A0A5K4FDH1_SCHMA Loading...

TPR_REGION domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDH1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 765 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	31	Very low	29.2	Very low	239 Å²	239	169.6 Å²	169.6	100%	1.177	83%	0.828	S	S	*	*				0	124.8	0	-77.6	-177	142.2	0	0	108
2	N	32.6	Very low	29.1	Very low	165 Å²	165	161.8 Å²	161.8	88%	0.882	80%	0.797	S	S	*	*			trans	-60.1	132.9	-163.7	-70.6	-16.1	0	0	0	113
3	K	32.8	Very low	28.8	Very low	207 Å²	207	156.1 Å²	156.1	90%	0.9	78%	0.776	S	S	*	*			trans	-101.9	32.2	-168.1	-133.1	-176.6	-170.7	-175.9	0	112.7
4	T	36.1	Very low	28.9	Very low	119 Å²	119	151.2 Å²	151.2	73%	0.73	76%	0.763	S	S	*	*			trans	-114.9	3.2	-167.5	49.1	0	0	0	0	116.9
5	D	31.6	Very low	29.2	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	73%	0.733	S	S	*	*			trans	-113.6	39.7	177.6	-72	-29.2	0	0	0	113.9	R7	D5-R7 PolarHBondContact O-N 3.35Å
6	W	25.4	Very low	29.4	Very low	238 Å²	238	143 Å²	143	90%	0.902	72%	0.724	S	S	*	*			trans	-81.6	96.5	167.6	-123.2	71	0	0	0	109.3	P8	W6-P8 WeakPolarHBondContact O-CD 3.44Å
7	R	26	Very low	30.1	Very low	225 Å²	225	141.4 Å²	141.4	85%	0.849	72%	0.723	S	S	*	*			trans	-76.4	115.9	169.4	-68.2	-174.9	179.2	-169.3	-0.2	108.8	D5 E9	D5-R7 PolarHBondContact O-N 3.35Å; R7-E9 PolarHBondContact O-N 2.93Å
8	P	28.7	Very low	30.7	Very low	88 Å²	88	143.7 Å²	143.7	57%	0.571	73%	0.727	S	S	*	*			trans	-78.4	92.7	175.6	30.9	-29.1	0	0	0	108.5	W6 N10 T11	W6-P8 WeakPolarHBondContact O-CD 3.44Å; P8-N10 PolarHBondContact O-N 3.16Å; P8-N10 VanDerWaalsContact O-N 3.16Å; P8-T11 HydrophobicContact CB-CG2 4.33Å
9	E	26.3	Very low	31.2	Very low	175 Å²	175	140.4 Å²	140.4	82%	0.818	71%	0.712	S	S	*	*			trans	-65.1	111.2	160.5	-73.7	-177.4	170.1	0	0	108.2	R7	R7-E9 PolarHBondContact O-N 2.93Å
10	N	28	Very low	31.6	Very low	149 Å²	149	138.2 Å²	138.2	80%	0.797	69%	0.694	S	S	*	*			trans	60.1	57.2	162.3	-59.2	-32.6	0	0	0	116.8	P8 V12	P8-N10 PolarHBondContact O-N 3.16Å; P8-N10 VanDerWaalsContact O-N 3.16Å; N10-V12 PolarHBondContact O-N 3.05Å; N10-V12 VanDerWaalsContact O-N 3.16Å
11	T	23.1	Very low	32.3	Very low	107 Å²	107	136.5 Å²	136.5	66%	0.656	70%	0.696	S	S	*	*			trans	-74.9	96	157.2	47.1	0	0	0	0	109.7	P8 V13	P8-T11 HydrophobicContact CB-CG2 4.33Å; T11-V13 PolarHBondContact O-N 3.28Å; T11-V13 VanDerWaalsContact O-N 3.11Å
12	V	27.8	Very low	33.1	Very low	76 Å²	76	132.2 Å²	132.2	46%	0.461	67%	0.673	S	S	.	*			trans	-65.8	105.2	164.9	177.9	0	0	0	0	107.5	N10 C14	N10-V12 PolarHBondContact O-N 3.05Å; N10-V12 VanDerWaalsContact O-N 3.16Å; V12-C14 PolarHBondContact O-N 2.73Å
13	V	25.4	Very low	33.2	Very low	87 Å²	87	128.6 Å²	128.6	53%	0.527	65%	0.647	S	S	.	*			trans	-75.4	116.8	174.5	-179.5	0	0	0	0	108	T11 I15	T11-V13 PolarHBondContact O-N 3.28Å; T11-V13 VanDerWaalsContact O-N 3.11Å; V13-I15 PolarHBondContact O-N 2.66Å; V13-I15 VanDerWaalsContact O-N 3.1Å
14	C	30.3	Very low	33.4	Very low	88 Å²	88	122.3 Å²	122.3	60%	0.595	63%	0.627	S	S	*	*			trans	-66.8	104.8	168.4	-68.1	0	0	0	0	108	V12 D16	V12-C14 PolarHBondContact O-N 2.73Å; C14-D16 PolarHBondContact O-N 3.43Å
15	I	33	Very low	33.5	Very low	60 Å²	60	120.1 Å²	120.1	31%	0.308	62%	0.622	S	S	.	*			trans	-73	109	-179.9	-57.1	173.3	0	0	0	108	V13 R20	V13-I15 PolarHBondContact O-N 2.66Å; V13-I15 VanDerWaalsContact O-N 3.1Å; I15-R20 HydrophobicContact CG2-CB 4.1Å; I15-R20 HydrophobicContact CG2-CG 4.19Å
16	D	33.1	Very low	33.9	Very low	111 Å²	111	118.8 Å²	118.8	59%	0.594	61%	0.614	S	S	*	*			trans	-64.1	134.4	168.5	-157.9	-6.1	0	0	0	108.9	C14 K18 N19	C14-D16 PolarHBondContact O-N 3.43Å; D16-K18 PolarHBondContact O-N 3.13Å; D16-N19 PolarHBondContact O-N 2.63Å
17	V	39.8	Very low	34.4	Very low	115 Å²	115	112.8 Å²	112.8	70%	0.697	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-56.1	-27.9	-169.2	176.7	0	0	0	0	111.8
18	K	41.4	Very low	34.8	Very low	184 Å²	184	105.3 Å²	105.3	80%	0.8	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-72.6	-24.7	178.1	-68.5	-176	178.3	178.9	0	114.5	D16	D16-K18 PolarHBondContact O-N 3.13Å
19	N	39.7	Very low	34.9	Very low	81 Å²	81	107.5 Å²	107.5	43%	0.433	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-103	8.1	-176.8	-68	-8.3	0	0	0	113.4	D16 S21 Q22	D16-N19 PolarHBondContact O-N 2.63Å; N19-S21 PolarHBondContact O-N 3.41Å; N19-S21 VanDerWaalsContact O-N 3.15Å; N19-Q22 PolarHBondContact O-N 3.41Å; N19-Q22 VanDerWaalsContact O-N 3.16Å
20	R	40	Very low	35.2	Very low	95 Å²	95	100.5 Å²	100.5	36%	0.358	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-60.7	-26.1	-173.9	-161.3	174.8	-178.7	172.3	1.3	114.3	I15 Q22 Q28 G30	I15-R20 HydrophobicContact CG2-CB 4.1Å; I15-R20 HydrophobicContact CG2-CG 4.19Å; R20-Q22 VanDerWaalsContact C-N 3.31Å; R20-Q22 PolarHBondContact O-N 3.07Å; R20-Q28 PolarHBondContact NH2-O 2.75Å; R20-Q28 PolarHBondContact O-NE2 3.34Å; R20-G30 PolarHBondContact NH2-O 2.9Å
21	S	47.1	Very low	35.1	Very low	104 Å²	104	99.7 Å²	99.7	73%	0.727	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-76.3	-11.4	179.7	54.7	0	0	0	0	114.6	N19	N19-S21 PolarHBondContact O-N 3.41Å; N19-S21 VanDerWaalsContact O-N 3.15Å
22	Q	46.4	Very low	35.4	Very low	149 Å²	149	100.3 Å²	100.3	70%	0.696	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-89.6	-5.1	-177.5	-65.6	-177.6	0	0	0	114.1	N19 R20	N19-Q22 PolarHBondContact O-N 3.41Å; N19-Q22 VanDerWaalsContact O-N 3.16Å; R20-Q22 VanDerWaalsContact C-N 3.31Å; R20-Q22 PolarHBondContact O-N 3.07Å
23	Y	36.3	Very low	35.3	Very low	89 Å²	89	103.7 Å²	103.7	35%	0.349	56%	0.557	S	S	.	*	S	Bend	trans	-111.8	145.8	-176.9	-70.9	-85.8	0	0	0	112.2	E27 Q28	Y23-E27 WeakPolarHBondContact CD1-OE2 3.18Å; Y23-Q28 PolarHBondContact O-NE2 2.77Å
24	P	37	Very low	35.4	Very low	74 Å²	74	105.6 Å²	105.6	48%	0.481	56%	0.562	S	S	.	*			trans	-63	147.8	-176.8	25.5	-33	0	0	0	112.4	N26 E27	P24-N26 WeakPolarHBondContact CB-OD1 3.44Å; P24-N26 PolarHBondContact O-N 2.85Å; P24-N26 PolarHBondContact O-OD1 3.08Å; P24-E27 PolarHBondContact O-N 3.31Å
25	A	37.6	Very low	35.2	Very low	74 Å²	74	106.2 Å²	106.2	61%	0.612	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-26	-166.2	0	0	0	0	0	115.4	E27 Q28	A25-E27 VanDerWaalsContact C-N 3.29Å; A25-E27 PolarHBondContact O-N 2.74Å; A25-Q28 PolarHBondContact O-N 3.32Å
26	N	39.1	Very low	34.9	Very low	126 Å²	126	112.2 Å²	112.2	67%	0.674	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-21	175.4	55.9	-26.4	0	0	0	113.7	P24	P24-N26 WeakPolarHBondContact CB-OD1 3.44Å; P24-N26 PolarHBondContact O-N 2.85Å; P24-N26 PolarHBondContact O-OD1 3.08Å
27	E	35.7	Very low	34.6	Very low	111 Å²	111	110 Å²	110	52%	0.519	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-9.4	175	-65.2	-175.9	159.7	0	0	113	Y23 P24 A25 L29	Y23-E27 WeakPolarHBondContact CD1-OE2 3.18Å; P24-E27 PolarHBondContact O-N 3.31Å; A25-E27 VanDerWaalsContact C-N 3.29Å; A25-E27 PolarHBondContact O-N 2.74Å; E27-L29 VanDerWaalsContact C-N 3.34Å; E27-L29 PolarHBondContact O-N 3.04Å
28	Q	34.6	Very low	34	Very low	69 Å²	69	111.9 Å²	111.9	32%	0.322	60%	0.598	S	S	.	*			trans	-82.6	-3.7	-175.8	-64.3	-178.5	-2.2	0	0	114.6	R20 Y23 A25 G30	R20-Q28 PolarHBondContact NH2-O 2.75Å; R20-Q28 PolarHBondContact O-NE2 3.34Å; Y23-Q28 PolarHBondContact O-NE2 2.77Å; A25-Q28 PolarHBondContact O-N 3.32Å; Q28-G30 VanDerWaalsContact C-N 3.26Å; Q28-G30 PolarHBondContact O-N 2.99Å
29	L	32.3	Very low	33.2	Very low	133 Å²	133	114.3 Å²	114.3	70%	0.696	60%	0.603	S	S	*	*			trans	-78.2	69.1	-179.1	-70.6	164.7	0	0	0	111.5	E27 Y79	E27-L29 VanDerWaalsContact C-N 3.34Å; E27-L29 PolarHBondContact O-N 3.04Å; L29-Y79 PolarHBondContact O-OH 3.4Å
30	G	30.6	Very low	32.5	Very low	28 Å²	28	115.3 Å²	115.3	29%	0.289	62%	0.616	S	S	.	*			trans	-134.9	132.1	171.2	0	0	0	0	0	110.3	R20 Q28	R20-G30 PolarHBondContact NH2-O 2.9Å; Q28-G30 VanDerWaalsContact C-N 3.26Å; Q28-G30 PolarHBondContact O-N 2.99Å
31	H	25.8	Very low	31.9	Very low	132 Å²	132	118 Å²	118	61%	0.611	64%	0.637	S	S	*	*			trans	70	74.8	178.7	-59.6	81	0	0	0	115.6	I33 Q109	H31-I33 PolarHBondContact O-N 3.19Å; H31-Q109 PolarHBondContact NE2-OE1 3.13Å
32	N	29.7	Very low	30.9	Very low	120 Å²	120	119.6 Å²	119.6	64%	0.642	64%	0.643	S	S	*	*			trans	-67.5	110.5	153.4	-79.8	-18.5	0	0	0	108.2	I34	N32-I34 PolarHBondContact O-N 3.3Å
33	I	27.3	Very low	29.8	Very low	148 Å²	148	121.3 Å²	121.3	76%	0.759	66%	0.656	S	S	*	*			trans	-52.3	125	171.7	-66.2	160.5	0	0	0	108.5	H31 V35	H31-I33 PolarHBondContact O-N 3.19Å; I33-V35 PolarHBondContact O-N 3.22Å
34	I	26.3	Very low	29.3	Very low	126 Å²	126	126 Å²	126	65%	0.646	68%	0.678	S	S	*	*			trans	-65.6	104.1	169	-65.7	170.8	0	0	0	106.6	N32 E36	N32-I34 PolarHBondContact O-N 3.3Å; I34-E36 VanDerWaalsContact C-N 3.34Å; I34-E36 HydrophobicContact CG2-CG 4.21Å; I34-E36 PolarHBondContact O-N 3.22Å; I34-E36 VanDerWaalsContact O-N 3.09Å
35	V	27	Very low	28.8	Very low	101 Å²	101	128 Å²	128	61%	0.612	69%	0.694	S	S	*	*			trans	-77.3	86.2	173.8	179.8	0	0	0	0	107.7	I33 G37 L38	I33-V35 PolarHBondContact O-N 3.22Å; V35-G37 PolarHBondContact O-N 3.44Å; V35-L38 HydrophobicContact CG1-CB 4.47Å; V35-L38 HydrophobicContact CG1-CD1 4.04Å; V35-L38 HydrophobicContact CG1-CG 4.16Å
36	E	25.8	Very low	28.1	Very low	186 Å²	186	132.6 Å²	132.6	87%	0.869	71%	0.706	S	S	*	*			trans	-81.7	8.8	169.5	-104.9	-166.6	166.6	0	0	113.4	I34	I34-E36 VanDerWaalsContact C-N 3.34Å; I34-E36 HydrophobicContact CG2-CG 4.21Å; I34-E36 PolarHBondContact O-N 3.22Å; I34-E36 VanDerWaalsContact O-N 3.09Å
37	G	27.3	Very low	27.3	Very low	64 Å²	64	131.7 Å²	131.7	66%	0.66	71%	0.71	S	S	*	*			trans	-96.3	-0.4	-173.9	0	0	0	0	0	117.8	V35	V35-G37 PolarHBondContact O-N 3.44Å
38	L	26.1	Very low	26.9	Very low	155 Å²	155	130.8 Å²	130.8	81%	0.812	72%	0.722	S	S	*	*			trans	-118.4	32.7	-171.6	-70.2	173.8	0	0	0	114.6	V35	V35-L38 HydrophobicContact CG1-CB 4.47Å; V35-L38 HydrophobicContact CG1-CD1 4.04Å; V35-L38 HydrophobicContact CG1-CG 4.16Å
39	R	24.9	Very low	26.3	Very low	236 Å²	236	134.1 Å²	134.1	89%	0.891	75%	0.747	S	S	*	*	S	Bend	trans	-87.4	121	152.6	-81.8	-175	177	-179.2	0.6	108.4
40	S	25.3	Very low	26	Very low	102 Å²	102	132.7 Å²	132.7	71%	0.713	75%	0.748	S	S	*	*	S	Bend	trans	88.7	105.2	171.8	78	0	0	0	0	117.3
41	N	28.2	Very low	25.7	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	77%	0.773	S	S	*	*			trans	65	84.5	139.1	-57.4	-14	0	0	0	118
42	T	25.6	Very low	25.7	Very low	137 Å²	137	139 Å²	139	84%	0.84	78%	0.783	S	S	*	*			trans	178.3	70.9	137.1	29.7	0	0	0	0	111.2
43	L	24.4	Very low	25.5	Very low	186 Å²	186	143 Å²	143	97%	0.974	80%	0.795	S	S	*	*			trans	-106.1	42.7	159.9	-96.9	167.6	0	0	0	110.6
44	K	25.5	Very low	25.3	Very low	188 Å²	188	141 Å²	141	82%	0.817	79%	0.794	S	S	*	*	S	Bend	trans	-120.2	129.2	159.7	-79.5	-174.5	176.7	179.6	0	108.2
45	S	24.8	Very low	25.2	Very low	115 Å²	115	139.2 Å²	139.2	80%	0.804	79%	0.793	S	S	*	*			trans	65.9	84.1	171.3	68.8	0	0	0	0	118.2
46	I	23.4	Very low	25.1	Very low	170 Å²	170	142.4 Å²	142.4	87%	0.872	81%	0.806	S	S	*	*			trans	-123.1	104.3	138	-60.9	178.1	0	0	0	106.5	A48	I46-A48 PolarHBondContact O-N 3.22Å
47	S	23.7	Very low	25.1	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	80%	0.804	S	S	*	*			trans	-66.2	114.9	169.6	35.9	0	0	0	0	109.1	T49	S47-T49 PolarHBondContact O-N 3.3Å
48	A	25.9	Very low	24.9	Very low	93 Å²	93	142.6 Å²	142.6	77%	0.769	82%	0.816	S	S	*	*			trans	-77.6	97.1	176.8	0	0	0	0	0	110.3	I46 S50	I46-A48 PolarHBondContact O-N 3.22Å; A48-S50 PolarHBondContact O-N 2.83Å
49	T	23.2	Very low	24.9	Very low	138 Å²	138	143.1 Å²	143.1	85%	0.847	82%	0.818	S	S	*	*			trans	-84.5	90.2	157.2	39.2	0	0	0	0	108.3	S47	S47-T49 PolarHBondContact O-N 3.3Å
50	S	24.8	Very low	25.2	Very low	104 Å²	104	137.4 Å²	137.4	73%	0.727	81%	0.811	S	S	*	*			trans	-121.6	113.1	164.2	61.2	0	0	0	0	109.1	A48 S52	A48-S50 PolarHBondContact O-N 2.83Å; S50-S52 PolarHBondContact O-N 3.03Å
51	H	25.6	Very low	25.3	Very low	175 Å²	175	140.6 Å²	140.6	81%	0.81	82%	0.819	S	S	*	*			trans	-41.8	119.8	-179.9	-72.3	-81.1	0	0	0	113.6	F53	H51-F53 PolarHBondContact O-N 3.35Å
52	S	25.8	Very low	25.2	Very low	117 Å²	117	143.5 Å²	143.5	82%	0.818	82%	0.818	S	S	*	*			trans	-63	108.1	162.6	50.4	0	0	0	0	109.8	S50	S50-S52 PolarHBondContact O-N 3.03Å
53	F	23.9	Very low	25.4	Very low	204 Å²	204	142.6 Å²	142.6	90%	0.895	81%	0.808	S	S	*	*			trans	-73.9	130	153.3	-86.6	-89.1	0	0	0	108.2	H51	H51-F53 PolarHBondContact O-N 3.35Å
54	S	24.6	Very low	25.5	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	79%	0.794	S	S	*	*			trans	-79.4	131.1	-173.3	49.8	0	0	0	0	113.2
55	S	23.8	Very low	25.7	Very low	90 Å²	90	135.7 Å²	135.7	63%	0.629	78%	0.783	S	S	*	*			trans	64	117.8	136.1	64.2	0	0	0	0	121.4
56	D	23.7	Very low	26	Very low	167 Å²	167	137.3 Å²	137.3	89%	0.893	78%	0.776	S	S	*	*			trans	96.4	119.1	131.5	-60	-15.3	0	0	0	119.9
57	G	26.3	Very low	26.4	Very low	79 Å²	79	136 Å²	136	81%	0.814	77%	0.77	S	S	*	*			trans	131.4	52.3	158.5	0	0	0	0	0	116.8	I59	G57-I59 PolarHBondContact O-N 3.5Å
58	L	23.8	Very low	26.7	Very low	175 Å²	175	140.1 Å²	140.1	92%	0.916	77%	0.771	S	S	*	*			trans	-56	126.9	162.5	-80.5	142.1	0	0	0	111.4
59	I	26	Very low	26.8	Very low	166 Å²	166	142.2 Å²	142.2	85%	0.851	77%	0.767	S	S	*	*			trans	-157.5	140.6	139.4	-88.6	143.8	0	0	0	107.1	G57	G57-I59 PolarHBondContact O-N 3.5Å
60	P	29.9	Very low	27.1	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-95.6	138.1	-138	31.4	-25.5	0	0	0	114.5	R62	P60-R62 PolarHBondContact O-N 2.97Å
61	I	27.7	Very low	27.6	Very low	170 Å²	170	139.2 Å²	139.2	87%	0.872	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-53.8	120.1	166.8	-61.2	170.6	0	0	0	108.6	N63	I61-N63 PolarHBondContact O-N 2.85Å
62	R	25.9	Very low	28.1	Very low	211 Å²	211	138.3 Å²	138.3	80%	0.796	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-47.1	128	179.5	-162.4	173.4	179.8	167	-0.8	111	P60 E64	P60-R62 PolarHBondContact O-N 2.97Å; R62-E64 PolarHBondContact O-N 3.21Å
63	N	29.9	Very low	28.6	Very low	118 Å²	118	141.6 Å²	141.6	63%	0.631	75%	0.745	S	S	*	*	S	Bend	trans	-73.7	41.3	-164	-133.2	-6.2	0	0	0	114.7	I61	I61-N63 PolarHBondContact O-N 2.85Å
64	E	27.4	Very low	29.4	Very low	144 Å²	144	135.2 Å²	135.2	67%	0.673	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-5.2	-179.2	-78.3	-179.2	-174.2	0	0	114.3	R62	R62-E64 PolarHBondContact O-N 3.21Å
65	S	30.4	Very low	30.9	Very low	85 Å²	85	133.9 Å²	133.9	59%	0.594	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-7.3	178.6	61.7	0	0	0	0	115.2
66	K	30.7	Very low	32.5	Very low	149 Å²	149	135 Å²	135	65%	0.648	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-22.5	179.6	-78.2	-172.8	178.3	-179.1	0	114.6
67	N	31	Very low	34.1	Very low	142 Å²	142	130.2 Å²	130.2	76%	0.759	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-13.8	177.3	-79.4	-5.4	0	0	0	114.1
68	Y	31.2	Very low	35.8	Very low	195 Å²	195	130.6 Å²	130.6	77%	0.765	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-17.8	176.9	-81.4	-80.4	0	0	0	114.1	S71	Y68-S71 PolarHBondContact O-OG 2.78Å
69	M	26.8	Very low	38	Very low	136 Å²	136	125.4 Å²	125.4	67%	0.67	64%	0.643	S	S	*	*	S	Bend	trans	-87.6	-13.8	-177.4	-82.7	-102.6	73.5	0	0	114.7
70	S	30.6	Very low	40.1	Very low	103 Å²	103	120.4 Å²	120.4	72%	0.72	62%	0.615	S	S	*	*	S	Bend	trans	-82.4	-13.6	175.7	57.9	0	0	0	0	113.6
71	S	33.6	Very low	42.1	Very low	76 Å²	76	116.6 Å²	116.6	53%	0.531	59%	0.592	S	S	.	*	S	Bend	trans	-90.5	-9.1	-172.4	62	0	0	0	0	115.7	Y68	Y68-S71 PolarHBondContact O-OG 2.78Å
72	F	37	Very low	44.4	Very low	157 Å²	157	111.5 Å²	111.5	69%	0.689	57%	0.568	S	S	*	*			trans	-146.7	61.6	-176.4	-93.3	-87.9	0	0	0	113.5	L74	F72-L74 VanDerWaalsContact C-N 3.31Å; F72-L74 HydrophobicContact CD1-CD1 3.65Å; F72-L74 HydrophobicContact CD1-CG 4.08Å; F72-L74 HydrophobicContact CE1-CD1 3.81Å; F72-L74 HydrophobicContact CE1-CG 4.44Å; F72-L74 PolarHBondContact O-N 2.95Å
73	K	35.6	Very low	46.9	Very low	186 Å²	186	102.8 Å²	102.8	81%	0.809	54%	0.539	S	S	*	.			trans	-93	72.2	154.2	-77.3	-173.1	179	179.9	0	108.6	T75	K73-T75 PolarHBondContact O-N 2.93Å
74	L	42.3	Very low	49.4	Very low	69 Å²	69	97.2 Å²	97.2	36%	0.361	51%	0.509	S	S	.	.			trans	-61.1	122.9	162.6	-75.6	157.9	0	0	0	106.6	F72 Q78 T82	F72-L74 VanDerWaalsContact C-N 3.31Å; F72-L74 HydrophobicContact CD1-CD1 3.65Å; F72-L74 HydrophobicContact CD1-CG 4.08Å; F72-L74 HydrophobicContact CE1-CD1 3.81Å; F72-L74 HydrophobicContact CE1-CG 4.44Å; F72-L74 PolarHBondContact O-N 2.95Å; L74-Q78 VanDerWaalsContact CA-OE1 3.25Å; L74-Q78 HydrophobicContact CB-CB 3.98Å; L74-Q78 HydrophobicContact CD2-CB 3.51Å; L74-Q78 HydrophobicContact CD2-CG 4.33Å; L74-Q78 HydrophobicContact CG-CB 4.35Å; L74-T82 HydrophobicContact CD2-CG2 4.31Å
75	T	55.7	Low	52	Low	78 Å²	78	99.3 Å²	99.3	48%	0.479	51%	0.511	S	S	.	.			trans	-57.9	155.4	170.1	54.7	0	0	0	0	109.3	K73 A77 Q78 Y79	K73-T75 PolarHBondContact O-N 2.93Å; T75-A77 PolarHBondContact O-N 3.5Å; T75-A77 VanDerWaalsContact O-N 3.12Å; T75-Q78 CarbonylContact O-C 3.36Å; T75-Q78 WeakPolarHBondContact O-CA 3.37Å; T75-Q78 WeakPolarHBondContact O-CB 3.43Å; T75-Q78 PolarHBondContact O-N 3.27Å; T75-Q78 VanDerWaalsContact OG1-CD 3.31Å; T75-Q78 WeakPolarHBondContact OG1-CG 3.19Å; T75-Q78 PolarHBondContact OG1-N 2.97Å; T75-Q78 PolarHBondContact OG1-OE1 2.92Å; T75-Y79 PolarHBondContact O-N 3.38Å
76	T	57.6	Low	54.5	Low	114 Å²	114	101.6 Å²	101.6	70%	0.699	51%	0.51	S	S	*	.	H	α-helix	trans	-50.5	-40	178.4	40.4	0	0	0	0	111.9	Y79 F80	T76-Y79 PolarHBondContact O-N 2.83Å; T76-F80 WeakPolarHBondContact O-CD2 3.4Å; T76-F80 PolarHBondContact O-N 2.91Å
