.29Å; G399-A403 PolarHBondContact O-N 3.45Å; T400-A403 PolarHBondContact O-N 3.21Å; A403-L406 PolarHBondContact O-N 3.15Å; A403-R407 VanDerWaalsContact O-CB 3.23Å; A403-R407 WeakPolarHBondContact O-CB 3.46Å; A403-R407 PolarHBondContact O-N 2.86Å; A403-I527 HydrophobicContact CB-CG2 4.23Å; A403-T531 HydrophobicContact CB-CG2 3.92Å; A403-T531 VanDerWaalsContact CB-OG1 3.28Å; A403-T531 WeakPolarHBondContact CB-OG1 3.45Å
404	Q	95.7	Very high	94.7	Very high	98 Å²	98	53.2 Å²	53.2	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-65.9	-41	176.3	-76.3	-178.2	3.1	0	0	111.9	T400 N401 L402 R407 K408	T400-Q404 HydrophobicContact CG2-CG 4.35Å; T400-Q404 WeakPolarHBondContact O-CB 3.43Å; T400-Q404 VanDerWaalsContact O-CG 3.29Å; T400-Q404 WeakPolarHBondContact O-CG 3.41Å; T400-Q404 PolarHBondContact O-N 3.25Å; N401-Q404 PolarHBondContact O-N 3.38Å; L402-Q404 VanDerWaalsContact C-N 3.35Å; L402-Q404 PolarHBondContact O-N 3.19Å; Q404-R407 PolarHBondContact O-N 3.26Å; Q404-K408 WeakPolarHBondContact O-CB 3.19Å; Q404-K408 VanDerWaalsContact O-CG 3.3Å; Q404-K408 WeakPolarHBondContact O-CG 3.42Å; Q404-K408 PolarHBondContact O-N 3.36Å
405	L	95.6	Very high	94.8	Very high	40 Å²	40	53.2 Å²	53.2	21%	0.209	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-51.1	174.6	-175.5	165.7	0	0	0	110.5	N401 L402 S409 A427 R430 V431	N401-L405 PolarHBondContact O-N 2.98Å; N401-L405 VanDerWaalsContact O-N 3.08Å; L402-L405 PolarHBondContact O-N 3.07Å; L405-S409 WeakPolarHBondContact O-CB 3.45Å; L405-S409 PolarHBondContact O-N 3.45Å; L405-A427 HydrophobicContact CD2-CB 4.06Å; L405-A427 WeakPolarHBondContact CD2-O 3.37Å; L405-R430 HydrophobicContact CD1-CB 4.26Å; L405-R430 HydrophobicContact CD1-CG 3.7Å; L405-V431 HydrophobicContact CD2-CG2 3.66Å
406	L	96.7	Very high	94.8	Very high	3 Å²	3	57 Å²	57	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-47.9	178.3	-76.2	169.6	0	0	0	111.7	L402 A403 S409 V410 V431 G528 L532	L402-L406 PolarHBondContact O-N 3.45Å; A403-L406 PolarHBondContact O-N 3.15Å; L406-S409 WeakPolarHBondContact O-CB 3.47Å; L406-S409 PolarHBondContact O-N 3.49Å; L406-S409 PolarHBondContact O-OG 3.3Å; L406-V410 WeakPolarHBondContact O-CG2 3.35Å; L406-V410 PolarHBondContact O-N 3.33Å; L406-V410 VanDerWaalsContact O-N 3.13Å; L406-V431 HydrophobicContact CD2-CG2 3.88Å; L406-V431 HydrophobicContact CG-CG2 4.01Å; L406-G528 WeakPolarHBondContact CD1-O 3.43Å; L406-L532 HydrophobicContact CD1-CB 4.48Å
407	R	96.9	Very high	94.8	Very high	104 Å²	104	59.1 Å²	59.1	39%	0.392	30%	0.297	S	S	.	.	H	α-helix	trans	-57.8	-53	178.8	179.4	-179.5	-63.7	-125	1.6	112	A403 Q404 S409 V410 E411 T531	A403-R407 VanDerWaalsContact O-CB 3.23Å; A403-R407 WeakPolarHBondContact O-CB 3.46Å; A403-R407 PolarHBondContact O-N 2.86Å; Q404-R407 PolarHBondContact O-N 3.26Å; R407-S409 PolarHBondContact O-N 3.25Å; R407-V410 PolarHBondContact O-N 3.28Å; R407-E411 WeakPolarHBondContact CD-OE1 3.38Å; R407-E411 HydrophobicContact CG-CG 4.29Å; R407-E411 WeakPolarHBondContact CG-OE1 3.39Å; R407-E411 WeakPolarHBondContact O-CG 3.5Å; R407-E411 PolarHBondContact O-N 3.46Å; R407-T531 HydrophobicContact CB-CG2 4.27Å
408	K	96.4	Very high	94.7	Very high	136 Å²	136	58.7 Å²	58.7	59%	0.591	30%	0.295	S	S	*	.	H	α-helix	trans	-58.2	-38.7	178.1	-73	176.3	-179.3	175.8	0	111.7	Q404 V410 A412	Q404-K408 WeakPolarHBondContact O-CB 3.19Å; Q404-K408 VanDerWaalsContact O-CG 3.3Å; Q404-K408 WeakPolarHBondContact O-CG 3.42Å; Q404-K408 PolarHBondContact O-N 3.36Å; K408-V410 VanDerWaalsContact C-N 3.25Å; K408-V410 PolarHBondContact O-N 3.21Å; K408-A412 VanDerWaalsContact O-CB 3.23Å; K408-A412 WeakPolarHBondContact O-CB 3.41Å; K408-A412 PolarHBondContact O-N 2.85Å
409	S	95.8	Very high	94.8	Very high	21 Å²	21	64.4 Å²	64.4	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-65.1	-28.7	177.8	84.9	0	0	0	0	113.7	L405 L406 R407 R425	L405-S409 WeakPolarHBondContact O-CB 3.45Å; L405-S409 PolarHBondContact O-N 3.45Å; L406-S409 WeakPolarHBondContact O-CB 3.47Å; L406-S409 PolarHBondContact O-N 3.49Å; L406-S409 PolarHBondContact O-OG 3.3Å; R407-S409 PolarHBondContact O-N 3.25Å; S409-R425 PolarHBondContact O-NH1 3.1Å; S409-R425 PolarHBondContact OG-NH1 3.14Å
410	V	96.1	Very high	94.8	Very high	1 Å²	1	69.1 Å²	69.1	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-84.2	-45.4	178.4	174.8	0	0	0	0	110.4	L406 R407 K408 A412 R413 W415 L532 C535 Q539	L406-V410 WeakPolarHBondContact O-CG2 3.35Å; L406-V410 PolarHBondContact O-N 3.33Å; L406-V410 VanDerWaalsContact O-N 3.13Å; R407-V410 PolarHBondContact O-N 3.28Å; K408-V410 VanDerWaalsContact C-N 3.25Å; K408-V410 PolarHBondContact O-N 3.21Å; V410-A412 VanDerWaalsContact C-N 3.32Å; V410-A412 PolarHBondContact O-N 3.08Å; V410-R413 PolarHBondContact O-N 2.85Å; V410-W415 HydrophobicContact CB-CZ2 4.37Å; V410-W415 HydrophobicContact CG1-CZ2 4.23Å; V410-W415 HydrophobicContact CG2-CZ2 4.22Å; V410-W415 PolarHBondContact O-NE1 3.44Å; V410-L532 HydrophobicContact CG2-CD1 3.71Å; V410-C535 HydrophobicContact CB-CB 4.13Å; V410-C535 HydrophobicContact CG1-CB 3.91Å; V410-C535 HydrophobicContact CG2-CB 4.29Å; V410-Q539 HydrophobicContact CG1-CG 3.7Å
411	E	95.3	Very high	94.8	Very high	109 Å²	109	66.2 Å²	66.2	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-66.9	-30.5	-178.9	-70.4	172.3	175.5	0	0	113.3	R407 R413	R407-E411 WeakPolarHBondContact CD-OE1 3.38Å; R407-E411 HydrophobicContact CG-CG 4.29Å; R407-E411 WeakPolarHBondContact CG-OE1 3.39Å; R407-E411 WeakPolarHBondContact O-CG 3.5Å; R407-E411 PolarHBondContact O-N 3.46Å; E411-R413 VanDerWaalsContact C-N 3.26Å; E411-R413 PolarHBondContact O-N 3.31Å
412	A	94.3	Very high	94.8	Very high	93 Å²	93	71.8 Å²	71.8	77%	0.769	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-5	-177.1	0	0	0	0	0	114.9	K408 V410	K408-A412 VanDerWaalsContact O-CB 3.23Å; K408-A412 WeakPolarHBondContact O-CB 3.41Å; K408-A412 PolarHBondContact O-N 2.85Å; V410-A412 VanDerWaalsContact C-N 3.32Å; V410-A412 PolarHBondContact O-N 3.08Å
413	R	93.3	Very high	94.9	Very high	92 Å²	92	75.7 Å²	75.7	35%	0.347	37%	0.37	S	S	.	.	S	Bend	trans	-117.9	138	-171.3	-165.2	171.6	-172.1	124.3	-5.6	112	V410 E411 W415 N418	V410-R413 PolarHBondContact O-N 2.85Å; E411-R413 VanDerWaalsContact C-N 3.26Å; E411-R413 PolarHBondContact O-N 3.31Å; R413-W415 HydrophobicContact CB-CZ2 4.47Å; R413-W415 VanDerWaalsContact O-CD1 3.26Å; R413-W415 PolarHBondContact O-N 2.88Å; R413-N418 PolarHBondContact NE-OD1 3.29Å; R413-N418 PolarHBondContact NH2-OD1 3.4Å
414	D	94.2	Very high	94.9	Very high	88 Å²	88	75.5 Å²	75.5	47%	0.471	37%	0.368	S	S	.	.			trans	-79	99.8	167.2	-175.5	-12.3	0	0	0	109.6	L416 K417	D414-L416 VanDerWaalsContact C-N 3.28Å; D414-L416 PolarHBondContact O-N 2.84Å; D414-L416 WeakPolarHBondContact OD1-CB 3.42Å; D414-L416 PolarHBondContact OD1-N 3.49Å; D414-K417 PolarHBondContact OD1-N 2.99Å
415	W	96.9	Very high	94.8	Very high	2 Å²	2	71.7 Å²	71.7	1%	0.008	35%	0.349	C	S	.	.	S	Bend	trans	-72.8	-18.4	-179.1	-67.6	100.2	0	0	0	113.9	V410 R413 T540 F541 G542 Q548 I549	V410-W415 HydrophobicContact CB-CZ2 4.37Å; V410-W415 HydrophobicContact CG1-CZ2 4.23Å; V410-W415 HydrophobicContact CG2-CZ2 4.22Å; V410-W415 PolarHBondContact O-NE1 3.44Å; R413-W415 HydrophobicContact CB-CZ2 4.47Å; R413-W415 VanDerWaalsContact O-CD1 3.26Å; R413-W415 PolarHBondContact O-N 2.88Å; W415-T540 WeakPolarHBondContact CB-O 3.28Å; W415-F541 HydrophobicContact CB-CD1 3.63Å; W415-F541 HydrophobicContact CB-CE1 3.98Å; W415-F541 HydrophobicContact CB-CG 4.16Å; W415-F541 AromaticContact CD2-CD1 3.74Å; W415-F541 HydrophobicContact CD2-CD1 3.74Å; W415-F541 AromaticContact CD2-CE1 3.34Å; W415-F541 HydrophobicContact CD2-CE1 3.34Å; W415-F541 HydrophobicContact CD2-CZ 4.3Å; W415-F541 AromaticContact CE2-CE1 3.97Å; W415-F541 AromaticContact CE3-CD1 3.58Å; W415-F541 HydrophobicContact CE3-CD1 3.58Å; W415-F541 AromaticContact CE3-CE1 3.41Å; W415-F541 HydrophobicContact CE3-CE1 3.41Å; W415-F541 VanDerWaalsContact CE3-CE1 3.41Å; W415-F541 AromaticContact CG-CD1 3.77Å; W415-F541 HydrophobicContact CG-CD1 3.77Å; W415-F541 AromaticContact CG-CE1 3.59Å; W415-F541 HydrophobicContact CG-CE1 3.59Å; W415-F541 HydrophobicContact CG-CZ 4.32Å; W415-F541 HydrophobicContact CZ3-CD1 4.47Å; W415-F541 HydrophobicContact CZ3-CE1 4.07Å; W415-G542 PolarHBondContact O-N 3.34Å; W415-Q548 HydrophobicContact CZ3-CB 4.31Å; W415-Q548 HydrophobicContact CZ3-CG 4.39Å; W415-I549 HydrophobicContact CE3-CG1 4.34Å; W415-I549 HydrophobicContact CH2-CD1 3.26Å; W415-I549 HydrophobicContact CH2-CG1 3.92Å; W415-I549 HydrophobicContact CZ2-CD1 4.05Å; W415-I549 HydrophobicContact CZ3-CD1 3.55Å; W415-I549 HydrophobicContact CZ3-CG1 3.63Å
416	L	94.1	Very high	94.8	Very high	87 Å²	87	74.6 Å²	74.6	46%	0.455	37%	0.373	S	S	.	.	S	Bend	trans	-80.1	-41.9	-179.7	-174.7	64	0	0	0	111.1	D414 I586	D414-L416 VanDerWaalsContact C-N 3.28Å; D414-L416 PolarHBondContact O-N 2.84Å; D414-L416 WeakPolarHBondContact OD1-CB 3.42Å; D414-L416 PolarHBondContact OD1-N 3.49Å; L416-I586 HydrophobicContact CD1-CD1 3.44Å; L416-I586 VanDerWaalsContact CD1-CD1 3.44Å; L416-I586 HydrophobicContact CD1-CG1 4.24Å
417	K	93.2	Very high	94.7	Very high	169 Å²	169	75.3 Å²	75.3	74%	0.735	38%	0.379	S	S	*	.	S	Bend	trans	-101.5	34	-179.8	-61.8	-179.7	-177.8	172.6	0	113	D414	D414-K417 PolarHBondContact OD1-N 2.99Å
418	N	90.8	Very high	94.7	Very high	13 Å²	13	70.4 Å²	70.4	7%	0.07	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-70.2	146.7	-175.8	-152.2	13.3	0	0	0	111.6	R413 Y544	R413-N418 PolarHBondContact NE-OD1 3.29Å; R413-N418 PolarHBondContact NH2-OD1 3.4Å; N418-Y544 PolarHBondContact ND2-O 3.26Å; N418-Y544 WeakPolarHBondContact O-CB 3.28Å; N418-Y544 WeakPolarHBondContact O-CD2 3.23Å
419	L	93.8	Very high	94.7	Very high	139 Å²	139	66.8 Å²	66.8	73%	0.728	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-78.2	155.5	173	-64	175	0	0	0	110.8
420	E	94.1	Very high	94.7	Very high	99 Å²	99	70.1 Å²	70.1	46%	0.463	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-53.4	126.3	174.5	-174.3	177.4	-151.1	0	0	111.2	R422 Y544	E420-R422 PolarHBondContact O-N 3.11Å; E420-Y544 HydrophobicContact CB-CD1 3.88Å; E420-Y544 HydrophobicContact CB-CE1 3.74Å; E420-Y544 HydrophobicContact CB-CG 4.42Å; E420-Y544 HydrophobicContact CG-CD1 4.06Å; E420-Y544 HydrophobicContact CG-CE1 3.77Å
421	P	93.6	Very high	94.7	Very high	6 Å²	6	70.2 Å²	70.2	4%	0.039	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-62	126.2	-177.5	-22.6	32.5	0	0	0	112.1	Q547 Q548 V551 M591 I599	P421-Q547 HydrophobicContact CG-CB 3.73Å; P421-Q548 HydrophobicContact CB-CB 4.48Å; P421-Q548 HydrophobicContact CG-CB 3.92Å; P421-Q548 VanDerWaalsContact CG-N 3.32Å; P421-V551 HydrophobicContact CB-CG2 4.21Å; P421-M591 HydrophobicContact CB-CE 4.15Å; P421-M591 HydrophobicContact CG-CE 4.08Å; P421-I599 WeakPolarHBondContact O-CD1 3.32Å
422	R	94.4	Very high	94.7	Very high	189 Å²	189	65.8 Å²	65.8	71%	0.713	33%	0.334	S	S	*	.			trans	-121.8	-16	174.7	-65.4	-173.9	177.9	-163.3	-2	113.6	E420	E420-R422 PolarHBondContact O-N 3.11Å
423	T	95.5	Very high	94.8	Very high	93 Å²	93	66 Å²	66	57%	0.571	32%	0.32	S	S	*	.	S	Bend	trans	-147.8	159.6	-177.9	58.9	0	0	0	0	109.7	Q548	T423-Q548 PolarHBondContact O-NE2 3.37Å
424	V	95.6	Very high	94.8	Very high	4 Å²	4	63.5 Å²	63.5	2%	0.024	31%	0.313	C	S	.	.			trans	-69.8	140.3	167.5	-179.7	0	0	0	0	109.2	V428 K429 V551 Y555 A603	V424-V428 HydrophobicContact CG1-CB 3.95Å; V424-V428 HydrophobicContact CG1-CG1 3.91Å; V424-K429 HydrophobicContact CG1-CG 4.3Å; V424-V551 HydrophobicContact CG2-CG1 3.87Å; V424-Y555 HydrophobicContact CB-CD2 4.37Å; V424-Y555 HydrophobicContact CB-CG 4.3Å; V424-Y555 HydrophobicContact CG1-CD1 3.74Å; V424-Y555 HydrophobicContact CG1-CD2 4.23Å; V424-Y555 HydrophobicContact CG1-CE1 4.24Å; V424-Y555 HydrophobicContact CG1-CG 3.69Å; V424-Y555 HydrophobicContact CG2-CD2 3.61Å; V424-Y555 HydrophobicContact CG2-CE2 4.27Å; V424-Y555 HydrophobicContact CG2-CG 3.77Å; V424-A603 HydrophobicContact CB-CB 4.12Å; V424-A603 HydrophobicContact CG2-CB 3.63Å
425	R	95.1	Very high	94.9	Very high	18 Å²	18	59.4 Å²	59.4	7%	0.068	29%	0.291	C	S	.	.			trans	-60.9	140.6	179.1	-74.1	-167.5	-66.7	141.1	9.4	111.6	S409 A427 V428 K429 Q548 D552	S409-R425 PolarHBondContact O-NH1 3.1Å; S409-R425 PolarHBondContact OG-NH1 3.14Å; R425-A427 PolarHBondContact O-N 3.49Å; R425-V428 HydrophobicContact CB-CG2 4.21Å; R425-V428 WeakPolarHBondContact O-CB 3.14Å; R425-V428 PolarHBondContact O-N 3.02Å; R425-K429 PolarHBondContact O-N 2.98Å; R425-Q548 HydrophobicContact CG-CG 4.07Å; R425-D552 IonicContact CZ-OD2 3.61Å; R425-D552 PolarHBondContact N-OD1 3.25Å; R425-D552 VanDerWaalsContact N-OD1 3.15Å; R425-D552 IonicContact NE-OD2 3.72Å; R425-D552 PolarHBondContact NE-OD2 3.36Å; R425-D552 IonicContact NH2-OD2 3.65Å; R425-D552 PolarHBondContact NH2-OD2 2.95Å
426	S	94.8	Very high	94.7	Very high	101 Å²	101	62 Å²	62	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-56.4	-36.5	176.3	53.3	0	0	0	0	113	V428 K429 R430	S426-V428 VanDerWaalsContact C-N 3.27Å; S426-V428 PolarHBondContact O-N 3.34Å; S426-K429 PolarHBondContact O-N 3.08Å; S426-R430 WeakPolarHBondContact O-CB 3.29Å; S426-R430 PolarHBondContact O-N 2.96Å
427	A	95.6	Very high	94.6	Very high	18 Å²	18	60.7 Å²	60.7	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-36.5	175.2	0	0	0	0	0	112.8	L405 R425 R430 V431	L405-A427 HydrophobicContact CD2-CB 4.06Å; L405-A427 WeakPolarHBondContact CD2-O 3.37Å; R425-A427 PolarHBondContact O-N 3.49Å; A427-R430 PolarHBondContact O-N 3.1Å; A427-V431 WeakPolarHBondContact O-CG2 3.45Å; A427-V431 PolarHBondContact O-N 3.5Å
428	V	96.2	Very high	94.6	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-73.9	-39.1	179.3	176	0	0	0	0	110.8	V424 R425 S426 R430 V431 I432 D552 Y555 L556	V424-V428 HydrophobicContact CG1-CB 3.95Å; V424-V428 HydrophobicContact CG1-CG1 3.91Å; R425-V428 HydrophobicContact CB-CG2 4.21Å; R425-V428 WeakPolarHBondContact O-CB 3.14Å; R425-V428 PolarHBondContact O-N 3.02Å; S426-V428 VanDerWaalsContact C-N 3.27Å; S426-V428 PolarHBondContact O-N 3.34Å; V428-R430 VanDerWaalsContact C-N 3.33Å; V428-V431 WeakPolarHBondContact O-CB 3.24Å; V428-V431 PolarHBondContact O-N 3.31Å; V428-I432 PolarHBondContact O-N 3.15Å; V428-D552 HydrophobicContact CG2-CB 3.86Å; V428-Y555 HydrophobicContact CG1-CD1 3.8Å; V428-Y555 HydrophobicContact CG1-CE1 4.49Å; V428-L556 HydrophobicContact CG1-CD1 4.38Å; V428-L556 HydrophobicContact CG1-CD2 3.72Å; V428-L556 HydrophobicContact CG1-CG 3.71Å
429	K	96	Very high	94.7	Very high	60 Å²	60	53.6 Å²	53.6	26%	0.261	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-44	170.9	-61	-167.8	-178.7	-159.8	0	111.4	V424 R425 S426 V431 I432 E433 Y555 A603	V424-K429 HydrophobicContact CG1-CG 4.3Å; R425-K429 PolarHBondContact O-N 2.98Å; S426-K429 PolarHBondContact O-N 3.08Å; K429-V431 VanDerWaalsContact C-N 3.31Å; K429-V431 PolarHBondContact O-N 3.11Å; K429-I432 PolarHBondContact O-N 2.98Å; K429-E433 WeakPolarHBondContact O-CG 3.49Å; K429-E433 PolarHBondContact O-N 3.26Å; K429-Y555 HydrophobicContact CG-CE1 4.23Å; K429-A603 PolarHBondContact NZ-O 3.34Å
430	R	95.5	Very high	94.5	Very high	90 Å²	90	51.8 Å²	51.8	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-38.1	176.3	-170.8	70.6	-176.2	101	19.5	112.7	L405 S426 A427 V428 I432 E433 D434	L405-R430 HydrophobicContact CD1-CB 4.26Å; L405-R430 HydrophobicContact CD1-CG 3.7Å; S426-R430 WeakPolarHBondContact O-CB 3.29Å; S426-R430 PolarHBondContact O-N 2.96Å; A427-R430 PolarHBondContact O-N 3.1Å; V428-R430 VanDerWaalsContact C-N 3.33Å; R430-I432 VanDerWaalsContact C-N 3.33Å; R430-I432 PolarHBondContact O-N 3.36Å; R430-E433 WeakPolarHBondContact CD-OE2 3.44Å; R430-E433 IonicContact NH1-OE2 3.52Å; R430-E433 PolarHBondContact O-N 3.5Å; R430-D434 IonicContact CZ-OD1 3.63Å; R430-D434 IonicContact CZ-OD2 2.66Å; R430-D434 IonicContact NE-OD1 3.88Å; R430-D434 IonicContact NH1-OD1 3.59Å; R430-D434 PolarHBondContact NH1-OD1 3.06Å; R430-D434 IonicContact NH1-OD2 2.66Å; R430-D434 IonicContact NH2-OD1 2.78Å; R430-D434 PolarHBondContact NH2-OD1 3.27Å; R430-D434 IonicContact NH2-OD2 2.73Å; R430-D434 WeakPolarHBondContact O-CB 3.38Å; R430-D434 PolarHBondContact O-N 3.46Å
431	V	96.6	Very high	94.3	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.024	24%	0.239	C	C	.	.	H	α-helix	trans	-58	-44.5	172.7	159.4	0	0	0	0	111.4	L402 L405 L406 A427 V428 K429 D434 L435 L556	L402-V431 HydrophobicContact CD1-CB 4.19Å; L402-V431 HydrophobicContact CD1-CG1 4.01Å; L402-V431 HydrophobicContact CD1-CG2 3.88Å; L402-V431 HydrophobicContact CG-CG2 4.48Å; L405-V431 HydrophobicContact CD2-CG2 3.66Å; L406-V431 HydrophobicContact CD2-CG2 3.88Å; L406-V431 HydrophobicContact CG-CG2 4.01Å; A427-V431 WeakPolarHBondContact O-CG2 3.45Å; A427-V431 PolarHBondContact O-N 3.5Å; V428-V431 WeakPolarHBondContact O-CB 3.24Å; V428-V431 PolarHBondContact O-N 3.31Å; K429-V431 VanDerWaalsContact C-N 3.31Å; K429-V431 PolarHBondContact O-N 3.11Å; V431-D434 PolarHBondContact O-N 3.13Å; V431-L435 HydrophobicContact CG1-CD1 4.09Å; V431-L435 WeakPolarHBondContact O-CB 3.3Å; V431-L435 VanDerWaalsContact O-CG 3.28Å; V431-L435 WeakPolarHBondContact O-CG 3.26Å; V431-L435 PolarHBondContact O-N 2.98Å; V431-L556 HydrophobicContact CG1-CD2 4.04Å
432	I	95.9	Very high	94.3	Very high	15 Å²	15	47.4 Å²	47.4	8%	0.077	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-43.5	177.3	-59.8	-53.4	0	0	0	110.7	V428 K429 R430 D434 L435 V436 Y555 L556 H559 L560	V428-I432 PolarHBondContact O-N 3.15Å; K429-I432 PolarHBondContact O-N 2.98Å; R430-I432 VanDerWaalsContact C-N 3.33Å; R430-I432 PolarHBondContact O-N 3.36Å; I432-D434 PolarHBondContact O-N 3.34Å; I432-L435 PolarHBondContact O-N 2.91Å; I432-V436 WeakPolarHBondContact O-CG2 3.46Å; I432-V436 PolarHBondContact O-N 3.45Å; I432-Y555 HydrophobicContact CG1-CD1 4.49Å; I432-Y555 HydrophobicContact CG1-CE1 3.99Å; I432-L556 HydrophobicContact CD1-CD2 3.89Å; I432-L556 HydrophobicContact CG1-CD2 4.47Å; I432-H559 HydrophobicContact CD1-CB 3.6Å; I432-H559 HydrophobicContact CG1-CB 3.95Å; I432-H559 HydrophobicContact CG2-CB 4.1Å; I432-L560 HydrophobicContact CD1-CD2 4Å; I432-L560 HydrophobicContact CD1-CG 4.38Å
433	E	94.7	Very high	94.2	Very high	99 Å²	99	41 Å²	41	46%	0.463	22%	0.221	S	C	.	.	H	α-helix	trans	-58.7	-45	175.6	-68.1	166.6	-168.4	0	0	112.3	K429 R430 V436 L437	K429-E433 WeakPolarHBondContact O-CG 3.49Å; K429-E433 PolarHBondContact O-N 3.26Å; R430-E433 WeakPolarHBondContact CD-OE2 3.44Å; R430-E433 IonicContact NH1-OE2 3.52Å; R430-E433 PolarHBondContact O-N 3.5Å; E433-V436 PolarHBondContact O-N 3.09Å; E433-L437 WeakPolarHBondContact O-CG 3.21Å; E433-L437 PolarHBondContact O-N 2.75Å
434	D	94.7	Very high	93.9	Very high	38 Å²	38	37.9 Å²	37.9	20%	0.203	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-40.1	177.1	-78.2	-23.5	0	0	0	112	R430 V431 I432 L437 L438	R430-D434 IonicContact CZ-OD1 3.63Å; R430-D434 IonicContact CZ-OD2 2.66Å; R430-D434 IonicContact NE-OD1 3.88Å; R430-D434 IonicContact NH1-OD1 3.59Å; R430-D434 PolarHBondContact NH1-OD1 3.06Å; R430-D434 IonicContact NH1-OD2 2.66Å; R430-D434 IonicContact NH2-OD1 2.78Å; R430-D434 PolarHBondContact NH2-OD1 3.27Å; R430-D434 IonicContact NH2-OD2 2.73Å; R430-D434 WeakPolarHBondContact O-CB 3.38Å; R430-D434 PolarHBondContact O-N 3.46Å; V431-D434 PolarHBondContact O-N 3.13Å; I432-D434 PolarHBondContact O-N 3.34Å; D434-L437 PolarHBondContact O-N 3.09Å; D434-L438 WeakPolarHBondContact O-CB 3.38Å; D434-L438 PolarHBondContact O-N 2.97Å
435	L	95.2	Very high	93.7	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-36	174.3	-72.2	171.1	0	0	0	112.2	L402 V431 I432 L438 D439 V524 I525 L560 F563	L402-L435 HydrophobicContact CD2-CD2 4.24Å; V431-L435 HydrophobicContact CG1-CD1 4.09Å; V431-L435 WeakPolarHBondContact O-CB 3.3Å; V431-L435 VanDerWaalsContact O-CG 3.28Å; V431-L435 WeakPolarHBondContact O-CG 3.26Å; V431-L435 PolarHBondContact O-N 2.98Å; I432-L435 PolarHBondContact O-N 2.91Å; L435-L438 HydrophobicContact CD2-CD2 4.49Å; L435-L438 PolarHBondContact O-N 3.3Å; L435-D439 WeakPolarHBondContact O-CB 3.49Å; L435-D439 PolarHBondContact O-N 2.95Å; L435-V524 HydrophobicContact CD2-CG1 4.23Å; L435-I525 HydrophobicContact CD1-CD1 4.27Å; L435-I525 HydrophobicContact CD1-CG1 3.89Å; L435-I525 HydrophobicContact CD2-CD1 4.35Å; L435-I525 HydrophobicContact CD2-CG1 3.78Å; L435-L560 HydrophobicContact CD1-CD2 3.37Å; L435-F563 HydrophobicContact CB-CD2 4.38Å; L435-F563 HydrophobicContact CB-CE1 4.19Å; L435-F563 HydrophobicContact CB-CE2 3.89Å; L435-F563 HydrophobicContact CB-CZ 3.78Å; L435-F563 HydrophobicContact CD1-CD2 4.4Å; L435-F563 HydrophobicContact CD1-CE2 4.3Å
436	V	93.3	Very high	93.5	Very high	58 Å²	58	37.7 Å²	37.7	35%	0.352	20%	0.2	S	C	.	.	H	α-helix	trans	-64.2	-43.2	173.9	171.2	0	0	0	0	111.2	I432 E433 D439 Q440 F563	I432-V436 WeakPolarHBondContact O-CG2 3.46Å; I432-V436 PolarHBondContact O-N 3.45Å; E433-V436 PolarHBondContact O-N 3.09Å; V436-D439 PolarHBondContact O-N 3.09Å; V436-Q440 VanDerWaalsContact O-CG 3.32Å; V436-Q440 WeakPolarHBondContact O-CG 3.47Å; V436-Q440 PolarHBondContact O-N 3.45Å; V436-F563 HydrophobicContact CG2-CE1 4.32Å; V436-F563 HydrophobicContact CG2-CZ 3.86Å
437	L	91.5	Very high	92.8	Very high	59 Å²	59	38 Å²	38	31%	0.309	20%	0.202	S	C	.	.	H	α-helix	trans	-64.6	-43.5	176.2	-68.8	174.9	0	0	0	111.5	E433 D434 D439 Q440 Q441	E433-L437 WeakPolarHBondContact O-CG 3.21Å; E433-L437 PolarHBondContact O-N 2.75Å; D434-L437 PolarHBondContact O-N 3.09Å; L437-D439 VanDerWaalsContact C-N 3.35Å; L437-Q440 PolarHBondContact O-N 3.29Å; L437-Q441 WeakPolarHBondContact O-CG 3.3Å; L437-Q441 PolarHBondContact O-N 3.43Å; L437-Q441 VanDerWaalsContact O-N 3.08Å
438	L	93.1	Very high	91.5	Very high	11 Å²	11	39.2 Å²	39.2	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-43.6	177	-171.3	67.3	0	0	0	111.5	F394 E398 D434 L435 Q440 Q441 V442 L521 V524	F394-L438 HydrophobicContact CE2-CD1 4.03Å; F394-L438 HydrophobicContact CZ-CD1 3.56Å; F394-L438 HydrophobicContact CZ-CG 4.4Å; E398-L438 HydrophobicContact CB-CD1 4.34Å; E398-L438 HydrophobicContact CB-CD2 4.28Å; E398-L438 HydrophobicContact CG-CD1 3.86Å; D434-L438 WeakPolarHBondContact O-CB 3.38Å; D434-L438 PolarHBondContact O-N 2.97Å; L435-L438 HydrophobicContact CD2-CD2 4.49Å; L435-L438 PolarHBondContact O-N 3.3Å; L438-Q440 PolarHBondContact O-N 3.08Å; L438-Q441 PolarHBondContact O-N 2.71Å; L438-V442 HydrophobicContact CG-CG2 4.42Å; L438-V442 VanDerWaalsContact O-CG2 3.31Å; L438-V442 WeakPolarHBondContact O-CG2 3.44Å; L438-V442 PolarHBondContact O-N 2.95Å; L438-L521 HydrophobicContact CB-CD2 4.4Å; L438-L521 HydrophobicContact CD2-CD2 3.91Å; L438-L521 HydrophobicContact CG-CD2 4.03Å; L438-V524 HydrophobicContact CD2-CB 4.23Å; L438-V524 HydrophobicContact CD2-CG1 3.9Å; L438-V524 HydrophobicContact CD2-CG2 4.02Å
439	D	92.5	Very high	89.6	Confident	22 Å²	22	44.2 Å²	44.2	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-43.5	177.2	-179.4	57.6	0	0	0	112.1	L435 V436 L437 V442 S443 R517 L521 F563	L435-D439 WeakPolarHBondContact O-CB 3.49Å; L435-D439 PolarHBondContact O-N 2.95Å; V436-D439 PolarHBondContact O-N 3.09Å; L437-D439 VanDerWaalsContact C-N 3.35Å; D439-V442 PolarHBondContact O-N 3.32Å; D439-S443 WeakPolarHBondContact O-CB 3.42Å; D439-S443 PolarHBondContact O-N 3.5Å; D439-S443 PolarHBondContact O-OG 3.12Å; D439-R517 IonicContact OD1-CZ 3.38Å; D439-R517 IonicContact OD1-NE 3.12Å; D439-R517 PolarHBondContact OD1-NE 3.02Å; D439-R517 IonicContact OD1-NH2 3.09Å; D439-R517 PolarHBondContact OD1-NH2 3.13Å; D439-R517 IonicContact OD2-CZ 2.71Å; D439-R517 IonicContact OD2-NH2 2.82Å; D439-R517 PolarHBondContact OD2-NH2 2.67Å; D439-L521 HydrophobicContact CB-CD1 4.16Å; D439-L521 HydrophobicContact CB-CD2 4.31Å; D439-L521 WeakPolarHBondContact OD1-CD1 3.34Å; D439-F563 HydrophobicContact CB-CD1 3.89Å; D439-F563 HydrophobicContact CB-CE1 3.76Å
440	Q	90	Very high	87.6	Confident	101 Å²	101	47.4 Å²	47.4	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-46.6	172.5	-72.8	172.4	6	0	0	111.6	V436 L437 L438 S443 Q444	V436-Q440 VanDerWaalsContact O-CG 3.32Å; V436-Q440 WeakPolarHBondContact O-CG 3.47Å; V436-Q440 PolarHBondContact O-N 3.45Å; L437-Q440 PolarHBondContact O-N 3.29Å; L438-Q440 PolarHBondContact O-N 3.08Å; Q440-S443 PolarHBondContact O-N 3.42Å; Q440-S443 PolarHBondContact O-OG 3.02Å; Q440-Q444 WeakPolarHBondContact O-CG 3.34Å; Q440-Q444 PolarHBondContact O-N 3.46Å
441	Q	90.9	Very high	85.5	Confident	13 Å²	13	52.6 Å²	52.6	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-47.7	178.8	-69.2	178.2	11.2	0	0	112.3	L221 L437 L438 S443 Q444	L221-Q441 HydrophobicContact CD2-CG 4.19Å; L437-Q441 WeakPolarHBondContact O-CG 3.3Å; L437-Q441 PolarHBondContact O-N 3.43Å; L437-Q441 VanDerWaalsContact O-N 3.08Å; L438-Q441 PolarHBondContact O-N 2.71Å; Q441-S443 VanDerWaalsContact C-N 3.29Å; Q441-S443 PolarHBondContact O-N 2.8Å; Q441-Q444 WeakPolarHBondContact O-CB 3.48Å; Q441-Q444 PolarHBondContact O-N 2.77Å
442	V	93.2	Very high	83.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-38	178.9	177	0	0	0	0	111	L324 F394 L438 D439 Q444 L445 F446 R517 L520	L324-V442 HydrophobicContact CD1-CG2 4.29Å; L324-V442 HydrophobicContact CD2-CG2 4.14Å; F394-V442 HydrophobicContact CE1-CG2 4.02Å; F394-V442 HydrophobicContact CZ-CG2 3.79Å; L438-V442 HydrophobicContact CG-CG2 4.42Å; L438-V442 VanDerWaalsContact O-CG2 3.31Å; L438-V442 WeakPolarHBondContact O-CG2 3.44Å; L438-V442 PolarHBondContact O-N 2.95Å; D439-V442 PolarHBondContact O-N 3.32Å; V442-Q444 PolarHBondContact O-N 3.47Å; V442-L445 PolarHBondContact O-N 2.99Å; V442-L445 VanDerWaalsContact O-N 3.12Å; V442-F446 HydrophobicContact CG1-CB 4.2Å; V442-F446 HydrophobicContact CG1-CD2 4.27Å; V442-F446 PolarHBondContact O-N 3.04Å; V442-R517 HydrophobicContact CG1-CB 4Å; V442-R517 HydrophobicContact CG1-CG 3.92Å; V442-L520 HydrophobicContact CG1-CB 4.49Å; V442-L520 HydrophobicContact CG1-CD1 3.76Å
443	S	91.3	Very high	81.1	Confident	53 Å²	53	63.1 Å²	63.1	37%	0.371	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-20.1	178.9	77.4	0	0	0	0	114.4	D439 Q440 Q441 L445	D439-S443 WeakPolarHBondContact O-CB 3.42Å; D439-S443 PolarHBondContact O-N 3.5Å; D439-S443 PolarHBondContact O-OG 3.12Å; Q440-S443 PolarHBondContact O-N 3.42Å; Q440-S443 PolarHBondContact O-OG 3.02Å; Q441-S443 VanDerWaalsContact C-N 3.29Å; Q441-S443 PolarHBondContact O-N 2.8Å; S443-L445 VanDerWaalsContact C-N 3.26Å; S443-L445 PolarHBondContact O-N 3.22Å
444	Q	90.7	Very high	78.6	Confident	28 Å²	28	65.1 Å²	65.1	13%	0.131	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.3	176	-53.1	-162.7	13.1	0	0	112.5	N240 N241 L244 Q440 Q441 V442	N240-Q444 PolarHBondContact O-NE2 3.21Å; N240-Q444 VanDerWaalsContact O-NE2 3.08Å; N241-Q444 WeakPolarHBondContact O-CG 3.37Å; L244-Q444 HydrophobicContact CB-CB 4.08Å; Q440-Q444 WeakPolarHBondContact O-CG 3.34Å; Q440-Q444 PolarHBondContact O-N 3.46Å; Q441-Q444 WeakPolarHBondContact O-CB 3.48Å; Q441-Q444 PolarHBondContact O-N 2.77Å; V442-Q444 PolarHBondContact O-N 3.47Å
445	L	91.3	Very high	76.3	Confident	12 Å²	12	70.9 Å²	70.9	6%	0.063	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-29.4	-173.2	-64.3	-176.6	0	0	0	113.8	L244 L248 L324 K328 V442 S443	L244-L445 HydrophobicContact CB-CD1 4.33Å; L244-L445 HydrophobicContact CB-CD2 4.13Å; L244-L445 HydrophobicContact CB-CG 4.12Å; L244-L445 HydrophobicContact CD2-CD1 3.65Å; L244-L445 HydrophobicContact CD2-CG 4.11Å; L244-L445 HydrophobicContact CG-CD1 4.17Å; L244-L445 HydrophobicContact CG-CG 4.49Å; L248-L445 HydrophobicContact CB-CD2 4.38Å; L248-L445 HydrophobicContact CD2-CD2 3.94Å; L324-L445 HydrophobicContact CD2-CD1 4.03Å; L324-L445 HydrophobicContact CG-CD1 3.91Å; K328-L445 HydrophobicContact CB-CB 4.39Å; K328-L445 HydrophobicContact CB-CD1 4.15Å; K328-L445 HydrophobicContact CD-CB 4.47Å; K328-L445 WeakPolarHBondContact CD-O 3.29Å; K328-L445 WeakPolarHBondContact CE-O 3.22Å; K328-L445 HydrophobicContact CG-CB 4.16Å; K328-L445 HydrophobicContact CG-CD2 4.45Å; K328-L445 PolarHBondContact NZ-O 3.33Å; V442-L445 PolarHBondContact O-N 2.99Å; V442-L445 VanDerWaalsContact O-N 3.12Å; S443-L445 VanDerWaalsContact C-N 3.26Å; S443-L445 PolarHBondContact O-N 3.22Å
446	F	90.7	Very high	73.9	Confident	7 Å²	7	76.9 Å²	76.9	3%	0.031	38%	0.384	C	S	.	.	S	Bend	trans	-121.1	116.9	-178.4	-64	-85.6	0	0	0	109.5	L324 K328 L331 L391 V442 A515 R517 L520	L324-F446 HydrophobicContact CD1-CD2 4Å; L324-F446 HydrophobicContact CD1-CE2 3.6Å; L324-F446 HydrophobicContact CG-CE2 4.13Å; K328-F446 HydrophobicContact CB-CE2 4.13Å; K328-F446 HydrophobicContact CB-CZ 3.89Å; K328-F446 HydrophobicContact CD-CD1 4.3Å; K328-F446 HydrophobicContact CD-CE1 3.76Å; K328-F446 HydrophobicContact CD-CE2 4.23Å; K328-F446 HydrophobicContact CD-CZ 3.72Å; K328-F446 HydrophobicContact CG-CZ 4.37Å; L331-F446 HydrophobicContact CD1-CE1 4.19Å; L331-F446 HydrophobicContact CD1-CZ 4.47Å; L391-F446 HydrophobicContact CD1-CE1 4.37Å; L391-F446 HydrophobicContact CD1-CZ 4.07Å; L391-F446 HydrophobicContact CD2-CE2 4.08Å; L391-F446 HydrophobicContact CD2-CZ 3.85Å; V442-F446 HydrophobicContact CG1-CB 4.2Å; V442-F446 HydrophobicContact CG1-CD2 4.27Å; V442-F446 PolarHBondContact O-N 3.04Å; F446-A515 WeakPolarHBondContact CD1-O 3.25Å; F446-A515 HydrophobicContact CE1-CB 4.18Å; F446-R517 HydrophobicContact CB-CB 4.4Å; F446-L520 HydrophobicContact CD2-CD1 3.92Å; F446-L520 HydrophobicContact CE2-CD1 4.17Å; F446-L520 HydrophobicContact CG-CD1 4.2Å