77	A	55.5	Low	57.2	Low	66 Å²	66	96.3 Å²	96.3	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-60.5	-42.6	172.6	0	0	0	0	0	113.3	T75 F80 S81	T75-A77 PolarHBondContact O-N 3.5Å; T75-A77 VanDerWaalsContact O-N 3.12Å; A77-F80 PolarHBondContact O-N 3.47Å; A77-S81 WeakPolarHBondContact O-CB 3.42Å; A77-S81 PolarHBondContact O-N 3.34Å; A77-S81 PolarHBondContact O-OG 3.13Å
78	Q	63.9	Low	59.9	Low	87 Å²	87	91.1 Å²	91.1	41%	0.407	46%	0.459	S	S	.	.	H	α-helix	trans	-69.3	-34.1	175.9	-70.1	169.6	-17.9	0	0	112.6	L74 T75 S81 T82	L74-Q78 VanDerWaalsContact CA-OE1 3.25Å; L74-Q78 HydrophobicContact CB-CB 3.98Å; L74-Q78 HydrophobicContact CD2-CB 3.51Å; L74-Q78 HydrophobicContact CD2-CG 4.33Å; L74-Q78 HydrophobicContact CG-CB 4.35Å; T75-Q78 CarbonylContact O-C 3.36Å; T75-Q78 WeakPolarHBondContact O-CA 3.37Å; T75-Q78 WeakPolarHBondContact O-CB 3.43Å; T75-Q78 PolarHBondContact O-N 3.27Å; T75-Q78 VanDerWaalsContact OG1-CD 3.31Å; T75-Q78 WeakPolarHBondContact OG1-CG 3.19Å; T75-Q78 PolarHBondContact OG1-N 2.97Å; T75-Q78 PolarHBondContact OG1-OE1 2.92Å; Q78-S81 WeakPolarHBondContact CA-OG 3.41Å; Q78-S81 PolarHBondContact O-OG 3.33Å; Q78-T82 WeakPolarHBondContact O-CB 3.38Å; Q78-T82 VanDerWaalsContact O-CG2 3.27Å; Q78-T82 WeakPolarHBondContact O-CG2 3.44Å; Q78-T82 PolarHBondContact O-N 3.41Å; Q78-T82 PolarHBondContact O-OG1 3.03Å
79	Y	69.1	Low	62.6	Low	66 Å²	66	88.2 Å²	88.2	26%	0.259	45%	0.45	S	S	.	.	H	α-helix	trans	-63.9	-47.1	173.2	176.6	-93.7	0	0	0	111.3	L29 T75 T76 T82 T83	L29-Y79 PolarHBondContact O-OH 3.4Å; T75-Y79 PolarHBondContact O-N 3.38Å; T76-Y79 PolarHBondContact O-N 2.83Å; Y79-T82 PolarHBondContact O-N 3Å; Y79-T82 PolarHBondContact O-OG1 3.42Å; Y79-T83 VanDerWaalsContact O-CB 3.3Å; Y79-T83 WeakPolarHBondContact O-CB 3.28Å; Y79-T83 PolarHBondContact O-N 3.19Å; Y79-T83 PolarHBondContact O-OG1 3.46Å
80	F	70.4	Confident	65.5	Low	60 Å²	60	83 Å²	83	26%	0.263	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-45	175.8	-74.2	-62.1	0	0	0	111.5	T76 A77 T82 T83 I84 L113 M172	T76-F80 WeakPolarHBondContact O-CD2 3.4Å; T76-F80 PolarHBondContact O-N 2.91Å; A77-F80 PolarHBondContact O-N 3.47Å; F80-T82 PolarHBondContact O-N 3.32Å; F80-T83 PolarHBondContact O-N 2.93Å; F80-I84 WeakPolarHBondContact O-CB 3.47Å; F80-I84 WeakPolarHBondContact O-CD1 3.18Å; F80-I84 WeakPolarHBondContact O-CG1 3.13Å; F80-I84 PolarHBondContact O-N 2.88Å; F80-L113 HydrophobicContact CD1-CD2 3.98Å; F80-L113 HydrophobicContact CE1-CD2 4Å; F80-M172 HydrophobicContact CB-SD 4.33Å
81	S	70.9	Confident	68.2	Low	36 Å²	36	78.3 Å²	78.3	25%	0.252	39%	0.394	S	S	.	.	H	α-helix	trans	-64.2	-41.3	-179.8	73	0	0	0	0	113.1	A77 Q78 R85	A77-S81 WeakPolarHBondContact O-CB 3.42Å; A77-S81 PolarHBondContact O-N 3.34Å; A77-S81 PolarHBondContact O-OG 3.13Å; Q78-S81 WeakPolarHBondContact CA-OG 3.41Å; Q78-S81 PolarHBondContact O-OG 3.33Å; S81-R85 VanDerWaalsContact O-CB 3.27Å; S81-R85 WeakPolarHBondContact O-CB 3.34Å; S81-R85 PolarHBondContact O-N 3.08Å
82	T	77.1	Confident	70.7	Confident	63 Å²	63	79.2 Å²	79.2	39%	0.387	39%	0.389	S	S	.	.	H	α-helix	trans	-67.8	-38.7	175.9	51.3	0	0	0	0	112.1	L74 Q78 Y79 F80 R85 K86	L74-T82 HydrophobicContact CD2-CG2 4.31Å; Q78-T82 WeakPolarHBondContact O-CB 3.38Å; Q78-T82 VanDerWaalsContact O-CG2 3.27Å; Q78-T82 WeakPolarHBondContact O-CG2 3.44Å; Q78-T82 PolarHBondContact O-N 3.41Å; Q78-T82 PolarHBondContact O-OG1 3.03Å; Y79-T82 PolarHBondContact O-N 3Å; Y79-T82 PolarHBondContact O-OG1 3.42Å; F80-T82 PolarHBondContact O-N 3.32Å; T82-R85 PolarHBondContact O-N 2.82Å; T82-K86 PolarHBondContact O-N 3.29Å
83	T	79.1	Confident	73.1	Confident	28 Å²	28	77.7 Å²	77.7	17%	0.172	39%	0.386	C	S	.	.	H	α-helix	trans	-67.5	-46.9	177.2	-57.3	0	0	0	0	111.8	Y79 F80 R85 K86 H87 L113	Y79-T83 VanDerWaalsContact O-CB 3.3Å; Y79-T83 WeakPolarHBondContact O-CB 3.28Å; Y79-T83 PolarHBondContact O-N 3.19Å; Y79-T83 PolarHBondContact O-OG1 3.46Å; F80-T83 PolarHBondContact O-N 2.93Å; T83-R85 VanDerWaalsContact C-N 3.3Å; T83-R85 PolarHBondContact O-N 3.36Å; T83-K86 PolarHBondContact O-N 3.34Å; T83-H87 PolarHBondContact O-CD2 3.16Å; T83-H87 PolarHBondContact O-N 3.45Å; T83-L113 HydrophobicContact CG2-CD1 3.82Å
84	I	81.1	Confident	75.5	Confident	1 Å²	1	69 Å²	69	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-57.3	-46.2	174.1	-69	163.4	0	0	0	109.7	F80 K86 H87 H88 L113 A114 F120 I171 M172	F80-I84 WeakPolarHBondContact O-CB 3.47Å; F80-I84 WeakPolarHBondContact O-CD1 3.18Å; F80-I84 WeakPolarHBondContact O-CG1 3.13Å; F80-I84 PolarHBondContact O-N 2.88Å; I84-K86 VanDerWaalsContact C-N 3.34Å; I84-K86 PolarHBondContact O-N 3.39Å; I84-H87 PolarHBondContact O-N 3.14Å; I84-H88 WeakPolarHBondContact O-CB 3.1Å; I84-H88 PolarHBondContact O-N 3.35Å; I84-L113 HydrophobicContact CD1-CB 4Å; I84-L113 HydrophobicContact CG1-CB 3.68Å; I84-L113 HydrophobicContact CG1-CD1 3.93Å; I84-L113 HydrophobicContact CG1-CG 4.48Å; I84-A114 HydrophobicContact CD1-CB 4Å; I84-F120 HydrophobicContact CG2-CE1 4.41Å; I84-F120 HydrophobicContact CG2-CE2 3.68Å; I84-F120 HydrophobicContact CG2-CZ 3.36Å; I84-I171 HydrophobicContact CB-CG2 4.17Å; I84-I171 HydrophobicContact CD1-CG2 4.26Å; I84-I171 HydrophobicContact CG2-CG2 3.57Å; I84-M172 HydrophobicContact CD1-SD 3.79Å
85	R	82.4	Confident	77.6	Confident	189 Å²	189	67.2 Å²	67.2	71%	0.713	34%	0.34	S	S	*	.	H	α-helix	trans	-61.8	-39	178.4	-170.6	177.5	-173.9	172.3	2.6	112.7	S81 T82 T83 K89	S81-R85 VanDerWaalsContact O-CB 3.27Å; S81-R85 WeakPolarHBondContact O-CB 3.34Å; S81-R85 PolarHBondContact O-N 3.08Å; T82-R85 PolarHBondContact O-N 2.82Å; T83-R85 VanDerWaalsContact C-N 3.3Å; T83-R85 PolarHBondContact O-N 3.36Å; R85-K89 WeakPolarHBondContact O-CB 3.31Å; R85-K89 PolarHBondContact O-N 3.09Å
86	K	83.7	Confident	79	Confident	132 Å²	132	72.1 Å²	72.1	57%	0.574	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-51.1	175.9	-176.5	-178.8	177.9	-178.4	0	110.9	T82 T83 I84 K89 C90	T82-K86 PolarHBondContact O-N 3.29Å; T83-K86 PolarHBondContact O-N 3.34Å; I84-K86 VanDerWaalsContact C-N 3.34Å; I84-K86 PolarHBondContact O-N 3.39Å; K86-K89 PolarHBondContact O-N 2.9Å; K86-C90 PolarHBondContact O-N 3.04Å; K86-C90 PolarHBondContact O-SG 3.45Å; K86-C90 VanDerWaalsContact O-SG 3.34Å
87	H	86.9	Confident	80.3	Confident	38 Å²	38	70.6 Å²	70.6	18%	0.176	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-44.3	178.2	-77.6	-56.9	0	0	0	112	T83 I84 K89 C90 V91 H106 C110	T83-H87 PolarHBondContact O-CD2 3.16Å; T83-H87 PolarHBondContact O-N 3.45Å; I84-H87 PolarHBondContact O-N 3.14Å; H87-K89 VanDerWaalsContact C-N 3.33Å; H87-K89 PolarHBondContact O-N 3.32Å; H87-C90 CarbonylContact O-C 3.55Å; H87-C90 WeakPolarHBondContact O-CA 3.22Å; H87-C90 WeakPolarHBondContact O-CB 3.44Å; H87-C90 PolarHBondContact O-N 2.07Å; H87-V91 WeakPolarHBondContact O-CG2 3.38Å; H87-V91 PolarHBondContact O-N 2.79Å; H87-H106 AromaticContact CE1-ND1 3.82Å; H87-H106 AromaticContact ND1-CE1 3.92Å; H87-H106 AromaticContact ND1-ND1 3.16Å; H87-H106 PolarHBondContact ND1-ND1 3.48Å; H87-H106 VanDerWaalsContact ND1-ND1 3.16Å; H87-C110 WeakPolarHBondContact CB-SG 3.3Å
88	H	87	Confident	81.5	Confident	34 Å²	34	75.8 Å²	75.8	16%	0.157	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-42.4	177.3	-175.1	-118	0	0	0	112.3	I84 C90 V91 Q92 C110 F120 E123	I84-H88 WeakPolarHBondContact O-CB 3.1Å; I84-H88 PolarHBondContact O-N 3.35Å; H88-C90 VanDerWaalsContact C-N 3.32Å; H88-C90 PolarHBondContact O-N 3.44Å; H88-V91 WeakPolarHBondContact O-CB 3.45Å; H88-V91 PolarHBondContact O-N 3.46Å; H88-V91 VanDerWaalsContact O-N 3.17Å; H88-Q92 PolarHBondContact CE1-NE2 3.15Å; H88-Q92 WeakPolarHBondContact O-CG 3.4Å; H88-Q92 PolarHBondContact O-N 3.09Å; H88-C110 PolarHBondContact N-SG 3.27Å; H88-C110 VanDerWaalsContact N-SG 3.45Å; H88-F120 HydrophobicContact CB-CE1 4.42Å; H88-F120 AromaticContact CD2-CE1 3.57Å; H88-E123 IonicContact CD2-OE1 3.29Å; H88-E123 IonicContact CD2-OE2 3.66Å; H88-E123 PolarHBondContact CD2-OE2 2.9Å; H88-E123 IonicContact CE1-OE1 3.72Å; H88-E123 IonicContact NE2-OE1 2.8Å; H88-E123 PolarHBondContact NE2-OE1 3.25Å; H88-E123 IonicContact NE2-OE2 2.7Å; H88-E123 PolarHBondContact NE2-OE2 3.19Å
89	K	87.4	Confident	82.7	Confident	134 Å²	134	74.5 Å²	74.5	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-61.8	-40.1	173	-167.2	177.3	-177.4	-179.5	0	111.8	R85 K86 H87 V91 Q92 M93	R85-K89 WeakPolarHBondContact O-CB 3.31Å; R85-K89 PolarHBondContact O-N 3.09Å; K86-K89 PolarHBondContact O-N 2.9Å; H87-K89 VanDerWaalsContact C-N 3.33Å; H87-K89 PolarHBondContact O-N 3.32Å; K89-V91 VanDerWaalsContact C-N 3.35Å; K89-Q92 PolarHBondContact O-N 3.32Å; K89-M93 WeakPolarHBondContact O-CG 3.42Å; K89-M93 PolarHBondContact O-N 3.47Å
90	C	88.1	Confident	83.5	Confident	27 Å²	27	73 Å²	73	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-64.1	-37.6	174.5	-66.2	0	0	0	0	112.3	K86 H87 H88 M93 A94 H106	K86-C90 PolarHBondContact O-N 3.04Å; K86-C90 PolarHBondContact O-SG 3.45Å; K86-C90 VanDerWaalsContact O-SG 3.34Å; H87-C90 CarbonylContact O-C 3.55Å; H87-C90 WeakPolarHBondContact O-CA 3.22Å; H87-C90 WeakPolarHBondContact O-CB 3.44Å; H87-C90 PolarHBondContact O-N 2.07Å; H88-C90 VanDerWaalsContact C-N 3.32Å; H88-C90 PolarHBondContact O-N 3.44Å; C90-M93 PolarHBondContact O-N 3.21Å; C90-A94 VanDerWaalsContact O-CB 3.24Å; C90-A94 WeakPolarHBondContact O-CB 3.21Å; C90-A94 PolarHBondContact O-N 3.5Å; C90-H106 HydrophobicContact CB-CB 4.35Å; C90-H106 VanDerWaalsContact CB-CD2 3.42Å; C90-H106 WeakPolarHBondContact CB-CD2 3.35Å
91	V	87	Confident	84.3	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.024	37%	0.371	C	S	.	.	H	α-helix	trans	-58.3	-53	172.1	177	0	0	0	0	110	H87 H88 K89 M93 A94 V95 H106 I107 I127	H87-V91 WeakPolarHBondContact O-CG2 3.38Å; H87-V91 PolarHBondContact O-N 2.79Å; H88-V91 WeakPolarHBondContact O-CB 3.45Å; H88-V91 PolarHBondContact O-N 3.46Å; H88-V91 VanDerWaalsContact O-N 3.17Å; K89-V91 VanDerWaalsContact C-N 3.35Å; V91-M93 VanDerWaalsContact C-N 3.28Å; V91-M93 PolarHBondContact O-N 3.42Å; V91-A94 PolarHBondContact O-N 3.18Å; V91-A94 VanDerWaalsContact O-N 3.14Å; V91-V95 HydrophobicContact CG1-CG2 4.1Å; V91-V95 WeakPolarHBondContact O-CB 3.45Å; V91-V95 VanDerWaalsContact O-CG2 3.28Å; V91-V95 WeakPolarHBondContact O-CG2 3.28Å; V91-V95 PolarHBondContact O-N 2.99Å; V91-H106 HydrophobicContact CG2-CB 3.57Å; V91-I107 HydrophobicContact CG1-CB 4.35Å; V91-I107 HydrophobicContact CG1-CD1 4.29Å; V91-I107 HydrophobicContact CG2-CB 3.81Å; V91-I107 HydrophobicContact CG2-CD1 4.12Å; V91-I107 VanDerWaalsContact CG2-N 3.31Å; V91-I127 HydrophobicContact CG1-CD1 3.92Å
92	Q	87.7	Confident	85	Confident	95 Å²	95	78 Å²	78	44%	0.444	38%	0.378	S	S	.	.	H	α-helix	trans	-58	-39.9	-179.7	-68.2	179.6	-9.4	0	0	112.7	H88 K89 K96	H88-Q92 PolarHBondContact CE1-NE2 3.15Å; H88-Q92 WeakPolarHBondContact O-CG 3.4Å; H88-Q92 PolarHBondContact O-N 3.09Å; K89-Q92 PolarHBondContact O-N 3.32Å; Q92-K96 WeakPolarHBondContact O-CG 3.21Å; Q92-K96 PolarHBondContact O-N 3.47Å
93	M	86.6	Confident	85.6	Confident	125 Å²	125	75 Å²	75	62%	0.616	36%	0.359	S	S	*	.	H	α-helix	trans	-68.8	-43.9	176.4	-68.8	-176.3	80.2	0	0	112	K89 C90 V91 K96 S97	K89-M93 WeakPolarHBondContact O-CG 3.42Å; K89-M93 PolarHBondContact O-N 3.47Å; C90-M93 PolarHBondContact O-N 3.21Å; V91-M93 VanDerWaalsContact C-N 3.28Å; V91-M93 PolarHBondContact O-N 3.42Å; M93-K96 PolarHBondContact O-N 3.26Å; M93-S97 PolarHBondContact O-N 3.41Å; M93-S97 PolarHBondContact O-OG 3.41Å
94	A	86.6	Confident	86.1	Confident	2 Å²	2	75 Å²	75	2%	0.017	36%	0.357	C	S	.	.	H	α-helix	trans	-65.4	-40.2	179.7	0	0	0	0	0	112.2	C90 V91 K96 S97 K98 D99 K102 A103	C90-A94 VanDerWaalsContact O-CB 3.24Å; C90-A94 WeakPolarHBondContact O-CB 3.21Å; C90-A94 PolarHBondContact O-N 3.5Å; V91-A94 PolarHBondContact O-N 3.18Å; V91-A94 VanDerWaalsContact O-N 3.14Å; A94-K96 VanDerWaalsContact C-N 3.33Å; A94-K96 PolarHBondContact O-N 3.35Å; A94-S97 WeakPolarHBondContact CA-OG 3.32Å; A94-S97 CarbonylContact O-C 3.59Å; A94-S97 PolarHBondContact O-N 3.41Å; A94-S97 PolarHBondContact O-OG 3.23Å; A94-K98 PolarHBondContact O-N 2.82Å; A94-K98 VanDerWaalsContact O-N 3.12Å; A94-D99 PolarHBondContact O-N 3.43Å; A94-K102 HydrophobicContact CB-CB 4.14Å; A94-K102 HydrophobicContact CB-CD 4.49Å; A94-K102 HydrophobicContact CB-CG 4.2Å; A94-A103 HydrophobicContact CB-CB 3.8Å
95	V	85	Confident	86.5	Confident	32 Å²	32	78.8 Å²	78.8	19%	0.194	38%	0.375	C	S	.	.	H	α-helix	trans	-61.8	-41.7	174	173.2	0	0	0	0	111	V91 K98 A103 I127	V91-V95 HydrophobicContact CG1-CG2 4.1Å; V91-V95 WeakPolarHBondContact O-CB 3.45Å; V91-V95 VanDerWaalsContact O-CG2 3.28Å; V91-V95 WeakPolarHBondContact O-CG2 3.28Å; V91-V95 PolarHBondContact O-N 2.99Å; V95-K98 PolarHBondContact O-N 3.07Å; V95-A103 HydrophobicContact CG2-CB 3.82Å; V95-I127 HydrophobicContact CG2-CD1 4.28Å; V95-I127 HydrophobicContact CG2-CG1 4Å
96	K	85.2	Confident	86.8	Confident	182 Å²	182	70.2 Å²	70.2	79%	0.791	34%	0.343	S	S	*	.	H	α-helix	trans	-66.6	-36.1	175.1	-75.4	178.1	-179.8	-175.8	0	112.6	Q92 M93 A94 K98	Q92-K96 WeakPolarHBondContact O-CG 3.21Å; Q92-K96 PolarHBondContact O-N 3.47Å; M93-K96 PolarHBondContact O-N 3.26Å; A94-K96 VanDerWaalsContact C-N 3.33Å; A94-K96 PolarHBondContact O-N 3.35Å; K96-K98 PolarHBondContact O-N 3.18Å
97	S	86	Confident	87.1	Confident	81 Å²	81	63.9 Å²	63.9	57%	0.566	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	3.4	176.5	68.6	0	0	0	0	113.9	M93 A94 D99	M93-S97 PolarHBondContact O-N 3.41Å; M93-S97 PolarHBondContact O-OG 3.41Å; A94-S97 WeakPolarHBondContact CA-OG 3.32Å; A94-S97 CarbonylContact O-C 3.59Å; A94-S97 PolarHBondContact O-N 3.41Å; A94-S97 PolarHBondContact O-OG 3.23Å; S97-D99 PolarHBondContact O-N 3.26Å
98	K	81.2	Confident	87.3	Confident	176 Å²	176	64.3 Å²	64.3	77%	0.765	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	17.4	-173.9	-57.3	-177.7	178.2	-178.7	0	114.5	A94 V95 K96 M100	A94-K98 PolarHBondContact O-N 2.82Å; A94-K98 VanDerWaalsContact O-N 3.12Å; V95-K98 PolarHBondContact O-N 3.07Å; K96-K98 PolarHBondContact O-N 3.18Å; K98-M100 HydrophobicContact CB-CE 4.47Å; K98-M100 PolarHBondContact O-N 2.89Å; K98-M100 VanDerWaalsContact O-N 3.17Å
99	D	88.2	Confident	87.4	Confident	60 Å²	60	63.8 Å²	63.8	32%	0.321	32%	0.317	S	S	.	.			trans	-87.1	84.7	175	-174.8	-9.7	0	0	0	109.4	A94 S97 T101 K102 A103	A94-D99 PolarHBondContact O-N 3.43Å; S97-D99 PolarHBondContact O-N 3.26Å; D99-T101 VanDerWaalsContact C-N 3.28Å; D99-T101 PolarHBondContact O-N 3.21Å; D99-T101 PolarHBondContact OD1-N 3.29Å; D99-T101 PolarHBondContact OD1-OG1 2.66Å; D99-K102 HydrophobicContact CB-CB 4.3Å; D99-K102 VanDerWaalsContact CG-CB 3.46Å; D99-K102 PolarHBondContact O-N 3.44Å; D99-K102 PolarHBondContact OD1-N 3.05Å; D99-K102 VanDerWaalsContact OD1-N 3.09Å; D99-K102 VanDerWaalsContact OD2-CB 3.31Å; D99-K102 WeakPolarHBondContact OD2-CB 3.09Å; D99-A103 WeakPolarHBondContact O-CB 3.16Å; D99-A103 PolarHBondContact O-N 3.18Å
100	M	85.5	Confident	87.3	Confident	35 Å²	35	57.4 Å²	57.4	17%	0.172	29%	0.289	C	S	.	.	H	α-helix	trans	-67.7	-29.4	-176.7	-56.4	-54.7	168	0	0	112.3	K98 A103 M104 K130 L131	K98-M100 HydrophobicContact CB-CE 4.47Å; K98-M100 PolarHBondContact O-N 2.89Å; K98-M100 VanDerWaalsContact O-N 3.17Å; M100-A103 PolarHBondContact O-N 3.1Å; M100-M104 WeakPolarHBondContact O-CB 3.11Å; M100-M104 PolarHBondContact O-N 3.31Å; M100-K130 HydrophobicContact CE-CB 3.76Å; M100-K130 HydrophobicContact CE-CD 3.62Å; M100-K130 HydrophobicContact CE-CG 4.18Å; M100-K130 HydrophobicContact SD-CB 3.93Å; M100-K130 HydrophobicContact SD-CD 3.99Å; M100-L131 HydrophobicContact CB-CD1 4.36Å; M100-L131 HydrophobicContact CB-CD2 3.56Å; M100-L131 HydrophobicContact CB-CG 4Å; M100-L131 HydrophobicContact CG-CD2 3.98Å; M100-L131 HydrophobicContact CG-CG 4.38Å
101	T	88.1	Confident	87.3	Confident	111 Å²	111	57.1 Å²	57.1	68%	0.681	29%	0.285	S	S	*	.	H	α-helix	trans	-66.7	-44.8	179.5	59.6	0	0	0	0	111.5	D99 M104 H105	D99-T101 VanDerWaalsContact C-N 3.28Å; D99-T101 PolarHBondContact O-N 3.21Å; D99-T101 PolarHBondContact OD1-N 3.29Å; D99-T101 PolarHBondContact OD1-OG1 2.66Å; T101-M104 PolarHBondContact O-N 2.83Å; T101-H105 PolarHBondContact O-N 3.1Å
102	K	86	Confident	87	Confident	90 Å²	90	63.8 Å²	63.8	39%	0.391	31%	0.314	S	S	.	.	H	α-helix	trans	-69.5	-37.7	175.9	-172.1	174.4	-176.6	176.2	0	112.1	A94 D99 M104 H105 H106	A94-K102 HydrophobicContact CB-CB 4.14Å; A94-K102 HydrophobicContact CB-CD 4.49Å; A94-K102 HydrophobicContact CB-CG 4.2Å; D99-K102 HydrophobicContact CB-CB 4.3Å; D99-K102 VanDerWaalsContact CG-CB 3.46Å; D99-K102 PolarHBondContact O-N 3.44Å; D99-K102 PolarHBondContact OD1-N 3.05Å; D99-K102 VanDerWaalsContact OD1-N 3.09Å; D99-K102 VanDerWaalsContact OD2-CB 3.31Å; D99-K102 WeakPolarHBondContact OD2-CB 3.09Å; K102-M104 VanDerWaalsContact C-N 3.35Å; K102-H105 PolarHBondContact O-N 2.7Å; K102-H106 PolarHBondContact O-CD2 3.44Å; K102-H106 VanDerWaalsContact O-CD2 3.3Å; K102-H106 PolarHBondContact O-N 3.4Å; K102-H106 VanDerWaalsContact O-N 3.12Å
103	A	89.6	Confident	86.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-47	173.8	0	0	0	0	0	111	A94 V95 D99 M100 H106 I107 I127	A94-A103 HydrophobicContact CB-CB 3.8Å; V95-A103 HydrophobicContact CG2-CB 3.82Å; D99-A103 WeakPolarHBondContact O-CB 3.16Å; D99-A103 PolarHBondContact O-N 3.18Å; M100-A103 PolarHBondContact O-N 3.1Å; A103-H106 PolarHBondContact O-N 2.96Å; A103-I107 WeakPolarHBondContact O-CG2 3.39Å; A103-I107 PolarHBondContact O-N 3.49Å; A103-I127 HydrophobicContact CB-CD1 3.86Å; A103-I127 HydrophobicContact CB-CG1 4.28Å; A103-I127 HydrophobicContact CB-CG2 4.39Å