447	S	78.9	Confident	71.3	Confident	108 Å²	108	78.9 Å²	78.9	76%	0.755	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-63.3	143.9	176.6	-50.6	0	0	0	0	110.7
448	S	68.7	Low	68.6	Low	43 Å²	43	83 Å²	83	30%	0.301	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-82.4	144	170.4	-173.3	0	0	0	0	110	T450 E518	S448-T450 PolarHBondContact O-N 3.38Å; S448-E518 VanDerWaalsContact CA-OE1 3.25Å; S448-E518 WeakPolarHBondContact CA-OE1 3.36Å; S448-E518 WeakPolarHBondContact CB-OE1 3.49Å; S448-E518 PolarHBondContact OG-OE1 3.05Å
449	N	56.7	Low	66	Low	106 Å²	106	87.5 Å²	87.5	57%	0.567	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-71.3	119.3	161.2	-82.4	-25.4	0	0	0	107.7	R451 E518	N449-R451 PolarHBondContact O-N 3.27Å; N449-E518 PolarHBondContact N-OE1 3.28Å
450	T	54.3	Low	63.8	Low	126 Å²	126	99 Å²	99	77%	0.773	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	16.8	-168	48.8	0	0	0	0	117.3	S448	S448-T450 PolarHBondContact O-N 3.38Å
451	R	51.6	Low	61.3	Low	199 Å²	199	98.4 Å²	98.4	75%	0.751	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-15.8	-169.2	-83.6	171.9	67.5	166.8	-1	116.4	N449	N449-R451 PolarHBondContact O-N 3.27Å
452	N	50.5	Low	58.8	Low	29 Å²	29	105.4 Å²	105.4	16%	0.155	54%	0.542	C	S	.	.	S	Bend	trans	-102	-13.1	-169.5	-77.7	-8.4	0	0	0	116.1	V564	N452-V564 PolarHBondContact ND2-O 3.04Å
453	R	48.6	Very low	56.7	Low	212 Å²	212	110.3 Å²	110.3	80%	0.8	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-80	-24.3	-176	-137.7	174.9	88.3	169.3	6.2	114.1
454	D	42.8	Very low	54.2	Low	140 Å²	140	111.9 Å²	111.9	75%	0.749	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-90.6	3.3	-172.2	-62.3	-31.1	0	0	0	114.3	I456	D454-I456 VanDerWaalsContact C-N 3.35Å
455	R	46.4	Very low	52	Low	160 Å²	160	114.6 Å²	114.6	60%	0.604	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-87	3.9	178.5	-79.9	-172.4	174.4	-175.7	-2.4	115.2	S457 W561	R455-S457 PolarHBondContact O-N 3.13Å; R455-W561 HydrophobicContact CB-CH2 4.11Å; R455-W561 HydrophobicContact CB-CZ3 4.24Å
456	I	45.1	Very low	49.7	Very low	128 Å²	128	123.6 Å²	123.6	66%	0.656	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-68.3	-13.3	-177.2	-65	170.4	0	0	0	112.6	D454	D454-I456 VanDerWaalsContact C-N 3.35Å
457	S	38.3	Very low	47.1	Very low	100 Å²	100	127.1 Å²	127.1	70%	0.699	64%	0.643	S	S	*	*	S	Bend	trans	-101.7	-29.4	-175.6	-78.1	0	0	0	0	117.4	R455	R455-S457 PolarHBondContact O-N 3.13Å
458	D	35.3	Very low	44.9	Very low	145 Å²	145	127.6 Å²	127.6	78%	0.775	65%	0.647	S	S	*	*	S	Bend	trans	-148.4	82.2	-167.3	-73.3	-51.1	0	0	0	113
459	S	38.8	Very low	43.6	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	66%	0.663	S	S	*	*			trans	179.6	66.7	152.2	-78.8	0	0	0	0	111.6	S461	S459-S461 PolarHBondContact O-N 3.49Å
460	R	45.1	Very low	42.6	Very low	262 Å²	262	131.3 Å²	131.3	99%	0.989	68%	0.677	S	S	*	*			trans	-78.6	19.2	163.7	-74.6	-178.7	172.2	149.4	-2.8	112.7
461	S	38.1	Very low	41.7	Very low	90 Å²	90	131.2 Å²	131.2	63%	0.629	68%	0.682	S	S	*	*	S	Bend	trans	-96.2	110	-173.5	61.6	0	0	0	0	112.7	S459	S459-S461 PolarHBondContact O-N 3.49Å
462	N	39.2	Very low	40.8	Very low	159 Å²	159	130.6 Å²	130.6	85%	0.85	69%	0.687	S	S	*	*			trans	61.5	46.7	153	-69.8	-3.1	0	0	0	119.6	S464	N462-S464 PolarHBondContact O-N 3.43Å
463	R	47.7	Very low	40.1	Very low	103 Å²	103	136.9 Å²	136.9	39%	0.389	72%	0.72	S	S	.	*			trans	-78.5	67	160.8	-81.7	-173.9	179.4	138.2	-0.2	111.3	R554 E567	R463-R554 PolarHBondContact O-NH1 2.83Å; R463-E567 IonicContact CZ-OE1 2.88Å; R463-E567 IonicContact CZ-OE2 2.7Å; R463-E567 IonicContact NE-OE1 3.14Å; R463-E567 PolarHBondContact NE-OE1 3.35Å; R463-E567 IonicContact NE-OE2 2.99Å; R463-E567 IonicContact NH2-OE1 2.63Å; R463-E567 PolarHBondContact NH2-OE1 2.9Å; R463-E567 IonicContact NH2-OE2 2.71Å; R463-E567 PolarHBondContact NH2-OE2 3.3Å
464	S	40.1	Very low	39.5	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	72%	0.721	S	S	*	*			trans	-83.8	131.8	164.8	179	0	0	0	0	108.7	N462 R466	N462-S464 PolarHBondContact O-N 3.43Å; S464-R466 PolarHBondContact O-N 3.39Å
465	L	43.7	Very low	39	Very low	85 Å²	85	134.8 Å²	134.8	45%	0.445	73%	0.729	S	S	.	*	S	Bend	trans	-67.1	35	173.5	-76	155.7	0	0	0	113	E575	L465-E575 HydrophobicContact CD2-CG 3.85Å
466	R	42.5	Very low	38.6	Very low	202 Å²	202	130.7 Å²	130.7	76%	0.762	73%	0.73	S	S	*	*			trans	-100.2	123.8	178.3	-153.2	176.9	-175.2	-158.3	0.4	109.9	S464 S468	S464-R466 PolarHBondContact O-N 3.39Å; R466-S468 PolarHBondContact O-N 3.47Å
467	P	37.3	Very low	38.5	Very low	80 Å²	80	130.6 Å²	130.6	52%	0.519	74%	0.735	S	S	.	*			trans	-61.7	108.1	174.2	-17	28.6	0	0	0	109.6	T469	P467-T469 PolarHBondContact O-N 2.88Å
468	S	31.6	Very low	38.7	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	74%	0.742	S	S	*	*			trans	-85.1	93.9	173.2	-63.8	0	0	0	0	108.9	R466	R466-S468 PolarHBondContact O-N 3.47Å
469	T	41.2	Very low	39	Very low	106 Å²	106	136 Å²	136	65%	0.65	74%	0.744	S	S	*	*			trans	-146.9	128.4	160.8	38.5	0	0	0	0	111.2	P467	P467-T469 PolarHBondContact O-N 2.88Å
470	S	35.6	Very low	39	Very low	122 Å²	122	134.6 Å²	134.6	85%	0.853	75%	0.746	S	S	*	*			trans	64.9	88.5	165.2	71.7	0	0	0	0	120.1
471	S	35.6	Very low	38.8	Very low	124 Å²	124	127.2 Å²	127.2	87%	0.867	74%	0.735	S	S	*	*			trans	-125.8	66.7	142.7	64.7	0	0	0	0	109.4
472	H	33.9	Very low	38.8	Very low	186 Å²	186	127.9 Å²	127.9	86%	0.861	74%	0.74	S	S	*	*			trans	-113.7	90.4	156.6	-112.5	-74.5	0	0	0	105
473	L	35.8	Very low	39.1	Very low	161 Å²	161	125.3 Å²	125.3	84%	0.843	73%	0.734	S	S	*	*	S	Bend	trans	177	134.2	159.5	-92	146.2	0	0	0	106.2
474	T	36.3	Very low	38.8	Very low	136 Å²	136	129.5 Å²	129.5	83%	0.834	76%	0.758	S	S	*	*			trans	75.4	68	175.6	79.9	0	0	0	0	117.2
475	D	32.3	Very low	38.4	Very low	171 Å²	171	128.6 Å²	128.6	91%	0.914	76%	0.763	S	S	*	*			trans	-121.7	84.4	137.1	-158.7	6.2	0	0	0	107.8
476	A	37.6	Very low	38	Very low	75 Å²	75	134.4 Å²	134.4	62%	0.62	78%	0.784	S	S	*	*			trans	-151	130.7	170.7	0	0	0	0	0	107.6
477	T	43	Very low	37.7	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	79%	0.79	S	S	*	*			trans	82.9	93.5	174.1	73.3	0	0	0	0	114.5
478	R	42.7	Very low	37.7	Very low	225 Å²	225	135.2 Å²	135.2	85%	0.849	80%	0.802	S	S	*	*				75.9	106.2	83.3	-76.6	177.7	108.9	177.8	5.5	112.1
479	T	41.8	Very low	38.2	Very low	133 Å²	133	135.3 Å²	135.3	82%	0.816	80%	0.799	S	S	*	*				47.6	111.7	129	61.6	0	0	0	0	117.7
480	G	38	Very low	38.1	Very low	76 Å²	76	138 Å²	138	78%	0.784	81%	0.81	S	S	*	*			trans	115.1	128.5	136.2	0	0	0	0	0	116.2
481	S	40.8	Very low	38.5	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	81%	0.806	S	S	*	*			trans	74.2	94	149.4	-173.8	0	0	0	0	118.6
482	S	38.5	Very low	38.8	Very low	104 Å²	104	137.1 Å²	137.1	73%	0.727	79%	0.785	S	S	*	*				14.7	116.4	126.8	50.2	0	0	0	0	118.4
483	S	44.5	Very low	40	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	77%	0.774	S	S	*	*				171.9	125.6	122.7	47.5	0	0	0	0	111.4
484	Q	42.3	Very low	40.9	Very low	192 Å²	192	128.2 Å²	128.2	90%	0.897	75%	0.752	S	S	*	*			trans	46.4	106.9	145.4	-64.3	173.6	-14.8	0	0	116.6
485	G	31.4	Very low	41.6	Very low	67 Å²	67	126.2 Å²	126.2	69%	0.691	74%	0.736	S	S	*	*				98.1	74.8	67.4	0	0	0	0	0	110.2
486	F	34.9	Very low	42.6	Very low	206 Å²	206	119.8 Å²	119.8	90%	0.904	71%	0.707	S	S	*	*			trans	-144.4	101.6	162.4	-107	-87.4	0	0	0	108.2	S488	F486-S488 PolarHBondContact O-N 2.92Å
487	H	37.3	Very low	43.6	Very low	189 Å²	189	119.4 Å²	119.4	88%	0.875	70%	0.697	S	S	*	*			trans	-75.3	114.1	172.3	-69.3	-82.2	0	0	0	108.7
488	S	36	Very low	44.1	Very low	110 Å²	110	117.3 Å²	117.3	77%	0.769	68%	0.678	S	S	*	*			trans	-83.9	137.4	159.4	-66.4	0	0	0	0	108.2	F486	F486-S488 PolarHBondContact O-N 2.92Å
489	P	43.9	Very low	44.4	Very low	120 Å²	120	110.8 Å²	110.8	78%	0.779	66%	0.66	S	S	*	*			trans	-72.8	144	-164.6	30.3	-33.3	0	0	0	111.7	L491	P489-L491 PolarHBondContact O-N 3.19Å; P489-L491 VanDerWaalsContact O-N 3.16Å
490	D	38.1	Very low	45.1	Very low	164 Å²	164	110.7 Å²	110.7	88%	0.877	64%	0.644	S	S	*	*			trans	-41.3	113.9	169.6	-98.4	-39.2	0	0	0	111.1	D492	D490-D492 PolarHBondContact O-N 3.06Å
491	L	43.6	Very low	45.9	Very low	144 Å²	144	110 Å²	110	75%	0.754	62%	0.621	S	S	*	*			trans	-70.3	115.3	166	-142.5	90.9	0	0	0	106.9	P489 P493	P489-L491 PolarHBondContact O-N 3.19Å; P489-L491 VanDerWaalsContact O-N 3.16Å; L491-P493 VanDerWaalsContact O-N 3.16Å
492	D	43.4	Very low	46.3	Very low	82 Å²	82	111.5 Å²	111.5	44%	0.439	62%	0.619	S	S	.	*			trans	-51.4	117.6	-176.1	-167.7	-17.8	0	0	0	110.7	D490 T494 L495	D490-D492 PolarHBondContact O-N 3.06Å; D492-T494 PolarHBondContact O-N 2.9Å; D492-T494 WeakPolarHBondContact OD1-CB 3.42Å; D492-T494 VanDerWaalsContact OD1-CG2 3.3Å; D492-T494 WeakPolarHBondContact OD1-CG2 3.26Å; D492-T494 PolarHBondContact OD1-N 3.06Å; D492-T494 PolarHBondContact OD1-OG1 3.43Å; D492-T494 PolarHBondContact OD2-OG1 3.22Å; D492-L495 HydrophobicContact CB-CB 4.4Å; D492-L495 WeakPolarHBondContact O-CB 3.46Å; D492-L495 PolarHBondContact O-N 3.2Å
493	P	57.5	Low	46.8	Very low	97 Å²	97	115 Å²	115	63%	0.63	62%	0.622	S	S	*	*	H	α-helix	trans	-58.3	-21.9	-179	22	-32.5	0	0	0	112.1	L491 L495 T497	L491-P493 VanDerWaalsContact O-N 3.16Å; P493-L495 VanDerWaalsContact C-N 3.34Å; P493-T497 PolarHBondContact O-N 2.88Å; P493-T497 PolarHBondContact O-OG1 3.09Å
494	T	55.7	Low	47.1	Very low	63 Å²	63	112.3 Å²	112.3	39%	0.387	60%	0.601	S	S	.	*	H	α-helix	trans	-66.4	-34.3	173	70.2	0	0	0	0	112.3	D492 T497 H498	D492-T494 PolarHBondContact O-N 2.9Å; D492-T494 WeakPolarHBondContact OD1-CB 3.42Å; D492-T494 VanDerWaalsContact OD1-CG2 3.3Å; D492-T494 WeakPolarHBondContact OD1-CG2 3.26Å; D492-T494 PolarHBondContact OD1-N 3.06Å; D492-T494 PolarHBondContact OD1-OG1 3.43Å; D492-T494 PolarHBondContact OD2-OG1 3.22Å; T494-T497 PolarHBondContact O-N 3.34Å; T494-T497 PolarHBondContact O-OG1 2.98Å; T494-H498 WeakPolarHBondContact O-CB 3.49Å; T494-H498 PolarHBondContact O-N 2.87Å; T494-H498 PolarHBondContact O-ND1 3.44Å
495	L	50.7	Low	47.4	Very low	94 Å²	94	111.1 Å²	111.1	49%	0.492	60%	0.595	S	S	.	*	H	α-helix	trans	-72.9	-37.2	-178.4	-133.6	155.9	0	0	0	110.8	D492 P493 T497 H498 L499	D492-L495 HydrophobicContact CB-CB 4.4Å; D492-L495 WeakPolarHBondContact O-CB 3.46Å; D492-L495 PolarHBondContact O-N 3.2Å; P493-L495 VanDerWaalsContact C-N 3.34Å; L495-T497 VanDerWaalsContact C-N 3.35Å; L495-H498 PolarHBondContact O-N 2.94Å; L495-L499 HydrophobicContact CD2-CD1 3.89Å; L495-L499 HydrophobicContact CD2-CG 4.19Å; L495-L499 WeakPolarHBondContact O-CB 3.37Å; L495-L499 WeakPolarHBondContact O-CG 3.39Å; L495-L499 PolarHBondContact O-N 3.48Å
496	A	53.7	Low	48.6	Very low	36 Å²	36	118.8 Å²	118.8	30%	0.298	60%	0.604	S	S	.	*	H	α-helix	trans	-66.4	-34	174.6	0	0	0	0	0	112.8	R500	A496-R500 WeakPolarHBondContact O-CG 3.45Å; A496-R500 PolarHBondContact O-N 3.44Å
497	T	58.2	Low	49.7	Very low	67 Å²	67	110.9 Å²	110.9	41%	0.411	57%	0.572	S	S	.	*	H	α-helix	trans	-75.4	-41	173.3	56.9	0	0	0	0	112.1	P493 T494 L495 L499 R500 H501	P493-T497 PolarHBondContact O-N 2.88Å; P493-T497 PolarHBondContact O-OG1 3.09Å; T494-T497 PolarHBondContact O-N 3.34Å; T494-T497 PolarHBondContact O-OG1 2.98Å; L495-T497 VanDerWaalsContact C-N 3.35Å; T497-L499 PolarHBondContact O-N 3.18Å; T497-R500 PolarHBondContact O-N 3.12Å; T497-H501 PolarHBondContact O-N 3.21Å; T497-H501 VanDerWaalsContact O-N 3.09Å
498	H	53	Low	50.6	Low	82 Å²	82	107 Å²	107	38%	0.38	56%	0.558	S	S	.	*	H	α-helix	trans	-58.6	-44.4	173.2	-79.6	93.5	0	0	0	112.5	T494 L495 R500 H501 L502 Y579 Q583	T494-H498 WeakPolarHBondContact O-CB 3.49Å; T494-H498 PolarHBondContact O-N 2.87Å; T494-H498 PolarHBondContact O-ND1 3.44Å; L495-H498 PolarHBondContact O-N 2.94Å; H498-R500 PolarHBondContact O-N 2.87Å; H498-H501 PolarHBondContact O-N 3.49Å; H498-L502 PolarHBondContact O-N 2.71Å; H498-Y579 AromaticContact CD2-CZ 3.99Å; H498-Y579 PolarHBondContact CD2-OH 3.18Å; H498-Y579 PolarHBondContact NE2-OH 2.74Å; H498-Y579 VanDerWaalsContact NE2-OH 3.09Å; H498-Q583 PolarHBondContact NE2-NE2 2.83Å
499	L	50.2	Low	51.6	Low	88 Å²	88	105.3 Å²	105.3	46%	0.461	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-38.4	178	-77.6	168.3	0	0	0	112.2	L495 T497 H501 L502 F503	L495-L499 HydrophobicContact CD2-CD1 3.89Å; L495-L499 HydrophobicContact CD2-CG 4.19Å; L495-L499 WeakPolarHBondContact O-CB 3.37Å; L495-L499 WeakPolarHBondContact O-CG 3.39Å; L495-L499 PolarHBondContact O-N 3.48Å; T497-L499 PolarHBondContact O-N 3.18Å; L499-H501 VanDerWaalsContact C-N 3.3Å; L499-H501 PolarHBondContact O-N 3.43Å; L499-L502 HydrophobicContact CD2-CD1 4.21Å; L499-L502 PolarHBondContact O-N 2.81Å; L499-F503 VanDerWaalsContact O-CD2 3.26Å; L499-F503 WeakPolarHBondContact O-CD2 3.14Å
500	R	54.9	Low	52.2	Low	132 Å²	132	105.9 Å²	105.9	50%	0.498	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-39.8	174.8	-80.4	-173.5	166.5	100.6	-1.2	111.6	A496 T497 H498 L502 F503 T504	A496-R500 WeakPolarHBondContact O-CG 3.45Å; A496-R500 PolarHBondContact O-N 3.44Å; T497-R500 PolarHBondContact O-N 3.12Å; H498-R500 PolarHBondContact O-N 2.87Å; R500-L502 VanDerWaalsContact C-N 3.31Å; R500-L502 PolarHBondContact O-N 2.93Å; R500-F503 PolarHBondContact O-N 3.14Å; R500-F503 VanDerWaalsContact O-N 3.11Å; R500-T504 PolarHBondContact O-N 3.01Å; R500-T504 PolarHBondContact O-OG1 3.2Å; R500-T504 VanDerWaalsContact O-OG1 3.06Å
501	H	55.8	Low	53.2	Low	61 Å²	61	101.3 Å²	101.3	28%	0.282	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-31.2	178.9	-129.6	-57.4	0	0	0	113.9	T497 H498 L499 F503 T504 D576 Y579	T497-H501 PolarHBondContact O-N 3.21Å; T497-H501 VanDerWaalsContact O-N 3.09Å; H498-H501 PolarHBondContact O-N 3.49Å; L499-H501 VanDerWaalsContact C-N 3.3Å; L499-H501 PolarHBondContact O-N 3.43Å; H501-F503 PolarHBondContact O-N 3.5Å; H501-T504 WeakPolarHBondContact CA-OG1 3.39Å; H501-T504 PolarHBondContact O-N 3.4Å; H501-D576 IonicContact CE1-OD1 3.67Å; H501-D576 PolarHBondContact CE1-OD1 3.39Å; H501-D576 IonicContact NE2-OD1 3.46Å; H501-D576 PolarHBondContact NE2-OD1 2.9Å; H501-D576 VanDerWaalsContact NE2-OD1 3.09Å; H501-Y579 AromaticContact CD2-CD1 3.29Å; H501-Y579 WeakPolarHBondContact CD2-CD1 3.47Å; H501-Y579 AromaticContact CD2-CE1 3.34Å; H501-Y579 WeakPolarHBondContact CD2-CE1 3.14Å; H501-Y579 AromaticContact CD2-CG 3.65Å; H501-Y579 AromaticContact CD2-CZ 3.77Å; H501-Y579 AromaticContact CG-CE1 3.99Å; H501-Y579 AromaticContact NE2-CD1 3.37Å; H501-Y579 WeakPolarHBondContact NE2-CD1 3.26Å; H501-Y579 AromaticContact NE2-CE1 3.81Å; H501-Y579 AromaticContact NE2-CG 3.86Å
502	L	48.5	Very low	54.1	Low	138 Å²	138	98.7 Å²	98.7	72%	0.723	51%	0.507	S	S	*	.	H	α-helix	trans	-63.7	-23.9	174.7	-74.1	169.8	0	0	0	112.7	H498 L499 R500	H498-L502 PolarHBondContact O-N 2.71Å; L499-L502 HydrophobicContact CD2-CD1 4.21Å; L499-L502 PolarHBondContact O-N 2.81Å; R500-L502 VanDerWaalsContact C-N 3.31Å; R500-L502 PolarHBondContact O-N 2.93Å
503	F	48.8	Very low	55.5	Low	178 Å²	178	95.7 Å²	95.7	78%	0.781	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	1.5	177.8	-64.2	-72.8	0	0	0	113.4	L499 R500 H501 Q505	L499-F503 VanDerWaalsContact O-CD2 3.26Å; L499-F503 WeakPolarHBondContact O-CD2 3.14Å; R500-F503 PolarHBondContact O-N 3.14Å; R500-F503 VanDerWaalsContact O-N 3.11Å; H501-F503 PolarHBondContact O-N 3.5Å; F503-Q505 PolarHBondContact O-N 3.31Å
504	T	51.9	Low	56.6	Low	49 Å²	49	95.9 Å²	95.9	30%	0.301	49%	0.487	S	S	.	.	S	Bend	trans	-73.9	116.7	175.6	-51.5	0	0	0	0	109.6	R500 H501 R506 M572	R500-T504 PolarHBondContact O-N 3.01Å; R500-T504 PolarHBondContact O-OG1 3.2Å; R500-T504 VanDerWaalsContact O-OG1 3.06Å; H501-T504 WeakPolarHBondContact CA-OG1 3.39Å; H501-T504 PolarHBondContact O-N 3.4Å; T504-R506 PolarHBondContact O-N 2.9Å; T504-M572 HydrophobicContact CG2-CE 3.52Å
505	Q	47.7	Very low	58	Low	166 Å²	166	94.8 Å²	94.8	78%	0.776	49%	0.485	S	S	*	.			trans	-52.1	126.3	178.2	-173.8	172.9	-1.1	0	0	110.5	F503 V507	F503-Q505 PolarHBondContact O-N 3.31Å; Q505-V507 PolarHBondContact O-N 3.47Å
506	R	57.3	Low	59.8	Low	229 Å²	229	92.4 Å²	92.4	86%	0.864	47%	0.473	S	S	*	.			trans	-56.3	111	173.2	-71.7	-176.4	179.7	173.1	0.7	108.4	T504 D508	T504-R506 PolarHBondContact O-N 2.9Å; R506-D508 PolarHBondContact O-N 3.34Å
507	V	58.2	Low	61.6	Low	39 Å²	39	93.2 Å²	93.2	24%	0.236	47%	0.468	C	S	.	.			trans	-70.2	121.1	169.9	-178.7	0	0	0	0	106.1	Q505 K530	Q505-V507 PolarHBondContact O-N 3.47Å; V507-K530 VanDerWaalsContact C-NZ 3.3Å; V507-K530 PolarHBondContact O-NZ 3.08Å
508	D	56.4	Low	63.2	Low	107 Å²	107	90.4 Å²	90.4	57%	0.572	45%	0.45	S	S	*	.			trans	-73.6	135.5	173.9	-72.1	-37.2	0	0	0	110.5	R506 T511 K526 K530	R506-D508 PolarHBondContact O-N 3.34Å; D508-T511 HydrophobicContact CB-CG2 3.74Å; D508-K526 WeakPolarHBondContact O-CE 3.32Å; D508-K526 PolarHBondContact O-NZ 3.08Å; D508-K530 PolarHBondContact O-NZ 3.48Å
509	I	55.5	Low	65	Low	75 Å²	75	87.6 Å²	87.6	39%	0.385	44%	0.44	S	S	.	.	S	Bend	trans	-70.9	-38.2	-179.2	-48.9	-171.9	0	0	0	110.1	I527 K530	I509-I527 HydrophobicContact CG2-CG1 4.28Å; I509-K530 HydrophobicContact CB-CD 4.36Å; I509-K530 HydrophobicContact CD1-CD 3.97Å; I509-K530 HydrophobicContact CG1-CD 3.55Å; I509-K530 HydrophobicContact CG2-CD 4.42Å; I509-K530 VanDerWaalsContact N-NZ 3.19Å
510	F	56.8	Low	67.1	Low	133 Å²	133	83.4 Å²	83.4	58%	0.583	42%	0.418	S	S	*	.	S	Bend	trans	-115.5	58.5	-171.3	-56.3	-69.1	0	0	0	110.8	R396	R396-F510 HydrophobicContact CG-CE1 4.28Å
511	T	58.9	Low	69	Low	67 Å²	67	77.2 Å²	77.2	41%	0.411	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-71.6	154.9	168.4	50.5	0	0	0	0	110	D508 V513 K526	D508-T511 HydrophobicContact CB-CG2 3.74Å; T511-V513 PolarHBondContact O-N 2.92Å; T511-K526 PolarHBondContact OG1-NZ 2.82Å
512	A	63.7	Low	70.8	Confident	90 Å²	90	75.6 Å²	75.6	74%	0.744	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-51.4	132	168.2	0	0	0	0	0	109.2
513	V	71.9	Confident	72.9	Confident	18 Å²	18	69.6 Å²	69.6	11%	0.109	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-98	119.7	178.6	-179.1	0	0	0	0	106.7	V392 V395 T511 L520	V392-V513 HydrophobicContact CG2-CG2 4.35Å; V395-V513 HydrophobicContact CG2-CG1 4.13Å; V395-V513 HydrophobicContact CG2-CG2 4.35Å; T511-V513 PolarHBondContact O-N 2.92Å; V513-L520 HydrophobicContact CG1-CD2 3.76Å; V513-L520 HydrophobicContact CG1-CG 4.3Å
514	D	81.4	Confident	75.1	Confident	101 Å²	101	61.2 Å²	61.2	54%	0.54	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-69.7	145.4	173.2	-65	-37.2	0	0	0	109.9	N516 S519	D514-N516 WeakPolarHBondContact CB-ND2 3.47Å; D514-N516 PolarHBondContact O-N 3.49Å; D514-S519 PolarHBondContact N-OG 2.74Å; D514-S519 WeakPolarHBondContact O-CB 3.43Å; D514-S519 PolarHBondContact O-OG 3.41Å
515	A	84.3	Confident	77.1	Confident	41 Å²	41	59 Å²	59	34%	0.339	31%	0.309	S	S	.	.	S	Bend	trans	-76	55.6	179.8	0	0	0	0	0	112.6	L331 L391 F446	L331-A515 HydrophobicContact CD1-CB 3.38Å; L391-A515 HydrophobicContact CD1-CB 3.8Å; F446-A515 WeakPolarHBondContact CD1-O 3.25Å; F446-A515 HydrophobicContact CE1-CB 4.18Å
516	N	89.1	Confident	79.3	Confident	44 Å²	44	51.6 Å²	51.6	24%	0.235	27%	0.274	C	S	.	.	S	Bend	trans	-135.1	158.9	174.2	63.2	62.4	0	0	0	110.6	D514 E518 S519 L520	D514-N516 WeakPolarHBondContact CB-ND2 3.47Å; D514-N516 PolarHBondContact O-N 3.49Å; N516-E518 PolarHBondContact O-N 3.42Å; N516-E518 PolarHBondContact OD1-N 3.36Å; N516-S519 PolarHBondContact O-N 3.23Å; N516-S519 WeakPolarHBondContact OD1-CB 3.35Å; N516-S519 PolarHBondContact OD1-N 3.03Å; N516-L520 VanDerWaalsContact O-CG 3.29Å; N516-L520 WeakPolarHBondContact O-CG 3.46Å; N516-L520 PolarHBondContact O-N 3.3Å; N516-L520 VanDerWaalsContact O-N 3.12Å
517	R	91.5	Very high	81.1	Confident	52 Å²	52	41.6 Å²	41.6	20%	0.196	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-47.3	-174.4	174.9	177.4	169.5	-171.8	-6.7	112.2	D439 V442 F446 S519 L520 L521	D439-R517 IonicContact OD1-CZ 3.38Å; D439-R517 IonicContact OD1-NE 3.12Å; D439-R517 PolarHBondContact OD1-NE 3.02Å; D439-R517 IonicContact OD1-NH2 3.09Å; D439-R517 PolarHBondContact OD1-NH2 3.13Å; D439-R517 IonicContact OD2-CZ 2.71Å; D439-R517 IonicContact OD2-NH2 2.82Å; D439-R517 PolarHBondContact OD2-NH2 2.67Å; V442-R517 HydrophobicContact CG1-CB 4Å; V442-R517 HydrophobicContact CG1-CG 3.92Å; F446-R517 HydrophobicContact CB-CB 4.4Å; R517-S519 PolarHBondContact O-N 2.65Å; R517-L520 PolarHBondContact O-N 3.06Å; R517-L521 HydrophobicContact CG-CD1 3.82Å; R517-L521 VanDerWaalsContact O-CG 3.32Å; R517-L521 WeakPolarHBondContact O-CG 3.34Å; R517-L521 PolarHBondContact O-N 3.08Å
518	E	91	Very high	82.9	Confident	9 Å²	9	39.8 Å²	39.8	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-70	-35.6	-173.6	-59.6	80.7	-171.3	0	0	112.3	S448 N449 N516 L522 N565	S448-E518 VanDerWaalsContact CA-OE1 3.25Å; S448-E518 WeakPolarHBondContact CA-OE1 3.36Å; S448-E518 WeakPolarHBondContact CB-OE1 3.49Å; S448-E518 PolarHBondContact OG-OE1 3.05Å; N449-E518 PolarHBondContact N-OE1 3.28Å; N516-E518 PolarHBondContact O-N 3.42Å; N516-E518 PolarHBondContact OD1-N 3.36Å; E518-L522 WeakPolarHBondContact O-CB 3.47Å; E518-L522 PolarHBondContact O-N 3.41Å; E518-N565 WeakPolarHBondContact CB-ND2 3.42Å; E518-N565 WeakPolarHBondContact CG-ND2 3.33Å
519	S	91	Very high	84.7	Confident	22 Å²	22	35 Å²	35	15%	0.154	20%	0.201	C	C	.	.	H	α-helix	trans	-70.3	-39.8	175.9	-179.5	0	0	0	0	111.9	D514 N516 R517 G523	D514-S519 PolarHBondContact N-OG 2.74Å; D514-S519 WeakPolarHBondContact O-CB 3.43Å; D514-S519 PolarHBondContact O-OG 3.41Å; N516-S519 PolarHBondContact O-N 3.23Å; N516-S519 WeakPolarHBondContact OD1-CB 3.35Å; N516-S519 PolarHBondContact OD1-N 3.03Å; R517-S519 PolarHBondContact O-N 2.65Å; S519-G523 PolarHBondContact O-N 3.05Å
520	L	94	Very high	86.6	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-49.1	175.2	-69.5	167.6	0	0	0	110.9	L324 L391 F394 V395 V442 F446 V513 N516 R517 G523 V524	L324-L520 HydrophobicContact CD1-CD1 4.13Å; L391-L520 HydrophobicContact CB-CD2 4.05Å; L391-L520 HydrophobicContact CD1-CD2 4.46Å; L391-L520 HydrophobicContact CD2-CD2 4.13Å; L391-L520 HydrophobicContact CG-CD2 4.44Å; F394-L520 HydrophobicContact CD1-CD2 4.22Å; V395-L520 HydrophobicContact CG2-CB 4.47Å; V395-L520 HydrophobicContact CG2-CD2 3.75Å; V442-L520 HydrophobicContact CG1-CB 4.49Å; V442-L520 HydrophobicContact CG1-CD1 3.76Å; F446-L520 HydrophobicContact CD2-CD1 3.92Å; F446-L520 HydrophobicContact CE2-CD1 4.17Å; F446-L520 HydrophobicContact CG-CD1 4.2Å; V513-L520 HydrophobicContact CG1-CD2 3.76Å; V513-L520 HydrophobicContact CG1-CG 4.3Å; N516-L520 VanDerWaalsContact O-CG 3.29Å; N516-L520 WeakPolarHBondContact O-CG 3.46Å; N516-L520 PolarHBondContact O-N 3.3Å; N516-L520 VanDerWaalsContact O-N 3.12Å; R517-L520 PolarHBondContact O-N 3.06Å; L520-G523 PolarHBondContact O-N 3.48Å; L520-V524 PolarHBondContact O-N 2.82Å
521	L	94.6	Very high	88.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-43.6	178.8	-66.8	168.1	0	0	0	112	L438 D439 R517 G523 V524 I525 F563	L438-L521 HydrophobicContact CB-CD2 4.4Å; L438-L521 HydrophobicContact CD2-CD2 3.91Å; L438-L521 HydrophobicContact CG-CD2 4.03Å; D439-L521 HydrophobicContact CB-CD1 4.16Å; D439-L521 HydrophobicContact CB-CD2 4.31Å; D439-L521 WeakPolarHBondContact OD1-CD1 3.34Å; R517-L521 HydrophobicContact CG-CD1 3.82Å; R517-L521 VanDerWaalsContact O-CG 3.32Å; R517-L521 WeakPolarHBondContact O-CG 3.34Å; R517-L521 PolarHBondContact O-N 3.08Å; L521-G523 VanDerWaalsContact C-N 3.28Å; L521-G523 PolarHBondContact O-N 3.04Å; L521-V524 PolarHBondContact O-N 2.86Å; L521-I525 WeakPolarHBondContact O-CD1 3.38Å; L521-I525 VanDerWaalsContact O-CG1 3.26Å; L521-I525 WeakPolarHBondContact O-CG1 3.31Å; L521-I525 PolarHBondContact O-N 3.03Å; L521-F563 HydrophobicContact CB-CB 4.22Å; L521-F563 HydrophobicContact CD1-CB 4.1Å; L521-F563 HydrophobicContact CD1-CD1 4.18Å
522	L	93.3	Very high	90.2	Very high	28 Å²	28	24.6 Å²	24.6	15%	0.147	15%	0.149	C	C	.	.	H	α-helix	trans	-58.9	-40.6	174.7	179.2	61.5	0	0	0	111.4	E518 V524 I525 K526 V564 I569 I570	E518-L522 WeakPolarHBondContact O-CB 3.47Å; E518-L522 PolarHBondContact O-N 3.41Å; L522-V524 PolarHBondContact O-N 3.27Å; L522-I525 PolarHBondContact O-N 3.42Å; L522-K526 HydrophobicContact CD1-CD 4.24Å; L522-K526 HydrophobicContact CD1-CG 4.05Å; L522-K526 HydrophobicContact CG-CD 3.98Å; L522-K526 HydrophobicContact CG-CG 4.25Å; L522-K526 VanDerWaalsContact O-CB 3.3Å; L522-K526 WeakPolarHBondContact O-CB 3.36Å; L522-K526 WeakPolarHBondContact O-CG 3.46Å; L522-K526 PolarHBondContact O-N 2.89Å; L522-V564 HydrophobicContact CB-CG1 3.88Å; L522-V564 HydrophobicContact CD1-CB 4.33Å; L522-V564 HydrophobicContact CD1-CG1 3.83Å; L522-V564 HydrophobicContact CG-CG1 4.42Å; L522-I569 HydrophobicContact CD1-CG2 4.29Å; L522-I569 HydrophobicContact CD2-CD1 4.33Å; L522-I570 HydrophobicContact CD1-CD1 3.91Å
523	G	92.9	Very high	91.7	Very high	11 Å²	11	21.8 Å²	21.8	11%	0.113	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-46.3	175.4	0	0	0	0	0	112.6	V395 S519 L520 L521 K526 I527	V395-G523 VanDerWaalsContact CG1-C 3.48Å; S519-G523 PolarHBondContact O-N 3.05Å; L520-G523 PolarHBondContact O-N 3.48Å; L521-G523 VanDerWaalsContact C-N 3.28Å; L521-G523 PolarHBondContact O-N 3.04Å; G523-K526 PolarHBondContact O-N 2.79Å; G523-I527 WeakPolarHBondContact O-CG1 3.44Å; G523-I527 PolarHBondContact O-N 3.19Å
524	V	94.7	Very high	92.8	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-64.7	-47.4	177.6	171	0	0	0	0	111.1	V395 E398 L402 L435 L438 L520 L521 L522 K526 I527 G528	V395-V524 HydrophobicContact CB-CG2 4.45Å; V395-V524 HydrophobicContact CG1-CG2 4.21Å; V395-V524 HydrophobicContact CG2-CG2 4.47Å; E398-V524 HydrophobicContact CB-CG1 4.3Å; E398-V524 HydrophobicContact CB-CG2 3.89Å; L402-V524 HydrophobicContact CD2-CG1 4.07Å; L435-V524 HydrophobicContact CD2-CG1 4.23Å; L438-V524 HydrophobicContact CD2-CB 4.23Å; L438-V524 HydrophobicContact CD2-CG1 3.9Å; L438-V524 HydrophobicContact CD2-CG2 4.02Å; L520-V524 PolarHBondContact O-N 2.82Å; L521-V524 PolarHBondContact O-N 2.86Å; L522-V524 PolarHBondContact O-N 3.27Å; V524-K526 PolarHBondContact O-N 3.43Å; V524-I527 PolarHBondContact O-N 3.46Å; V524-G528 PolarHBondContact O-N 3.3Å; V524-G528 VanDerWaalsContact O-N 3.15Å
525	I	95.2	Very high	93.5	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-61.6	-42.6	178.9	-65.9	162.1	0	0	0	111	L435 L521 L522 I527 G528 L529 L560 F563 V564 I570	L435-I525 HydrophobicContact CD1-CD1 4.27Å; L435-I525 HydrophobicContact CD1-CG1 3.89Å; L435-I525 HydrophobicContact CD2-CD1 4.35Å; L435-I525 HydrophobicContact CD2-CG1 3.78Å; L521-I525 WeakPolarHBondContact O-CD1 3.38Å; L521-I525 VanDerWaalsContact O-CG1 3.26Å; L521-I525 WeakPolarHBondContact O-CG1 3.31Å; L521-I525 PolarHBondContact O-N 3.03Å; L522-I525 PolarHBondContact O-N 3.42Å; I525-I527 VanDerWaalsContact C-N 3.33Å; I525-I527 PolarHBondContact O-N 3.26Å; I525-G528 PolarHBondContact O-N 3.41Å; I525-L529 HydrophobicContact CG2-CD1 3.81Å; I525-L529 HydrophobicContact CG2-CG 4.03Å; I525-L529 WeakPolarHBondContact O-CG 3.23Å; I525-L529 PolarHBondContact O-N 2.96Å; I525-L560 HydrophobicContact CD1-CD2 4.03Å; I525-L560 HydrophobicContact CG1-CD2 4.18Å; I525-L560 HydrophobicContact CG2-CD1 4Å; I525-L560 HydrophobicContact CG2-CD2 4.24Å; I525-F563 HydrophobicContact CD1-CB 3.91Å; I525-F563 HydrophobicContact CD1-CD2 4.44Å; I525-V564 HydrophobicContact CD1-CG1 3.78Å; I525-I570 HydrophobicContact CB-CD1 4.5Å; I525-I570 HydrophobicContact CG2-CD1 3.53Å
526	K	93.5	Very high	94	Very high	12 Å²	12	18 Å²	18	5%	0.052	9%	0.093	C	C	.	.	H	α-helix	trans	-58.1	-42.4	177.4	-80.3	176	65.3	-179.8	0	112	D508 T511 L522 G523 V524 K530 I569 L573	D508-K526 WeakPolarHBondContact O-CE 3.32Å; D508-K526 PolarHBondContact O-NZ 3.08Å; T511-K526 PolarHBondContact OG1-NZ 2.82Å; L522-K526 HydrophobicContact CD1-CD 4.24Å; L522-K526 HydrophobicContact CD1-CG 4.05Å; L522-K526 HydrophobicContact CG-CD 3.98Å; L522-K526 HydrophobicContact CG-CG 4.25Å; L522-K526 VanDerWaalsContact O-CB 3.3Å; L522-K526 WeakPolarHBondContact O-CB 3.36Å; L522-K526 WeakPolarHBondContact O-CG 3.46Å; L522-K526 PolarHBondContact O-N 2.89Å; G523-K526 PolarHBondContact O-N 2.79Å; V524-K526 PolarHBondContact O-N 3.43Å; K526-K530 WeakPolarHBondContact O-CB 3.41Å; K526-K530 VanDerWaalsContact O-CG 3.31Å; K526-K530 WeakPolarHBondContact O-CG 3.37Å; K526-K530 PolarHBondContact O-N 2.86Å; K526-K530 VanDerWaalsContact O-N 3.08Å; K526-I569 HydrophobicContact CD-CG2 4.5Å; K526-I569 HydrophobicContact CG-CG2 4.44Å; K526-L573 HydrophobicContact CG-CD1 4.03Å