104	M	89.6	Confident	86.4	Confident	26 Å²	26	55.3 Å²	55.3	13%	0.128	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-47.1	177.8	-168.4	61	74.2	0	0	111.7	M100 T101 K102 H106 I107 D108 R124 I127 Y128 L131	M100-M104 WeakPolarHBondContact O-CB 3.11Å; M100-M104 PolarHBondContact O-N 3.31Å; T101-M104 PolarHBondContact O-N 2.83Å; K102-M104 VanDerWaalsContact C-N 3.35Å; M104-H106 VanDerWaalsContact C-N 3.32Å; M104-H106 PolarHBondContact O-N 3.44Å; M104-I107 WeakPolarHBondContact O-CG2 3.16Å; M104-I107 PolarHBondContact O-N 3.3Å; M104-I107 HydrophobicContact SD-CG2 4.14Å; M104-D108 PolarHBondContact O-N 3.03Å; M104-D108 VanDerWaalsContact O-N 3.08Å; M104-R124 HydrophobicContact SD-CG 4Å; M104-I127 HydrophobicContact CE-CB 4.31Å; M104-I127 HydrophobicContact CE-CG2 3.68Å; M104-Y128 HydrophobicContact CE-CD1 3.51Å; M104-Y128 HydrophobicContact CE-CD2 4.36Å; M104-Y128 HydrophobicContact CE-CE1 3.32Å; M104-Y128 HydrophobicContact CE-CE2 4.21Å; M104-Y128 HydrophobicContact CE-CG 4.02Å; M104-Y128 HydrophobicContact SD-CE1 4.18Å; M104-Y128 HydrophobicContact SD-CE2 4.48Å; M104-L131 HydrophobicContact CE-CD1 3.76Å
105	H	87.9	Confident	85.9	Confident	82 Å²	82	58.8 Å²	58.8	38%	0.38	30%	0.296	S	S	.	.	H	α-helix	trans	-56.7	-45.5	178.1	176.1	74.3	0	0	0	112.4	T101 K102 Q109	T101-H105 PolarHBondContact O-N 3.1Å; K102-H105 PolarHBondContact O-N 2.7Å; H105-Q109 WeakPolarHBondContact O-CG 3.12Å; H105-Q109 PolarHBondContact O-N 2.61Å
106	H	89.6	Confident	85.4	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-76.5	-34.9	-177.4	-72.8	-50	0	0	0	113.6	H87 C90 V91 K102 A103 M104 D108 Q109 C110	H87-H106 AromaticContact CE1-ND1 3.82Å; H87-H106 AromaticContact ND1-CE1 3.92Å; H87-H106 AromaticContact ND1-ND1 3.16Å; H87-H106 PolarHBondContact ND1-ND1 3.48Å; H87-H106 VanDerWaalsContact ND1-ND1 3.16Å; C90-H106 HydrophobicContact CB-CB 4.35Å; C90-H106 VanDerWaalsContact CB-CD2 3.42Å; C90-H106 WeakPolarHBondContact CB-CD2 3.35Å; V91-H106 HydrophobicContact CG2-CB 3.57Å; K102-H106 PolarHBondContact O-CD2 3.44Å; K102-H106 VanDerWaalsContact O-CD2 3.3Å; K102-H106 PolarHBondContact O-N 3.4Å; K102-H106 VanDerWaalsContact O-N 3.12Å; A103-H106 PolarHBondContact O-N 2.96Å; M104-H106 VanDerWaalsContact C-N 3.32Å; M104-H106 PolarHBondContact O-N 3.44Å; H106-D108 VanDerWaalsContact C-N 3.32Å; H106-Q109 PolarHBondContact O-N 3.29Å; H106-C110 PolarHBondContact O-N 3.32Å; H106-C110 VanDerWaalsContact O-N 3.1Å
107	I	90.8	Very high	85.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-68.9	-34.6	178	-163.1	63.4	0	0	0	111	V91 A103 M104 Q109 C110 I111 F120 E123 R124 I127	V91-I107 HydrophobicContact CG1-CB 4.35Å; V91-I107 HydrophobicContact CG1-CD1 4.29Å; V91-I107 HydrophobicContact CG2-CB 3.81Å; V91-I107 HydrophobicContact CG2-CD1 4.12Å; V91-I107 VanDerWaalsContact CG2-N 3.31Å; A103-I107 WeakPolarHBondContact O-CG2 3.39Å; A103-I107 PolarHBondContact O-N 3.49Å; M104-I107 WeakPolarHBondContact O-CG2 3.16Å; M104-I107 PolarHBondContact O-N 3.3Å; M104-I107 HydrophobicContact SD-CG2 4.14Å; I107-Q109 VanDerWaalsContact C-N 3.3Å; I107-Q109 PolarHBondContact O-N 2.71Å; I107-C110 HydrophobicContact CD1-CB 4.3Å; I107-C110 WeakPolarHBondContact O-CB 3.34Å; I107-C110 PolarHBondContact O-N 3.38Å; I107-C110 VanDerWaalsContact O-N 3.1Å; I107-I111 HydrophobicContact CG1-CD1 4.36Å; I107-I111 WeakPolarHBondContact O-CG1 3.27Å; I107-I111 PolarHBondContact O-N 2.79Å; I107-F120 HydrophobicContact CD1-CB 4.13Å; I107-F120 HydrophobicContact CD1-CD1 4.18Å; I107-F120 HydrophobicContact CD1-CG 4.49Å; I107-E123 HydrophobicContact CD1-CB 4Å; I107-R124 HydrophobicContact CG1-CB 3.83Å; I107-R124 HydrophobicContact CG1-CG 4.49Å; I107-R124 HydrophobicContact CG2-CB 4.04Å; I107-R124 HydrophobicContact CG2-CG 3.79Å; I107-I127 HydrophobicContact CB-CD1 4.08Å; I107-I127 HydrophobicContact CG1-CD1 4.45Å; I107-I127 HydrophobicContact CG2-CD1 3.82Å
108	D	90.6	Very high	85	Confident	47 Å²	47	51.2 Å²	51.2	25%	0.251	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-33.9	173.4	-78.5	-25.2	0	0	0	112.4	M104 H106 K112 R124	M104-D108 PolarHBondContact O-N 3.03Å; M104-D108 VanDerWaalsContact O-N 3.08Å; H106-D108 VanDerWaalsContact C-N 3.32Å; D108-K112 WeakPolarHBondContact O-CB 3.21Å; D108-K112 VanDerWaalsContact O-CG 3.27Å; D108-K112 WeakPolarHBondContact O-CG 3.4Å; D108-K112 PolarHBondContact O-N 2.98Å; D108-R124 WeakPolarHBondContact OD1-CD 3.47Å; D108-R124 IonicContact OD1-CZ 3.11Å; D108-R124 IonicContact OD1-NH1 2.67Å; D108-R124 PolarHBondContact OD1-NH1 2.96Å
109	Q	88.4	Confident	85.1	Confident	22 Å²	22	46.3 Å²	46.3	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-66.9	-40.2	171.2	-60.6	-57.6	-47	0	0	111.2	H31 H105 H106 I107 I111 K112 L113	H31-Q109 PolarHBondContact NE2-OE1 3.13Å; H105-Q109 WeakPolarHBondContact O-CG 3.12Å; H105-Q109 PolarHBondContact O-N 2.61Å; H106-Q109 PolarHBondContact O-N 3.29Å; I107-Q109 VanDerWaalsContact C-N 3.3Å; I107-Q109 PolarHBondContact O-N 2.71Å; Q109-I111 PolarHBondContact O-N 3.15Å; Q109-K112 PolarHBondContact O-N 2.99Å; Q109-L113 VanDerWaalsContact O-CG 3.24Å; Q109-L113 WeakPolarHBondContact O-CG 3.17Å; Q109-L113 PolarHBondContact O-N 3.18Å; Q109-L113 VanDerWaalsContact O-N 3.13Å
110	C	86.4	Confident	84.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-45.9	174.7	-69.1	0	0	0	0	111.7	H87 H88 H106 I107 L113 A114 F120	H87-C110 WeakPolarHBondContact CB-SG 3.3Å; H88-C110 PolarHBondContact N-SG 3.27Å; H88-C110 VanDerWaalsContact N-SG 3.45Å; H106-C110 PolarHBondContact O-N 3.32Å; H106-C110 VanDerWaalsContact O-N 3.1Å; I107-C110 HydrophobicContact CD1-CB 4.3Å; I107-C110 WeakPolarHBondContact O-CB 3.34Å; I107-C110 PolarHBondContact O-N 3.38Å; I107-C110 VanDerWaalsContact O-N 3.1Å; C110-L113 PolarHBondContact O-N 3.34Å; C110-A114 PolarHBondContact O-N 2.88Å; C110-F120 HydrophobicContact CB-CD1 4.18Å; C110-F120 HydrophobicContact CB-CD2 4.02Å; C110-F120 HydrophobicContact CB-CE1 4.39Å; C110-F120 HydrophobicContact CB-CE2 4.24Å; C110-F120 HydrophobicContact CB-CG 4.02Å; C110-F120 HydrophobicContact CB-CZ 4.44Å
111	I	86.7	Confident	85.1	Confident	22 Å²	22	42.5 Å²	42.5	11%	0.113	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-39.1	-179.6	-66.4	165.7	0	0	0	111.5	I107 Q109 L113 A114 P115 F120 L121 R124	I107-I111 HydrophobicContact CG1-CD1 4.36Å; I107-I111 WeakPolarHBondContact O-CG1 3.27Å; I107-I111 PolarHBondContact O-N 2.79Å; Q109-I111 PolarHBondContact O-N 3.15Å; I111-L113 VanDerWaalsContact C-N 3.27Å; I111-L113 PolarHBondContact O-N 2.78Å; I111-A114 CarbonylContact O-C 3.45Å; I111-A114 PolarHBondContact O-N 3.15Å; I111-P115 WeakPolarHBondContact O-CA 3.47Å; I111-F120 HydrophobicContact CG1-CB 3.75Å; I111-L121 HydrophobicContact CD1-CD2 4.08Å; I111-L121 HydrophobicContact CG2-CD2 4.46Å; I111-R124 HydrophobicContact CD1-CB 3.95Å; I111-R124 HydrophobicContact CD1-CG 4.32Å; I111-R124 VanDerWaalsContact CD1-CZ 3.5Å
112	K	81.6	Confident	85	Confident	143 Å²	143	38.2 Å²	38.2	62%	0.622	19%	0.185	S	C	*	.	H	α-helix	trans	-60.9	-36.7	174.5	-77.1	174.4	-175.9	179.2	0	112.8	D108 Q109	D108-K112 WeakPolarHBondContact O-CB 3.21Å; D108-K112 VanDerWaalsContact O-CG 3.27Å; D108-K112 WeakPolarHBondContact O-CG 3.4Å; D108-K112 PolarHBondContact O-N 2.98Å; Q109-K112 PolarHBondContact O-N 2.99Å
113	L	81.2	Confident	85	Confident	41 Å²	41	35.4 Å²	35.4	22%	0.215	17%	0.173	C	C	.	.	H	α-helix	trans	-81.7	-27.2	-179.6	-64.5	174	0	0	0	112.6	F80 T83 I84 Q109 C110 I111	F80-L113 HydrophobicContact CD1-CD2 3.98Å; F80-L113 HydrophobicContact CE1-CD2 4Å; T83-L113 HydrophobicContact CG2-CD1 3.82Å; I84-L113 HydrophobicContact CD1-CB 4Å; I84-L113 HydrophobicContact CG1-CB 3.68Å; I84-L113 HydrophobicContact CG1-CD1 3.93Å; I84-L113 HydrophobicContact CG1-CG 4.48Å; Q109-L113 VanDerWaalsContact O-CG 3.24Å; Q109-L113 WeakPolarHBondContact O-CG 3.17Å; Q109-L113 PolarHBondContact O-N 3.18Å; Q109-L113 VanDerWaalsContact O-N 3.13Å; C110-L113 PolarHBondContact O-N 3.34Å; I111-L113 VanDerWaalsContact C-N 3.27Å; I111-L113 PolarHBondContact O-N 2.78Å
114	A	79.4	Confident	85	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.008	18%	0.18	C	C	.	.			trans	-140.4	75.6	-179.8	0	0	0	0	0	111.3	I84 C110 I111 H116 N117 F120	I84-A114 HydrophobicContact CD1-CB 4Å; C110-A114 PolarHBondContact O-N 2.88Å; I111-A114 CarbonylContact O-C 3.45Å; I111-A114 PolarHBondContact O-N 3.15Å; A114-H116 VanDerWaalsContact C-N 3.25Å; A114-H116 PolarHBondContact O-N 2.85Å; A114-N117 HydrophobicContact CB-CB 4.06Å; A114-N117 PolarHBondContact O-N 3.37Å; A114-F120 HydrophobicContact CB-CD2 4.22Å; A114-F120 HydrophobicContact CB-CE2 3.93Å
115	P	76.8	Confident	85	Confident	75 Å²	75	36 Å²	36	49%	0.487	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.7	-172.2	26.4	-35.4	0	0	0	114.2	I111	I111-P115 WeakPolarHBondContact O-CA 3.47Å
116	H	75.5	Confident	85	Confident	129 Å²	129	35.7 Å²	35.7	60%	0.597	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	6.6	179.4	-64.7	-55	0	0	0	113.7	A114 A118	A114-H116 VanDerWaalsContact C-N 3.25Å; A114-H116 PolarHBondContact O-N 2.85Å; H116-A118 PolarHBondContact O-N 3.48Å
117	N	79.9	Confident	84.9	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.021	17%	0.171	C	C	.	.			trans	-86.6	100	175.3	-172.7	-25.7	0	0	0	110	A114 K119 F120 I171	A114-N117 HydrophobicContact CB-CB 4.06Å; A114-N117 PolarHBondContact O-N 3.37Å; N117-K119 PolarHBondContact O-N 3.17Å; N117-K119 VanDerWaalsContact OD1-CB 3.23Å; N117-K119 WeakPolarHBondContact OD1-CB 3.39Å; N117-K119 PolarHBondContact OD1-N 3.27Å; N117-F120 HydrophobicContact CB-CD2 3.66Å; N117-F120 HydrophobicContact CB-CE2 3.92Å; N117-F120 HydrophobicContact CB-CG 4.48Å; N117-F120 VanDerWaalsContact ND2-CE2 3.32Å; N117-F120 WeakPolarHBondContact ND2-CE2 3.25Å; N117-F120 PolarHBondContact O-N 2.83Å; N117-I171 PolarHBondContact ND2-O 3.16Å
118	A	81.7	Confident	84.8	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-25.2	-177.8	0	0	0	0	0	113.5	H116 F120 L121 I122 A144 L147 L176	H116-A118 PolarHBondContact O-N 3.48Å; A118-F120 PolarHBondContact O-N 3.2Å; A118-L121 WeakPolarHBondContact O-CB 2.91Å; A118-L121 PolarHBondContact O-N 2.96Å; A118-I122 PolarHBondContact O-N 2.74Å; A118-I122 VanDerWaalsContact O-N 3.12Å; A118-A144 HydrophobicContact CB-CB 4.28Å; A118-L147 HydrophobicContact CB-CB 4.1Å; A118-L176 HydrophobicContact CB-CD1 3.72Å; A118-L176 HydrophobicContact CB-CD2 4.24Å; A118-L176 HydrophobicContact CB-CG 3.74Å
119	K	83.9	Confident	84.6	Confident	73 Å²	73	35 Å²	35	32%	0.317	17%	0.166	S	C	.	.	H	α-helix	trans	-64	-40	177.4	-172.9	176.1	-173.6	126	0	112.6	N117 L121 I122 E123 E180	N117-K119 PolarHBondContact O-N 3.17Å; N117-K119 VanDerWaalsContact OD1-CB 3.23Å; N117-K119 WeakPolarHBondContact OD1-CB 3.39Å; N117-K119 PolarHBondContact OD1-N 3.27Å; K119-L121 VanDerWaalsContact C-N 3.27Å; K119-L121 PolarHBondContact O-N 2.98Å; K119-I122 PolarHBondContact O-N 2.97Å; K119-E123 WeakPolarHBondContact O-CG 3.46Å; K119-E123 PolarHBondContact O-N 3.27Å; K119-E180 IonicContact NZ-OE1 3.24Å; K119-E180 PolarHBondContact NZ-OE1 2.73Å
120	F	84.9	Confident	84.4	Confident	7 Å²	7	37.6 Å²	37.6	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-68.3	-29.8	178.3	-61.5	-38.8	0	0	0	112.3	I84 H88 I107 C110 I111 A114 N117 A118 R124 I171	I84-F120 HydrophobicContact CG2-CE1 4.41Å; I84-F120 HydrophobicContact CG2-CE2 3.68Å; I84-F120 HydrophobicContact CG2-CZ 3.36Å; H88-F120 HydrophobicContact CB-CE1 4.42Å; H88-F120 AromaticContact CD2-CE1 3.57Å; I107-F120 HydrophobicContact CD1-CB 4.13Å; I107-F120 HydrophobicContact CD1-CD1 4.18Å; I107-F120 HydrophobicContact CD1-CG 4.49Å; C110-F120 HydrophobicContact CB-CD1 4.18Å; C110-F120 HydrophobicContact CB-CD2 4.02Å; C110-F120 HydrophobicContact CB-CE1 4.39Å; C110-F120 HydrophobicContact CB-CE2 4.24Å; C110-F120 HydrophobicContact CB-CG 4.02Å; C110-F120 HydrophobicContact CB-CZ 4.44Å; I111-F120 HydrophobicContact CG1-CB 3.75Å; A114-F120 HydrophobicContact CB-CD2 4.22Å; A114-F120 HydrophobicContact CB-CE2 3.93Å; N117-F120 HydrophobicContact CB-CD2 3.66Å; N117-F120 HydrophobicContact CB-CE2 3.92Å; N117-F120 HydrophobicContact CB-CG 4.48Å; N117-F120 VanDerWaalsContact ND2-CE2 3.32Å; N117-F120 WeakPolarHBondContact ND2-CE2 3.25Å; N117-F120 PolarHBondContact O-N 2.83Å; A118-F120 PolarHBondContact O-N 3.2Å; F120-R124 WeakPolarHBondContact O-CB 3.08Å; F120-R124 PolarHBondContact O-N 3.12Å; F120-I171 HydrophobicContact CZ-CG2 4.46Å
121	L	87.8	Confident	84.4	Confident	9 Å²	9	41.5 Å²	41.5	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-42	172.6	-65.1	172.7	0	0	0	111.4	I111 A118 K119 R124 S125 L143 A144 L147	I111-L121 HydrophobicContact CD1-CD2 4.08Å; I111-L121 HydrophobicContact CG2-CD2 4.46Å; A118-L121 WeakPolarHBondContact O-CB 2.91Å; A118-L121 PolarHBondContact O-N 2.96Å; K119-L121 VanDerWaalsContact C-N 3.27Å; K119-L121 PolarHBondContact O-N 2.98Å; L121-R124 PolarHBondContact O-N 3.25Å; L121-S125 WeakPolarHBondContact O-CB 3.48Å; L121-S125 PolarHBondContact O-N 3.48Å; L121-L143 HydrophobicContact CD1-CB 3.87Å; L121-A144 HydrophobicContact CB-CB 3.95Å; L121-A144 HydrophobicContact CD1-CB 4.44Å; L121-L147 HydrophobicContact CD1-CD1 3.76Å
122	I	85.9	Confident	84.2	Confident	21 Å²	21	43.8 Å²	43.8	11%	0.108	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-49	173.3	-64	173.9	0	0	0	110.3	A118 K119 R124 S125 E126 L141 A144 L176 A184	A118-I122 PolarHBondContact O-N 2.74Å; A118-I122 VanDerWaalsContact O-N 3.12Å; K119-I122 PolarHBondContact O-N 2.97Å; I122-R124 VanDerWaalsContact C-N 3.31Å; I122-R124 PolarHBondContact O-N 3.07Å; I122-S125 WeakPolarHBondContact O-CB 3.06Å; I122-S125 PolarHBondContact O-N 3.24Å; I122-S125 VanDerWaalsContact O-N 3.1Å; I122-S125 PolarHBondContact O-OG 3.29Å; I122-E126 PolarHBondContact O-N 3.2Å; I122-L141 HydrophobicContact CG1-CD2 4.13Å; I122-A144 HydrophobicContact CG1-CB 3.86Å; I122-L176 HydrophobicContact CD1-CD1 4.1Å; I122-L176 HydrophobicContact CD1-CD2 3.35Å; I122-L176 HydrophobicContact CD1-CG 4.4Å; I122-A184 HydrophobicContact CD1-CB 3.78Å; I122-A184 HydrophobicContact CG1-CB 4.28Å
123	E	86.5	Confident	84.4	Confident	31 Å²	31	39.5 Å²	39.5	15%	0.145	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-37.5	179.5	-71.3	179	-172.9	0	0	112.5	H88 I107 K119 E126 I127	H88-E123 IonicContact CD2-OE1 3.29Å; H88-E123 IonicContact CD2-OE2 3.66Å; H88-E123 PolarHBondContact CD2-OE2 2.9Å; H88-E123 IonicContact CE1-OE1 3.72Å; H88-E123 IonicContact NE2-OE1 2.8Å; H88-E123 PolarHBondContact NE2-OE1 3.25Å; H88-E123 IonicContact NE2-OE2 2.7Å; H88-E123 PolarHBondContact NE2-OE2 3.19Å; I107-E123 HydrophobicContact CD1-CB 4Å; K119-E123 WeakPolarHBondContact O-CG 3.46Å; K119-E123 PolarHBondContact O-N 3.27Å; E123-E126 PolarHBondContact O-N 2.94Å; E123-I127 WeakPolarHBondContact O-CG1 3.27Å; E123-I127 PolarHBondContact O-N 2.81Å
124	R	90.2	Very high	84.6	Confident	39 Å²	39	38.3 Å²	38.3	15%	0.147	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-40.9	173.1	-170.4	170	67.3	176.4	4	111.5	M104 I107 D108 I111 F120 L121 I122 E126 I127 Y128 D140	M104-R124 HydrophobicContact SD-CG 4Å; I107-R124 HydrophobicContact CG1-CB 3.83Å; I107-R124 HydrophobicContact CG1-CG 4.49Å; I107-R124 HydrophobicContact CG2-CB 4.04Å; I107-R124 HydrophobicContact CG2-CG 3.79Å; D108-R124 WeakPolarHBondContact OD1-CD 3.47Å; D108-R124 IonicContact OD1-CZ 3.11Å; D108-R124 IonicContact OD1-NH1 2.67Å; D108-R124 PolarHBondContact OD1-NH1 2.96Å; I111-R124 HydrophobicContact CD1-CB 3.95Å; I111-R124 HydrophobicContact CD1-CG 4.32Å; I111-R124 VanDerWaalsContact CD1-CZ 3.5Å; F120-R124 WeakPolarHBondContact O-CB 3.08Å; F120-R124 PolarHBondContact O-N 3.12Å; L121-R124 PolarHBondContact O-N 3.25Å; I122-R124 VanDerWaalsContact C-N 3.31Å; I122-R124 PolarHBondContact O-N 3.07Å; R124-E126 VanDerWaalsContact C-N 3.31Å; R124-E126 PolarHBondContact O-N 2.88Å; R124-I127 WeakPolarHBondContact O-CB 3.18Å; R124-I127 PolarHBondContact O-N 3.07Å; R124-I127 VanDerWaalsContact O-N 3.11Å; R124-Y128 HydrophobicContact CG-CD2 3.92Å; R124-Y128 HydrophobicContact CG-CE2 3.6Å; R124-Y128 WeakPolarHBondContact O-CD2 3.39Å; R124-Y128 PolarHBondContact O-N 3.41Å; R124-D140 WeakPolarHBondContact CG-OD2 3.42Å; R124-D140 IonicContact CZ-OD1 2.76Å; R124-D140 IonicContact CZ-OD2 3.8Å; R124-D140 IonicContact NE-OD1 3.63Å; R124-D140 IonicContact NE-OD2 3.34Å; R124-D140 PolarHBondContact NE-OD2 2.71Å; R124-D140 VanDerWaalsContact NH2-CG 3.32Å; R124-D140 IonicContact NH2-OD1 3.03Å; R124-D140 PolarHBondContact NH2-OD1 3.23Å; R124-D140 IonicContact NH2-OD2 3.79Å; R124-D140 PolarHBondContact NH2-OD2 3.44Å
125	S	88.5	Confident	85	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.6	-42.1	174.7	82.6	0	0	0	0	111.7	L121 I122 I127 Y128 I129 L141	L121-S125 WeakPolarHBondContact O-CB 3.48Å; L121-S125 PolarHBondContact O-N 3.48Å; I122-S125 WeakPolarHBondContact O-CB 3.06Å; I122-S125 PolarHBondContact O-N 3.24Å; I122-S125 VanDerWaalsContact O-N 3.1Å; I122-S125 PolarHBondContact O-OG 3.29Å; S125-I127 VanDerWaalsContact C-N 3.27Å; S125-I127 PolarHBondContact O-N 3.23Å; S125-Y128 WeakPolarHBondContact O-CB 3.41Å; S125-Y128 PolarHBondContact O-N 3.47Å; S125-Y128 VanDerWaalsContact O-N 3.09Å; S125-I129 VanDerWaalsContact O-CG1 3.25Å; S125-I129 WeakPolarHBondContact O-CG1 3.5Å; S125-I129 PolarHBondContact O-N 2.94Å; S125-L141 WeakPolarHBondContact OG-CD2 3.19Å; S125-L141 WeakPolarHBondContact OG-CG 3.5Å
126	E	87.8	Confident	85.6	Confident	74 Å²	74	45.2 Å²	45.2	35%	0.346	22%	0.218	S	C	.	.	H	α-helix	trans	-62.2	-33.6	176.4	-69.8	-178.7	178.2	0	0	113.1	I122 E123 R124 K130 M187	I122-E126 PolarHBondContact O-N 3.2Å; E123-E126 PolarHBondContact O-N 2.94Å; R124-E126 VanDerWaalsContact C-N 3.31Å; R124-E126 PolarHBondContact O-N 2.88Å; E126-K130 WeakPolarHBondContact O-CG 3.33Å; E126-K130 PolarHBondContact O-N 3.24Å; E126-M187 HydrophobicContact CG-CE 3.87Å