527	I	94.2	Very high	94.3	Very high	19 Å²	19	21.8 Å²	21.8	10%	0.097	10%	0.104	C	C	.	.	H	α-helix	trans	-65.3	-44.2	177.9	-65.4	165.9	0	0	0	110.4	V395 G399 A403 I509 G523 V524 I525 T531	V395-I527 HydrophobicContact CG1-CD1 4.05Å; V395-I527 WeakPolarHBondContact O-CD1 3.47Å; G399-I527 WeakPolarHBondContact O-CG2 3.4Å; A403-I527 HydrophobicContact CB-CG2 4.23Å; I509-I527 HydrophobicContact CG2-CG1 4.28Å; G523-I527 WeakPolarHBondContact O-CG1 3.44Å; G523-I527 PolarHBondContact O-N 3.19Å; V524-I527 PolarHBondContact O-N 3.46Å; I525-I527 VanDerWaalsContact C-N 3.33Å; I525-I527 PolarHBondContact O-N 3.26Å; I527-T531 WeakPolarHBondContact O-CB 3.32Å; I527-T531 PolarHBondContact O-N 3.46Å; I527-T531 VanDerWaalsContact O-N 3.07Å; I527-T531 PolarHBondContact O-OG1 2.87Å
528	G	95.8	Very high	94.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-53.2	177	0	0	0	0	0	112.9	L406 V524 I525 K530 T531 L532	L406-G528 WeakPolarHBondContact CD1-O 3.43Å; V524-G528 PolarHBondContact O-N 3.3Å; V524-G528 VanDerWaalsContact O-N 3.15Å; I525-G528 PolarHBondContact O-N 3.41Å; G528-K530 PolarHBondContact O-N 3.13Å; G528-T531 WeakPolarHBondContact O-CB 3.45Å; G528-T531 PolarHBondContact O-N 3.31Å; G528-L532 PolarHBondContact O-N 3.04Å
529	L	95.4	Very high	94.7	Very high	6 Å²	6	25.9 Å²	25.9	3%	0.031	13%	0.128	C	C	.	.	H	α-helix	trans	-64.3	-40	-178.1	-67.2	-176	0	0	0	112.4	I525 T531 L532 I533 L556 L560 I570 L573 L574	I525-L529 HydrophobicContact CG2-CD1 3.81Å; I525-L529 HydrophobicContact CG2-CG 4.03Å; I525-L529 WeakPolarHBondContact O-CG 3.23Å; I525-L529 PolarHBondContact O-N 2.96Å; L529-T531 VanDerWaalsContact C-N 3.31Å; L529-T531 PolarHBondContact O-N 3.47Å; L529-L532 WeakPolarHBondContact O-CA 3.3Å; L529-L532 WeakPolarHBondContact O-CB 3.3Å; L529-L532 PolarHBondContact O-N 3.05Å; L529-L532 VanDerWaalsContact O-N 3.09Å; L529-I533 WeakPolarHBondContact O-CG1 3.34Å; L529-I533 PolarHBondContact O-N 3.38Å; L529-L556 HydrophobicContact CD2-CD1 4.23Å; L529-L560 HydrophobicContact CD1-CD1 4.21Å; L529-L560 HydrophobicContact CD2-CD1 4.42Å; L529-I570 HydrophobicContact CD1-CD1 4.17Å; L529-L573 HydrophobicContact CB-CB 4.13Å; L529-L573 HydrophobicContact CB-CD1 4.27Å; L529-L573 HydrophobicContact CD1-CB 3.8Å; L529-L573 HydrophobicContact CD1-CD1 4.06Å; L529-L574 HydrophobicContact CD1-CD2 4.36Å; L529-L574 HydrophobicContact CD1-CG 4.42Å; L529-L574 HydrophobicContact CD2-CD2 3.79Å
530	K	94.2	Very high	95	Very high	31 Å²	31	27.7 Å²	27.7	14%	0.135	14%	0.138	C	C	.	.	H	α-helix	trans	-66.9	-33.2	175.4	-73.2	-175.8	175.9	172.9	0	113.5	V507 D508 I509 K526 G528 L532 I533 E534 L573	V507-K530 VanDerWaalsContact C-NZ 3.3Å; V507-K530 PolarHBondContact O-NZ 3.08Å; D508-K530 PolarHBondContact O-NZ 3.48Å; I509-K530 HydrophobicContact CB-CD 4.36Å; I509-K530 HydrophobicContact CD1-CD 3.97Å; I509-K530 HydrophobicContact CG1-CD 3.55Å; I509-K530 HydrophobicContact CG2-CD 4.42Å; I509-K530 VanDerWaalsContact N-NZ 3.19Å; K526-K530 WeakPolarHBondContact O-CB 3.41Å; K526-K530 VanDerWaalsContact O-CG 3.31Å; K526-K530 WeakPolarHBondContact O-CG 3.37Å; K526-K530 PolarHBondContact O-N 2.86Å; K526-K530 VanDerWaalsContact O-N 3.08Å; G528-K530 PolarHBondContact O-N 3.13Å; K530-L532 VanDerWaalsContact C-N 3.31Å; K530-I533 HydrophobicContact CG-CD1 4.46Å; K530-I533 PolarHBondContact O-N 3.36Å; K530-E534 PolarHBondContact O-N 2.96Å; K530-E534 VanDerWaalsContact O-N 3.15Å; K530-L573 HydrophobicContact CG-CD2 3.89Å
531	T	95.9	Very high	95.1	Very high	22 Å²	22	27.7 Å²	27.7	14%	0.135	14%	0.138	C	C	.	.	H	α-helix	trans	-64.5	-40.2	170.6	-58.7	0	0	0	0	110.7	A403 R407 I527 G528 L529 E534 C535	A403-T531 HydrophobicContact CB-CG2 3.92Å; A403-T531 VanDerWaalsContact CB-OG1 3.28Å; A403-T531 WeakPolarHBondContact CB-OG1 3.45Å; R407-T531 HydrophobicContact CB-CG2 4.27Å; I527-T531 WeakPolarHBondContact O-CB 3.32Å; I527-T531 PolarHBondContact O-N 3.46Å; I527-T531 VanDerWaalsContact O-N 3.07Å; I527-T531 PolarHBondContact O-OG1 2.87Å; G528-T531 WeakPolarHBondContact O-CB 3.45Å; G528-T531 PolarHBondContact O-N 3.31Å; L529-T531 VanDerWaalsContact C-N 3.31Å; L529-T531 PolarHBondContact O-N 3.47Å; T531-E534 PolarHBondContact O-N 3.16Å; T531-C535 WeakPolarHBondContact O-CB 3.46Å; T531-C535 PolarHBondContact O-N 2.73Å; T531-C535 PolarHBondContact O-SG 2.66Å
532	L	96.3	Very high	95.2	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-63	-41.6	176.4	-177.1	59.9	0	0	0	112.4	L406 V410 G528 L529 K530 E534 C535 A536 V577	L406-L532 HydrophobicContact CD1-CB 4.48Å; V410-L532 HydrophobicContact CG2-CD1 3.71Å; G528-L532 PolarHBondContact O-N 3.04Å; L529-L532 WeakPolarHBondContact O-CA 3.3Å; L529-L532 WeakPolarHBondContact O-CB 3.3Å; L529-L532 PolarHBondContact O-N 3.05Å; L529-L532 VanDerWaalsContact O-N 3.09Å; K530-L532 VanDerWaalsContact C-N 3.31Å; L532-E534 PolarHBondContact O-N 3.12Å; L532-C535 PolarHBondContact O-N 2.61Å; L532-A536 WeakPolarHBondContact O-CB 3.36Å; L532-A536 PolarHBondContact O-N 3.34Å; L532-V577 HydrophobicContact CB-CG2 4.28Å; L532-V577 HydrophobicContact CD2-CG1 4.02Å; L532-V577 HydrophobicContact CD2-CG2 4.05Å; L532-V577 HydrophobicContact CG-CG1 3.97Å; L532-V577 HydrophobicContact CG-CG2 4Å
533	I	95.3	Very high	95.4	Very high	31 Å²	31	31.9 Å²	31.9	16%	0.159	16%	0.155	C	C	.	.	H	α-helix	trans	-55.1	-52	172.8	-65.2	168.7	0	0	0	110.2	L529 K530 C535 A536 R537 L573 D576 V577	L529-I533 WeakPolarHBondContact O-CG1 3.34Å; L529-I533 PolarHBondContact O-N 3.38Å; K530-I533 HydrophobicContact CG-CD1 4.46Å; K530-I533 PolarHBondContact O-N 3.36Å; I533-C535 PolarHBondContact O-N 2.83Å; I533-A536 WeakPolarHBondContact O-CB 3.43Å; I533-A536 PolarHBondContact O-N 3.22Å; I533-R537 PolarHBondContact O-N 3.06Å; I533-L573 HydrophobicContact CD1-CD2 4.06Å; I533-D576 HydrophobicContact CD1-CB 3.56Å; I533-D576 HydrophobicContact CG1-CB 4.12Å; I533-V577 HydrophobicContact CB-CG2 4.44Å; I533-V577 HydrophobicContact CD1-CG2 4.43Å; I533-V577 HydrophobicContact CG1-CB 4.33Å; I533-V577 HydrophobicContact CG1-CG2 3.42Å; I533-V577 VanDerWaalsContact CG1-CG2 3.42Å
534	E	95.3	Very high	95.6	Very high	74 Å²	74	35.5 Å²	35.5	35%	0.346	17%	0.165	S	C	.	.	H	α-helix	trans	-66.1	-39.3	-179.5	179	58.4	-168.8	0	0	112.3	K530 T531 L532 A536 R537 L538	K530-E534 PolarHBondContact O-N 2.96Å; K530-E534 VanDerWaalsContact O-N 3.15Å; T531-E534 PolarHBondContact O-N 3.16Å; L532-E534 PolarHBondContact O-N 3.12Å; E534-A536 VanDerWaalsContact C-N 3.31Å; E534-A536 PolarHBondContact O-N 3.33Å; E534-R537 WeakPolarHBondContact O-CB 3.25Å; E534-R537 PolarHBondContact O-N 3.19Å; E534-R537 IonicContact OE1-CZ 2.62Å; E534-R537 IonicContact OE1-NE 3.05Å; E534-R537 PolarHBondContact OE1-NE 2.66Å; E534-R537 IonicContact OE1-NH2 2.75Å; E534-R537 PolarHBondContact OE1-NH2 2.9Å; E534-R537 IonicContact OE2-CZ 3.12Å; E534-R537 IonicContact OE2-NE 3.68Å; E534-R537 PolarHBondContact OE2-NE 3.42Å; E534-R537 IonicContact OE2-NH2 3.26Å; E534-L538 HydrophobicContact CG-CD1 4.5Å; E534-L538 WeakPolarHBondContact O-CG 3.34Å; E534-L538 PolarHBondContact O-N 3.16Å
535	C	96.8	Very high	95.6	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.027	17%	0.165	C	C	.	.	H	α-helix	trans	-62.9	-39.5	175.3	-65.9	0	0	0	0	111.3	V410 T531 L532 I533 L538 Q539	V410-C535 HydrophobicContact CB-CB 4.13Å; V410-C535 HydrophobicContact CG1-CB 3.91Å; V410-C535 HydrophobicContact CG2-CB 4.29Å; T531-C535 WeakPolarHBondContact O-CB 3.46Å; T531-C535 PolarHBondContact O-N 2.73Å; T531-C535 PolarHBondContact O-SG 2.66Å; L532-C535 PolarHBondContact O-N 2.61Å; I533-C535 PolarHBondContact O-N 2.83Å; C535-L538 PolarHBondContact O-N 3.03Å; C535-Q539 WeakPolarHBondContact O-CG 3.45Å; C535-Q539 PolarHBondContact O-N 3.44Å
536	A	94.9	Very high	95.7	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.025	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-43.5	174.2	0	0	0	0	0	111.6	L532 I533 E534 L538 Q539 F541 V581	L532-A536 WeakPolarHBondContact O-CB 3.36Å; L532-A536 PolarHBondContact O-N 3.34Å; I533-A536 WeakPolarHBondContact O-CB 3.43Å; I533-A536 PolarHBondContact O-N 3.22Å; E534-A536 VanDerWaalsContact C-N 3.31Å; E534-A536 PolarHBondContact O-N 3.33Å; A536-L538 PolarHBondContact O-N 3.2Å; A536-L538 VanDerWaalsContact O-N 3.14Å; A536-Q539 PolarHBondContact O-N 3.01Å; A536-Q539 VanDerWaalsContact O-N 3.14Å; A536-F541 HydrophobicContact CB-CE2 4.47Å; A536-F541 HydrophobicContact CB-CZ 4.3Å; A536-F541 WeakPolarHBondContact O-CE2 3.44Å; A536-V581 HydrophobicContact CB-CG2 3.64Å
537	R	95.2	Very high	95.9	Very high	122 Å²	122	35 Å²	35	46%	0.46	16%	0.163	S	C	.	.	H	α-helix	trans	-57.4	-30.4	178.4	-164.2	-170.6	66.4	74.6	0.6	113.3	I533 E534 R584	I533-R537 PolarHBondContact O-N 3.06Å; E534-R537 WeakPolarHBondContact O-CB 3.25Å; E534-R537 PolarHBondContact O-N 3.19Å; E534-R537 IonicContact OE1-CZ 2.62Å; E534-R537 IonicContact OE1-NE 3.05Å; E534-R537 PolarHBondContact OE1-NE 2.66Å; E534-R537 IonicContact OE1-NH2 2.75Å; E534-R537 PolarHBondContact OE1-NH2 2.9Å; E534-R537 IonicContact OE2-CZ 3.12Å; E534-R537 IonicContact OE2-NE 3.68Å; E534-R537 PolarHBondContact OE2-NE 3.42Å; E534-R537 IonicContact OE2-NH2 3.26Å; R537-R584 WeakPolarHBondContact O-CD 3.31Å; R537-R584 PolarHBondContact O-NE 2.98Å
538	L	95.3	Very high	96	Very high	97 Å²	97	34.4 Å²	34.4	51%	0.508	16%	0.16	S	C	.	.	H	α-helix	trans	-87.4	-10.9	-177.2	-65.2	174.6	0	0	0	114.4	E534 C535 A536	E534-L538 HydrophobicContact CG-CD1 4.5Å; E534-L538 WeakPolarHBondContact O-CG 3.34Å; E534-L538 PolarHBondContact O-N 3.16Å; C535-L538 PolarHBondContact O-N 3.03Å; A536-L538 PolarHBondContact O-N 3.2Å; A536-L538 VanDerWaalsContact O-N 3.14Å
539	Q	95.8	Very high	96	Very high	50 Å²	50	34.6 Å²	34.6	23%	0.234	16%	0.161	C	C	.	.	S	Bend	trans	-98.2	171.8	-178.5	-66.1	-62.7	-23.8	0	0	111.8	V410 C535 A536 F541 R584	V410-Q539 HydrophobicContact CG1-CG 3.7Å; C535-Q539 WeakPolarHBondContact O-CG 3.45Å; C535-Q539 PolarHBondContact O-N 3.44Å; A536-Q539 PolarHBondContact O-N 3.01Å; A536-Q539 VanDerWaalsContact O-N 3.14Å; Q539-F541 HydrophobicContact CB-CD2 4.36Å; Q539-F541 HydrophobicContact CB-CE2 3.62Å; Q539-F541 HydrophobicContact CB-CZ 3.76Å; Q539-R584 WeakPolarHBondContact O-CB 3.41Å; Q539-R584 PolarHBondContact O-NE 2.8Å; Q539-R584 PolarHBondContact O-NH2 3.18Å; Q539-R584 VanDerWaalsContact O-NH2 3.1Å
540	T	96.3	Very high	96.1	Very high	61 Å²	61	35.4 Å²	35.4	37%	0.374	17%	0.165	S	C	.	.			trans	-124.2	129.5	169.3	-59.1	0	0	0	0	107.9	W415 R584 I586	W415-T540 WeakPolarHBondContact CB-O 3.28Å; T540-R584 PolarHBondContact OG1-NH2 3.49Å; T540-I586 HydrophobicContact CG2-CD1 4.02Å; T540-I586 HydrophobicContact CG2-CG1 3.98Å
541	F	97.1	Very high	96.2	Very high	1 Å²	1	33.9 Å²	33.9	0%	0.004	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-111	140.9	-171.9	-62.3	-98.7	0	0	0	111.8	W415 A536 Q539 I549 V581 R584 C585 I586	W415-F541 HydrophobicContact CB-CD1 3.63Å; W415-F541 HydrophobicContact CB-CE1 3.98Å; W415-F541 HydrophobicContact CB-CG 4.16Å; W415-F541 AromaticContact CD2-CD1 3.74Å; W415-F541 HydrophobicContact CD2-CD1 3.74Å; W415-F541 AromaticContact CD2-CE1 3.34Å; W415-F541 HydrophobicContact CD2-CE1 3.34Å; W415-F541 HydrophobicContact CD2-CZ 4.3Å; W415-F541 AromaticContact CE2-CE1 3.97Å; W415-F541 AromaticContact CE3-CD1 3.58Å; W415-F541 HydrophobicContact CE3-CD1 3.58Å; W415-F541 AromaticContact CE3-CE1 3.41Å; W415-F541 HydrophobicContact CE3-CE1 3.41Å; W415-F541 VanDerWaalsContact CE3-CE1 3.41Å; W415-F541 AromaticContact CG-CD1 3.77Å; W415-F541 HydrophobicContact CG-CD1 3.77Å; W415-F541 AromaticContact CG-CE1 3.59Å; W415-F541 HydrophobicContact CG-CE1 3.59Å; W415-F541 HydrophobicContact CG-CZ 4.32Å; W415-F541 HydrophobicContact CZ3-CD1 4.47Å; W415-F541 HydrophobicContact CZ3-CE1 4.07Å; A536-F541 HydrophobicContact CB-CE2 4.47Å; A536-F541 HydrophobicContact CB-CZ 4.3Å; A536-F541 WeakPolarHBondContact O-CE2 3.44Å; Q539-F541 HydrophobicContact CB-CD2 4.36Å; Q539-F541 HydrophobicContact CB-CE2 3.62Å; Q539-F541 HydrophobicContact CB-CZ 3.76Å; F541-I549 HydrophobicContact CE1-CG1 3.93Å; F541-V581 HydrophobicContact CB-CG1 4.23Å; F541-V581 HydrophobicContact CD1-CG1 3.74Å; F541-V581 HydrophobicContact CD2-CB 4.46Å; F541-V581 HydrophobicContact CD2-CG1 3.83Å; F541-V581 HydrophobicContact CE1-CG1 3.99Å; F541-V581 HydrophobicContact CE1-CG2 4.17Å; F541-V581 HydrophobicContact CE2-CB 4.35Å; F541-V581 HydrophobicContact CE2-CG1 4.06Å; F541-V581 HydrophobicContact CE2-CG2 4.02Å; F541-V581 HydrophobicContact CG-CG1 3.67Å; F541-V581 HydrophobicContact CZ-CG1 4.16Å; F541-V581 HydrophobicContact CZ-CG2 3.81Å; F541-R584 HydrophobicContact CD2-CB 3.86Å; F541-R584 HydrophobicContact CE2-CB 4.2Å; F541-R584 PolarHBondContact N-O 2.98Å; F541-C585 HydrophobicContact CB-CB 4.15Å; F541-C585 CarbonylContact O-C 3.6Å; F541-C585 VanDerWaalsContact O-CA 3.28Å; F541-C585 WeakPolarHBondContact O-CA 3.31Å; F541-C585 PolarHBondContact O-SG 3.38Å; F541-I586 PolarHBondContact O-N 3.45Å
542	G	96.8	Very high	96.3	Very high	9 Å²	9	33 Å²	33	9%	0.093	15%	0.152	C	C	.	.			trans	-86.7	176.1	159.5	0	0	0	0	0	110.8	W415 Y544 G545 L546	W415-G542 PolarHBondContact O-N 3.34Å; G542-Y544 PolarHBondContact O-N 2.9Å; G542-G545 WeakPolarHBondContact O-CA 3.46Å; G542-G545 PolarHBondContact O-N 2.97Å; G542-L546 PolarHBondContact O-N 3.47Å
543	R	95.8	Very high	96.3	Very high	107 Å²	107	33.1 Å²	33.1	40%	0.404	15%	0.154	S	C	.	.	H	α-helix	trans	-49.2	-53.8	176.4	174.2	173.4	179.6	-168.6	1.5	112.8	G545 L546 Q547 C589	R543-G545 PolarHBondContact O-N 2.78Å; R543-L546 PolarHBondContact O-N 2.97Å; R543-Q547 WeakPolarHBondContact O-CG 3.33Å; R543-Q547 PolarHBondContact O-N 3.29Å; R543-C589 HydrophobicContact CG-CB 4Å; R543-C589 PolarHBondContact NE-SG 3.34Å; R543-C589 VanDerWaalsContact NE-SG 3.45Å
544	Y	96.9	Very high	96.2	Very high	87 Å²	87	32.8 Å²	32.8	34%	0.341	15%	0.151	S	C	.	.	H	α-helix	trans	-70.4	-20.5	179.1	-60.6	-52.7	0	0	0	113.3	N418 E420 G542 Q548	N418-Y544 PolarHBondContact ND2-O 3.26Å; N418-Y544 WeakPolarHBondContact O-CB 3.28Å; N418-Y544 WeakPolarHBondContact O-CD2 3.23Å; E420-Y544 HydrophobicContact CB-CD1 3.88Å; E420-Y544 HydrophobicContact CB-CE1 3.74Å; E420-Y544 HydrophobicContact CB-CG 4.42Å; E420-Y544 HydrophobicContact CG-CD1 4.06Å; E420-Y544 HydrophobicContact CG-CE1 3.77Å; G542-Y544 PolarHBondContact O-N 2.9Å; Y544-Q548 WeakPolarHBondContact O-CB 3.22Å; Y544-Q548 PolarHBondContact O-N 3.46Å
545	G	96.7	Very high	96.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-51.4	168.8	0	0	0	0	0	111.6	G542 R543 Q548 I549	G542-G545 WeakPolarHBondContact O-CA 3.46Å; G542-G545 PolarHBondContact O-N 2.97Å; R543-G545 PolarHBondContact O-N 2.78Å; G545-Q548 PolarHBondContact O-N 3.06Å; G545-I549 PolarHBondContact O-N 3.47Å