127	I	87.7	Confident	86.3	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-69	-44.4	173.9	-61.9	162.8	0	0	0	109.8	V91 V95 A103 M104 I107 E123 R124 S125 I129 K130 L131	V91-I127 HydrophobicContact CG1-CD1 3.92Å; V95-I127 HydrophobicContact CG2-CD1 4.28Å; V95-I127 HydrophobicContact CG2-CG1 4Å; A103-I127 HydrophobicContact CB-CD1 3.86Å; A103-I127 HydrophobicContact CB-CG1 4.28Å; A103-I127 HydrophobicContact CB-CG2 4.39Å; M104-I127 HydrophobicContact CE-CB 4.31Å; M104-I127 HydrophobicContact CE-CG2 3.68Å; I107-I127 HydrophobicContact CB-CD1 4.08Å; I107-I127 HydrophobicContact CG1-CD1 4.45Å; I107-I127 HydrophobicContact CG2-CD1 3.82Å; E123-I127 WeakPolarHBondContact O-CG1 3.27Å; E123-I127 PolarHBondContact O-N 2.81Å; R124-I127 WeakPolarHBondContact O-CB 3.18Å; R124-I127 PolarHBondContact O-N 3.07Å; R124-I127 VanDerWaalsContact O-N 3.11Å; S125-I127 VanDerWaalsContact C-N 3.27Å; S125-I127 PolarHBondContact O-N 3.23Å; I127-I129 VanDerWaalsContact C-N 3.34Å; I127-I129 PolarHBondContact O-N 3.1Å; I127-K130 WeakPolarHBondContact O-CB 3.44Å; I127-K130 PolarHBondContact O-N 2.76Å; I127-K130 VanDerWaalsContact O-N 3.16Å; I127-L131 HydrophobicContact CG2-CD1 4.27Å; I127-L131 WeakPolarHBondContact O-CG 3.45Å; I127-L131 PolarHBondContact O-N 3.18Å
128	Y	90.2	Very high	86.8	Confident	35 Å²	35	39.6 Å²	39.6	14%	0.137	19%	0.192	C	C	.	.	H	α-helix	trans	-60.6	-39.9	174.9	-78.9	-54.2	0	0	0	112.8	M104 R124 S125 K130 L131 S132 D133 H136 D140	M104-Y128 HydrophobicContact CE-CD1 3.51Å; M104-Y128 HydrophobicContact CE-CD2 4.36Å; M104-Y128 HydrophobicContact CE-CE1 3.32Å; M104-Y128 HydrophobicContact CE-CE2 4.21Å; M104-Y128 HydrophobicContact CE-CG 4.02Å; M104-Y128 HydrophobicContact SD-CE1 4.18Å; M104-Y128 HydrophobicContact SD-CE2 4.48Å; R124-Y128 HydrophobicContact CG-CD2 3.92Å; R124-Y128 HydrophobicContact CG-CE2 3.6Å; R124-Y128 WeakPolarHBondContact O-CD2 3.39Å; R124-Y128 PolarHBondContact O-N 3.41Å; S125-Y128 WeakPolarHBondContact O-CB 3.41Å; S125-Y128 PolarHBondContact O-N 3.47Å; S125-Y128 VanDerWaalsContact O-N 3.09Å; Y128-K130 VanDerWaalsContact C-N 3.28Å; Y128-K130 PolarHBondContact O-N 3.22Å; Y128-L131 CarbonylContact O-C 3.47Å; Y128-L131 WeakPolarHBondContact O-CA 3.39Å; Y128-L131 PolarHBondContact O-N 2.91Å; Y128-S132 PolarHBondContact O-N 3.46Å; Y128-D133 HydrophobicContact CD1-CB 4.03Å; Y128-D133 PolarHBondContact O-N 3.15Å; Y128-H136 HydrophobicContact CD1-CB 3.93Å; Y128-H136 HydrophobicContact CD2-CB 3.85Å; Y128-H136 HydrophobicContact CE1-CB 3.81Å; Y128-H136 HydrophobicContact CE2-CB 3.72Å; Y128-H136 HydrophobicContact CG-CB 3.97Å; Y128-D140 WeakPolarHBondContact CE2-OD2 3.47Å
129	I	85.3	Confident	87.1	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-56.6	-45.1	173.7	-65.1	170.6	0	0	0	110.6	S125 I127 L131 S132 A137 M187 L191 L287	S125-I129 VanDerWaalsContact O-CG1 3.25Å; S125-I129 WeakPolarHBondContact O-CG1 3.5Å; S125-I129 PolarHBondContact O-N 2.94Å; I127-I129 VanDerWaalsContact C-N 3.34Å; I127-I129 PolarHBondContact O-N 3.1Å; I129-L131 VanDerWaalsContact C-N 3.26Å; I129-L131 PolarHBondContact O-N 3.33Å; I129-S132 PolarHBondContact O-N 3.45Å; I129-A137 HydrophobicContact CG1-CB 4.08Å; I129-M187 HydrophobicContact CD1-CE 3.63Å; I129-L191 HydrophobicContact CD1-CD1 3.74Å; I129-L191 HydrophobicContact CD1-CD2 4.05Å; I129-L191 HydrophobicContact CD1-CG 4.21Å; I129-L191 HydrophobicContact CG1-CD1 3.95Å; I129-L191 HydrophobicContact CG1-CD2 3.67Å; I129-L191 HydrophobicContact CG1-CG 4.32Å; I129-L287 HydrophobicContact CD1-CD1 4.46Å; I129-L287 HydrophobicContact CG2-CD2 4.07Å
130	K	83.7	Confident	87.4	Confident	77 Å²	77	38.7 Å²	38.7	34%	0.335	19%	0.194	S	C	.	.	H	α-helix	trans	-68.4	-26.1	178.9	-71.4	172.8	-179.1	175.3	0	112.9	M100 E126 I127 Y128 S132 I286	M100-K130 HydrophobicContact CE-CB 3.76Å; M100-K130 HydrophobicContact CE-CD 3.62Å; M100-K130 HydrophobicContact CE-CG 4.18Å; M100-K130 HydrophobicContact SD-CB 3.93Å; M100-K130 HydrophobicContact SD-CD 3.99Å; E126-K130 WeakPolarHBondContact O-CG 3.33Å; E126-K130 PolarHBondContact O-N 3.24Å; I127-K130 WeakPolarHBondContact O-CB 3.44Å; I127-K130 PolarHBondContact O-N 2.76Å; I127-K130 VanDerWaalsContact O-N 3.16Å; Y128-K130 VanDerWaalsContact C-N 3.28Å; Y128-K130 PolarHBondContact O-N 3.22Å; K130-S132 VanDerWaalsContact C-N 3.29Å; K130-I286 HydrophobicContact CG-CD1 4.19Å
131	L	86.5	Confident	87.5	Confident	83 Å²	83	38.3 Å²	38.3	44%	0.435	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-2.4	171.5	-69.3	173.4	0	0	0	113.3	M100 M104 I127 Y128 I129 D133	M100-L131 HydrophobicContact CB-CD1 4.36Å; M100-L131 HydrophobicContact CB-CD2 3.56Å; M100-L131 HydrophobicContact CB-CG 4Å; M100-L131 HydrophobicContact CG-CD2 3.98Å; M100-L131 HydrophobicContact CG-CG 4.38Å; M104-L131 HydrophobicContact CE-CD1 3.76Å; I127-L131 HydrophobicContact CG2-CD1 4.27Å; I127-L131 WeakPolarHBondContact O-CG 3.45Å; I127-L131 PolarHBondContact O-N 3.18Å; Y128-L131 CarbonylContact O-C 3.47Å; Y128-L131 WeakPolarHBondContact O-CA 3.39Å; Y128-L131 PolarHBondContact O-N 2.91Å; I129-L131 VanDerWaalsContact C-N 3.26Å; I129-L131 PolarHBondContact O-N 3.33Å; L131-D133 PolarHBondContact O-N 3.02Å
132	S	82.6	Confident	87.6	Confident	69 Å²	69	41.3 Å²	41.3	48%	0.483	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	19.7	-173	-49.6	0	0	0	0	114.8	Y128 I129 K130 Y134	Y128-S132 PolarHBondContact O-N 3.46Å; I129-S132 PolarHBondContact O-N 3.45Å; K130-S132 VanDerWaalsContact C-N 3.29Å; S132-Y134 WeakPolarHBondContact O-CD2 3.47Å; S132-Y134 WeakPolarHBondContact O-CE2 3.46Å; S132-Y134 PolarHBondContact O-N 3.24Å
133	D	87	Confident	87.7	Confident	54 Å²	54	44.5 Å²	44.5	29%	0.289	22%	0.223	S	C	.	.			trans	-93.4	78.1	174.9	-169.9	-16.5	0	0	0	110.2	Y128 L131 Q135 H136 A137	Y128-D133 HydrophobicContact CD1-CB 4.03Å; Y128-D133 PolarHBondContact O-N 3.15Å; L131-D133 PolarHBondContact O-N 3.02Å; D133-Q135 VanDerWaalsContact C-N 3.3Å; D133-Q135 PolarHBondContact O-N 3.43Å; D133-H136 IonicContact OD1-CE1 3.12Å; D133-H136 IonicContact OD1-CG 2.8Å; D133-H136 PolarHBondContact OD1-N 3.09Å; D133-H136 IonicContact OD1-ND1 2.76Å; D133-H136 PolarHBondContact OD1-ND1 2.88Å; D133-H136 IonicContact OD2-CE1 2.62Å; D133-H136 IonicContact OD2-CG 3.38Å; D133-H136 IonicContact OD2-ND1 3.32Å; D133-H136 PolarHBondContact OD2-ND1 3.06Å; D133-A137 PolarHBondContact O-N 3.37Å
134	Y	84.9	Confident	87.7	Confident	15 Å²	15	43 Å²	43	6%	0.059	22%	0.216	C	C	.	.	H	α-helix	trans	-69.7	-27.5	-173.3	-52.8	-60.7	0	0	0	113.3	S132 A137 I138 L191 V194 N198 R290	S132-Y134 WeakPolarHBondContact O-CD2 3.47Å; S132-Y134 WeakPolarHBondContact O-CE2 3.46Å; S132-Y134 PolarHBondContact O-N 3.24Å; Y134-A137 PolarHBondContact O-N 3.12Å; Y134-I138 WeakPolarHBondContact O-CB 3.39Å; Y134-I138 WeakPolarHBondContact O-CD1 3.29Å; Y134-I138 WeakPolarHBondContact O-CG1 3.32Å; Y134-I138 PolarHBondContact O-N 3.14Å; Y134-L191 HydrophobicContact CD1-CD2 3.65Å; Y134-L191 HydrophobicContact CE1-CD2 4.37Å; Y134-V194 HydrophobicContact CD1-CG1 4.29Å; Y134-V194 HydrophobicContact CD2-CG1 4.32Å; Y134-V194 HydrophobicContact CE1-CG1 3.98Å; Y134-V194 HydrophobicContact CE2-CG1 4.01Å; Y134-V194 HydrophobicContact CG-CG1 4.46Å; Y134-N198 WeakPolarHBondContact CD2-ND2 3.41Å; Y134-N198 WeakPolarHBondContact CE2-ND2 3.26Å; Y134-R290 PolarHBondContact OH-NH1 3.08Å
135	Q	86.8	Confident	87.4	Confident	134 Å²	134	42 Å²	42	63%	0.626	21%	0.214	S	C	*	.	H	α-helix	trans	-66.9	-47	-176.9	-173.9	174.8	-5.1	0	0	111.2	D133 I138 S139	D133-Q135 VanDerWaalsContact C-N 3.3Å; D133-Q135 PolarHBondContact O-N 3.43Å; Q135-I138 PolarHBondContact O-N 3.34Å; Q135-S139 PolarHBondContact O-N 3.06Å; Q135-S139 VanDerWaalsContact O-N 3.1Å; Q135-S139 PolarHBondContact O-OG 3.03Å
136	H	90	Very high	87.2	Confident	88 Å²	88	44.4 Å²	44.4	41%	0.407	23%	0.23	S	C	.	.	H	α-helix	trans	-69.2	-36.5	175.9	-66.1	94.2	0	0	0	111.9	Y128 D133 I138 S139 D140	Y128-H136 HydrophobicContact CD1-CB 3.93Å; Y128-H136 HydrophobicContact CD2-CB 3.85Å; Y128-H136 HydrophobicContact CE1-CB 3.81Å; Y128-H136 HydrophobicContact CE2-CB 3.72Å; Y128-H136 HydrophobicContact CG-CB 3.97Å; D133-H136 IonicContact OD1-CE1 3.12Å; D133-H136 IonicContact OD1-CG 2.8Å; D133-H136 PolarHBondContact OD1-N 3.09Å; D133-H136 IonicContact OD1-ND1 2.76Å; D133-H136 PolarHBondContact OD1-ND1 2.88Å; D133-H136 IonicContact OD2-CE1 2.62Å; D133-H136 IonicContact OD2-CG 3.38Å; D133-H136 IonicContact OD2-ND1 3.32Å; D133-H136 PolarHBondContact OD2-ND1 3.06Å; H136-I138 PolarHBondContact O-N 3.26Å; H136-S139 WeakPolarHBondContact CA-OG 3.45Å; H136-S139 PolarHBondContact O-N 3.04Å; H136-S139 PolarHBondContact O-OG 3.08Å; H136-D140 PolarHBondContact O-N 3.15Å
137	A	89.4	Confident	86.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.9	-47	174.2	0	0	0	0	0	112.2	I129 D133 Y134 D140 L141 L191	I129-A137 HydrophobicContact CG1-CB 4.08Å; D133-A137 PolarHBondContact O-N 3.37Å; Y134-A137 PolarHBondContact O-N 3.12Å; A137-D140 PolarHBondContact O-N 3.22Å; A137-L141 WeakPolarHBondContact O-CG 3.49Å; A137-L141 PolarHBondContact O-N 2.8Å; A137-L141 VanDerWaalsContact O-N 3.08Å; A137-L191 HydrophobicContact CB-CD1 4.11Å
138	I	90.4	Very high	86	Confident	15 Å²	15	42.6 Å²	42.6	8%	0.077	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-47.1	177.6	-72	165.8	0	0	0	110.1	Y134 Q135 H136 D140 L141 H142 L191 H195	Y134-I138 WeakPolarHBondContact O-CB 3.39Å; Y134-I138 WeakPolarHBondContact O-CD1 3.29Å; Y134-I138 WeakPolarHBondContact O-CG1 3.32Å; Y134-I138 PolarHBondContact O-N 3.14Å; Q135-I138 PolarHBondContact O-N 3.34Å; H136-I138 PolarHBondContact O-N 3.26Å; I138-D140 VanDerWaalsContact C-N 3.3Å; I138-D140 PolarHBondContact O-N 3.42Å; I138-L141 PolarHBondContact O-N 2.92Å; I138-H142 PolarHBondContact O-CD2 3.23Å; I138-H142 VanDerWaalsContact O-CD2 3.23Å; I138-H142 PolarHBondContact O-N 3.45Å; I138-L191 HydrophobicContact CD1-CB 4.35Å; I138-L191 HydrophobicContact CG1-CB 3.83Å; I138-H195 HydrophobicContact CD1-CB 3.7Å
139	S	89.3	Confident	84.8	Confident	51 Å²	51	42.7 Å²	42.7	36%	0.357	23%	0.228	S	C	.	.	H	α-helix	trans	-60.5	-39.2	-180	61	0	0	0	0	113.1	Q135 H136 H142 L143	Q135-S139 PolarHBondContact O-N 3.06Å; Q135-S139 VanDerWaalsContact O-N 3.1Å; Q135-S139 PolarHBondContact O-OG 3.03Å; H136-S139 WeakPolarHBondContact CA-OG 3.45Å; H136-S139 PolarHBondContact O-N 3.04Å; H136-S139 PolarHBondContact O-OG 3.08Å; S139-H142 PolarHBondContact O-N 2.85Å; S139-L143 WeakPolarHBondContact O-CG 3.24Å; S139-L143 PolarHBondContact O-N 3.46Å; S139-L143 VanDerWaalsContact O-N 3.09Å
140	D	89.3	Confident	83.7	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-39.2	178.2	-79.5	-7.8	0	0	0	112.2	R124 Y128 H136 A137 I138 L143 A144	R124-D140 WeakPolarHBondContact CG-OD2 3.42Å; R124-D140 IonicContact CZ-OD1 2.76Å; R124-D140 IonicContact CZ-OD2 3.8Å; R124-D140 IonicContact NE-OD1 3.63Å; R124-D140 IonicContact NE-OD2 3.34Å; R124-D140 PolarHBondContact NE-OD2 2.71Å; R124-D140 VanDerWaalsContact NH2-CG 3.32Å; R124-D140 IonicContact NH2-OD1 3.03Å; R124-D140 PolarHBondContact NH2-OD1 3.23Å; R124-D140 IonicContact NH2-OD2 3.79Å; R124-D140 PolarHBondContact NH2-OD2 3.44Å; Y128-D140 WeakPolarHBondContact CE2-OD2 3.47Å; H136-D140 PolarHBondContact O-N 3.15Å; A137-D140 PolarHBondContact O-N 3.22Å; I138-D140 VanDerWaalsContact C-N 3.3Å; I138-D140 PolarHBondContact O-N 3.42Å; D140-L143 PolarHBondContact O-N 3.32Å; D140-A144 WeakPolarHBondContact O-CB 3.31Å; D140-A144 PolarHBondContact O-N 2.66Å
141	L	88.6	Confident	82.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69	-39.9	177	-73.8	170.3	0	0	0	112.4	I122 S125 A137 I138 L143 A144 I145 A184 M187 T188 L191	I122-L141 HydrophobicContact CG1-CD2 4.13Å; S125-L141 WeakPolarHBondContact OG-CD2 3.19Å; S125-L141 WeakPolarHBondContact OG-CG 3.5Å; A137-L141 WeakPolarHBondContact O-CG 3.49Å; A137-L141 PolarHBondContact O-N 2.8Å; A137-L141 VanDerWaalsContact O-N 3.08Å; I138-L141 PolarHBondContact O-N 2.92Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 3.18Å; L141-A144 WeakPolarHBondContact O-CB 3.33Å; L141-A144 PolarHBondContact O-N 3.11Å; L141-A144 VanDerWaalsContact O-N 3.14Å; L141-I145 WeakPolarHBondContact O-CB 3.21Å; L141-I145 VanDerWaalsContact O-CG1 3.3Å; L141-I145 WeakPolarHBondContact O-CG1 3.46Å; L141-I145 PolarHBondContact O-N 2.88Å; L141-A184 HydrophobicContact CD2-CB 4.46Å; L141-M187 HydrophobicContact CD1-CB 4.29Å; L141-T188 VanDerWaalsContact CB-OG1 3.31Å; L141-T188 WeakPolarHBondContact CB-OG1 3.46Å; L141-L191 HydrophobicContact CD1-CD1 3.24Å
142	H	89.8	Confident	80.9	Confident	71 Å²	71	45.7 Å²	45.7	33%	0.329	24%	0.243	S	C	.	.	H	α-helix	trans	-58.2	-44.8	172.4	-87.3	-79.8	0	0	0	111.3	I138 S139 I145 S146 H192 F218	I138-H142 PolarHBondContact O-CD2 3.23Å; I138-H142 VanDerWaalsContact O-CD2 3.23Å; I138-H142 PolarHBondContact O-N 3.45Å; S139-H142 PolarHBondContact O-N 2.85Å; H142-I145 PolarHBondContact O-N 2.94Å; H142-S146 WeakPolarHBondContact O-CB 3.45Å; H142-S146 PolarHBondContact O-N 3.44Å; H142-S146 PolarHBondContact O-OG 3.05Å; H142-H192 AromaticContact CE1-NE2 3.9Å; H142-H192 AromaticContact NE2-CE1 3.69Å; H142-H192 AromaticContact NE2-NE2 3.02Å; H142-H192 PolarHBondContact NE2-NE2 3.41Å; H142-F218 AromaticContact CE1-CE2 3.51Å; H142-F218 AromaticContact CE1-CZ 3.33Å; H142-F218 WeakPolarHBondContact CE1-CZ 3.48Å; H142-F218 AromaticContact ND1-CZ 3.94Å; H142-F218 AromaticContact NE2-CE2 3.92Å
143	L	87.1	Confident	79.4	Confident	89 Å²	89	47 Å²	47	47%	0.466	25%	0.245	S	C	.	.	H	α-helix	trans	-61.3	-45.2	173.7	-74.9	163.5	0	0	0	111.3	L121 S139 D140 L141 I145 S146 L147	L121-L143 HydrophobicContact CD1-CB 3.87Å; S139-L143 WeakPolarHBondContact O-CG 3.24Å; S139-L143 PolarHBondContact O-N 3.46Å; S139-L143 VanDerWaalsContact O-N 3.09Å; D140-L143 PolarHBondContact O-N 3.32Å; L141-L143 VanDerWaalsContact C-N 3.3Å; L141-L143 PolarHBondContact O-N 3.18Å; L143-I145 PolarHBondContact O-N 2.89Å; L143-S146 PolarHBondContact O-N 3.42Å; L143-S146 PolarHBondContact O-OG 3.09Å; L143-L147 WeakPolarHBondContact O-CG 3.16Å; L143-L147 PolarHBondContact O-N 3.08Å
144	A	85.8	Confident	77.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-44.7	178.1	0	0	0	0	0	112.4	A118 L121 I122 D140 L141 L147 G148	A118-A144 HydrophobicContact CB-CB 4.28Å; L121-A144 HydrophobicContact CB-CB 3.95Å; L121-A144 HydrophobicContact CD1-CB 4.44Å; I122-A144 HydrophobicContact CG1-CB 3.86Å; D140-A144 WeakPolarHBondContact O-CB 3.31Å; D140-A144 PolarHBondContact O-N 2.66Å; L141-A144 WeakPolarHBondContact O-CB 3.33Å; L141-A144 PolarHBondContact O-N 3.11Å; L141-A144 VanDerWaalsContact O-N 3.14Å; A144-L147 PolarHBondContact O-N 3.08Å; A144-G148 PolarHBondContact O-N 3.19Å
145	I	86	Confident	75.4	Confident	18 Å²	18	50.8 Å²	50.8	9%	0.092	27%	0.268	C	S	.	.	H	α-helix	trans	-64.2	-42.9	176.5	-68.4	168	0	0	0	110.3	L141 H142 L143 L147 G148 S149 Y181 A184 V185 T188 F218	L141-I145 WeakPolarHBondContact O-CB 3.21Å; L141-I145 VanDerWaalsContact O-CG1 3.3Å; L141-I145 WeakPolarHBondContact O-CG1 3.46Å; L141-I145 PolarHBondContact O-N 2.88Å; H142-I145 PolarHBondContact O-N 2.94Å; L143-I145 PolarHBondContact O-N 2.89Å; I145-L147 VanDerWaalsContact C-N 3.32Å; I145-L147 PolarHBondContact O-N 2.75Å; I145-G148 PolarHBondContact O-N 2.66Å; I145-S149 PolarHBondContact O-N 3.47Å; I145-S149 PolarHBondContact O-OG 2.89Å; I145-Y181 HydrophobicContact CG2-CE2 3.96Å; I145-A184 HydrophobicContact CG1-CB 4.2Å; I145-V185 HydrophobicContact CD1-CG2 4.16Å; I145-V185 HydrophobicContact CG1-CG2 4.33Å; I145-T188 HydrophobicContact CD1-CG2 4.25Å; I145-T188 VanDerWaalsContact CD1-OG1 3.26Å; I145-T188 WeakPolarHBondContact CD1-OG1 3.48Å; I145-F218 HydrophobicContact CD1-CE1 4.06Å
146	S	83.6	Confident	73.3	Confident	49 Å²	49	47.9 Å²	47.9	34%	0.343	26%	0.263	S	S	.	.	H	α-helix	trans	-66.2	-31.5	179.6	78	0	0	0	0	113.9	H142 L143 S149 K150	H142-S146 WeakPolarHBondContact O-CB 3.45Å; H142-S146 PolarHBondContact O-N 3.44Å; H142-S146 PolarHBondContact O-OG 3.05Å; L143-S146 PolarHBondContact O-N 3.42Å; L143-S146 PolarHBondContact O-OG 3.09Å; S146-S149 PolarHBondContact O-OG 2.8Å; S146-K150 WeakPolarHBondContact O-CG 3.45Å
147	L	78.5	Confident	70.8	Confident	39 Å²	39	49.6 Å²	49.6	20%	0.204	27%	0.274	C	S	.	.	H	α-helix	trans	-78.1	-37.9	172.7	-69.1	172.5	0	0	0	110.7	A118 L121 L143 A144 I145 S151	A118-L147 HydrophobicContact CB-CB 4.1Å; L121-L147 HydrophobicContact CD1-CD1 3.76Å; L143-L147 WeakPolarHBondContact O-CG 3.16Å; L143-L147 PolarHBondContact O-N 3.08Å; A144-L147 PolarHBondContact O-N 3.08Å; I145-L147 VanDerWaalsContact C-N 3.32Å; I145-L147 PolarHBondContact O-N 2.75Å; L147-S151 PolarHBondContact O-N 3.35Å
148	G	70.8	Confident	68.4	Low	0 Å²	0	54 Å²	54	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-46.8	176.5	0	0	0	0	0	113.3	A144 I145 K150 S151 L152	A144-G148 PolarHBondContact O-N 3.19Å; I145-G148 PolarHBondContact O-N 2.66Å; G148-K150 PolarHBondContact O-N 3.45Å; G148-S151 CarbonylContact O-C 3.19Å; G148-S151 WeakPolarHBondContact O-CA 3.38Å; G148-S151 WeakPolarHBondContact O-CB 3.43Å; G148-S151 PolarHBondContact O-N 3.05Å; G148-S151 PolarHBondContact O-OG 3.2Å; G148-L152 PolarHBondContact O-N 3.34Å
149	S	66.1	Low	65.9	Low	37 Å²	37	62.3 Å²	62.3	26%	0.259	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-44.4	179.8	62.9	0	0	0	0	111.8	I145 S146 S151 L152 D153	I145-S149 PolarHBondContact O-N 3.47Å; I145-S149 PolarHBondContact O-OG 2.89Å; S146-S149 PolarHBondContact O-OG 2.8Å; S149-S151 PolarHBondContact O-N 3.48Å; S149-L152 PolarHBondContact O-N 3.17Å; S149-L152 VanDerWaalsContact O-N 3.08Å; S149-D153 PolarHBondContact O-N 3.15Å