546	L	96.4	Very high	96.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-49	175	171.1	66.5	0	0	0	111.4	G542 R543 Q548 I549 Q550 V581 V582 P588 F590	G542-L546 PolarHBondContact O-N 3.47Å; R543-L546 PolarHBondContact O-N 2.97Å; L546-Q548 VanDerWaalsContact C-N 3.3Å; L546-Q548 PolarHBondContact O-N 3.28Å; L546-I549 PolarHBondContact O-N 3Å; L546-I549 VanDerWaalsContact O-N 3.15Å; L546-Q550 PolarHBondContact O-N 3.02Å; L546-V581 HydrophobicContact CB-CG1 4.11Å; L546-V581 HydrophobicContact CD1-CB 4.14Å; L546-V581 HydrophobicContact CD1-CG1 3.54Å; L546-V581 HydrophobicContact CG-CG1 4.44Å; L546-V582 HydrophobicContact CD1-CG2 3.75Å; L546-V582 HydrophobicContact CD2-CG2 4.38Å; L546-P588 HydrophobicContact CD2-CB 4.04Å; L546-F590 HydrophobicContact CD1-CE1 4.25Å
547	Q	97	Very high	96.1	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.028	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-34.9	-179.1	-66.2	178.2	-6.1	0	0	112.6	P421 R543 Q550 V551 C589 M591	P421-Q547 HydrophobicContact CG-CB 3.73Å; R543-Q547 WeakPolarHBondContact O-CG 3.33Å; R543-Q547 PolarHBondContact O-N 3.29Å; Q547-Q550 WeakPolarHBondContact O-CB 3.39Å; Q547-Q550 PolarHBondContact O-N 3.24Å; Q547-V551 WeakPolarHBondContact O-CG2 3.37Å; Q547-V551 PolarHBondContact O-N 3.34Å; Q547-C589 VanDerWaalsContact CG-O 3.31Å; Q547-C589 WeakPolarHBondContact CG-O 3.31Å; Q547-C589 PolarHBondContact NE2-O 3.23Å; Q547-M591 HydrophobicContact CB-CB 4.3Å; Q547-M591 HydrophobicContact CB-CE 4.23Å; Q547-M591 HydrophobicContact CG-CB 4Å
548	Q	97.3	Very high	96	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.033	13%	0.129	C	C	.	.	H	α-helix	trans	-65.6	-42.1	175.1	-175.3	64.6	62.1	0	0	111.5	W415 P421 T423 R425 Y544 G545 L546 Q550 V551 D552	W415-Q548 HydrophobicContact CZ3-CB 4.31Å; W415-Q548 HydrophobicContact CZ3-CG 4.39Å; P421-Q548 HydrophobicContact CB-CB 4.48Å; P421-Q548 HydrophobicContact CG-CB 3.92Å; P421-Q548 VanDerWaalsContact CG-N 3.32Å; T423-Q548 PolarHBondContact O-NE2 3.37Å; R425-Q548 HydrophobicContact CG-CG 4.07Å; Y544-Q548 WeakPolarHBondContact O-CB 3.22Å; Y544-Q548 PolarHBondContact O-N 3.46Å; G545-Q548 PolarHBondContact O-N 3.06Å; L546-Q548 VanDerWaalsContact C-N 3.3Å; L546-Q548 PolarHBondContact O-N 3.28Å; Q548-Q550 VanDerWaalsContact C-N 3.33Å; Q548-V551 PolarHBondContact O-N 2.93Å; Q548-D552 PolarHBondContact NE2-OD1 3.25Å; Q548-D552 PolarHBondContact O-N 3.49Å
549	I	96.5	Very high	95.8	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-67.4	-35.7	175.9	-61.9	-65.9	0	0	0	111.1	W415 F541 G545 L546 V551 D552 C553 V577 I578 V581	W415-I549 HydrophobicContact CE3-CG1 4.34Å; W415-I549 HydrophobicContact CH2-CD1 3.26Å; W415-I549 HydrophobicContact CH2-CG1 3.92Å; W415-I549 HydrophobicContact CZ2-CD1 4.05Å; W415-I549 HydrophobicContact CZ3-CD1 3.55Å; W415-I549 HydrophobicContact CZ3-CG1 3.63Å; F541-I549 HydrophobicContact CE1-CG1 3.93Å; G545-I549 PolarHBondContact O-N 3.47Å; L546-I549 PolarHBondContact O-N 3Å; L546-I549 VanDerWaalsContact O-N 3.15Å; I549-V551 PolarHBondContact O-N 3Å; I549-D552 PolarHBondContact O-N 3.3Å; I549-C553 WeakPolarHBondContact O-CB 3.4Å; I549-C553 PolarHBondContact O-N 3.02Å; I549-C553 PolarHBondContact O-SG 3.23Å; I549-V577 HydrophobicContact CG2-CG1 3.88Å; I549-I578 HydrophobicContact CG2-CD1 4.06Å; I549-V581 HydrophobicContact CB-CG1 4.5Å; I549-V581 HydrophobicContact CB-CG2 4.24Å; I549-V581 HydrophobicContact CG1-CG1 4.48Å; I549-V581 HydrophobicContact CG1-CG2 4.13Å; I549-V581 HydrophobicContact CG2-CG2 3.89Å
550	Q	96.6	Very high	95.7	Very high	22 Å²	22	22.9 Å²	22.9	10%	0.103	11%	0.106	C	C	.	.	H	α-helix	trans	-56.3	-49.6	172.4	-175.2	-172.8	0.7	0	0	111.3	L546 Q547 Q548 C553 R554 I578 F590 M591 V596	L546-Q550 PolarHBondContact O-N 3.02Å; Q547-Q550 WeakPolarHBondContact O-CB 3.39Å; Q547-Q550 PolarHBondContact O-N 3.24Å; Q548-Q550 VanDerWaalsContact C-N 3.33Å; Q550-C553 PolarHBondContact O-N 2.86Å; Q550-R554 WeakPolarHBondContact O-CB 3.17Å; Q550-R554 PolarHBondContact O-N 3.37Å; Q550-I578 HydrophobicContact CB-CD1 4.3Å; Q550-F590 HydrophobicContact CG-CD1 4.29Å; Q550-M591 PolarHBondContact NE2-O 2.65Å; Q550-V596 HydrophobicContact CG-CG2 4.25Å
551	V	96.8	Very high	95.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.8	-46.6	175.9	170.3	0	0	0	0	111.6	P421 V424 Q547 Q548 I549 R554 Y555 M591 V596 I599	P421-V551 HydrophobicContact CB-CG2 4.21Å; V424-V551 HydrophobicContact CG2-CG1 3.87Å; Q547-V551 WeakPolarHBondContact O-CG2 3.37Å; Q547-V551 PolarHBondContact O-N 3.34Å; Q548-V551 PolarHBondContact O-N 2.93Å; I549-V551 PolarHBondContact O-N 3Å; V551-R554 PolarHBondContact O-N 2.89Å; V551-Y555 PolarHBondContact O-N 3.19Å; V551-M591 HydrophobicContact CG2-SD 4.25Å; V551-V596 HydrophobicContact CG2-CG1 4.2Å; V551-V596 HydrophobicContact CG2-CG2 4.33Å; V551-I599 HydrophobicContact CG1-CB 4.37Å; V551-I599 HydrophobicContact CG1-CG2 3.63Å; V551-I599 HydrophobicContact CG2-CD1 4.11Å
552	D	96.9	Very high	94.8	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-64.1	-42.5	179.9	-68.9	-17.3	0	0	0	112.8	R425 V428 Q548 I549 Y555 L556	R425-D552 IonicContact CZ-OD2 3.61Å; R425-D552 PolarHBondContact N-OD1 3.25Å; R425-D552 VanDerWaalsContact N-OD1 3.15Å; R425-D552 IonicContact NE-OD2 3.72Å; R425-D552 PolarHBondContact NE-OD2 3.36Å; R425-D552 IonicContact NH2-OD2 3.65Å; R425-D552 PolarHBondContact NH2-OD2 2.95Å; V428-D552 HydrophobicContact CG2-CB 3.86Å; Q548-D552 PolarHBondContact NE2-OD1 3.25Å; Q548-D552 PolarHBondContact O-N 3.49Å; I549-D552 PolarHBondContact O-N 3.3Å; D552-Y555 PolarHBondContact O-N 3.27Å; D552-L556 WeakPolarHBondContact O-CG 3.28Å; D552-L556 PolarHBondContact O-N 3.46Å
553	C	96.2	Very high	94.4	Very high	8 Å²	8	25.6 Å²	25.6	5%	0.054	11%	0.11	C	C	.	.	H	α-helix	trans	-67	-38.5	178.6	-68.1	0	0	0	0	111.2	I549 Q550 L556 Q557 L574 I578	I549-C553 WeakPolarHBondContact O-CB 3.4Å; I549-C553 PolarHBondContact O-N 3.02Å; I549-C553 PolarHBondContact O-SG 3.23Å; Q550-C553 PolarHBondContact O-N 2.86Å; C553-L556 PolarHBondContact O-N 2.97Å; C553-Q557 WeakPolarHBondContact O-CB 3.48Å; C553-Q557 PolarHBondContact O-N 3.45Å; C553-L574 HydrophobicContact CB-CD2 4.29Å; C553-I578 HydrophobicContact CB-CD1 3.94Å; C553-I578 HydrophobicContact CB-CG1 4.12Å
554	R	94.1	Very high	93.9	Very high	24 Å²	24	20.6 Å²	20.6	9%	0.091	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-45.1	174.1	-178.3	55.4	169.1	-173.5	-9.8	111.1	R463 Q550 V551 L556 Q557 I558 E593 V596 E597	R463-R554 PolarHBondContact O-NH1 2.83Å; Q550-R554 WeakPolarHBondContact O-CB 3.17Å; Q550-R554 PolarHBondContact O-N 3.37Å; V551-R554 PolarHBondContact O-N 2.89Å; R554-L556 PolarHBondContact O-N 2.96Å; R554-Q557 WeakPolarHBondContact O-CB 3.05Å; R554-Q557 PolarHBondContact O-N 2.71Å; R554-I558 HydrophobicContact CG-CD1 4.09Å; R554-I558 VanDerWaalsContact O-CG1 3.31Å; R554-I558 WeakPolarHBondContact O-CG1 3.2Å; R554-I558 PolarHBondContact O-N 2.88Å; R554-E593 IonicContact CZ-OE1 3.49Å; R554-E593 IonicContact NE-OE1 2.83Å; R554-E593 PolarHBondContact NE-OE1 3.17Å; R554-E593 IonicContact NH2-OE1 3.9Å; R554-V596 HydrophobicContact CB-CG1 3.68Å; R554-V596 HydrophobicContact CG-CG1 3.8Å; R554-E597 IonicContact CZ-OE1 3.95Å; R554-E597 IonicContact NH2-OE1 2.65Å; R554-E597 PolarHBondContact NH2-OE1 2.88Å
555	Y	96.3	Very high	93.3	Very high	19 Å²	19	20.5 Å²	20.5	8%	0.075	10%	0.097	C	C	.	.	H	α-helix	trans	-60.7	-45.5	175.9	-172.2	-95.4	0	0	0	112.2	V424 V428 K429 I432 V551 D552 Q557 I558 H559 C600 A603	V424-Y555 HydrophobicContact CB-CD2 4.37Å; V424-Y555 HydrophobicContact CB-CG 4.3Å; V424-Y555 HydrophobicContact CG1-CD1 3.74Å; V424-Y555 HydrophobicContact CG1-CD2 4.23Å; V424-Y555 HydrophobicContact CG1-CE1 4.24Å; V424-Y555 HydrophobicContact CG1-CG 3.69Å; V424-Y555 HydrophobicContact CG2-CD2 3.61Å; V424-Y555 HydrophobicContact CG2-CE2 4.27Å; V424-Y555 HydrophobicContact CG2-CG 3.77Å; V428-Y555 HydrophobicContact CG1-CD1 3.8Å; V428-Y555 HydrophobicContact CG1-CE1 4.49Å; K429-Y555 HydrophobicContact CG-CE1 4.23Å; I432-Y555 HydrophobicContact CG1-CD1 4.49Å; I432-Y555 HydrophobicContact CG1-CE1 3.99Å; V551-Y555 PolarHBondContact O-N 3.19Å; D552-Y555 PolarHBondContact O-N 3.27Å; Y555-Q557 VanDerWaalsContact C-N 3.33Å; Y555-Q557 PolarHBondContact O-N 3.41Å; Y555-I558 PolarHBondContact O-N 3.37Å; Y555-H559 AromaticContact CD1-CD2 3.81Å; Y555-H559 AromaticContact CD2-CD2 3.92Å; Y555-H559 AromaticContact CD2-NE2 3.92Å; Y555-H559 AromaticContact CE1-CD2 3.55Å; Y555-H559 AromaticContact CE1-NE2 3.95Å; Y555-H559 AromaticContact CE2-CD2 3.65Å; Y555-H559 AromaticContact CE2-NE2 3.31Å; Y555-H559 VanDerWaalsContact CE2-NE2 3.31Å; Y555-H559 WeakPolarHBondContact CE2-NE2 3.28Å; Y555-H559 AromaticContact CZ-CD2 3.46Å; Y555-H559 VanDerWaalsContact CZ-CD2 3.46Å; Y555-H559 AromaticContact CZ-NE2 3.34Å; Y555-H559 VanDerWaalsContact CZ-NE2 3.34Å; Y555-H559 PolarHBondContact O-CD2 3.3Å; Y555-H559 VanDerWaalsContact O-CD2 3.28Å; Y555-H559 PolarHBondContact O-N 3.16Å; Y555-C600 HydrophobicContact CD2-CB 4.33Å; Y555-A603 HydrophobicContact CD2-CB 4.23Å; Y555-A603 HydrophobicContact CE2-CB 3.83Å
556	L	95.9	Very high	92.6	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-58.6	-43.7	173.7	-73.4	174.8	0	0	0	111.7	V428 V431 I432 L529 D552 C553 R554 I558 H559 L560 L574	V428-L556 HydrophobicContact CG1-CD1 4.38Å; V428-L556 HydrophobicContact CG1-CD2 3.72Å; V428-L556 HydrophobicContact CG1-CG 3.71Å; V431-L556 HydrophobicContact CG1-CD2 4.04Å; I432-L556 HydrophobicContact CD1-CD2 3.89Å; I432-L556 HydrophobicContact CG1-CD2 4.47Å; L529-L556 HydrophobicContact CD2-CD1 4.23Å; D552-L556 WeakPolarHBondContact O-CG 3.28Å; D552-L556 PolarHBondContact O-N 3.46Å; C553-L556 PolarHBondContact O-N 2.97Å; R554-L556 PolarHBondContact O-N 2.96Å; L556-I558 VanDerWaalsContact C-N 3.3Å; L556-I558 PolarHBondContact O-N 3.22Å; L556-H559 PolarHBondContact O-N 3.28Å; L556-L560 HydrophobicContact CB-CD1 3.97Å; L556-L560 HydrophobicContact CB-CG 4.35Å; L556-L560 HydrophobicContact CD2-CD1 4.32Å; L556-L560 HydrophobicContact CD2-CG 4.41Å; L556-L560 VanDerWaalsContact O-CB 3.22Å; L556-L560 WeakPolarHBondContact O-CB 3.38Å; L556-L560 WeakPolarHBondContact O-CG 3.41Å; L556-L560 PolarHBondContact O-N 3.02Å; L556-L574 HydrophobicContact CB-CD1 4.34Å; L556-L574 HydrophobicContact CB-CD2 4.09Å; L556-L574 HydrophobicContact CD1-CD2 4.08Å
557	Q	92.8	Very high	92	Very high	16 Å²	16	26 Å²	26	8%	0.075	13%	0.125	C	C	.	.	H	α-helix	trans	-59.3	-40.7	177.6	-167.8	-177.1	31	0	0	112.1	C553 R554 Y555 H559 C571 L574	C553-Q557 WeakPolarHBondContact O-CB 3.48Å; C553-Q557 PolarHBondContact O-N 3.45Å; R554-Q557 WeakPolarHBondContact O-CB 3.05Å; R554-Q557 PolarHBondContact O-N 2.71Å; Y555-Q557 VanDerWaalsContact C-N 3.33Å; Y555-Q557 PolarHBondContact O-N 3.41Å; Q557-H559 VanDerWaalsContact C-N 3.31Å; Q557-H559 PolarHBondContact O-N 2.7Å; Q557-C571 PolarHBondContact NE2-SG 2.71Å; Q557-C571 VanDerWaalsContact NE2-SG 3.41Å; Q557-L574 HydrophobicContact CB-CD1 3.74Å; Q557-L574 HydrophobicContact CG-CD1 4.32Å
558	I	91.9	Very high	91.5	Very high	51 Å²	51	33.4 Å²	33.4	26%	0.262	16%	0.157	S	C	.	.	H	α-helix	trans	-65.2	-33.8	179.2	-68.4	163.4	0	0	0	111.8	R554 Y555 L556 W561 C600	R554-I558 HydrophobicContact CG-CD1 4.09Å; R554-I558 VanDerWaalsContact O-CG1 3.31Å; R554-I558 WeakPolarHBondContact O-CG1 3.2Å; R554-I558 PolarHBondContact O-N 2.88Å; Y555-I558 PolarHBondContact O-N 3.37Å; L556-I558 VanDerWaalsContact C-N 3.3Å; L556-I558 PolarHBondContact O-N 3.22Å; I558-W561 PolarHBondContact O-NE1 3.26Å; I558-C600 HydrophobicContact CD1-CB 3.77Å
559	H	92.8	Very high	91.1	Very high	52 Å²	52	34.9 Å²	34.9	24%	0.241	17%	0.165	C	C	.	.	H	α-helix	trans	-100.5	-35	-173.9	-71.7	-72.1	0	0	0	114.3	I432 Y555 L556 Q557 W561 H562	I432-H559 HydrophobicContact CD1-CB 3.6Å; I432-H559 HydrophobicContact CG1-CB 3.95Å; I432-H559 HydrophobicContact CG2-CB 4.1Å; Y555-H559 AromaticContact CD1-CD2 3.81Å; Y555-H559 AromaticContact CD2-CD2 3.92Å; Y555-H559 AromaticContact CD2-NE2 3.92Å; Y555-H559 AromaticContact CE1-CD2 3.55Å; Y555-H559 AromaticContact CE1-NE2 3.95Å; Y555-H559 AromaticContact CE2-CD2 3.65Å; Y555-H559 AromaticContact CE2-NE2 3.31Å; Y555-H559 VanDerWaalsContact CE2-NE2 3.31Å; Y555-H559 WeakPolarHBondContact CE2-NE2 3.28Å; Y555-H559 AromaticContact CZ-CD2 3.46Å; Y555-H559 VanDerWaalsContact CZ-CD2 3.46Å; Y555-H559 AromaticContact CZ-NE2 3.34Å; Y555-H559 VanDerWaalsContact CZ-NE2 3.34Å; Y555-H559 PolarHBondContact O-CD2 3.3Å; Y555-H559 VanDerWaalsContact O-CD2 3.28Å; Y555-H559 PolarHBondContact O-N 3.16Å; L556-H559 PolarHBondContact O-N 3.28Å; Q557-H559 VanDerWaalsContact C-N 3.31Å; Q557-H559 PolarHBondContact O-N 2.7Å; H559-W561 VanDerWaalsContact C-N 3.29Å; H559-W561 PolarHBondContact O-N 3.4Å; H559-H562 PolarHBondContact O-N 2.81Å; H559-H562 PolarHBondContact O-ND1 2.98Å
560	L	93.3	Very high	90.8	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-25.3	-171.3	-72.4	179.1	0	0	0	114.2	I432 L435 I525 L529 L556 H562 F563 I570	I432-L560 HydrophobicContact CD1-CD2 4Å; I432-L560 HydrophobicContact CD1-CG 4.38Å; L435-L560 HydrophobicContact CD1-CD2 3.37Å; I525-L560 HydrophobicContact CD1-CD2 4.03Å; I525-L560 HydrophobicContact CG1-CD2 4.18Å; I525-L560 HydrophobicContact CG2-CD1 4Å; I525-L560 HydrophobicContact CG2-CD2 4.24Å; L529-L560 HydrophobicContact CD1-CD1 4.21Å; L529-L560 HydrophobicContact CD2-CD1 4.42Å; L556-L560 HydrophobicContact CB-CD1 3.97Å; L556-L560 HydrophobicContact CB-CG 4.35Å; L556-L560 HydrophobicContact CD2-CD1 4.32Å; L556-L560 HydrophobicContact CD2-CG 4.41Å; L556-L560 VanDerWaalsContact O-CB 3.22Å; L556-L560 WeakPolarHBondContact O-CB 3.38Å; L556-L560 WeakPolarHBondContact O-CG 3.41Å; L556-L560 PolarHBondContact O-N 3.02Å; L560-H562 PolarHBondContact O-N 3.44Å; L560-H562 VanDerWaalsContact O-N 3.16Å; L560-F563 HydrophobicContact CD2-CD2 4.33Å; L560-F563 PolarHBondContact O-N 2.89Å; L560-F563 VanDerWaalsContact O-N 3.12Å; L560-I570 HydrophobicContact CB-CG2 3.99Å; L560-I570 HydrophobicContact CD1-CG2 3.91Å
561	W	87.4	Confident	90.5	Very high	35 Å²	35	34.9 Å²	34.9	13%	0.133	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-62.7	-22.4	-178.6	74.3	-91.3	0	0	0	113.4	R455 I558 H559 F563 V564 E567	R455-W561 HydrophobicContact CB-CH2 4.11Å; R455-W561 HydrophobicContact CB-CZ3 4.24Å; I558-W561 PolarHBondContact O-NE1 3.26Å; H559-W561 VanDerWaalsContact C-N 3.29Å; H559-W561 PolarHBondContact O-N 3.4Å; W561-F563 PolarHBondContact O-N 3.49Å; W561-V564 VanDerWaalsContact O-O 3.12Å; W561-E567 HydrophobicContact CB-CG 4.38Å