150	K	61.5	Low	63.7	Low	144 Å²	144	63.1 Å²	63.1	63%	0.626	34%	0.344	S	S	*	.	H	α-helix	trans	-58.4	-37.9	173.2	-69.7	178.2	-178.2	178.6	0	112.2	S146 G148 T154	S146-K150 WeakPolarHBondContact O-CG 3.45Å; G148-K150 PolarHBondContact O-N 3.45Å; K150-T154 PolarHBondContact O-N 3.39Å; K150-T154 PolarHBondContact O-OG1 3.46Å
151	S	57	Low	61.2	Low	19 Å²	19	70.6 Å²	70.6	13%	0.133	38%	0.383	C	S	.	.	H	α-helix	trans	-72.1	-33.3	176.3	77.8	0	0	0	0	113.1	L147 G148 S149 T154 L155	L147-S151 PolarHBondContact O-N 3.35Å; G148-S151 CarbonylContact O-C 3.19Å; G148-S151 WeakPolarHBondContact O-CA 3.38Å; G148-S151 WeakPolarHBondContact O-CB 3.43Å; G148-S151 PolarHBondContact O-N 3.05Å; G148-S151 PolarHBondContact O-OG 3.2Å; S149-S151 PolarHBondContact O-N 3.48Å; S151-T154 VanDerWaalsContact CA-OG1 3.3Å; S151-T154 WeakPolarHBondContact CA-OG1 3.42Å; S151-T154 PolarHBondContact O-OG1 3.27Å; S151-L155 WeakPolarHBondContact O-CB 3.31Å; S151-L155 PolarHBondContact O-N 2.69Å
152	L	53.9	Low	58.6	Low	62 Å²	62	73 Å²	73	33%	0.325	40%	0.404	S	S	.	.	H	α-helix	trans	-72.8	-40.7	177.2	-136.6	86	0	0	0	111.8	G148 S149 T154 L155 S156	G148-L152 PolarHBondContact O-N 3.34Å; S149-L152 PolarHBondContact O-N 3.17Å; S149-L152 VanDerWaalsContact O-N 3.08Å; L152-T154 VanDerWaalsContact C-N 3.33Å; L152-L155 CarbonylContact O-C 3.44Å; L152-L155 WeakPolarHBondContact O-CB 3.13Å; L152-L155 PolarHBondContact O-N 3.1Å; L152-S156 PolarHBondContact O-N 3.3Å
153	D	52.3	Low	55.8	Low	98 Å²	98	77.9 Å²	77.9	52%	0.524	43%	0.432	S	S	.	.	H	α-helix	trans	-64.1	-38.1	175.5	-72.9	-20.2	0	0	0	111.5	S149 S156 I157	S149-D153 PolarHBondContact O-N 3.15Å; D153-S156 PolarHBondContact O-N 3.39Å; D153-S156 PolarHBondContact O-OG 3.03Å; D153-I157 WeakPolarHBondContact O-CG1 3.06Å; D153-I157 PolarHBondContact O-N 3.15Å
154	T	48.4	Very low	53.2	Low	77 Å²	77	76.8 Å²	76.8	47%	0.472	44%	0.436	S	S	.	.	H	α-helix	trans	-69.9	-34.1	173.7	39.5	0	0	0	0	112.3	K150 S151 L152 N158	K150-T154 PolarHBondContact O-N 3.39Å; K150-T154 PolarHBondContact O-OG1 3.46Å; S151-T154 VanDerWaalsContact CA-OG1 3.3Å; S151-T154 WeakPolarHBondContact CA-OG1 3.42Å; S151-T154 PolarHBondContact O-OG1 3.27Å; L152-T154 VanDerWaalsContact C-N 3.33Å; T154-N158 WeakPolarHBondContact O-CB 3.27Å; T154-N158 VanDerWaalsContact O-CG 3.26Å; T154-N158 PolarHBondContact O-N 3.07Å; T154-N158 VanDerWaalsContact O-N 3.14Å; T154-N158 PolarHBondContact O-ND2 2.85Å
155	L	39.8	Very low	50.8	Low	70 Å²	70	85.2 Å²	85.2	37%	0.366	48%	0.481	S	S	.	.	H	α-helix	trans	-69.2	-34.6	172.2	-88.4	160.8	0	0	0	113.2	S151 L152 N158 R159	S151-L155 WeakPolarHBondContact O-CB 3.31Å; S151-L155 PolarHBondContact O-N 2.69Å; L152-L155 CarbonylContact O-C 3.44Å; L152-L155 WeakPolarHBondContact O-CB 3.13Å; L152-L155 PolarHBondContact O-N 3.1Å; L155-N158 PolarHBondContact O-N 3.35Å; L155-R159 WeakPolarHBondContact O-CB 3.24Å; L155-R159 WeakPolarHBondContact O-CG 3.33Å; L155-R159 PolarHBondContact O-N 3.3Å
156	S	41.3	Very low	48.2	Very low	73 Å²	73	89.1 Å²	89.1	51%	0.51	51%	0.51	S	S	.	.	H	α-helix	trans	-71.8	-39	178.7	70.1	0	0	0	0	111.9	L152 D153 N158	L152-S156 PolarHBondContact O-N 3.3Å; D153-S156 PolarHBondContact O-N 3.39Å; D153-S156 PolarHBondContact O-OG 3.03Å; S156-N158 VanDerWaalsContact C-N 3.32Å; S156-N158 PolarHBondContact O-N 2.62Å
157	I	38.9	Very low	45.8	Very low	124 Å²	124	95.6 Å²	95.6	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-39.1	172.4	-65.5	168.9	0	0	0	110.6	D153	D153-I157 WeakPolarHBondContact O-CG1 3.06Å; D153-I157 PolarHBondContact O-N 3.15Å
158	N	37.9	Very low	43.7	Very low	92 Å²	92	98.6 Å²	98.6	49%	0.492	56%	0.559	S	S	.	*	H	α-helix	trans	-84.7	-18	-177.8	-69.6	-22.9	0	0	0	114.4	T154 L155 S156 G160 L161 A162	T154-N158 WeakPolarHBondContact O-CB 3.27Å; T154-N158 VanDerWaalsContact O-CG 3.26Å; T154-N158 PolarHBondContact O-N 3.07Å; T154-N158 VanDerWaalsContact O-N 3.14Å; T154-N158 PolarHBondContact O-ND2 2.85Å; L155-N158 PolarHBondContact O-N 3.35Å; S156-N158 VanDerWaalsContact C-N 3.32Å; S156-N158 PolarHBondContact O-N 2.62Å; N158-G160 PolarHBondContact O-N 3.41Å; N158-L161 CarbonylContact O-C 3.57Å; N158-L161 PolarHBondContact O-N 2.98Å; N158-A162 PolarHBondContact O-N 3.28Å
159	R	38.8	Very low	42.1	Very low	190 Å²	190	103.1 Å²	103.1	72%	0.717	59%	0.588	S	S	*	*	H	α-helix	trans	-66.1	-23.2	173.5	-93.8	-178	175.3	157.7	0.7	113.1	L155 L161	L155-R159 WeakPolarHBondContact O-CB 3.24Å; L155-R159 WeakPolarHBondContact O-CG 3.33Å; L155-R159 PolarHBondContact O-N 3.3Å; R159-L161 PolarHBondContact O-N 3.08Å
160	G	41.9	Very low	41.3	Very low	69 Å²	69	104.4 Å²	104.4	71%	0.711	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-15.9	168	0	0	0	0	0	114	N158	N158-G160 PolarHBondContact O-N 3.41Å
161	L	37.4	Very low	41	Very low	161 Å²	161	101 Å²	101	84%	0.843	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	0.2	-168.8	-81.1	168	0	0	0	116.8	N158 R159	N158-L161 CarbonylContact O-C 3.57Å; N158-L161 PolarHBondContact O-N 2.98Å; R159-L161 PolarHBondContact O-N 3.08Å
162	A	33.4	Very low	40.3	Very low	52 Å²	52	104.2 Å²	104.2	43%	0.43	60%	0.599	S	S	.	*			trans	-149.3	73	-174.4	0	0	0	0	0	114.8	N158 A164	N158-A162 PolarHBondContact O-N 3.28Å; A162-A164 PolarHBondContact O-N 2.85Å
163	N	32.1	Very low	40.2	Very low	173 Å²	173	104.6 Å²	104.6	93%	0.925	61%	0.607	S	S	*	*			trans	-80.6	72.1	141.5	-78.5	-16.9	0	0	0	107.3
164	A	31.9	Very low	40.5	Very low	65 Å²	65	101 Å²	101	54%	0.537	59%	0.591	S	S	.	*	S	Bend	trans	-155.9	107.3	173.9	0	0	0	0	0	108.9	A162 S166	A162-A164 PolarHBondContact O-N 2.85Å; A164-S166 PolarHBondContact O-N 3.27Å; A164-S166 VanDerWaalsContact O-N 3.14Å; A164-S166 PolarHBondContact O-OG 3.21Å
165	D	35.7	Very low	41.2	Very low	177 Å²	177	99.2 Å²	99.2	95%	0.947	58%	0.582	S	S	*	*			trans	4.1	94.9	153.2	-60.5	-35.9	0	0	0	115.2
166	S	31.7	Very low	42.5	Very low	101 Å²	101	96 Å²	96	71%	0.706	57%	0.565	S	S	*	*			trans	-140.9	88.6	163.9	38.2	0	0	0	0	109.5	A164	A164-S166 PolarHBondContact O-N 3.27Å; A164-S166 VanDerWaalsContact O-N 3.14Å; A164-S166 PolarHBondContact O-OG 3.21Å
167	E	32.4	Very low	44	Very low	184 Å²	184	97.2 Å²	97.2	86%	0.86	57%	0.566	S	S	*	*			trans	39.9	102.9	135	-62.7	-176.7	158.2	0	0	117.2
168	S	33.5	Very low	45.8	Very low	102 Å²	102	98.5 Å²	98.5	71%	0.713	56%	0.563	S	S	*	*			trans	24.7	106.8	152.2	58.2	0	0	0	0	116.1	S170	S168-S170 PolarHBondContact O-N 2.93Å
169	P	37.7	Very low	47.6	Very low	96 Å²	96	98 Å²	98	62%	0.623	56%	0.563	S	S	*	*			trans	-53.2	119.5	175.7	20.4	-30.4	0	0	0	109	I171	P169-I171 PolarHBondContact O-N 3.37Å
170	S	50.1	Low	49.6	Very low	64 Å²	64	91.3 Å²	91.3	45%	0.448	54%	0.54	S	S	.	.			trans	-55.9	130.4	-178.5	81.2	0	0	0	0	108.1	S168 M172 S173 A174	S168-S170 PolarHBondContact O-N 2.93Å; S170-M172 PolarHBondContact O-N 2.96Å; S170-S173 CarbonylContact O-C 3.56Å; S170-S173 PolarHBondContact O-N 3.16Å; S170-S173 PolarHBondContact OG-OG 3.49Å; S170-A174 PolarHBondContact O-N 3Å
171	I	55.1	Low	51.5	Low	73 Å²	73	89.3 Å²	89.3	37%	0.374	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-53.3	-19.5	-179.5	-68.3	160.9	0	0	0	111.6	I84 N117 F120 P169	I84-I171 HydrophobicContact CB-CG2 4.17Å; I84-I171 HydrophobicContact CD1-CG2 4.26Å; I84-I171 HydrophobicContact CG2-CG2 3.57Å; N117-I171 PolarHBondContact ND2-O 3.16Å; F120-I171 HydrophobicContact CZ-CG2 4.46Å; P169-I171 PolarHBondContact O-N 3.37Å
172	M	42.6	Very low	53.7	Low	85 Å²	85	82 Å²	82	42%	0.419	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-71.2	-29.7	177.1	-61.2	-68.7	-75	0	0	114.1	F80 I84 S170	F80-M172 HydrophobicContact CB-SD 4.33Å; I84-M172 HydrophobicContact CD1-SD 3.79Å; S170-M172 PolarHBondContact O-N 2.96Å
173	S	52	Low	56	Low	71 Å²	71	83.8 Å²	83.8	50%	0.497	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-143.1	50.7	-176.3	68.9	0	0	0	0	111	S170 S175	S170-S173 CarbonylContact O-C 3.56Å; S170-S173 PolarHBondContact O-N 3.16Å; S170-S173 PolarHBondContact OG-OG 3.49Å; S173-S175 PolarHBondContact O-N 3.17Å
174	A	56.8	Low	58.6	Low	23 Å²	23	75.6 Å²	75.6	19%	0.19	43%	0.431	C	S	.	.			trans	-62.2	109.9	174.9	0	0	0	0	0	108.9	S170	S170-A174 PolarHBondContact O-N 3Å
175	S	64.8	Low	61.2	Low	39 Å²	39	72.5 Å²	72.5	27%	0.273	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-61.5	137.1	166.2	52.9	0	0	0	0	108.4	S173 N177	S173-S175 PolarHBondContact O-N 3.17Å; S175-N177 PolarHBondContact O-N 3.36Å
176	L	66.7	Low	63.6	Low	1 Å²	1	64.5 Å²	64.5	1%	0.005	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-61	131	170.6	-72.2	167.2	0	0	0	108.6	A118 I122 E180 Y181	A118-L176 HydrophobicContact CB-CD1 3.72Å; A118-L176 HydrophobicContact CB-CD2 4.24Å; A118-L176 HydrophobicContact CB-CG 3.74Å; I122-L176 HydrophobicContact CD1-CD1 4.1Å; I122-L176 HydrophobicContact CD1-CD2 3.35Å; I122-L176 HydrophobicContact CD1-CG 4.4Å; L176-E180 HydrophobicContact CB-CB 4.31Å; L176-E180 HydrophobicContact CD2-CB 3.73Å; L176-Y181 HydrophobicContact CD1-CD2 4.36Å
177	N	72.9	Confident	66.2	Low	100 Å²	100	60.6 Å²	60.6	54%	0.535	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-65.2	157	167	-72.3	-6.7	0	0	0	109.1	S175 T179 E180 Y181	S175-N177 PolarHBondContact O-N 3.36Å; N177-T179 PolarHBondContact O-N 3.3Å; N177-T179 VanDerWaalsContact O-N 3.12Å; N177-E180 HydrophobicContact CB-CG 4.37Å; N177-E180 PolarHBondContact N-OE2 3.33Å; N177-E180 PolarHBondContact O-N 3.39Å; N177-Y181 PolarHBondContact O-N 2.82Å
178	R	75.4	Confident	68.9	Low	151 Å²	151	51.9 Å²	51.9	57%	0.57	29%	0.293	S	S	*	.	H	α-helix	trans	-49.8	-43.4	-179.7	-179.9	175.8	176.7	171.7	5.1	112.3	Y181 E182 M225	R178-Y181 PolarHBondContact O-N 3.3Å; R178-E182 HydrophobicContact CG-CG 4.41Å; R178-E182 VanDerWaalsContact CG-OE1 3.24Å; R178-E182 WeakPolarHBondContact CG-OE1 3.48Å; R178-E182 IonicContact CZ-OE1 3.98Å; R178-E182 IonicContact NE-OE1 2.99Å; R178-E182 PolarHBondContact NE-OE1 3.35Å; R178-E182 IonicContact NH2-OE1 2.77Å; R178-E182 WeakPolarHBondContact O-CB 3.37Å; R178-E182 VanDerWaalsContact O-CG 3.26Å; R178-E182 WeakPolarHBondContact O-CG 3.5Å; R178-E182 PolarHBondContact O-N 3.24Å; R178-M225 PolarHBondContact NH2-O 3.44Å
179	T	76.6	Confident	71.5	Confident	82 Å²	82	47 Å²	47	50%	0.503	26%	0.259	S	S	.	.	H	α-helix	trans	-66.1	-39	177.7	51.4	0	0	0	0	113.4	N177 N183	N177-T179 PolarHBondContact O-N 3.3Å; N177-T179 VanDerWaalsContact O-N 3.12Å; T179-N183 WeakPolarHBondContact O-CB 3.43Å; T179-N183 PolarHBondContact O-N 2.78Å; T179-N183 PolarHBondContact O-ND2 2.89Å; T179-N183 PolarHBondContact O-OD1 3.26Å
180	E	80.2	Confident	73.9	Confident	48 Å²	48	42.5 Å²	42.5	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-37.3	177.1	-64.2	178.1	147.7	0	0	110.9	K119 L176 N177 A184	K119-E180 IonicContact NZ-OE1 3.24Å; K119-E180 PolarHBondContact NZ-OE1 2.73Å; L176-E180 HydrophobicContact CB-CB 4.31Å; L176-E180 HydrophobicContact CD2-CB 3.73Å; N177-E180 HydrophobicContact CB-CG 4.37Å; N177-E180 PolarHBondContact N-OE2 3.33Å; N177-E180 PolarHBondContact O-N 3.39Å; E180-A184 WeakPolarHBondContact O-CB 3.37Å; E180-A184 PolarHBondContact O-N 3.12Å
181	Y	83	Confident	75.7	Confident	28 Å²	28	39.4 Å²	39.4	11%	0.11	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-50.1	173.8	-178.5	-94.2	0	0	0	111.6	I145 L176 N177 R178 N183 A184 V185 M225	I145-Y181 HydrophobicContact CG2-CE2 3.96Å; L176-Y181 HydrophobicContact CD1-CD2 4.36Å; N177-Y181 PolarHBondContact O-N 2.82Å; R178-Y181 PolarHBondContact O-N 3.3Å; Y181-N183 VanDerWaalsContact C-N 3.3Å; Y181-N183 PolarHBondContact O-N 3.14Å; Y181-A184 WeakPolarHBondContact O-CB 3.22Å; Y181-A184 PolarHBondContact O-N 3.22Å; Y181-A184 VanDerWaalsContact O-N 3.12Å; Y181-V185 HydrophobicContact CD1-CG2 4.22Å; Y181-V185 HydrophobicContact CE1-CG2 3.84Å; Y181-V185 WeakPolarHBondContact O-CG2 3.3Å; Y181-V185 PolarHBondContact O-N 2.85Å; Y181-M225 HydrophobicContact CD1-SD 4.18Å; Y181-M225 HydrophobicContact CE1-CE 3.82Å; Y181-M225 HydrophobicContact CE1-SD 3.88Å
182	E	82.7	Confident	77.4	Confident	7 Å²	7	36.1 Å²	36.1	3%	0.033	19%	0.191	C	C	.	.	H	α-helix	trans	-54.6	-46.6	175	-76.4	170.3	-172.2	0	0	111	R178 A184 V185 L186 Y222 M225 K226	R178-E182 HydrophobicContact CG-CG 4.41Å; R178-E182 VanDerWaalsContact CG-OE1 3.24Å; R178-E182 WeakPolarHBondContact CG-OE1 3.48Å; R178-E182 IonicContact CZ-OE1 3.98Å; R178-E182 IonicContact NE-OE1 2.99Å; R178-E182 PolarHBondContact NE-OE1 3.35Å; R178-E182 IonicContact NH2-OE1 2.77Å; R178-E182 WeakPolarHBondContact O-CB 3.37Å; R178-E182 VanDerWaalsContact O-CG 3.26Å; R178-E182 WeakPolarHBondContact O-CG 3.5Å; R178-E182 PolarHBondContact O-N 3.24Å; E182-A184 PolarHBondContact O-N 3.43Å; E182-V185 PolarHBondContact O-N 2.86Å; E182-L186 PolarHBondContact O-N 3.2Å; E182-Y222 HydrophobicContact CB-CD2 4.19Å; E182-Y222 HydrophobicContact CB-CE2 3.95Å; E182-Y222 VanDerWaalsContact O-CD2 3.28Å; E182-Y222 WeakPolarHBondContact O-CD2 2.87Å; E182-M225 HydrophobicContact CG-CB 4.48Å; E182-M225 HydrophobicContact CG-SD 4.28Å; E182-K226 VanDerWaalsContact OE2-CE 3.27Å; E182-K226 WeakPolarHBondContact OE2-CE 3.43Å; E182-K226 IonicContact OE2-NZ 2.71Å; E182-K226 PolarHBondContact OE2-NZ 3.32Å
183	N	82.8	Confident	79.5	Confident	89 Å²	89	32.2 Å²	32.2	48%	0.476	17%	0.172	S	C	.	.	H	α-helix	trans	-64.7	-38.2	176.8	-71.5	-10.8	0	0	0	112.9	T179 Y181 L186 M187	T179-N183 WeakPolarHBondContact O-CB 3.43Å; T179-N183 PolarHBondContact O-N 2.78Å; T179-N183 PolarHBondContact O-ND2 2.89Å; T179-N183 PolarHBondContact O-OD1 3.26Å; Y181-N183 VanDerWaalsContact C-N 3.3Å; Y181-N183 PolarHBondContact O-N 3.14Å; N183-L186 PolarHBondContact O-N 3.41Å; N183-M187 WeakPolarHBondContact O-CB 3.46Å; N183-M187 WeakPolarHBondContact O-CG 3.35Å; N183-M187 PolarHBondContact O-N 2.73Å
184	A	85.3	Confident	81.1	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-41.6	176.8	0	0	0	0	0	111.5	I122 L141 I145 E180 Y181 E182 T188	I122-A184 HydrophobicContact CD1-CB 3.78Å; I122-A184 HydrophobicContact CG1-CB 4.28Å; L141-A184 HydrophobicContact CD2-CB 4.46Å; I145-A184 HydrophobicContact CG1-CB 4.2Å; E180-A184 WeakPolarHBondContact O-CB 3.37Å; E180-A184 PolarHBondContact O-N 3.12Å; Y181-A184 WeakPolarHBondContact O-CB 3.22Å; Y181-A184 PolarHBondContact O-N 3.22Å; Y181-A184 VanDerWaalsContact O-N 3.12Å; E182-A184 PolarHBondContact O-N 3.43Å; A184-T188 WeakPolarHBondContact O-CB 3.34Å; A184-T188 PolarHBondContact O-N 3.24Å; A184-T188 PolarHBondContact O-OG1 3.41Å
185	V	87.3	Confident	82.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-50.6	175.1	171.6	0	0	0	0	110.5	I145 Y181 E182 M187 T188 G189 F218 Q221 M225	I145-V185 HydrophobicContact CD1-CG2 4.16Å; I145-V185 HydrophobicContact CG1-CG2 4.33Å; Y181-V185 HydrophobicContact CD1-CG2 4.22Å; Y181-V185 HydrophobicContact CE1-CG2 3.84Å; Y181-V185 WeakPolarHBondContact O-CG2 3.3Å; Y181-V185 PolarHBondContact O-N 2.85Å; E182-V185 PolarHBondContact O-N 2.86Å; V185-M187 PolarHBondContact O-N 2.92Å; V185-T188 WeakPolarHBondContact O-CB 3.5Å; V185-T188 PolarHBondContact O-N 3.14Å; V185-G189 PolarHBondContact O-N 2.81Å; V185-F218 HydrophobicContact CG1-CD1 4.21Å; V185-F218 WeakPolarHBondContact CG1-O 3.32Å; V185-Q221 HydrophobicContact CG1-CB 4.22Å; V185-M225 HydrophobicContact CG1-CE 4.34Å; V185-M225 HydrophobicContact CG2-CE 4.24Å
186	L	86.1	Confident	83.7	Confident	10 Å²	10	27.5 Å²	27.5	5%	0.052	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-46.1	178.4	-176.4	62.1	0	0	0	112.2	E182 N183 T188 G189 H190 Y222	E182-L186 PolarHBondContact O-N 3.2Å; N183-L186 PolarHBondContact O-N 3.41Å; L186-T188 VanDerWaalsContact C-N 3.3Å; L186-T188 PolarHBondContact O-N 2.91Å; L186-G189 PolarHBondContact O-N 3.2Å; L186-H190 WeakPolarHBondContact CD1-NE2 3.49Å; L186-H190 PolarHBondContact O-CD2 3.11Å; L186-H190 VanDerWaalsContact O-CD2 3.24Å; L186-H190 PolarHBondContact O-N 3.39Å; L186-Y222 HydrophobicContact CB-CD1 4.5Å; L186-Y222 HydrophobicContact CB-CD2 3.76Å; L186-Y222 HydrophobicContact CB-CE2 4.07Å; L186-Y222 HydrophobicContact CB-CG 3.98Å; L186-Y222 HydrophobicContact CD1-CD1 3.88Å; L186-Y222 HydrophobicContact CD1-CE1 4.3Å; L186-Y222 HydrophobicContact CD1-CG 4.08Å; L186-Y222 HydrophobicContact CD2-CD1 4.4Å; L186-Y222 HydrophobicContact CD2-CE1 4.05Å; L186-Y222 HydrophobicContact CD2-CE2 4.14Å; L186-Y222 HydrophobicContact CG-CD1 4.49Å; L186-Y222 HydrophobicContact CG-CG 4.44Å
187	M	86.6	Confident	84.6	Confident	19 Å²	19	29.4 Å²	29.4	9%	0.094	14%	0.143	C	C	.	.	H	α-helix	trans	-58	-41.1	175.9	-79.3	-91.3	-75.7	0	0	112.1	E126 I129 L141 N183 V185 H190 L191 N284 L287	E126-M187 HydrophobicContact CG-CE 3.87Å; I129-M187 HydrophobicContact CD1-CE 3.63Å; L141-M187 HydrophobicContact CD1-CB 4.29Å; N183-M187 WeakPolarHBondContact O-CB 3.46Å; N183-M187 WeakPolarHBondContact O-CG 3.35Å; N183-M187 PolarHBondContact O-N 2.73Å; V185-M187 PolarHBondContact O-N 2.92Å; M187-H190 PolarHBondContact O-N 3.36Å; M187-L191 WeakPolarHBondContact O-CB 3.35Å; M187-L191 WeakPolarHBondContact O-CG 3.38Å; M187-L191 PolarHBondContact O-N 3.44Å; M187-N284 HydrophobicContact SD-CB 3.76Å; M187-L287 HydrophobicContact SD-CD1 4.11Å
188	T	89.4	Confident	85.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.4	-44.7	177	-55.2	0	0	0	0	110.8	L141 I145 A184 V185 L186 L191 H192 F218	L141-T188 VanDerWaalsContact CB-OG1 3.31Å; L141-T188 WeakPolarHBondContact CB-OG1 3.46Å; I145-T188 HydrophobicContact CD1-CG2 4.25Å; I145-T188 VanDerWaalsContact CD1-OG1 3.26Å; I145-T188 WeakPolarHBondContact CD1-OG1 3.48Å; A184-T188 WeakPolarHBondContact O-CB 3.34Å; A184-T188 PolarHBondContact O-N 3.24Å; A184-T188 PolarHBondContact O-OG1 3.41Å; V185-T188 WeakPolarHBondContact O-CB 3.5Å; V185-T188 PolarHBondContact O-N 3.14Å; L186-T188 VanDerWaalsContact C-N 3.3Å; L186-T188 PolarHBondContact O-N 2.91Å; T188-L191 PolarHBondContact O-N 3.5Å; T188-H192 PolarHBondContact O-CD2 3.43Å; T188-H192 PolarHBondContact O-N 3.28Å; T188-F218 HydrophobicContact CG2-CD1 4.33Å; T188-F218 HydrophobicContact CG2-CD2 3.9Å; T188-F218 HydrophobicContact CG2-CE1 4.25Å; T188-F218 HydrophobicContact CG2-CE2 3.82Å; T188-F218 HydrophobicContact CG2-CG 4.17Å; T188-F218 HydrophobicContact CG2-CZ 4.01Å
189	G	88	Confident	85.7	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57.7	-50	175.2	0	0	0	0	0	113	V185 L186 L191 H192 I193	V185-G189 PolarHBondContact O-N 2.81Å; L186-G189 PolarHBondContact O-N 3.2Å; G189-L191 VanDerWaalsContact C-N 3.34Å; G189-L191 PolarHBondContact O-N 3.25Å; G189-H192 PolarHBondContact O-N 2.92Å; G189-I193 PolarHBondContact O-N 3.02Å
190	H	87.9	Confident	86.1	Confident	1 Å²	1	17.4 Å²	17.4	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-62.9	-37.9	176.8	-68.3	-49.7	0	0	0	113.3	L186 M187 I193 V194 I280 L287 L291	L186-H190 WeakPolarHBondContact CD1-NE2 3.49Å; L186-H190 PolarHBondContact O-CD2 3.11Å; L186-H190 VanDerWaalsContact O-CD2 3.24Å; L186-H190 PolarHBondContact O-N 3.39Å; M187-H190 PolarHBondContact O-N 3.36Å; H190-I193 WeakPolarHBondContact O-CB 3.39Å; H190-I193 PolarHBondContact O-N 2.79Å; H190-V194 WeakPolarHBondContact O-CG2 3.49Å; H190-V194 PolarHBondContact O-N 3.45Å; H190-I280 PolarHBondContact CE1-O 3.03Å; H190-I280 PolarHBondContact NE2-O 3.1Å; H190-L287 HydrophobicContact CB-CB 4.42Å; H190-L287 HydrophobicContact CB-CD1 3.95Å; H190-L291 HydrophobicContact CB-CD1 4.18Å; H190-L291 WeakPolarHBondContact ND1-CD1 3.36Å
191	L	87.8	Confident	86.3	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.1	-38.3	178.4	-84.1	167	0	0	0	113	I129 Y134 A137 I138 L141 M187 T188 G189 I193 V194 H195 L287	I129-L191 HydrophobicContact CD1-CD1 3.74Å; I129-L191 HydrophobicContact CD1-CD2 4.05Å; I129-L191 HydrophobicContact CD1-CG 4.21Å; I129-L191 HydrophobicContact CG1-CD1 3.95Å; I129-L191 HydrophobicContact CG1-CD2 3.67Å; I129-L191 HydrophobicContact CG1-CG 4.32Å; Y134-L191 HydrophobicContact CD1-CD2 3.65Å; Y134-L191 HydrophobicContact CE1-CD2 4.37Å; A137-L191 HydrophobicContact CB-CD1 4.11Å; I138-L191 HydrophobicContact CD1-CB 4.35Å; I138-L191 HydrophobicContact CG1-CB 3.83Å; L141-L191 HydrophobicContact CD1-CD1 3.24Å; M187-L191 WeakPolarHBondContact O-CB 3.35Å; M187-L191 WeakPolarHBondContact O-CG 3.38Å; M187-L191 PolarHBondContact O-N 3.44Å; T188-L191 PolarHBondContact O-N 3.5Å; G189-L191 VanDerWaalsContact C-N 3.34Å; G189-L191 PolarHBondContact O-N 3.25Å; L191-I193 VanDerWaalsContact C-N 3.27Å; L191-I193 PolarHBondContact O-N 2.9Å; L191-V194 PolarHBondContact O-N 2.75Å; L191-H195 VanDerWaalsContact O-CB 3.26Å; L191-H195 WeakPolarHBondContact O-CB 3.33Å; L191-H195 PolarHBondContact O-N 3.08Å; L191-L287 HydrophobicContact CD2-CD2 4.08Å; L191-L287 HydrophobicContact CG-CD1 4.25Å
192	H	90.5	Very high	86.6	Confident	3 Å²	3	28.1 Å²	28.1	1%	0.014	13%	0.13	C	C	.	.	H	α-helix	trans	-59.4	-39.7	172.2	-84.4	-63.1	0	0	0	111.7	H142 T188 G189 H195 G196 Q211 F218	H142-H192 AromaticContact CE1-NE2 3.9Å; H142-H192 AromaticContact NE2-CE1 3.69Å; H142-H192 AromaticContact NE2-NE2 3.02Å; H142-H192 PolarHBondContact NE2-NE2 3.41Å; T188-H192 PolarHBondContact O-CD2 3.43Å; T188-H192 PolarHBondContact O-N 3.28Å; G189-H192 PolarHBondContact O-N 2.92Å; H192-H195 PolarHBondContact O-N 3.45Å; H192-G196 PolarHBondContact O-N 3.31Å; H192-Q211 WeakPolarHBondContact CB-O 3.32Å; H192-Q211 PolarHBondContact CE1-OE1 3.26Å; H192-Q211 PolarHBondContact ND1-OE1 3.44Å; H192-F218 AromaticContact CD2-CD2 3.78Å; H192-F218 AromaticContact CD2-CE2 3.93Å; H192-F218 AromaticContact NE2-CE2 3.77Å
193	I	87.6	Confident	86.6	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-50.7	174.8	-69.1	156.6	0	0	0	111.5	G189 H190 L191 H195 G196 E197 Y212 I219 V240 T241 L291	G189-I193 PolarHBondContact O-N 3.02Å; H190-I193 WeakPolarHBondContact O-CB 3.39Å; H190-I193 PolarHBondContact O-N 2.79Å; L191-I193 VanDerWaalsContact C-N 3.27Å; L191-I193 PolarHBondContact O-N 2.9Å; I193-H195 VanDerWaalsContact C-N 3.3Å; I193-H195 PolarHBondContact O-N 3.21Å; I193-G196 PolarHBondContact O-N 3.1Å; I193-G196 VanDerWaalsContact O-N 3.17Å; I193-E197 PolarHBondContact O-N 3.38Å; I193-Y212 HydrophobicContact CG1-CD1 4.41Å; I193-Y212 HydrophobicContact CG2-CE1 4.1Å; I193-I219 HydrophobicContact CD1-CD1 3.41Å; I193-I219 VanDerWaalsContact CD1-CD1 3.41Å; I193-V240 HydrophobicContact CD1-CB 4.49Å; I193-V240 HydrophobicContact CD1-CG1 3.66Å; I193-T241 HydrophobicContact CD1-CG2 3.93Å; I193-T241 HydrophobicContact CG1-CG2 3.74Å; I193-L291 HydrophobicContact CB-CD2 4.1Å; I193-L291 HydrophobicContact CD1-CD2 3.92Å; I193-L291 HydrophobicContact CG2-CD2 3.49Å; I193-L291 VanDerWaalsContact CG2-CD2 3.49Å
194	V	85.2	Confident	86.9	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-37.3	179	173.8	0	0	0	0	111.4	Y134 H190 L191 E197 N198 L287	Y134-V194 HydrophobicContact CD1-CG1 4.29Å; Y134-V194 HydrophobicContact CD2-CG1 4.32Å; Y134-V194 HydrophobicContact CE1-CG1 3.98Å; Y134-V194 HydrophobicContact CE2-CG1 4.01Å; Y134-V194 HydrophobicContact CG-CG1 4.46Å; H190-V194 WeakPolarHBondContact O-CG2 3.49Å; H190-V194 PolarHBondContact O-N 3.45Å; L191-V194 PolarHBondContact O-N 2.75Å; V194-E197 PolarHBondContact O-N 3.41Å; V194-N198 PolarHBondContact O-N 2.81Å; V194-N198 VanDerWaalsContact O-N 3.12Å; V194-N198 PolarHBondContact O-ND2 3.31Å; V194-L287 HydrophobicContact CG2-CD2 4.03Å
195	H	87.5	Confident	86.9	Confident	33 Å²	33	40.3 Å²	40.3	15%	0.153	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-41	174.9	-173	45.8	0	0	0	111.6	I138 L191 H192 I193 E197 N198 L199	I138-H195 HydrophobicContact CD1-CB 3.7Å; L191-H195 VanDerWaalsContact O-CB 3.26Å; L191-H195 WeakPolarHBondContact O-CB 3.33Å; L191-H195 PolarHBondContact O-N 3.08Å; H192-H195 PolarHBondContact O-N 3.45Å; I193-H195 VanDerWaalsContact C-N 3.3Å; I193-H195 PolarHBondContact O-N 3.21Å; H195-E197 VanDerWaalsContact C-N 3.32Å; H195-E197 PolarHBondContact O-N 2.95Å; H195-N198 PolarHBondContact O-N 3.02Å; H195-L199 WeakPolarHBondContact O-CG 3.45Å; H195-L199 PolarHBondContact O-N 3.45Å
196	G	87.7	Confident	86.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-42.9	171.8	0	0	0	0	0	112.5	H192 I193 N198 L199 K200 A208	H192-G196 PolarHBondContact O-N 3.31Å; I193-G196 PolarHBondContact O-N 3.1Å; I193-G196 VanDerWaalsContact O-N 3.17Å; G196-N198 PolarHBondContact O-N 3.32Å; G196-L199 PolarHBondContact O-N 3.1Å; G196-K200 WeakPolarHBondContact O-CB 3.23Å; G196-K200 PolarHBondContact O-N 3.3Å; G196-A208 WeakPolarHBondContact O-CB 3.21Å
197	E	85.3	Confident	86.9	Confident	42 Å²	42	50 Å²	50	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-42.6	174.7	-71	-178	160.6	0	0	112.7	I193 V194 H195 K200 Y201 Y212	I193-E197 PolarHBondContact O-N 3.38Å; V194-E197 PolarHBondContact O-N 3.41Å; H195-E197 VanDerWaalsContact C-N 3.32Å; H195-E197 PolarHBondContact O-N 2.95Å; E197-K200 WeakPolarHBondContact O-CB 3.38Å; E197-K200 PolarHBondContact O-N 2.95Å; E197-Y201 WeakPolarHBondContact O-CD2 3.28Å; E197-Y201 PolarHBondContact O-N 3.26Å; E197-Y212 WeakPolarHBondContact CA-OH 3.4Å; E197-Y212 VanDerWaalsContact CG-OH 3.26Å; E197-Y212 WeakPolarHBondContact CG-OH 3.27Å; E197-Y212 PolarHBondContact N-OH 3.4Å
198	N	85.5	Confident	87	Confident	46 Å²	46	49.1 Å²	49.1	25%	0.246	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-41	176.5	-71.1	-53.6	0	0	0	112.1	Y134 V194 H195 G196 K200 Y201 Q202	Y134-N198 WeakPolarHBondContact CD2-ND2 3.41Å; Y134-N198 WeakPolarHBondContact CE2-ND2 3.26Å; V194-N198 PolarHBondContact O-N 2.81Å; V194-N198 VanDerWaalsContact O-N 3.12Å; V194-N198 PolarHBondContact O-ND2 3.31Å; H195-N198 PolarHBondContact O-N 3.02Å; G196-N198 PolarHBondContact O-N 3.32Å; N198-K200 VanDerWaalsContact C-N 3.33Å; N198-Y201 PolarHBondContact O-N 2.94Å; N198-Q202 WeakPolarHBondContact O-CG 3.46Å; N198-Q202 PolarHBondContact O-N 3.43Å
199	L	87.2	Confident	86.9	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-65	-37.3	176.1	-71.4	170.1	0	0	0	111.9	H195 G196 Q202 R203 K204 E207 A208 Q211	H195-L199 WeakPolarHBondContact O-CG 3.45Å; H195-L199 PolarHBondContact O-N 3.45Å; G196-L199 PolarHBondContact O-N 3.1Å; L199-Q202 CarbonylContact O-C 3.22Å; L199-Q202 WeakPolarHBondContact O-CA 3.43Å; L199-Q202 WeakPolarHBondContact O-CB 3.21Å; L199-Q202 PolarHBondContact O-N 2.82Å; L199-Q202 VanDerWaalsContact O-N 3.14Å; L199-R203 PolarHBondContact O-N 3.14Å; L199-R203 VanDerWaalsContact O-N 3.16Å; L199-K204 HydrophobicContact CB-CB 4.41Å; L199-K204 HydrophobicContact CD2-CB 4.26Å; L199-K204 HydrophobicContact CD2-CD 3.96Å; L199-K204 PolarHBondContact O-N 3.36Å; L199-E207 HydrophobicContact CD1-CB 3.94Å; L199-A208 HydrophobicContact CB-CB 4Å; L199-Q211 HydrophobicContact CD1-CG 3.52Å
200	K	84.9	Confident	87	Confident	29 Å²	29	56.4 Å²	56.4	13%	0.126	25%	0.247	C	C	.	.	H	α-helix	trans	-58.8	-47.4	171.3	178.9	-168.6	72.4	-165.8	0	111.1	G196 E197 N198 Q202 R203 A208 Q247 V248	G196-K200 WeakPolarHBondContact O-CB 3.23Å; G196-K200 PolarHBondContact O-N 3.3Å; E197-K200 WeakPolarHBondContact O-CB 3.38Å; E197-K200 PolarHBondContact O-N 2.95Å; N198-K200 VanDerWaalsContact C-N 3.33Å; K200-Q202 PolarHBondContact O-N 2.82Å; K200-R203 WeakPolarHBondContact O-CA 3.2Å; K200-R203 PolarHBondContact O-N 3.13Å; K200-A208 HydrophobicContact CB-CB 4.43Å; K200-Q247 HydrophobicContact CD-CB 4.09Å; K200-V248 HydrophobicContact CB-CG2 4.21Å; K200-V248 HydrophobicContact CD-CG2 4.12Å; K200-V248 HydrophobicContact CG-CG2 4.05Å
201	Y	84.8	Confident	87.1	Confident	180 Å²	180	58 Å²	58	71%	0.706	25%	0.254	S	S	*	.	H	α-helix	trans	-61.8	-31.2	174.7	-72.6	-61.6	0	0	0	112.9	E197 N198 R203	E197-Y201 WeakPolarHBondContact O-CD2 3.28Å; E197-Y201 PolarHBondContact O-N 3.26Å; N198-Y201 PolarHBondContact O-N 2.94Å; Y201-R203 PolarHBondContact O-N 3.22Å
202	Q	87.7	Confident	87.2	Confident	121 Å²	121	58.1 Å²	58.1	57%	0.565	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	1.8	173.1	-66.5	175.3	10.8	0	0	114	N198 L199 K200 K204	N198-Q202 WeakPolarHBondContact O-CG 3.46Å; N198-Q202 PolarHBondContact O-N 3.43Å; L199-Q202 CarbonylContact O-C 3.22Å; L199-Q202 WeakPolarHBondContact O-CA 3.43Å; L199-Q202 WeakPolarHBondContact O-CB 3.21Å; L199-Q202 PolarHBondContact O-N 2.82Å; L199-Q202 VanDerWaalsContact O-N 3.14Å; K200-Q202 PolarHBondContact O-N 2.82Å; Q202-K204 HydrophobicContact CB-CG 4.45Å; Q202-K204 PolarHBondContact O-N 2.87Å
203	R	84.1	Confident	87.1	Confident	223 Å²	223	64.1 Å²	64.1	84%	0.842	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	20.6	-174.3	-58.3	-174.8	172.7	-169.5	-3.4	115.1	L199 K200 Y201 L205	L199-R203 PolarHBondContact O-N 3.14Å; L199-R203 VanDerWaalsContact O-N 3.16Å; K200-R203 WeakPolarHBondContact O-CA 3.2Å; K200-R203 PolarHBondContact O-N 3.13Å; Y201-R203 PolarHBondContact O-N 3.22Å; R203-L205 PolarHBondContact O-N 2.98Å
204	K	88.1	Confident	87.3	Confident	97 Å²	97	67.3 Å²	67.3	42%	0.422	30%	0.3	S	S	.	.			trans	-90.5	71	173.5	-66.4	-172.8	176.5	-172.5	0	110.8	L199 Q202 E207 A208	L199-K204 HydrophobicContact CB-CB 4.41Å; L199-K204 HydrophobicContact CD2-CB 4.26Å; L199-K204 HydrophobicContact CD2-CD 3.96Å; L199-K204 PolarHBondContact O-N 3.36Å; Q202-K204 HydrophobicContact CB-CG 4.45Å; Q202-K204 PolarHBondContact O-N 2.87Å; K204-E207 HydrophobicContact CB-CB 4.37Å; K204-E207 WeakPolarHBondContact CD-OE2 3.32Å; K204-E207 IonicContact NZ-OE2 2.74Å; K204-E207 PolarHBondContact O-N 2.82Å; K204-A208 PolarHBondContact O-N 2.89Å
205	L	85.8	Confident	87.4	Confident	34 Å²	34	67.3 Å²	67.3	18%	0.178	30%	0.299	C	S	.	.	H	α-helix	trans	-67.2	-41.4	-165.1	-57.3	-178.7	0	0	0	113.7	R203 A208 L209 V248 S251 M252	R203-L205 PolarHBondContact O-N 2.98Å; L205-A208 WeakPolarHBondContact O-CB 3.39Å; L205-A208 PolarHBondContact O-N 2.99Å; L205-L209 PolarHBondContact O-N 3.28Å; L205-L209 VanDerWaalsContact O-N 3.08Å; L205-V248 HydrophobicContact CB-CG1 3.96Å; L205-V248 HydrophobicContact CD2-CG1 4.34Å; L205-S251 VanDerWaalsContact CD1-OG 3.24Å; L205-S251 WeakPolarHBondContact CD1-OG 3.17Å; L205-S251 WeakPolarHBondContact CD2-OG 3.03Å; L205-M252 HydrophobicContact CB-CE 3.34Å; L205-M252 HydrophobicContact CB-CG 3.92Å; L205-M252 HydrophobicContact CB-SD 4.47Å; L205-M252 HydrophobicContact CD1-CB 4.49Å; L205-M252 HydrophobicContact CD1-CG 3.62Å; L205-M252 HydrophobicContact CG-CG 4.4Å; L205-M252 WeakPolarHBondContact O-CE 3.22Å
206	E	85.8	Confident	87.4	Confident	125 Å²	125	71 Å²	71	58%	0.584	31%	0.312	S	S	*	.	H	α-helix	trans	-68.3	-37.1	179.3	-66	-172.6	166.3	0	0	112.7	A208 L209 K210 M252	E206-A208 VanDerWaalsContact C-N 3.32Å; E206-L209 PolarHBondContact O-N 2.83Å; E206-K210 PolarHBondContact O-N 3.47Å; E206-M252 HydrophobicContact CB-CE 4.46Å; E206-M252 HydrophobicContact CG-CE 3.91Å
207	E	88.4	Confident	87.5	Confident	89 Å²	89	73 Å²	73	42%	0.416	33%	0.326	S	S	.	.	H	α-helix	trans	-66.3	-39.1	174.2	-65.2	179.4	-166	0	0	110.3	L199 K204 L209 K210 Q211	L199-E207 HydrophobicContact CD1-CB 3.94Å; K204-E207 HydrophobicContact CB-CB 4.37Å; K204-E207 WeakPolarHBondContact CD-OE2 3.32Å; K204-E207 IonicContact NZ-OE2 2.74Å; K204-E207 PolarHBondContact O-N 2.82Å; E207-L209 PolarHBondContact O-N 2.88Å; E207-K210 PolarHBondContact O-N 3.3Å; E207-Q211 WeakPolarHBondContact O-CG 3.43Å; E207-Q211 PolarHBondContact O-N 3.18Å
208	A	88	Confident	87.6	Confident	0 Å²	0	72 Å²	72	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59.7	-44.4	175.4	0	0	0	0	0	112.1	G196 L199 K200 K204 L205 E206 K210 Q211 Y212 V248	G196-A208 WeakPolarHBondContact O-CB 3.21Å; L199-A208 HydrophobicContact CB-CB 4Å; K200-A208 HydrophobicContact CB-CB 4.43Å; K204-A208 PolarHBondContact O-N 2.89Å; L205-A208 WeakPolarHBondContact O-CB 3.39Å; L205-A208 PolarHBondContact O-N 2.99Å; E206-A208 VanDerWaalsContact C-N 3.32Å; A208-K210 PolarHBondContact O-N 3.08Å; A208-Q211 PolarHBondContact O-N 3.29Å; A208-Q211 VanDerWaalsContact O-N 3.17Å; A208-Y212 HydrophobicContact CB-CE2 4.29Å; A208-Y212 WeakPolarHBondContact O-CD2 3.41Å; A208-Y212 PolarHBondContact O-N 3.06Å; A208-V248 HydrophobicContact CB-CG2 3.97Å
209	L	87	Confident	87.6	Confident	25 Å²	25	69.8 Å²	69.8	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-45.6	175.5	-71.7	-179.5	0	0	0	112.1	L205 E206 E207 Q211 Y212 E213 V245 V248 Y249 M252	L205-L209 PolarHBondContact O-N 3.28Å; L205-L209 VanDerWaalsContact O-N 3.08Å; E206-L209 PolarHBondContact O-N 2.83Å; E207-L209 PolarHBondContact O-N 2.88Å; L209-Q211 VanDerWaalsContact C-N 3.28Å; L209-Q211 PolarHBondContact O-N 3.04Å; L209-Y212 PolarHBondContact O-N 3.11Å; L209-Y212 VanDerWaalsContact O-N 3.13Å; L209-E213 WeakPolarHBondContact O-CG 3.23Å; L209-E213 PolarHBondContact O-N 3.34Å; L209-V245 HydrophobicContact CD2-CG1 4.09Å; L209-V248 HydrophobicContact CD1-CG1 4.35Å; L209-V248 HydrophobicContact CD2-CB 4Å; L209-V248 HydrophobicContact CD2-CG1 3.73Å; L209-V248 HydrophobicContact CG-CB 4.5Å; L209-V248 HydrophobicContact CG-CG1 3.71Å; L209-Y249 HydrophobicContact CD1-CE1 4.43Å; L209-Y249 HydrophobicContact CD2-CE2 4.25Å; L209-M252 HydrophobicContact CD1-CE 3.56Å; L209-M252 HydrophobicContact CD1-SD 3.95Å; L209-M252 HydrophobicContact CG-CE 4.1Å
210	K	89.7	Confident	87.5	Confident	127 Å²	127	70.3 Å²	70.3	55%	0.552	31%	0.312	S	S	*	.	H	α-helix	trans	-59.5	-40.1	176.1	-69.5	175	-177.4	173.3	0	111.8	E206 E207 A208 E213 L214	E206-K210 PolarHBondContact O-N 3.47Å; E207-K210 PolarHBondContact O-N 3.3Å; A208-K210 PolarHBondContact O-N 3.08Å; K210-E213 PolarHBondContact O-N 3.27Å; K210-L214 WeakPolarHBondContact O-CG 3.13Å; K210-L214 PolarHBondContact O-N 3.06Å
211	Q	91.1	Very high	87.5	Confident	35 Å²	35	72.4 Å²	72.4	16%	0.164	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-41.4	175.7	-63.7	-50.2	-49.9	0	0	111.8	H192 L199 E207 A208 L209 L214 G215	H192-Q211 WeakPolarHBondContact CB-O 3.32Å; H192-Q211 PolarHBondContact CE1-OE1 3.26Å; H192-Q211 PolarHBondContact ND1-OE1 3.44Å; L199-Q211 HydrophobicContact CD1-CG 3.52Å; E207-Q211 WeakPolarHBondContact O-CG 3.43Å; E207-Q211 PolarHBondContact O-N 3.18Å; A208-Q211 PolarHBondContact O-N 3.29Å; A208-Q211 VanDerWaalsContact O-N 3.17Å; L209-Q211 VanDerWaalsContact C-N 3.28Å; L209-Q211 PolarHBondContact O-N 3.04Å; Q211-L214 PolarHBondContact O-N 3.44Å; Q211-G215 PolarHBondContact O-N 3.5Å
212	Y	89.2	Confident	87.5	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-38.8	175.8	-70.4	-57.6	0	0	0	112.7	I193 E197 A208 L209 G215 R216 T241 G244 V245 V248	I193-Y212 HydrophobicContact CG1-CD1 4.41Å; I193-Y212 HydrophobicContact CG2-CE1 4.1Å; E197-Y212 WeakPolarHBondContact CA-OH 3.4Å; E197-Y212 VanDerWaalsContact CG-OH 3.26Å; E197-Y212 WeakPolarHBondContact CG-OH 3.27Å; E197-Y212 PolarHBondContact N-OH 3.4Å; A208-Y212 HydrophobicContact CB-CE2 4.29Å; A208-Y212 WeakPolarHBondContact O-CD2 3.41Å; A208-Y212 PolarHBondContact O-N 3.06Å; L209-Y212 PolarHBondContact O-N 3.11Å; L209-Y212 VanDerWaalsContact O-N 3.13Å; Y212-G215 PolarHBondContact O-N 3.45Å; Y212-R216 WeakPolarHBondContact O-CB 3.43Å; Y212-R216 PolarHBondContact O-N 3.09Å; Y212-T241 HydrophobicContact CD1-CG2 4.44Å; Y212-T241 WeakPolarHBondContact O-CG2 3.45Å; Y212-G244 WeakPolarHBondContact OH-CA 3.41Å; Y212-V245 HydrophobicContact CD2-CG2 3.97Å; Y212-V245 HydrophobicContact CG-CG2 3.79Å; Y212-V248 HydrophobicContact CD2-CG2 4.38Å; Y212-V248 HydrophobicContact CE2-CG2 3.75Å