562	H	85.9	Confident	90.2	Very high	82 Å²	82	37.9 Å²	37.9	38%	0.38	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-66.3	-25.8	177.4	-60.4	91.8	0	0	0	112.7	H559 L560	H559-H562 PolarHBondContact O-N 2.81Å; H559-H562 PolarHBondContact O-ND1 2.98Å; L560-H562 PolarHBondContact O-N 3.44Å; L560-H562 VanDerWaalsContact O-N 3.16Å
563	F	88.8	Confident	90	Very high	11 Å²	11	37.8 Å²	37.8	5%	0.048	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-94.1	-12.9	-174.3	-55.4	-69.3	0	0	0	113.7	L435 V436 D439 L521 I525 L560 W561	L435-F563 HydrophobicContact CB-CD2 4.38Å; L435-F563 HydrophobicContact CB-CE1 4.19Å; L435-F563 HydrophobicContact CB-CE2 3.89Å; L435-F563 HydrophobicContact CB-CZ 3.78Å; L435-F563 HydrophobicContact CD1-CD2 4.4Å; L435-F563 HydrophobicContact CD1-CE2 4.3Å; V436-F563 HydrophobicContact CG2-CE1 4.32Å; V436-F563 HydrophobicContact CG2-CZ 3.86Å; D439-F563 HydrophobicContact CB-CD1 3.89Å; D439-F563 HydrophobicContact CB-CE1 3.76Å; L521-F563 HydrophobicContact CB-CB 4.22Å; L521-F563 HydrophobicContact CD1-CB 4.1Å; L521-F563 HydrophobicContact CD1-CD1 4.18Å; I525-F563 HydrophobicContact CD1-CB 3.91Å; I525-F563 HydrophobicContact CD1-CD2 4.44Å; L560-F563 HydrophobicContact CD2-CD2 4.33Å; L560-F563 PolarHBondContact O-N 2.89Å; L560-F563 VanDerWaalsContact O-N 3.12Å; W561-F563 PolarHBondContact O-N 3.49Å
564	V	86.3	Confident	89.9	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.018	18%	0.18	C	C	.	.			trans	-132.4	150.7	-168.8	-54.2	0	0	0	0	112.3	N452 L522 I525 W561 I570	N452-V564 PolarHBondContact ND2-O 3.04Å; L522-V564 HydrophobicContact CB-CG1 3.88Å; L522-V564 HydrophobicContact CD1-CB 4.33Å; L522-V564 HydrophobicContact CD1-CG1 3.83Å; L522-V564 HydrophobicContact CG-CG1 4.42Å; I525-V564 HydrophobicContact CD1-CG1 3.78Å; W561-V564 VanDerWaalsContact O-O 3.12Å; V564-I570 HydrophobicContact CG1-CD1 4.44Å; V564-I570 HydrophobicContact CG2-CD1 4.47Å; V564-I570 HydrophobicContact CG2-CG1 3.69Å
565	N	83.6	Confident	89.8	Confident	84 Å²	84	40.8 Å²	40.8	45%	0.449	20%	0.196	S	C	.	.	S	Bend	trans	-85.3	-36.1	174.4	-71.3	-40.1	0	0	0	112.6	E518 E567	E518-N565 WeakPolarHBondContact CB-ND2 3.42Å; E518-N565 WeakPolarHBondContact CG-ND2 3.33Å; N565-E567 PolarHBondContact O-N 3.37Å
566	D	81.7	Confident	89.6	Confident	67 Å²	67	41.3 Å²	41.3	36%	0.358	20%	0.2	S	C	.	.			trans	-98.9	88.1	-178.8	-167.4	-7.9	0	0	0	111.1	K568 I569	D566-K568 PolarHBondContact O-N 2.83Å; D566-K568 VanDerWaalsContact OD1-CB 3.3Å; D566-K568 WeakPolarHBondContact OD1-CB 3.34Å; D566-K568 PolarHBondContact OD1-N 3.01Å; D566-I569 HydrophobicContact CB-CD1 4.04Å; D566-I569 HydrophobicContact CB-CG1 4.34Å; D566-I569 PolarHBondContact O-N 3.39Å; D566-I569 VanDerWaalsContact OD2-CD1 3.3Å; D566-I569 WeakPolarHBondContact OD2-CD1 3.32Å; D566-I569 WeakPolarHBondContact OD2-CG1 3.47Å
567	E	85.1	Confident	89.6	Confident	50 Å²	50	41.3 Å²	41.3	23%	0.234	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-27.5	176.5	-169.3	-170.9	156.6	0	0	112.5	R463 W561 N565 I569 I570 C571	R463-E567 IonicContact CZ-OE1 2.88Å; R463-E567 IonicContact CZ-OE2 2.7Å; R463-E567 IonicContact NE-OE1 3.14Å; R463-E567 PolarHBondContact NE-OE1 3.35Å; R463-E567 IonicContact NE-OE2 2.99Å; R463-E567 IonicContact NH2-OE1 2.63Å; R463-E567 PolarHBondContact NH2-OE1 2.9Å; R463-E567 IonicContact NH2-OE2 2.71Å; R463-E567 PolarHBondContact NH2-OE2 3.3Å; W561-E567 HydrophobicContact CB-CG 4.38Å; N565-E567 PolarHBondContact O-N 3.37Å; E567-I569 VanDerWaalsContact C-N 3.29Å; E567-I569 PolarHBondContact O-N 2.88Å; E567-I570 PolarHBondContact O-N 3.4Å; E567-I570 VanDerWaalsContact O-N 3.13Å; E567-C571 PolarHBondContact O-N 2.91Å; E567-C571 PolarHBondContact O-SG 3.43Å
568	K	86.7	Confident	89.7	Confident	161 Å²	161	41.9 Å²	41.9	70%	0.7	20%	0.203	S	C	*	.	H	α-helix	trans	-63.3	-39.9	-176.7	-61.5	179.3	178.7	177.8	0	110.9	D566 I570 C571 M572	D566-K568 PolarHBondContact O-N 2.83Å; D566-K568 VanDerWaalsContact OD1-CB 3.3Å; D566-K568 WeakPolarHBondContact OD1-CB 3.34Å; D566-K568 PolarHBondContact OD1-N 3.01Å; K568-I570 VanDerWaalsContact C-N 3.29Å; K568-I570 PolarHBondContact O-N 3.36Å; K568-C571 PolarHBondContact O-N 2.98Å; K568-M572 WeakPolarHBondContact O-CB 3.42Å; K568-M572 WeakPolarHBondContact O-CG 3.17Å; K568-M572 PolarHBondContact O-N 3.21Å
569	I	88	Confident	89.7	Confident	38 Å²	38	41.2 Å²	41.2	20%	0.195	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-40.9	177.5	-65.1	173.5	0	0	0	110.7	L522 K526 D566 E567 L573	L522-I569 HydrophobicContact CD1-CG2 4.29Å; L522-I569 HydrophobicContact CD2-CD1 4.33Å; K526-I569 HydrophobicContact CD-CG2 4.5Å; K526-I569 HydrophobicContact CG-CG2 4.44Å; D566-I569 HydrophobicContact CB-CD1 4.04Å; D566-I569 HydrophobicContact CB-CG1 4.34Å; D566-I569 PolarHBondContact O-N 3.39Å; D566-I569 VanDerWaalsContact OD2-CD1 3.3Å; D566-I569 WeakPolarHBondContact OD2-CD1 3.32Å; D566-I569 WeakPolarHBondContact OD2-CG1 3.47Å; E567-I569 VanDerWaalsContact C-N 3.29Å; E567-I569 PolarHBondContact O-N 2.88Å; I569-L573 HydrophobicContact CG2-CD1 3.94Å; I569-L573 HydrophobicContact CG2-CG 4.5Å; I569-L573 WeakPolarHBondContact O-CB 3.43Å; I569-L573 VanDerWaalsContact O-CG 3.26Å; I569-L573 WeakPolarHBondContact O-CG 3.39Å; I569-L573 PolarHBondContact O-N 3.36Å
570	I	90.2	Very high	89.8	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-66.3	-47.4	177.4	-60.6	-55.6	0	0	0	110.8	L522 I525 L529 L560 V564 E567 K568 M572 L573 L574	L522-I570 HydrophobicContact CD1-CD1 3.91Å; I525-I570 HydrophobicContact CB-CD1 4.5Å; I525-I570 HydrophobicContact CG2-CD1 3.53Å; L529-I570 HydrophobicContact CD1-CD1 4.17Å; L560-I570 HydrophobicContact CB-CG2 3.99Å; L560-I570 HydrophobicContact CD1-CG2 3.91Å; V564-I570 HydrophobicContact CG1-CD1 4.44Å; V564-I570 HydrophobicContact CG2-CD1 4.47Å; V564-I570 HydrophobicContact CG2-CG1 3.69Å; E567-I570 PolarHBondContact O-N 3.4Å; E567-I570 VanDerWaalsContact O-N 3.13Å; K568-I570 VanDerWaalsContact C-N 3.29Å; K568-I570 PolarHBondContact O-N 3.36Å; I570-M572 PolarHBondContact O-N 3.49Å; I570-L573 PolarHBondContact O-N 3.34Å; I570-L574 HydrophobicContact CG2-CD1 3.83Å; I570-L574 HydrophobicContact CG2-CG 4.35Å; I570-L574 WeakPolarHBondContact O-CG 3.41Å; I570-L574 PolarHBondContact O-N 2.95Å
571	C	90.5	Very high	89.9	Confident	22 Å²	22	39.2 Å²	39.2	15%	0.149	19%	0.19	C	C	.	.	H	α-helix	trans	-58	-47.4	177	-69.2	0	0	0	0	111.6	Q557 E567 K568 L573 L574 E575	Q557-C571 PolarHBondContact NE2-SG 2.71Å; Q557-C571 VanDerWaalsContact NE2-SG 3.41Å; E567-C571 PolarHBondContact O-N 2.91Å; E567-C571 PolarHBondContact O-SG 3.43Å; K568-C571 PolarHBondContact O-N 2.98Å; C571-L573 PolarHBondContact O-N 3.03Å; C571-L574 PolarHBondContact O-N 3.42Å; C571-E575 WeakPolarHBondContact O-CB 3.5Å; C571-E575 WeakPolarHBondContact O-CG 3.42Å; C571-E575 PolarHBondContact O-N 3.2Å
572	M	90.5	Very high	90.2	Very high	63 Å²	63	39.3 Å²	39.3	31%	0.31	19%	0.194	S	C	.	.	H	α-helix	trans	-58.6	-46.7	177	-71.8	175.1	66.8	0	0	112	T504 K568 I570 L574 E575 D576	T504-M572 HydrophobicContact CG2-CE 3.52Å; K568-M572 WeakPolarHBondContact O-CB 3.42Å; K568-M572 WeakPolarHBondContact O-CG 3.17Å; K568-M572 PolarHBondContact O-N 3.21Å; I570-M572 PolarHBondContact O-N 3.49Å; M572-L574 VanDerWaalsContact C-N 3.34Å; M572-L574 PolarHBondContact O-N 3.28Å; M572-E575 PolarHBondContact O-N 3.21Å; M572-D576 VanDerWaalsContact O-CG 3.29Å; M572-D576 PolarHBondContact O-N 3.49Å
573	L	92.2	Very high	90.6	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-36	179.4	-71.7	170.5	0	0	0	112.6	K526 L529 K530 I533 I569 I570 C571 D576 V577	K526-L573 HydrophobicContact CG-CD1 4.03Å; L529-L573 HydrophobicContact CB-CB 4.13Å; L529-L573 HydrophobicContact CB-CD1 4.27Å; L529-L573 HydrophobicContact CD1-CB 3.8Å; L529-L573 HydrophobicContact CD1-CD1 4.06Å; K530-L573 HydrophobicContact CG-CD2 3.89Å; I533-L573 HydrophobicContact CD1-CD2 4.06Å; I569-L573 HydrophobicContact CG2-CD1 3.94Å; I569-L573 HydrophobicContact CG2-CG 4.5Å; I569-L573 WeakPolarHBondContact O-CB 3.43Å; I569-L573 VanDerWaalsContact O-CG 3.26Å; I569-L573 WeakPolarHBondContact O-CG 3.39Å; I569-L573 PolarHBondContact O-N 3.36Å; I570-L573 PolarHBondContact O-N 3.34Å; C571-L573 PolarHBondContact O-N 3.03Å; L573-D576 PolarHBondContact O-N 3.25Å; L573-V577 WeakPolarHBondContact O-CG2 3.4Å; L573-V577 PolarHBondContact O-N 3.02Å; L573-V577 VanDerWaalsContact O-N 3.13Å
574	L	94.7	Very high	90.9	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.037	21%	0.213	C	C	.	.	H	α-helix	trans	-72.4	-36.2	176.1	-68.9	173.9	0	0	0	112	L529 C553 L556 Q557 I570 C571 M572 D576 V577 I578	L529-L574 HydrophobicContact CD1-CD2 4.36Å; L529-L574 HydrophobicContact CD1-CG 4.42Å; L529-L574 HydrophobicContact CD2-CD2 3.79Å; C553-L574 HydrophobicContact CB-CD2 4.29Å; L556-L574 HydrophobicContact CB-CD1 4.34Å; L556-L574 HydrophobicContact CB-CD2 4.09Å; L556-L574 HydrophobicContact CD1-CD2 4.08Å; Q557-L574 HydrophobicContact CB-CD1 3.74Å; Q557-L574 HydrophobicContact CG-CD1 4.32Å; I570-L574 HydrophobicContact CG2-CD1 3.83Å; I570-L574 HydrophobicContact CG2-CG 4.35Å; I570-L574 WeakPolarHBondContact O-CG 3.41Å; I570-L574 PolarHBondContact O-N 2.95Å; C571-L574 PolarHBondContact O-N 3.42Å; M572-L574 VanDerWaalsContact C-N 3.34Å; M572-L574 PolarHBondContact O-N 3.28Å; L574-D576 VanDerWaalsContact C-N 3.35Å; L574-V577 WeakPolarHBondContact O-CB 3.41Å; L574-V577 PolarHBondContact O-N 3.15Å; L574-I578 WeakPolarHBondContact O-CG1 3.36Å; L574-I578 PolarHBondContact O-N 3.24Å
575	E	91.9	Very high	91.3	Very high	89 Å²	89	44.9 Å²	44.9	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-43.7	170.8	-75.7	175	-170.4	0	0	111.1	L465 C571 M572 V577 I578 Y579	L465-E575 HydrophobicContact CD2-CG 3.85Å; C571-E575 WeakPolarHBondContact O-CB 3.5Å; C571-E575 WeakPolarHBondContact O-CG 3.42Å; C571-E575 PolarHBondContact O-N 3.2Å; M572-E575 PolarHBondContact O-N 3.21Å; E575-V577 VanDerWaalsContact C-N 3.3Å; E575-V577 PolarHBondContact O-N 3.34Å; E575-I578 PolarHBondContact O-N 3.35Å; E575-Y579 VanDerWaalsContact O-CB 3.28Å; E575-Y579 WeakPolarHBondContact O-CB 3.34Å; E575-Y579 PolarHBondContact O-N 3.36Å
576	D	91.9	Very high	91.8	Very high	30 Å²	30	46.6 Å²	46.6	16%	0.16	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-35.3	175.5	-69.7	-7.7	0	0	0	112.2	H501 I533 M572 L573 L574 S580	H501-D576 IonicContact CE1-OD1 3.67Å; H501-D576 PolarHBondContact CE1-OD1 3.39Å; H501-D576 IonicContact NE2-OD1 3.46Å; H501-D576 PolarHBondContact NE2-OD1 2.9Å; H501-D576 VanDerWaalsContact NE2-OD1 3.09Å; I533-D576 HydrophobicContact CD1-CB 3.56Å; I533-D576 HydrophobicContact CG1-CB 4.12Å; M572-D576 VanDerWaalsContact O-CG 3.29Å; M572-D576 PolarHBondContact O-N 3.49Å; L573-D576 PolarHBondContact O-N 3.25Å; L574-D576 VanDerWaalsContact C-N 3.35Å; D576-S580 WeakPolarHBondContact O-CB 3.38Å; D576-S580 PolarHBondContact O-N 3Å; D576-S580 PolarHBondContact O-OG 3.34Å
577	V	95.4	Very high	92.3	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-53.7	172.9	172.7	0	0	0	0	109.9	L532 I533 I549 L573 L574 E575 Y579 S580 V581	L532-V577 HydrophobicContact CB-CG2 4.28Å; L532-V577 HydrophobicContact CD2-CG1 4.02Å; L532-V577 HydrophobicContact CD2-CG2 4.05Å; L532-V577 HydrophobicContact CG-CG1 3.97Å; L532-V577 HydrophobicContact CG-CG2 4Å; I533-V577 HydrophobicContact CB-CG2 4.44Å; I533-V577 HydrophobicContact CD1-CG2 4.43Å; I533-V577 HydrophobicContact CG1-CB 4.33Å; I533-V577 HydrophobicContact CG1-CG2 3.42Å; I533-V577 VanDerWaalsContact CG1-CG2 3.42Å; I549-V577 HydrophobicContact CG2-CG1 3.88Å; L573-V577 WeakPolarHBondContact O-CG2 3.4Å; L573-V577 PolarHBondContact O-N 3.02Å; L573-V577 VanDerWaalsContact O-N 3.13Å; L574-V577 WeakPolarHBondContact O-CB 3.41Å; L574-V577 PolarHBondContact O-N 3.15Å; E575-V577 VanDerWaalsContact C-N 3.3Å; E575-V577 PolarHBondContact O-N 3.34Å; V577-Y579 VanDerWaalsContact C-N 3.29Å; V577-Y579 PolarHBondContact O-N 3.06Å; V577-S580 PolarHBondContact O-N 3.29Å; V577-V581 WeakPolarHBondContact O-CG2 3.42Å; V577-V581 PolarHBondContact O-N 3.08Å
578	I	94.7	Very high	92.7	Very high	28 Å²	28	48.9 Å²	48.9	14%	0.144	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-44.1	-179	-66.9	-69.7	0	0	0	110.6	I549 Q550 C553 L574 E575 S580 V581 V582 F590	I549-I578 HydrophobicContact CG2-CD1 4.06Å; Q550-I578 HydrophobicContact CB-CD1 4.3Å; C553-I578 HydrophobicContact CB-CD1 3.94Å; C553-I578 HydrophobicContact CB-CG1 4.12Å; L574-I578 WeakPolarHBondContact O-CG1 3.36Å; L574-I578 PolarHBondContact O-N 3.24Å; E575-I578 PolarHBondContact O-N 3.35Å; I578-S580 PolarHBondContact O-N 3.21Å; I578-V581 PolarHBondContact O-N 3.16Å; I578-V581 VanDerWaalsContact O-N 3.16Å; I578-V582 HydrophobicContact CG2-CG2 4.33Å; I578-V582 WeakPolarHBondContact O-CG2 3.45Å; I578-V582 PolarHBondContact O-N 3.18Å; I578-F590 HydrophobicContact CG2-CE1 3.73Å; I578-F590 HydrophobicContact CG2-CZ 3.94Å
579	Y	92.7	Very high	92.9	Very high	37 Å²	37	43.2 Å²	43.2	15%	0.145	22%	0.223	C	C	.	.	H	α-helix	trans	-59.1	-46.6	177.3	179.8	-102.4	0	0	0	112.1	H498 H501 E575 V577 V581 V582 Q583	H498-Y579 AromaticContact CD2-CZ 3.99Å; H498-Y579 PolarHBondContact CD2-OH 3.18Å; H498-Y579 PolarHBondContact NE2-OH 2.74Å; H498-Y579 VanDerWaalsContact NE2-OH 3.09Å; H501-Y579 AromaticContact CD2-CD1 3.29Å; H501-Y579 WeakPolarHBondContact CD2-CD1 3.47Å; H501-Y579 AromaticContact CD2-CE1 3.34Å; H501-Y579 WeakPolarHBondContact CD2-CE1 3.14Å; H501-Y579 AromaticContact CD2-CG 3.65Å; H501-Y579 AromaticContact CD2-CZ 3.77Å; H501-Y579 AromaticContact CG-CE1 3.99Å; H501-Y579 AromaticContact NE2-CD1 3.37Å; H501-Y579 WeakPolarHBondContact NE2-CD1 3.26Å; H501-Y579 AromaticContact NE2-CE1 3.81Å; H501-Y579 AromaticContact NE2-CG 3.86Å; E575-Y579 VanDerWaalsContact O-CB 3.28Å; E575-Y579 WeakPolarHBondContact O-CB 3.34Å; E575-Y579 PolarHBondContact O-N 3.36Å; V577-Y579 VanDerWaalsContact C-N 3.29Å; V577-Y579 PolarHBondContact O-N 3.06Å; Y579-V581 VanDerWaalsContact C-N 3.27Å; Y579-V581 PolarHBondContact O-N 2.99Å; Y579-V582 PolarHBondContact O-N 2.63Å; Y579-Q583 VanDerWaalsContact CE1-CD 3.48Å; Y579-Q583 HydrophobicContact CE1-CG 4.21Å; Y579-Q583 WeakPolarHBondContact O-CG 3.37Å; Y579-Q583 PolarHBondContact O-N 3.15Å; Y579-Q583 PolarHBondContact OH-NE2 2.76Å