213	E	88.6	Confident	87.2	Confident	130 Å²	130	58.4 Å²	58.4	61%	0.607	26%	0.263	S	S	*	.	H	α-helix	trans	-61.8	-44.7	174.4	-73.5	178.5	169.8	0	0	112	L209 K210 R216 S217	L209-E213 WeakPolarHBondContact O-CG 3.23Å; L209-E213 PolarHBondContact O-N 3.34Å; K210-E213 PolarHBondContact O-N 3.27Å; E213-R216 PolarHBondContact O-N 2.89Å; E213-S217 PolarHBondContact O-N 3.24Å
214	L	90.9	Very high	87	Confident	70 Å²	70	53.4 Å²	53.4	37%	0.366	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-47.9	174	-69.5	173.4	0	0	0	110.6	K210 Q211 R216 S217 F218	K210-L214 WeakPolarHBondContact O-CG 3.13Å; K210-L214 PolarHBondContact O-N 3.06Å; Q211-L214 PolarHBondContact O-N 3.44Å; L214-R216 VanDerWaalsContact C-N 3.33Å; L214-R216 PolarHBondContact O-N 3.01Å; L214-S217 PolarHBondContact O-N 2.58Å; L214-S217 VanDerWaalsContact O-N 3.15Å; L214-S217 PolarHBondContact O-OG 3.04Å; L214-F218 VanDerWaalsContact O-CD2 3.23Å; L214-F218 WeakPolarHBondContact O-CD2 3.44Å; L214-F218 PolarHBondContact O-N 3.41Å
215	G	88.3	Confident	86.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.5	-46.2	177	0	0	0	0	0	112.9	Q211 Y212 F218 I219	Q211-G215 PolarHBondContact O-N 3.5Å; Y212-G215 PolarHBondContact O-N 3.45Å; G215-F218 PolarHBondContact O-N 3.43Å; G215-I219 WeakPolarHBondContact O-CG1 3.32Å; G215-I219 PolarHBondContact O-N 3.39Å; G215-I219 VanDerWaalsContact O-N 3.09Å
216	R	88	Confident	86.3	Confident	110 Å²	110	52.9 Å²	52.9	42%	0.415	25%	0.247	S	C	.	.	H	α-helix	trans	-56	-53.1	174	173.8	-177.4	174.6	-169.3	4.1	111	Y212 E213 L214 F218 I219 D220 T238 T241	Y212-R216 WeakPolarHBondContact O-CB 3.43Å; Y212-R216 PolarHBondContact O-N 3.09Å; E213-R216 PolarHBondContact O-N 2.89Å; L214-R216 VanDerWaalsContact C-N 3.33Å; L214-R216 PolarHBondContact O-N 3.01Å; R216-F218 VanDerWaalsContact C-N 3.31Å; R216-F218 PolarHBondContact O-N 2.94Å; R216-I219 PolarHBondContact O-N 3.08Å; R216-D220 IonicContact NE-OD2 2.77Å; R216-D220 WeakPolarHBondContact O-CB 3.3Å; R216-D220 VanDerWaalsContact O-CG 3.27Å; R216-D220 PolarHBondContact O-N 3.33Å; R216-T238 PolarHBondContact NE-OG1 3.3Å; R216-T238 PolarHBondContact NH2-OG1 2.83Å; R216-T241 HydrophobicContact CB-CG2 4.03Å
217	S	88.7	Confident	85.6	Confident	43 Å²	43	54.1 Å²	54.1	30%	0.301	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-38.2	-176.1	68.7	0	0	0	0	113	E213 L214 Q221	E213-S217 PolarHBondContact O-N 3.24Å; L214-S217 PolarHBondContact O-N 2.58Å; L214-S217 VanDerWaalsContact O-N 3.15Å; L214-S217 PolarHBondContact O-OG 3.04Å; S217-Q221 WeakPolarHBondContact O-CB 3.44Å; S217-Q221 WeakPolarHBondContact O-CG 3.38Å; S217-Q221 PolarHBondContact O-N 2.84Å
218	F	88.7	Confident	84.6	Confident	20 Å²	20	52.1 Å²	52.1	9%	0.088	25%	0.25	C	C	.	.	H	α-helix	trans	-70.6	-40.4	176.8	-80.7	-67.7	0	0	0	112.9	H142 I145 V185 T188 H192 L214 G215 R216 D220 Q221 Y222	H142-F218 AromaticContact CE1-CE2 3.51Å; H142-F218 AromaticContact CE1-CZ 3.33Å; H142-F218 WeakPolarHBondContact CE1-CZ 3.48Å; H142-F218 AromaticContact ND1-CZ 3.94Å; H142-F218 AromaticContact NE2-CE2 3.92Å; I145-F218 HydrophobicContact CD1-CE1 4.06Å; V185-F218 HydrophobicContact CG1-CD1 4.21Å; V185-F218 WeakPolarHBondContact CG1-O 3.32Å; T188-F218 HydrophobicContact CG2-CD1 4.33Å; T188-F218 HydrophobicContact CG2-CD2 3.9Å; T188-F218 HydrophobicContact CG2-CE1 4.25Å; T188-F218 HydrophobicContact CG2-CE2 3.82Å; T188-F218 HydrophobicContact CG2-CG 4.17Å; T188-F218 HydrophobicContact CG2-CZ 4.01Å; H192-F218 AromaticContact CD2-CD2 3.78Å; H192-F218 AromaticContact CD2-CE2 3.93Å; H192-F218 AromaticContact NE2-CE2 3.77Å; L214-F218 VanDerWaalsContact O-CD2 3.23Å; L214-F218 WeakPolarHBondContact O-CD2 3.44Å; L214-F218 PolarHBondContact O-N 3.41Å; G215-F218 PolarHBondContact O-N 3.43Å; R216-F218 VanDerWaalsContact C-N 3.31Å; R216-F218 PolarHBondContact O-N 2.94Å; F218-D220 VanDerWaalsContact C-N 3.32Å; F218-Q221 PolarHBondContact O-N 3.41Å; F218-Y222 PolarHBondContact O-N 3.23Å
219	I	85.5	Confident	83.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-40	175.8	-66.8	171.6	0	0	0	110.5	I193 G215 R216 Y222 A223 V240 I280	I193-I219 HydrophobicContact CD1-CD1 3.41Å; I193-I219 VanDerWaalsContact CD1-CD1 3.41Å; G215-I219 WeakPolarHBondContact O-CG1 3.32Å; G215-I219 PolarHBondContact O-N 3.39Å; G215-I219 VanDerWaalsContact O-N 3.09Å; R216-I219 PolarHBondContact O-N 3.08Å; I219-Y222 WeakPolarHBondContact O-CB 3.17Å; I219-Y222 PolarHBondContact O-N 3.03Å; I219-A223 WeakPolarHBondContact O-CB 3.46Å; I219-A223 PolarHBondContact O-N 3.2Å; I219-V240 HydrophobicContact CD1-CB 4.17Å; I219-V240 HydrophobicContact CD1-CG1 4.08Å; I219-I280 HydrophobicContact CG2-CG2 4Å
220	D	84.3	Confident	82	Confident	16 Å²	16	57.6 Å²	57.6	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-39.4	177.2	-69.7	-15.2	0	0	0	111.5	R216 F218 Y222 A223 Q224 T235 G237	R216-D220 IonicContact NE-OD2 2.77Å; R216-D220 WeakPolarHBondContact O-CB 3.3Å; R216-D220 VanDerWaalsContact O-CG 3.27Å; R216-D220 PolarHBondContact O-N 3.33Å; F218-D220 VanDerWaalsContact C-N 3.32Å; D220-Y222 VanDerWaalsContact C-N 3.35Å; D220-Y222 PolarHBondContact O-N 2.94Å; D220-A223 PolarHBondContact O-N 3.41Å; D220-Q224 VanDerWaalsContact O-CG 3.29Å; D220-Q224 WeakPolarHBondContact O-CG 3.35Å; D220-Q224 PolarHBondContact O-N 3Å; D220-T235 WeakPolarHBondContact OD1-CB 3.49Å; D220-T235 PolarHBondContact OD1-OG1 3.33Å; D220-T235 WeakPolarHBondContact OD2-CB 3.47Å; D220-T235 PolarHBondContact OD2-OG1 2.99Å; D220-G237 WeakPolarHBondContact OD1-CA 3.47Å; D220-G237 PolarHBondContact OD1-N 3.45Å
221	Q	84.9	Confident	80.5	Confident	73 Å²	73	60 Å²	60	34%	0.341	30%	0.3	S	S	.	.	H	α-helix	trans	-59.6	-43.9	171.4	-77.1	171.8	23.7	0	0	111.9	V185 S217 F218 Q224 M225	V185-Q221 HydrophobicContact CG1-CB 4.22Å; S217-Q221 WeakPolarHBondContact O-CB 3.44Å; S217-Q221 WeakPolarHBondContact O-CG 3.38Å; S217-Q221 PolarHBondContact O-N 2.84Å; F218-Q221 PolarHBondContact O-N 3.41Å; Q221-Q224 PolarHBondContact O-N 3.45Å; Q221-M225 HydrophobicContact CB-CE 4.19Å; Q221-M225 VanDerWaalsContact O-CG 3.32Å; Q221-M225 WeakPolarHBondContact O-CG 3.35Å; Q221-M225 PolarHBondContact O-N 2.82Å
222	Y	84	Confident	79.1	Confident	8 Å²	8	59.1 Å²	59.1	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-46.4	174.9	174.5	-94.4	0	0	0	111.7	E182 L186 F218 I219 D220 Q224 M225 K226 I280	E182-Y222 HydrophobicContact CB-CD2 4.19Å; E182-Y222 HydrophobicContact CB-CE2 3.95Å; E182-Y222 VanDerWaalsContact O-CD2 3.28Å; E182-Y222 WeakPolarHBondContact O-CD2 2.87Å; L186-Y222 HydrophobicContact CB-CD1 4.5Å; L186-Y222 HydrophobicContact CB-CD2 3.76Å; L186-Y222 HydrophobicContact CB-CE2 4.07Å; L186-Y222 HydrophobicContact CB-CG 3.98Å; L186-Y222 HydrophobicContact CD1-CD1 3.88Å; L186-Y222 HydrophobicContact CD1-CE1 4.3Å; L186-Y222 HydrophobicContact CD1-CG 4.08Å; L186-Y222 HydrophobicContact CD2-CD1 4.4Å; L186-Y222 HydrophobicContact CD2-CE1 4.05Å; L186-Y222 HydrophobicContact CD2-CE2 4.14Å; L186-Y222 HydrophobicContact CG-CD1 4.49Å; L186-Y222 HydrophobicContact CG-CG 4.44Å; F218-Y222 PolarHBondContact O-N 3.23Å; I219-Y222 WeakPolarHBondContact O-CB 3.17Å; I219-Y222 PolarHBondContact O-N 3.03Å; D220-Y222 VanDerWaalsContact C-N 3.35Å; D220-Y222 PolarHBondContact O-N 2.94Å; Y222-Q224 VanDerWaalsContact C-N 3.28Å; Y222-Q224 PolarHBondContact O-N 3.19Å; Y222-M225 PolarHBondContact O-N 3.09Å; Y222-M225 VanDerWaalsContact O-N 3.12Å; Y222-K226 HydrophobicContact CE1-CG 4.01Å; Y222-K226 HydrophobicContact CE2-CG 4.22Å; Y222-K226 PolarHBondContact O-N 3.38Å; Y222-K226 VanDerWaalsContact OH-CE 3.26Å; Y222-K226 WeakPolarHBondContact OH-CE 3.46Å; Y222-I280 HydrophobicContact CD1-CG1 4.34Å; Y222-I280 HydrophobicContact CE1-CG1 4.16Å
223	A	81.2	Confident	78	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-38.1	178	0	0	0	0	0	112	I219 D220 K226 D227 L228 I229 P236 I280	I219-A223 WeakPolarHBondContact O-CB 3.46Å; I219-A223 PolarHBondContact O-N 3.2Å; D220-A223 PolarHBondContact O-N 3.41Å; A223-K226 PolarHBondContact O-N 3.02Å; A223-D227 PolarHBondContact O-N 2.87Å; A223-L228 HydrophobicContact CB-CB 4.32Å; A223-L228 PolarHBondContact O-N 3.17Å; A223-I229 HydrophobicContact CB-CD1 4.44Å; A223-I229 HydrophobicContact CB-CG1 3.9Å; A223-P236 HydrophobicContact CB-CB 4.46Å; A223-P236 HydrophobicContact CB-CG 3.98Å; A223-I280 HydrophobicContact CB-CD1 4.44Å
224	Q	81.6	Confident	76.9	Confident	117 Å²	117	55.9 Å²	55.9	55%	0.547	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-44	173.1	-72.2	171.7	8	0	0	111.9	D220 Q221 Y222 K226 D227 I229	D220-Q224 VanDerWaalsContact O-CG 3.29Å; D220-Q224 WeakPolarHBondContact O-CG 3.35Å; D220-Q224 PolarHBondContact O-N 3Å; Q221-Q224 PolarHBondContact O-N 3.45Å; Y222-Q224 VanDerWaalsContact C-N 3.28Å; Y222-Q224 PolarHBondContact O-N 3.19Å; Q224-K226 PolarHBondContact O-N 3.1Å; Q224-D227 PolarHBondContact O-N 3.43Å; Q224-D227 VanDerWaalsContact O-N 3.08Å; Q224-I229 HydrophobicContact CB-CD1 4.42Å; Q224-I229 HydrophobicContact CG-CD1 3.24Å; Q224-I229 HydrophobicContact CG-CG1 3.79Å
225	M	79.4	Confident	76.2	Confident	51 Å²	51	53.7 Å²	53.7	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-63.6	-24.7	-179.9	-70.7	177.9	-148.2	0	0	113.5	R178 Y181 E182 V185 Q221 Y222	R178-M225 PolarHBondContact NH2-O 3.44Å; Y181-M225 HydrophobicContact CD1-SD 4.18Å; Y181-M225 HydrophobicContact CE1-CE 3.82Å; Y181-M225 HydrophobicContact CE1-SD 3.88Å; E182-M225 HydrophobicContact CG-CB 4.48Å; E182-M225 HydrophobicContact CG-SD 4.28Å; V185-M225 HydrophobicContact CG1-CE 4.34Å; V185-M225 HydrophobicContact CG2-CE 4.24Å; Q221-M225 HydrophobicContact CB-CE 4.19Å; Q221-M225 VanDerWaalsContact O-CG 3.32Å; Q221-M225 WeakPolarHBondContact O-CG 3.35Å; Q221-M225 PolarHBondContact O-N 2.82Å; Y222-M225 PolarHBondContact O-N 3.09Å; Y222-M225 VanDerWaalsContact O-N 3.12Å
226	K	78.3	Confident	75.6	Confident	70 Å²	70	54.1 Å²	54.1	30%	0.304	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	4.2	177.5	-68.8	-61.6	-155.3	-169.5	0	113.7	E182 Y222 A223 Q224 L228	E182-K226 VanDerWaalsContact OE2-CE 3.27Å; E182-K226 WeakPolarHBondContact OE2-CE 3.43Å; E182-K226 IonicContact OE2-NZ 2.71Å; E182-K226 PolarHBondContact OE2-NZ 3.32Å; Y222-K226 HydrophobicContact CE1-CG 4.01Å; Y222-K226 HydrophobicContact CE2-CG 4.22Å; Y222-K226 PolarHBondContact O-N 3.38Å; Y222-K226 VanDerWaalsContact OH-CE 3.26Å; Y222-K226 WeakPolarHBondContact OH-CE 3.46Å; A223-K226 PolarHBondContact O-N 3.02Å; Q224-K226 PolarHBondContact O-N 3.1Å; K226-L228 HydrophobicContact CB-CB 4.48Å; K226-L228 HydrophobicContact CB-CD1 3.53Å; K226-L228 HydrophobicContact CB-CG 3.6Å; K226-L228 HydrophobicContact CG-CD1 4.2Å; K226-L228 PolarHBondContact O-N 3Å
227	D	72.3	Confident	75.2	Confident	150 Å²	150	48.9 Å²	48.9	80%	0.802	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	30.3	-173.6	-60	-39.3	0	0	0	113.4	A223 Q224	A223-D227 PolarHBondContact O-N 2.87Å; Q224-D227 PolarHBondContact O-N 3.43Å; Q224-D227 VanDerWaalsContact O-N 3.08Å
228	L	67.2	Low	74.7	Confident	48 Å²	48	47.7 Å²	47.7	25%	0.251	25%	0.254	S	S	.	.			trans	-88	-5	-179.9	-64	170.3	0	0	0	112.9	A223 K226 T230 P277 I280	A223-L228 HydrophobicContact CB-CB 4.32Å; A223-L228 PolarHBondContact O-N 3.17Å; K226-L228 HydrophobicContact CB-CB 4.48Å; K226-L228 HydrophobicContact CB-CD1 3.53Å; K226-L228 HydrophobicContact CB-CG 3.6Å; K226-L228 HydrophobicContact CG-CD1 4.2Å; K226-L228 PolarHBondContact O-N 3Å; L228-T230 PolarHBondContact O-N 3.28Å; L228-P277 HydrophobicContact CB-CG 4.17Å; L228-P277 HydrophobicContact CD1-CB 3.93Å; L228-P277 HydrophobicContact CD1-CG 3.87Å; L228-P277 HydrophobicContact CD2-CB 4.06Å; L228-P277 HydrophobicContact CD2-CG 3.68Å; L228-P277 HydrophobicContact CG-CG 4.09Å; L228-I280 HydrophobicContact CD1-CD1 4.41Å; L228-I280 HydrophobicContact CD1-CG1 4.47Å
229	I	63.8	Low	73.9	Confident	58 Å²	58	47 Å²	47	30%	0.297	25%	0.251	S	S	.	.			trans	-76.3	108.1	176	-62.1	-148.5	0	0	0	109.1	A223 Q224	A223-I229 HydrophobicContact CB-CD1 4.44Å; A223-I229 HydrophobicContact CB-CG1 3.9Å; Q224-I229 HydrophobicContact CB-CD1 4.42Å; Q224-I229 HydrophobicContact CG-CD1 3.24Å; Q224-I229 HydrophobicContact CG-CG1 3.79Å
230	T	56	Low	73.5	Confident	81 Å²	81	47.5 Å²	47.5	50%	0.497	25%	0.254	S	S	.	.			trans	-68.8	155.7	162.1	43.4	0	0	0	0	109.6	L228 S232	L228-T230 PolarHBondContact O-N 3.28Å; T230-S232 PolarHBondContact O-N 3.45Å; T230-S232 PolarHBondContact O-OG 2.87Å; T230-S232 PolarHBondContact OG1-OG 3.41Å
231	N	59.5	Low	73.3	Confident	178 Å²	178	47 Å²	47	95%	0.952	25%	0.251	S	S	*	.	S	Bend	trans	-64.4	22.4	174.3	-73.1	-25.2	0	0	0	113.7
232	S	61.4	Low	72.9	Confident	16 Å²	16	43.7 Å²	43.7	11%	0.112	24%	0.236	C	C	.	.			trans	-76.3	148.3	-178.7	53.2	0	0	0	0	111.5	T230 I234 E272	T230-S232 PolarHBondContact O-N 3.45Å; T230-S232 PolarHBondContact O-OG 2.87Å; T230-S232 PolarHBondContact OG1-OG 3.41Å; S232-I234 VanDerWaalsContact C-N 3.26Å; S232-I234 PolarHBondContact O-N 3.26Å; S232-I234 PolarHBondContact OG-O 3.47Å; S232-E272 WeakPolarHBondContact CB-OE2 3.49Å
233	S	64.5	Low	72.4	Confident	62 Å²	62	45.3 Å²	45.3	43%	0.434	24%	0.244	S	C	.	.	S	Bend	trans	-66.5	-28.2	172.7	46	0	0	0	0	112.8	D268	S233-D268 PolarHBondContact OG-OD1 3.26Å; S233-D268 PolarHBondContact OG-OD2 2.95Å
234	I	67.2	Low	72.1	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.015	25%	0.247	C	C	.	.	S	Bend	trans	-93.8	126.9	174.6	-68.2	177.4	0	0	0	110	S232 L239 D268 L269 L274	S232-I234 VanDerWaalsContact C-N 3.26Å; S232-I234 PolarHBondContact O-N 3.26Å; S232-I234 PolarHBondContact OG-O 3.47Å; I234-L239 HydrophobicContact CG2-CD1 4.13Å; I234-L239 HydrophobicContact CG2-CD2 3.78Å; I234-L239 HydrophobicContact CG2-CG 3.54Å; I234-D268 HydrophobicContact CD1-CB 3.24Å; I234-D268 HydrophobicContact CG1-CB 3.48Å; I234-D268 VanDerWaalsContact CG1-CB 3.48Å; I234-L269 HydrophobicContact CD1-CD2 4.48Å; I234-L269 HydrophobicContact CD1-CG 3.94Å; I234-L274 HydrophobicContact CB-CD2 4.26Å; I234-L274 HydrophobicContact CG2-CD2 3.96Å
235	T	76.1	Confident	72	Confident	24 Å²	24	41 Å²	41	15%	0.147	23%	0.227	C	C	.	.			trans	-92.4	152.7	171	61.8	0	0	0	0	111.3	D220 G237 T238 L239	D220-T235 WeakPolarHBondContact OD1-CB 3.49Å; D220-T235 PolarHBondContact OD1-OG1 3.33Å; D220-T235 WeakPolarHBondContact OD2-CB 3.47Å; D220-T235 PolarHBondContact OD2-OG1 2.99Å; T235-G237 PolarHBondContact O-N 3.41Å; T235-T238 WeakPolarHBondContact O-CA 3.25Å; T235-T238 VanDerWaalsContact O-CB 3.27Å; T235-T238 WeakPolarHBondContact O-CB 3.27Å; T235-T238 PolarHBondContact O-N 3.27Å; T235-T238 PolarHBondContact OG1-N 3.34Å; T235-T238 PolarHBondContact OG1-OG1 3.13Å; T235-L239 PolarHBondContact O-N 3.12Å
236	P	75.6	Confident	71.7	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.052	22%	0.216	C	C	.	.	H	α-helix	trans	-54.1	-37	177.3	-27.9	35.8	0	0	0	113.9	A223 T238 L239 V240 I280	A223-P236 HydrophobicContact CB-CB 4.46Å; A223-P236 HydrophobicContact CB-CG 3.98Å; P236-T238 VanDerWaalsContact C-N 3.3Å; P236-T238 PolarHBondContact O-N 3.32Å; P236-L239 PolarHBondContact O-N 2.83Å; P236-V240 WeakPolarHBondContact O-CG2 3.28Å; P236-V240 PolarHBondContact O-N 2.67Å; P236-I280 HydrophobicContact CB-CD1 3.49Å; P236-I280 VanDerWaalsContact CB-CD1 3.49Å; P236-I280 HydrophobicContact CG-CD1 4Å
237	G	78.8	Confident	71.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.9	-31.5	175.7	0	0	0	0	0	113.1	D220 T235 T241	D220-G237 WeakPolarHBondContact OD1-CA 3.47Å; D220-G237 PolarHBondContact OD1-N 3.45Å; T235-G237 PolarHBondContact O-N 3.41Å; G237-T241 WeakPolarHBondContact O-CB 3.32Å; G237-T241 WeakPolarHBondContact O-CG2 3.4Å; G237-T241 PolarHBondContact O-N 3.11Å; G237-T241 VanDerWaalsContact O-N 3.17Å; G237-T241 PolarHBondContact O-OG1 2.9Å
238	T	78	Confident	71.9	Confident	19 Å²	19	32.2 Å²	32.2	12%	0.117	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-45.7	172.9	-54	0	0	0	0	110.3	R216 T235 P236 T241 L242	R216-T238 PolarHBondContact NE-OG1 3.3Å; R216-T238 PolarHBondContact NH2-OG1 2.83Å; T235-T238 WeakPolarHBondContact O-CA 3.25Å; T235-T238 VanDerWaalsContact O-CB 3.27Å; T235-T238 WeakPolarHBondContact O-CB 3.27Å; T235-T238 PolarHBondContact O-N 3.27Å; T235-T238 PolarHBondContact OG1-N 3.34Å; T235-T238 PolarHBondContact OG1-OG1 3.13Å; P236-T238 VanDerWaalsContact C-N 3.3Å; P236-T238 PolarHBondContact O-N 3.32Å; T238-T241 PolarHBondContact O-N 3.22Å; T238-T241 PolarHBondContact O-OG1 3.02Å; T238-L242 WeakPolarHBondContact O-CA 3.39Å; T238-L242 VanDerWaalsContact O-CB 3.27Å; T238-L242 WeakPolarHBondContact O-CB 3.44Å; T238-L242 PolarHBondContact O-N 3.41Å
239	L	72.7	Confident	72.2	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-62.3	-45.4	-180	-70.9	175.6	0	0	0	113.2	I234 T235 P236 T241 L242 L269 L274 I276 P294	I234-L239 HydrophobicContact CG2-CD1 4.13Å; I234-L239 HydrophobicContact CG2-CD2 3.78Å; I234-L239 HydrophobicContact CG2-CG 3.54Å; T235-L239 PolarHBondContact O-N 3.12Å; P236-L239 PolarHBondContact O-N 2.83Å; L239-T241 VanDerWaalsContact C-N 3.33Å; L239-T241 PolarHBondContact O-N 3.33Å; L239-L242 WeakPolarHBondContact O-CB 3.48Å; L239-L242 PolarHBondContact O-N 2.84Å; L239-L269 HydrophobicContact CD2-CD1 4.34Å; L239-L269 HydrophobicContact CD2-CD2 3.99Å; L239-L269 HydrophobicContact CD2-CG 4.45Å; L239-L274 HydrophobicContact CD1-CB 4.47Å; L239-L274 HydrophobicContact CD1-CD2 3.57Å; L239-L274 HydrophobicContact CG-CD2 4.5Å; L239-I276 HydrophobicContact CB-CD1 4.01Å; L239-I276 HydrophobicContact CD1-CD1 3.83Å; L239-I276 HydrophobicContact CD1-CG1 3.76Å; L239-P294 WeakPolarHBondContact O-CD 3.47Å
240	V	77	Confident	72.5	Confident	10 Å²	10	32.5 Å²	32.5	6%	0.061	18%	0.179	C	C	.	.	H	α-helix	trans	-69	-33	-177.5	-178.3	0	0	0	0	111.8	I193 I219 P236 I280 L291	I193-V240 HydrophobicContact CD1-CB 4.49Å; I193-V240 HydrophobicContact CD1-CG1 3.66Å; I219-V240 HydrophobicContact CD1-CB 4.17Å; I219-V240 HydrophobicContact CD1-CG1 4.08Å; P236-V240 WeakPolarHBondContact O-CG2 3.28Å; P236-V240 PolarHBondContact O-N 2.67Å; V240-I280 HydrophobicContact CG2-CG2 4.32Å; V240-L291 HydrophobicContact CG1-CD2 3.69Å