580	S	94.2	Very high	93.2	Very high	13 Å²	13	46.3 Å²	46.3	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-37	176.1	-60.2	0	0	0	0	112.2	D576 V577 I578 R584	D576-S580 WeakPolarHBondContact O-CB 3.38Å; D576-S580 PolarHBondContact O-N 3Å; D576-S580 PolarHBondContact O-OG 3.34Å; V577-S580 PolarHBondContact O-N 3.29Å; I578-S580 PolarHBondContact O-N 3.21Å; S580-R584 VanDerWaalsContact O-CG 3.25Å; S580-R584 WeakPolarHBondContact O-CG 3.48Å; S580-R584 PolarHBondContact O-N 3.01Å
581	V	95.3	Very high	93.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-70.4	-42.9	176.2	177.5	0	0	0	0	111.7	A536 F541 L546 I549 V577 I578 Y579 Q583 R584 C585	A536-V581 HydrophobicContact CB-CG2 3.64Å; F541-V581 HydrophobicContact CB-CG1 4.23Å; F541-V581 HydrophobicContact CD1-CG1 3.74Å; F541-V581 HydrophobicContact CD2-CB 4.46Å; F541-V581 HydrophobicContact CD2-CG1 3.83Å; F541-V581 HydrophobicContact CE1-CG1 3.99Å; F541-V581 HydrophobicContact CE1-CG2 4.17Å; F541-V581 HydrophobicContact CE2-CB 4.35Å; F541-V581 HydrophobicContact CE2-CG1 4.06Å; F541-V581 HydrophobicContact CE2-CG2 4.02Å; F541-V581 HydrophobicContact CG-CG1 3.67Å; F541-V581 HydrophobicContact CZ-CG1 4.16Å; F541-V581 HydrophobicContact CZ-CG2 3.81Å; L546-V581 HydrophobicContact CB-CG1 4.11Å; L546-V581 HydrophobicContact CD1-CB 4.14Å; L546-V581 HydrophobicContact CD1-CG1 3.54Å; L546-V581 HydrophobicContact CG-CG1 4.44Å; I549-V581 HydrophobicContact CB-CG1 4.5Å; I549-V581 HydrophobicContact CB-CG2 4.24Å; I549-V581 HydrophobicContact CG1-CG1 4.48Å; I549-V581 HydrophobicContact CG1-CG2 4.13Å; I549-V581 HydrophobicContact CG2-CG2 3.89Å; V577-V581 WeakPolarHBondContact O-CG2 3.42Å; V577-V581 PolarHBondContact O-N 3.08Å; I578-V581 PolarHBondContact O-N 3.16Å; I578-V581 VanDerWaalsContact O-N 3.16Å; Y579-V581 VanDerWaalsContact C-N 3.27Å; Y579-V581 PolarHBondContact O-N 2.99Å; V581-Q583 VanDerWaalsContact C-N 3.32Å; V581-Q583 PolarHBondContact O-N 2.99Å; V581-R584 CarbonylContact O-C 3.41Å; V581-R584 PolarHBondContact O-N 2.83Å; V581-C585 WeakPolarHBondContact O-CB 3.5Å; V581-C585 PolarHBondContact O-N 2.83Å
582	V	94.8	Very high	93.4	Very high	37 Å²	37	53 Å²	53	22%	0.224	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-44.5	177.5	170.8	0	0	0	0	110.8	L546 I578 Y579 R584 C585 P588 F590	L546-V582 HydrophobicContact CD1-CG2 3.75Å; L546-V582 HydrophobicContact CD2-CG2 4.38Å; I578-V582 HydrophobicContact CG2-CG2 4.33Å; I578-V582 WeakPolarHBondContact O-CG2 3.45Å; I578-V582 PolarHBondContact O-N 3.18Å; Y579-V582 PolarHBondContact O-N 2.63Å; V582-R584 PolarHBondContact O-N 3.43Å; V582-C585 PolarHBondContact O-N 2.86Å; V582-P588 HydrophobicContact CG1-CB 4.19Å; V582-F590 HydrophobicContact CG2-CE1 4.33Å; V582-F590 HydrophobicContact CG2-CE2 4.07Å; V582-F590 HydrophobicContact CG2-CZ 3.5Å
583	Q	93.6	Very high	93.4	Very high	98 Å²	98	53.2 Å²	53.2	46%	0.458	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-23.7	177	-73	-172.2	-27.8	0	0	113.8	H498 Y579 V581	H498-Q583 PolarHBondContact NE2-NE2 2.83Å; Y579-Q583 VanDerWaalsContact CE1-CD 3.48Å; Y579-Q583 HydrophobicContact CE1-CG 4.21Å; Y579-Q583 WeakPolarHBondContact O-CG 3.37Å; Y579-Q583 PolarHBondContact O-N 3.15Å; Y579-Q583 PolarHBondContact OH-NE2 2.76Å; V581-Q583 VanDerWaalsContact C-N 3.32Å; V581-Q583 PolarHBondContact O-N 2.99Å
584	R	94.8	Very high	93.5	Very high	99 Å²	99	56.6 Å²	56.6	37%	0.374	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	3.7	-178.1	-62.4	-62.9	-63	160.9	0.8	112.7	R537 Q539 T540 F541 S580 V581 V582	R537-R584 WeakPolarHBondContact O-CD 3.31Å; R537-R584 PolarHBondContact O-NE 2.98Å; Q539-R584 WeakPolarHBondContact O-CB 3.41Å; Q539-R584 PolarHBondContact O-NE 2.8Å; Q539-R584 PolarHBondContact O-NH2 3.18Å; Q539-R584 VanDerWaalsContact O-NH2 3.1Å; T540-R584 PolarHBondContact OG1-NH2 3.49Å; F541-R584 HydrophobicContact CD2-CB 3.86Å; F541-R584 HydrophobicContact CE2-CB 4.2Å; F541-R584 PolarHBondContact N-O 2.98Å; S580-R584 VanDerWaalsContact O-CG 3.25Å; S580-R584 WeakPolarHBondContact O-CG 3.48Å; S580-R584 PolarHBondContact O-N 3.01Å; V581-R584 CarbonylContact O-C 3.41Å; V581-R584 PolarHBondContact O-N 2.83Å; V582-R584 PolarHBondContact O-N 3.43Å
585	C	95.5	Very high	93.5	Very high	15 Å²	15	59.1 Å²	59.1	10%	0.101	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-92.1	134.1	-179.5	-167.8	0	0	0	0	111	F541 V581 V582 D587 P588	F541-C585 HydrophobicContact CB-CB 4.15Å; F541-C585 CarbonylContact O-C 3.6Å; F541-C585 VanDerWaalsContact O-CA 3.28Å; F541-C585 WeakPolarHBondContact O-CA 3.31Å; F541-C585 PolarHBondContact O-SG 3.38Å; V581-C585 WeakPolarHBondContact O-CB 3.5Å; V581-C585 PolarHBondContact O-N 2.83Å; V582-C585 PolarHBondContact O-N 2.86Å; C585-D587 PolarHBondContact SG-O 3.01Å; C585-P588 HydrophobicContact CB-CB 4.25Å
586	I	94.5	Very high	93.6	Very high	121 Å²	121	54.9 Å²	54.9	62%	0.621	28%	0.284	S	S	*	.	S	Bend	trans	-74.2	-34.6	179.4	-55.9	-174.4	0	0	0	111.5	L416 T540 F541	L416-I586 HydrophobicContact CD1-CD1 3.44Å; L416-I586 VanDerWaalsContact CD1-CD1 3.44Å; L416-I586 HydrophobicContact CD1-CG1 4.24Å; T540-I586 HydrophobicContact CG2-CD1 4.02Å; T540-I586 HydrophobicContact CG2-CG1 3.98Å; F541-I586 PolarHBondContact O-N 3.45Å
587	D	90.9	Very high	93.6	Very high	95 Å²	95	57 Å²	57	51%	0.508	29%	0.294	S	S	.	.	S	Bend	trans	-136.8	80	-179	178.5	32.1	0	0	0	109.2	C585 C589	C585-D587 PolarHBondContact SG-O 3.01Å; D587-C589 PolarHBondContact O-N 3Å
588	P	93.2	Very high	93.6	Very high	69 Å²	69	59 Å²	59	45%	0.448	31%	0.309	S	S	.	.			trans	-71.1	98.6	-175	27.4	-33	0	0	0	111	L546 V582 C585	L546-P588 HydrophobicContact CD2-CB 4.04Å; V582-P588 HydrophobicContact CG1-CB 4.19Å; C585-P588 HydrophobicContact CB-CB 4.25Å
589	C	92.4	Very high	93.6	Very high	42 Å²	42	57.9 Å²	57.9	28%	0.284	30%	0.304	S	S	.	.			trans	-128.6	109.8	174.3	176.2	0	0	0	0	110.4	R543 Q547 D587	R543-C589 HydrophobicContact CG-CB 4Å; R543-C589 PolarHBondContact NE-SG 3.34Å; R543-C589 VanDerWaalsContact NE-SG 3.45Å; Q547-C589 VanDerWaalsContact CG-O 3.31Å; Q547-C589 WeakPolarHBondContact CG-O 3.31Å; Q547-C589 PolarHBondContact NE2-O 3.23Å; D587-C589 PolarHBondContact O-N 3Å
590	F	93.2	Very high	93.6	Very high	104 Å²	104	56.3 Å²	56.3	46%	0.456	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-67.6	150.3	177	-71.7	-81.8	0	0	0	112.2	L546 Q550 I578 V582	L546-F590 HydrophobicContact CD1-CE1 4.25Å; Q550-F590 HydrophobicContact CG-CD1 4.29Å; I578-F590 HydrophobicContact CG2-CE1 3.73Å; I578-F590 HydrophobicContact CG2-CZ 3.94Å; V582-F590 HydrophobicContact CG2-CE1 4.33Å; V582-F590 HydrophobicContact CG2-CE2 4.07Å; V582-F590 HydrophobicContact CG2-CZ 3.5Å
591	M	92.3	Very high	93.5	Very high	18 Å²	18	61.9 Å²	61.9	9%	0.089	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-80.4	146.2	169.1	-177.2	175.5	-77	0	0	109.4	P421 Q547 Q550 V551 E593 V595 V596 I599	P421-M591 HydrophobicContact CB-CE 4.15Å; P421-M591 HydrophobicContact CG-CE 4.08Å; Q547-M591 HydrophobicContact CB-CB 4.3Å; Q547-M591 HydrophobicContact CB-CE 4.23Å; Q547-M591 HydrophobicContact CG-CB 4Å; Q550-M591 PolarHBondContact NE2-O 2.65Å; V551-M591 HydrophobicContact CG2-SD 4.25Å; M591-E593 PolarHBondContact O-N 3.38Å; M591-V595 HydrophobicContact CG-CB 3.92Å; M591-V595 HydrophobicContact CG-CG1 3.99Å; M591-V595 HydrophobicContact SD-CB 4.08Å; M591-V595 HydrophobicContact SD-CG1 3.57Å; M591-V595 VanDerWaalsContact SD-CG1 3.57Å; M591-V596 HydrophobicContact CB-CG2 3.89Å; M591-V596 HydrophobicContact CG-CG2 3.87Å; M591-V596 HydrophobicContact SD-CG2 3.98Å; M591-I599 HydrophobicContact CE-CD1 4.44Å; M591-I599 HydrophobicContact SD-CD1 3.81Å
592	E	93	Very high	93.2	Very high	146 Å²	146	70.8 Å²	70.8	68%	0.682	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-57.9	134.7	175.3	-67.5	-173.4	173.8	0	0	111	S594 V595 V596	E592-S594 PolarHBondContact O-N 3.2Å; E592-V595 HydrophobicContact CB-CG2 4.14Å; E592-V595 WeakPolarHBondContact O-CB 3.37Å; E592-V595 PolarHBondContact O-N 3.46Å; E592-V596 PolarHBondContact O-N 3.37Å; E592-V596 VanDerWaalsContact O-N 3.12Å
593	E	90.1	Very high	92.7	Very high	69 Å²	69	71.6 Å²	71.6	32%	0.322	37%	0.371	S	S	.	.	H	α-helix	trans	-56.5	-38	-175.3	-171	64.3	-158.9	0	0	112.3	R554 M591 V595 V596 E597	R554-E593 IonicContact CZ-OE1 3.49Å; R554-E593 IonicContact NE-OE1 2.83Å; R554-E593 PolarHBondContact NE-OE1 3.17Å; R554-E593 IonicContact NH2-OE1 3.9Å; M591-E593 PolarHBondContact O-N 3.38Å; E593-V595 VanDerWaalsContact C-N 3.27Å; E593-V595 PolarHBondContact O-N 3.16Å; E593-V596 WeakPolarHBondContact O-CB 3.45Å; E593-V596 PolarHBondContact O-N 3.32Å; E593-V596 VanDerWaalsContact O-N 3.16Å; E593-E597 HydrophobicContact CG-CG 4.36Å; E593-E597 WeakPolarHBondContact O-CB 3.41Å; E593-E597 WeakPolarHBondContact O-CG 3.47Å; E593-E597 PolarHBondContact O-N 3.32Å
594	S	93.8	Very high	92.7	Very high	72 Å²	72	70.3 Å²	70.3	50%	0.503	37%	0.367	S	S	.	.	H	α-helix	trans	-59.6	-36.3	176.6	56.2	0	0	0	0	113	E592 A598	E592-S594 PolarHBondContact O-N 3.2Å; S594-A598 VanDerWaalsContact O-CB 3.28Å; S594-A598 WeakPolarHBondContact O-CB 3.42Å; S594-A598 PolarHBondContact O-N 2.83Å
595	V	95.1	Very high	92.6	Very high	60 Å²	60	68.7 Å²	68.7	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-74.4	-40.5	177.3	-177.5	0	0	0	0	110.1	M591 E592 E593 A598 I599	M591-V595 HydrophobicContact CG-CB 3.92Å; M591-V595 HydrophobicContact CG-CG1 3.99Å; M591-V595 HydrophobicContact SD-CB 4.08Å; M591-V595 HydrophobicContact SD-CG1 3.57Å; M591-V595 VanDerWaalsContact SD-CG1 3.57Å; E592-V595 HydrophobicContact CB-CG2 4.14Å; E592-V595 WeakPolarHBondContact O-CB 3.37Å; E592-V595 PolarHBondContact O-N 3.46Å; E593-V595 VanDerWaalsContact C-N 3.27Å; E593-V595 PolarHBondContact O-N 3.16Å; V595-A598 PolarHBondContact O-N 3.12Å; V595-I599 HydrophobicContact CG1-CD1 4.09Å; V595-I599 VanDerWaalsContact O-CG1 3.28Å; V595-I599 WeakPolarHBondContact O-CG1 3.28Å; V595-I599 PolarHBondContact O-N 2.94Å
596	V	93.7	Very high	92.4	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-61.5	-48	176.2	179.6	0	0	0	0	110.8	Q550 V551 R554 M591 E592 E593 I599 C600	Q550-V596 HydrophobicContact CG-CG2 4.25Å; V551-V596 HydrophobicContact CG2-CG1 4.2Å; V551-V596 HydrophobicContact CG2-CG2 4.33Å; R554-V596 HydrophobicContact CB-CG1 3.68Å; R554-V596 HydrophobicContact CG-CG1 3.8Å; M591-V596 HydrophobicContact CB-CG2 3.89Å; M591-V596 HydrophobicContact CG-CG2 3.87Å; M591-V596 HydrophobicContact SD-CG2 3.98Å; E592-V596 PolarHBondContact O-N 3.37Å; E592-V596 VanDerWaalsContact O-N 3.12Å; E593-V596 WeakPolarHBondContact O-CB 3.45Å; E593-V596 PolarHBondContact O-N 3.32Å; E593-V596 VanDerWaalsContact O-N 3.16Å; V596-I599 PolarHBondContact O-N 2.96Å; V596-C600 PolarHBondContact O-N 2.84Å; V596-C600 PolarHBondContact O-SG 3.49Å
597	E	93	Very high	92.3	Very high	75 Å²	75	68.8 Å²	68.8	35%	0.35	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-47.1	175.7	-71.7	-176.3	158.9	0	0	110.9	R554 E593 I599 C600 D601	R554-E597 IonicContact CZ-OE1 3.95Å; R554-E597 IonicContact NH2-OE1 2.65Å; R554-E597 PolarHBondContact NH2-OE1 2.88Å; E593-E597 HydrophobicContact CG-CG 4.36Å; E593-E597 WeakPolarHBondContact O-CB 3.41Å; E593-E597 WeakPolarHBondContact O-CG 3.47Å; E593-E597 PolarHBondContact O-N 3.32Å; E597-I599 VanDerWaalsContact C-N 3.28Å; E597-I599 PolarHBondContact O-N 3.04Å; E597-C600 PolarHBondContact O-N 3.08Å; E597-C600 VanDerWaalsContact O-N 3.08Å; E597-D601 WeakPolarHBondContact O-CB 3.48Å; E597-D601 PolarHBondContact O-N 3.27Å
598	A	94.5	Very high	92.4	Very high	40 Å²	40	67.2 Å²	67.2	33%	0.331	36%	0.358	S	S	.	.	H	α-helix	trans	-63	-30	177.2	0	0	0	0	0	113.8	S594 V595 R602	S594-A598 VanDerWaalsContact O-CB 3.28Å; S594-A598 WeakPolarHBondContact O-CB 3.42Å; S594-A598 PolarHBondContact O-N 2.83Å; V595-A598 PolarHBondContact O-N 3.12Å; A598-R602 VanDerWaalsContact O-CG 3.32Å; A598-R602 WeakPolarHBondContact O-CG 3.5Å; A598-R602 PolarHBondContact O-NE 2.99Å
599	I	95.2	Very high	92.3	Very high	5 Å²	5	67.1 Å²	67.1	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-72.3	-42.6	172.8	-68.2	165.6	0	0	0	110.5	P421 V551 M591 V595 V596 E597 R602 A603	P421-I599 WeakPolarHBondContact O-CD1 3.32Å; V551-I599 HydrophobicContact CG1-CB 4.37Å; V551-I599 HydrophobicContact CG1-CG2 3.63Å; V551-I599 HydrophobicContact CG2-CD1 4.11Å; M591-I599 HydrophobicContact CE-CD1 4.44Å; M591-I599 HydrophobicContact SD-CD1 3.81Å; V595-I599 HydrophobicContact CG1-CD1 4.09Å; V595-I599 VanDerWaalsContact O-CG1 3.28Å; V595-I599 WeakPolarHBondContact O-CG1 3.28Å; V595-I599 PolarHBondContact O-N 2.94Å; V596-I599 PolarHBondContact O-N 2.96Å; E597-I599 VanDerWaalsContact C-N 3.28Å; E597-I599 PolarHBondContact O-N 3.04Å; I599-R602 PolarHBondContact O-N 3.22Å; I599-A603 PolarHBondContact O-N 3.41Å
600	C	93.4	Very high	92.3	Very high	5 Å²	5	68.9 Å²	68.9	3%	0.034	36%	0.357	C	S	.	.	H	α-helix	trans	-68	-40.6	180	-64	0	0	0	0	112.3	Y555 I558 V596 E597 R602 A603	Y555-C600 HydrophobicContact CD2-CB 4.33Å; I558-C600 HydrophobicContact CD1-CB 3.77Å; V596-C600 PolarHBondContact O-N 2.84Å; V596-C600 PolarHBondContact O-SG 3.49Å; E597-C600 PolarHBondContact O-N 3.08Å; E597-C600 VanDerWaalsContact O-N 3.08Å; C600-R602 VanDerWaalsContact C-N 3.25Å; C600-R602 PolarHBondContact O-N 2.84Å; C600-A603 WeakPolarHBondContact O-CB 3.28Å; C600-A603 PolarHBondContact O-N 3.13Å; C600-A603 VanDerWaalsContact O-N 3.13Å
601	D	90.7	Very high	92.3	Very high	130 Å²	130	66.2 Å²	66.2	70%	0.695	35%	0.35	S	S	*	.	H	α-helix	trans	-67.1	-25.9	179.6	-74	-14.9	0	0	0	113.1	E597	E597-D601 WeakPolarHBondContact O-CB 3.48Å; E597-D601 PolarHBondContact O-N 3.27Å
602	R	90.6	Very high	92.3	Very high	186 Å²	186	70.2 Å²	70.2	70%	0.702	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-12.4	175.8	-74.4	-176.9	-68.7	-176.3	-0.6	113.3	A598 I599 C600	A598-R602 VanDerWaalsContact O-CG 3.32Å; A598-R602 WeakPolarHBondContact O-CG 3.5Å; A598-R602 PolarHBondContact O-NE 2.99Å; I599-R602 PolarHBondContact O-N 3.22Å; C600-R602 VanDerWaalsContact C-N 3.25Å; C600-R602 PolarHBondContact O-N 2.84Å
603	A	84.4	Confident	92.2	Very high	54 Å²	54	63.3 Å²	63.3	45%	0.446	34%	0.343	S	S	.	.			trans	-90.2	0	-170.8	0	0	0	0	0	111.7	V424 K429 Y555 I599 C600	V424-A603 HydrophobicContact CB-CB 4.12Å; V424-A603 HydrophobicContact CG2-CB 3.63Å; K429-A603 PolarHBondContact NZ-O 3.34Å; Y555-A603 HydrophobicContact CD2-CB 4.23Å; Y555-A603 HydrophobicContact CE2-CB 3.83Å; I599-A603 PolarHBondContact O-N 3.41Å; C600-A603 WeakPolarHBondContact O-CB 3.28Å; C600-A603 PolarHBondContact O-N 3.13Å; C600-A603 VanDerWaalsContact O-N 3.13Å

Retrieved 603 of 603 residues in 512.2 ms (Link to these results)

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