241	T	79.9	Confident	73.4	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-86	-19	179.4	54.8	0	0	0	0	113.4	I193 Y212 R216 G237 T238 L239 M243 G244 V245	I193-T241 HydrophobicContact CD1-CG2 3.93Å; I193-T241 HydrophobicContact CG1-CG2 3.74Å; Y212-T241 HydrophobicContact CD1-CG2 4.44Å; Y212-T241 WeakPolarHBondContact O-CG2 3.45Å; R216-T241 HydrophobicContact CB-CG2 4.03Å; G237-T241 WeakPolarHBondContact O-CB 3.32Å; G237-T241 WeakPolarHBondContact O-CG2 3.4Å; G237-T241 PolarHBondContact O-N 3.11Å; G237-T241 VanDerWaalsContact O-N 3.17Å; G237-T241 PolarHBondContact O-OG1 2.9Å; T238-T241 PolarHBondContact O-N 3.22Å; T238-T241 PolarHBondContact O-OG1 3.02Å; L239-T241 VanDerWaalsContact C-N 3.33Å; L239-T241 PolarHBondContact O-N 3.33Å; T241-M243 PolarHBondContact O-N 2.84Å; T241-G244 PolarHBondContact O-N 3.22Å; T241-G244 VanDerWaalsContact O-N 3.13Å; T241-V245 WeakPolarHBondContact O-CG2 3.38Å; T241-V245 PolarHBondContact O-N 2.94Å
242	L	76.8	Confident	73.8	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-51.9	-57.1	-166.6	-172	57.7	0	0	0	112.2	T238 L239 G244 V245 L246 L261 C265 P294 L299	T238-L242 WeakPolarHBondContact O-CA 3.39Å; T238-L242 VanDerWaalsContact O-CB 3.27Å; T238-L242 WeakPolarHBondContact O-CB 3.44Å; T238-L242 PolarHBondContact O-N 3.41Å; L239-L242 WeakPolarHBondContact O-CB 3.48Å; L239-L242 PolarHBondContact O-N 2.84Å; L242-G244 VanDerWaalsContact C-N 3.32Å; L242-G244 PolarHBondContact O-N 3.26Å; L242-V245 WeakPolarHBondContact O-CB 3.39Å; L242-V245 PolarHBondContact O-N 3.18Å; L242-V245 VanDerWaalsContact O-N 3.13Å; L242-L246 HydrophobicContact CD1-CD2 3.73Å; L242-L246 HydrophobicContact CD1-CG 4.25Å; L242-L246 HydrophobicContact CG-CD1 4.43Å; L242-L246 HydrophobicContact CG-CD2 4.21Å; L242-L246 HydrophobicContact CG-CG 4.19Å; L242-L246 WeakPolarHBondContact O-CB 3.33Å; L242-L246 WeakPolarHBondContact O-CG 3.41Å; L242-L246 PolarHBondContact O-N 3.47Å; L242-L261 HydrophobicContact CD1-CD2 3.46Å; L242-L261 VanDerWaalsContact CD1-CD2 3.46Å; L242-C265 HydrophobicContact CD1-CB 4.41Å; L242-C265 VanDerWaalsContact CD1-SG 3.54Å; L242-C265 HydrophobicContact CD2-CB 3.93Å; L242-P294 HydrophobicContact CB-CG 3.93Å; L242-P294 HydrophobicContact CD2-CG 4.12Å; L242-P294 HydrophobicContact CG-CG 4.35Å; L242-L299 HydrophobicContact CD2-CD1 3.71Å; L242-L299 HydrophobicContact CD2-CD2 3.51Å; L242-L299 HydrophobicContact CD2-CG 4.26Å; L242-L299 HydrophobicContact CG-CD2 3.98Å
243	M	73	Confident	74.2	Confident	42 Å²	42	32 Å²	32	21%	0.207	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-34.8	-176.9	-93.8	178.9	68.5	0	0	114.2	T241 L246 Q247 Y292 P294	T241-M243 PolarHBondContact O-N 2.84Å; M243-L246 PolarHBondContact O-N 3.34Å; M243-Q247 WeakPolarHBondContact O-CG 3.49Å; M243-Q247 PolarHBondContact O-N 3.27Å; M243-Y292 HydrophobicContact CE-CD1 3.46Å; M243-Y292 VanDerWaalsContact CE-CD1 3.46Å; M243-Y292 HydrophobicContact CE-CE1 3.58Å; M243-Y292 HydrophobicContact CE-CG 4.33Å; M243-Y292 HydrophobicContact SD-CD1 3.18Å; M243-Y292 WeakPolarHBondContact SD-CD1 3.34Å; M243-Y292 HydrophobicContact SD-CE1 3.25Å; M243-Y292 WeakPolarHBondContact SD-CE1 3.23Å; M243-Y292 HydrophobicContact SD-CG 4.42Å; M243-P294 HydrophobicContact CB-CG 4.33Å; M243-P294 HydrophobicContact CG-CB 3.74Å; M243-P294 HydrophobicContact CG-CG 3.78Å; M243-P294 HydrophobicContact SD-CB 3.63Å; M243-P294 HydrophobicContact SD-CG 4.07Å
244	G	75.2	Confident	74.3	Confident	7 Å²	7	35.4 Å²	35.4	7%	0.072	17%	0.174	C	C	.	.	H	α-helix	trans	-61.9	-48	173.5	0	0	0	0	0	111.2	Y212 T241 L242 Q247 V248	Y212-G244 WeakPolarHBondContact OH-CA 3.41Å; T241-G244 PolarHBondContact O-N 3.22Å; T241-G244 VanDerWaalsContact O-N 3.13Å; L242-G244 VanDerWaalsContact C-N 3.32Å; L242-G244 PolarHBondContact O-N 3.26Å; G244-Q247 PolarHBondContact O-N 2.9Å; G244-V248 WeakPolarHBondContact O-CG2 3.49Å; G244-V248 PolarHBondContact O-N 3.26Å; G244-V248 VanDerWaalsContact O-N 3.11Å
245	V	78.9	Confident	74.3	Confident	20 Å²	20	37.6 Å²	37.6	12%	0.121	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-44.2	175.9	173.2	0	0	0	0	111.2	L209 Y212 T241 L242 Q247 V248 Y249 L261	L209-V245 HydrophobicContact CD2-CG1 4.09Å; Y212-V245 HydrophobicContact CD2-CG2 3.97Å; Y212-V245 HydrophobicContact CG-CG2 3.79Å; T241-V245 WeakPolarHBondContact O-CG2 3.38Å; T241-V245 PolarHBondContact O-N 2.94Å; L242-V245 WeakPolarHBondContact O-CB 3.39Å; L242-V245 PolarHBondContact O-N 3.18Å; L242-V245 VanDerWaalsContact O-N 3.13Å; V245-Q247 PolarHBondContact O-N 3.32Å; V245-V248 PolarHBondContact O-N 3.04Å; V245-Y249 HydrophobicContact CG1-CD2 3.59Å; V245-Y249 HydrophobicContact CG1-CE2 3.36Å; V245-Y249 VanDerWaalsContact O-CD2 3.26Å; V245-Y249 WeakPolarHBondContact O-CD2 3.25Å; V245-Y249 PolarHBondContact O-N 2.73Å; V245-L261 HydrophobicContact CG1-CD1 4.33Å
246	L	74.2	Confident	74.1	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-58.3	-48.2	178.7	-67.8	-153.1	0	0	0	111.7	L242 M243 V248 Y249 E250 Y258 L261 I262 L299 A302	L242-L246 HydrophobicContact CD1-CD2 3.73Å; L242-L246 HydrophobicContact CD1-CG 4.25Å; L242-L246 HydrophobicContact CG-CD1 4.43Å; L242-L246 HydrophobicContact CG-CD2 4.21Å; L242-L246 HydrophobicContact CG-CG 4.19Å; L242-L246 WeakPolarHBondContact O-CB 3.33Å; L242-L246 WeakPolarHBondContact O-CG 3.41Å; L242-L246 PolarHBondContact O-N 3.47Å; M243-L246 PolarHBondContact O-N 3.34Å; L246-V248 VanDerWaalsContact C-N 3.31Å; L246-V248 PolarHBondContact O-N 3.38Å; L246-Y249 PolarHBondContact O-N 3.43Å; L246-E250 PolarHBondContact O-N 3.06Å; L246-Y258 HydrophobicContact CB-CE2 3.41Å; L246-Y258 VanDerWaalsContact CB-CE2 3.41Å; L246-Y258 WeakPolarHBondContact CB-OH 3.49Å; L246-Y258 HydrophobicContact CD1-CE2 4.12Å; L246-Y258 HydrophobicContact CD2-CD2 3.98Å; L246-Y258 HydrophobicContact CD2-CE2 3.49Å; L246-Y258 VanDerWaalsContact CD2-CE2 3.49Å; L246-Y258 HydrophobicContact CG-CE2 3.76Å; L246-Y258 WeakPolarHBondContact O-CE2 3.48Å; L246-Y258 PolarHBondContact O-OH 3.24Å; L246-L261 HydrophobicContact CD2-CD2 3.61Å; L246-I262 HydrophobicContact CD1-CD1 4.19Å; L246-I262 HydrophobicContact CD1-CG1 3.79Å; L246-I262 HydrophobicContact CD2-CD1 4.46Å; L246-I262 HydrophobicContact CD2-CG1 3.66Å; L246-I262 HydrophobicContact CG-CG1 4.34Å; L246-L299 HydrophobicContact CD1-CD2 3.52Å; L246-A302 HydrophobicContact CD1-CB 4.18Å
247	Q	76.3	Confident	73.8	Confident	83 Å²	83	45.8 Å²	45.8	39%	0.388	23%	0.229	S	C	.	.	H	α-helix	trans	-65.2	-33.7	178.3	-71.4	175.2	-4.4	0	0	112.7	K200 M243 G244 V245 S251	K200-Q247 HydrophobicContact CD-CB 4.09Å; M243-Q247 WeakPolarHBondContact O-CG 3.49Å; M243-Q247 PolarHBondContact O-N 3.27Å; G244-Q247 PolarHBondContact O-N 2.9Å; V245-Q247 PolarHBondContact O-N 3.32Å; Q247-S251 PolarHBondContact O-N 3.34Å; Q247-S251 VanDerWaalsContact O-N 3.16Å; Q247-S251 PolarHBondContact O-OG 3.15Å
248	V	77.6	Confident	73.5	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-45.9	173.6	174.8	0	0	0	0	110.6	K200 L205 A208 L209 Y212 G244 V245 L246 E250 S251 M252	K200-V248 HydrophobicContact CB-CG2 4.21Å; K200-V248 HydrophobicContact CD-CG2 4.12Å; K200-V248 HydrophobicContact CG-CG2 4.05Å; L205-V248 HydrophobicContact CB-CG1 3.96Å; L205-V248 HydrophobicContact CD2-CG1 4.34Å; A208-V248 HydrophobicContact CB-CG2 3.97Å; L209-V248 HydrophobicContact CD1-CG1 4.35Å; L209-V248 HydrophobicContact CD2-CB 4Å; L209-V248 HydrophobicContact CD2-CG1 3.73Å; L209-V248 HydrophobicContact CG-CB 4.5Å; L209-V248 HydrophobicContact CG-CG1 3.71Å; Y212-V248 HydrophobicContact CD2-CG2 4.38Å; Y212-V248 HydrophobicContact CE2-CG2 3.75Å; G244-V248 WeakPolarHBondContact O-CG2 3.49Å; G244-V248 PolarHBondContact O-N 3.26Å; G244-V248 VanDerWaalsContact O-N 3.11Å; V245-V248 PolarHBondContact O-N 3.04Å; L246-V248 VanDerWaalsContact C-N 3.31Å; L246-V248 PolarHBondContact O-N 3.38Å; V248-E250 VanDerWaalsContact C-N 3.33Å; V248-E250 PolarHBondContact O-N 3.45Å; V248-S251 PolarHBondContact O-N 2.87Å; V248-S251 VanDerWaalsContact O-N 3.13Å; V248-S251 PolarHBondContact O-OG 3.01Å; V248-M252 HydrophobicContact CG1-CE 3.85Å; V248-M252 HydrophobicContact CG1-CG 4.38Å; V248-M252 HydrophobicContact CG1-SD 4.35Å; V248-M252 WeakPolarHBondContact O-CG 3.48Å; V248-M252 PolarHBondContact O-N 2.82Å
249	Y	73.7	Confident	73.5	Confident	39 Å²	39	45.9 Å²	45.9	15%	0.153	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-39.9	176.3	-82.3	-64.1	0	0	0	112.9	L209 V245 L246 S251 M252 E253 R254 D257 Y258 L261	L209-Y249 HydrophobicContact CD1-CE1 4.43Å; L209-Y249 HydrophobicContact CD2-CE2 4.25Å; V245-Y249 HydrophobicContact CG1-CD2 3.59Å; V245-Y249 HydrophobicContact CG1-CE2 3.36Å; V245-Y249 VanDerWaalsContact O-CD2 3.26Å; V245-Y249 WeakPolarHBondContact O-CD2 3.25Å; V245-Y249 PolarHBondContact O-N 2.73Å; L246-Y249 PolarHBondContact O-N 3.43Å; Y249-S251 VanDerWaalsContact C-N 3.27Å; Y249-S251 PolarHBondContact O-N 3.09Å; Y249-M252 PolarHBondContact O-N 3.06Å; Y249-M252 VanDerWaalsContact O-N 3.09Å; Y249-E253 PolarHBondContact O-N 3.08Å; Y249-R254 HydrophobicContact CD1-CB 4.43Å; Y249-D257 HydrophobicContact CE1-CB 4.36Å; Y249-Y258 HydrophobicContact CD2-CD2 4.23Å; Y249-Y258 HydrophobicContact CG-CD2 4.17Å; Y249-Y258 HydrophobicContact CG-CG 4.17Å; Y249-L261 HydrophobicContact CE2-CD1 4.1Å
250	E	69.3	Low	73.8	Confident	73 Å²	73	50.8 Å²	50.8	34%	0.341	26%	0.255	S	S	.	.	H	α-helix	trans	-57.5	-42.5	174	-171.6	172.4	-169.4	0	0	111.4	L246 V248 M252 E253 Y258 K309	L246-E250 PolarHBondContact O-N 3.06Å; V248-E250 VanDerWaalsContact C-N 3.33Å; V248-E250 PolarHBondContact O-N 3.45Å; E250-M252 VanDerWaalsContact C-N 3.29Å; E250-M252 PolarHBondContact O-N 3.49Å; E250-E253 PolarHBondContact O-N 2.73Å; E250-Y258 HydrophobicContact CB-CE1 3.77Å; E250-K309 IonicContact OE1-NZ 2.64Å; E250-K309 PolarHBondContact OE1-NZ 3.34Å
251	S	75.2	Confident	73.6	Confident	62 Å²	62	52.9 Å²	52.9	43%	0.434	27%	0.265	S	S	.	.	H	α-helix	trans	-73.8	-16.3	178.2	66.5	0	0	0	0	114.8	L205 Q247 V248 Y249	L205-S251 VanDerWaalsContact CD1-OG 3.24Å; L205-S251 WeakPolarHBondContact CD1-OG 3.17Å; L205-S251 WeakPolarHBondContact CD2-OG 3.03Å; Q247-S251 PolarHBondContact O-N 3.34Å; Q247-S251 VanDerWaalsContact O-N 3.16Å; Q247-S251 PolarHBondContact O-OG 3.15Å; V248-S251 PolarHBondContact O-N 2.87Å; V248-S251 VanDerWaalsContact O-N 3.13Å; V248-S251 PolarHBondContact O-OG 3.01Å; Y249-S251 VanDerWaalsContact C-N 3.27Å; Y249-S251 PolarHBondContact O-N 3.09Å
252	M	69	Low	73.5	Confident	36 Å²	36	52.6 Å²	52.6	18%	0.177	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-7.2	177.6	-74.4	-170.1	173.8	0	0	113.7	L205 E206 L209 V248 Y249 E250 R254	L205-M252 HydrophobicContact CB-CE 3.34Å; L205-M252 HydrophobicContact CB-CG 3.92Å; L205-M252 HydrophobicContact CB-SD 4.47Å; L205-M252 HydrophobicContact CD1-CB 4.49Å; L205-M252 HydrophobicContact CD1-CG 3.62Å; L205-M252 HydrophobicContact CG-CG 4.4Å; L205-M252 WeakPolarHBondContact O-CE 3.22Å; E206-M252 HydrophobicContact CB-CE 4.46Å; E206-M252 HydrophobicContact CG-CE 3.91Å; L209-M252 HydrophobicContact CD1-CE 3.56Å; L209-M252 HydrophobicContact CD1-SD 3.95Å; L209-M252 HydrophobicContact CG-CE 4.1Å; V248-M252 HydrophobicContact CG1-CE 3.85Å; V248-M252 HydrophobicContact CG1-CG 4.38Å; V248-M252 HydrophobicContact CG1-SD 4.35Å; V248-M252 WeakPolarHBondContact O-CG 3.48Å; V248-M252 PolarHBondContact O-N 2.82Å; Y249-M252 PolarHBondContact O-N 3.06Å; Y249-M252 VanDerWaalsContact O-N 3.09Å; E250-M252 VanDerWaalsContact C-N 3.29Å; E250-M252 PolarHBondContact O-N 3.49Å; M252-R254 HydrophobicContact CB-CB 4.5Å; M252-R254 HydrophobicContact CB-CG 4.29Å; M252-R254 PolarHBondContact O-N 3.28Å
253	E	69	Low	73.7	Confident	167 Å²	167	54.4 Å²	54.4	78%	0.78	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	13.8	-172.9	-58.1	-177.1	169.3	0	0	114.7	Y249 E250 N255	Y249-E253 PolarHBondContact O-N 3.08Å; E250-E253 PolarHBondContact O-N 2.73Å; E253-N255 VanDerWaalsContact C-N 3.31Å; E253-N255 PolarHBondContact O-N 2.78Å
254	R	66.2	Low	73.9	Confident	132 Å²	132	58.7 Å²	58.7	50%	0.498	29%	0.293	S	S	.	.			trans	-83.4	70.8	176.1	-70.1	-169.9	-176.6	-177.8	6.2	111.2	Y249 M252 D256 Y258	Y249-R254 HydrophobicContact CD1-CB 4.43Å; M252-R254 HydrophobicContact CB-CB 4.5Å; M252-R254 HydrophobicContact CB-CG 4.29Å; M252-R254 PolarHBondContact O-N 3.28Å; R254-D256 PolarHBondContact O-N 2.83Å; R254-Y258 WeakPolarHBondContact O-CB 3.46Å; R254-Y258 PolarHBondContact O-N 2.79Å
255	N	67.3	Low	73.8	Confident	50 Å²	50	58.7 Å²	58.7	27%	0.267	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-34.9	-168.6	-65.4	-27.9	0	0	0	114.4	E253 Y258 V259	E253-N255 VanDerWaalsContact C-N 3.31Å; E253-N255 PolarHBondContact O-N 2.78Å; N255-Y258 WeakPolarHBondContact O-CB 3.22Å; N255-Y258 PolarHBondContact O-N 2.71Å; N255-V259 WeakPolarHBondContact O-CB 3.4Å; N255-V259 VanDerWaalsContact O-CG2 3.24Å; N255-V259 WeakPolarHBondContact O-CG2 3.42Å; N255-V259 PolarHBondContact O-N 2.65Å
256	D	71.7	Confident	73.8	Confident	113 Å²	113	57.8 Å²	57.8	60%	0.604	29%	0.286	S	S	*	.	H	α-helix	trans	-73.8	-47	-171.6	-64.1	-22.9	0	0	0	113	R254 Y258 V259 N260 Q310	R254-D256 PolarHBondContact O-N 2.83Å; D256-Y258 PolarHBondContact O-N 2.73Å; D256-V259 PolarHBondContact O-N 3.48Å; D256-N260 WeakPolarHBondContact O-CB 3.26Å; D256-N260 VanDerWaalsContact O-CG 3.3Å; D256-N260 PolarHBondContact O-N 2.81Å; D256-N260 PolarHBondContact O-ND2 3.05Å; D256-Q310 PolarHBondContact OD1-NE2 3.41Å
257	D	71.1	Confident	73.9	Confident	90 Å²	90	61.4 Å²	61.4	48%	0.481	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-38.3	174.3	-67.2	-28.1	0	0	0	110.8	Y249 N260 L261	Y249-D257 HydrophobicContact CE1-CB 4.36Å; D257-N260 PolarHBondContact O-N 2.87Å; D257-L261 WeakPolarHBondContact O-CB 3.42Å; D257-L261 PolarHBondContact O-N 3.18Å
258	Y	72.1	Confident	73.6	Confident	6 Å²	6	58.6 Å²	58.6	2%	0.024	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-48.4	179.3	-171.9	-162.2	0	0	0	112	L246 Y249 E250 R254 N255 D256 N260 L261 I262 L306	L246-Y258 HydrophobicContact CB-CE2 3.41Å; L246-Y258 VanDerWaalsContact CB-CE2 3.41Å; L246-Y258 WeakPolarHBondContact CB-OH 3.49Å; L246-Y258 HydrophobicContact CD1-CE2 4.12Å; L246-Y258 HydrophobicContact CD2-CD2 3.98Å; L246-Y258 HydrophobicContact CD2-CE2 3.49Å; L246-Y258 VanDerWaalsContact CD2-CE2 3.49Å; L246-Y258 HydrophobicContact CG-CE2 3.76Å; L246-Y258 WeakPolarHBondContact O-CE2 3.48Å; L246-Y258 PolarHBondContact O-OH 3.24Å; Y249-Y258 HydrophobicContact CD2-CD2 4.23Å; Y249-Y258 HydrophobicContact CG-CD2 4.17Å; Y249-Y258 HydrophobicContact CG-CG 4.17Å; E250-Y258 HydrophobicContact CB-CE1 3.77Å; R254-Y258 WeakPolarHBondContact O-CB 3.46Å; R254-Y258 PolarHBondContact O-N 2.79Å; N255-Y258 WeakPolarHBondContact O-CB 3.22Å; N255-Y258 PolarHBondContact O-N 2.71Å; D256-Y258 PolarHBondContact O-N 2.73Å; Y258-N260 VanDerWaalsContact C-N 3.33Å; Y258-N260 PolarHBondContact O-N 3.43Å; Y258-L261 PolarHBondContact O-N 3.29Å; Y258-I262 HydrophobicContact CD2-CD1 3.66Å; Y258-I262 HydrophobicContact CD2-CG1 3.98Å; Y258-I262 HydrophobicContact CE1-CD1 4.49Å; Y258-I262 HydrophobicContact CE2-CD1 3.32Å; Y258-I262 HydrophobicContact CE2-CG1 3.8Å; Y258-I262 HydrophobicContact CG-CD1 4.31Å; Y258-I262 VanDerWaalsContact O-CG1 3.32Å; Y258-I262 WeakPolarHBondContact O-CG1 3.38Å; Y258-I262 PolarHBondContact O-N 2.95Å; Y258-L306 HydrophobicContact CD1-CD1 3.1Å; Y258-L306 HydrophobicContact CD1-CD2 3.41Å; Y258-L306 VanDerWaalsContact CD1-CD2 3.41Å; Y258-L306 HydrophobicContact CD1-CG 3.77Å; Y258-L306 HydrophobicContact CD2-CD1 4.19Å; Y258-L306 HydrophobicContact CE1-CD1 3.18Å; Y258-L306 HydrophobicContact CE1-CD2 3.45Å; Y258-L306 VanDerWaalsContact CE1-CD2 3.45Å; Y258-L306 HydrophobicContact CE1-CG 3.64Å; Y258-L306 HydrophobicContact CE2-CD1 4.18Å; Y258-L306 HydrophobicContact CG-CD1 3.62Å
259	V	77.5	Confident	73.3	Confident	16 Å²	16	60.3 Å²	60.3	10%	0.097	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-40.3	177.2	168.4	0	0	0	0	111.3	N255 D256 I262 T263 L306 L307	N255-V259 WeakPolarHBondContact O-CB 3.4Å; N255-V259 VanDerWaalsContact O-CG2 3.24Å; N255-V259 WeakPolarHBondContact O-CG2 3.42Å; N255-V259 PolarHBondContact O-N 2.65Å; D256-V259 PolarHBondContact O-N 3.48Å; V259-I262 PolarHBondContact O-N 2.83Å; V259-T263 VanDerWaalsContact O-CB 3.3Å; V259-T263 WeakPolarHBondContact O-CB 3.23Å; V259-T263 PolarHBondContact O-N 3.33Å; V259-T263 PolarHBondContact O-OG1 3.48Å; V259-L306 HydrophobicContact CG2-CB 3.99Å; V259-L306 HydrophobicContact CG2-CD1 3.89Å; V259-L307 HydrophobicContact CG1-CD2 4.01Å; V259-L307 HydrophobicContact CG2-CD2 4.11Å
260	N	78	Confident	73.1	Confident	108 Å²	108	62 Å²	62	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-63.8	-44	178.3	-74.2	-26.7	0	0	0	111.9	D256 D257 Y258 T263 K264	D256-N260 WeakPolarHBondContact O-CB 3.26Å; D256-N260 VanDerWaalsContact O-CG 3.3Å; D256-N260 PolarHBondContact O-N 2.81Å; D256-N260 PolarHBondContact O-ND2 3.05Å; D257-N260 PolarHBondContact O-N 2.87Å; Y258-N260 VanDerWaalsContact C-N 3.33Å; Y258-N260 PolarHBondContact O-N 3.43Å; N260-T263 PolarHBondContact O-N 3.15Å; N260-K264 PolarHBondContact O-N 2.93Å
261	L	73.4	Confident	73	Confident	54 Å²	54	64.9 Å²	64.9	28%	0.283	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-47.5	177.5	-170.5	151.1	0	0	0	111.1	L242 V245 L246 Y249 D257 Y258 T263 K264 C265	L242-L261 HydrophobicContact CD1-CD2 3.46Å; L242-L261 VanDerWaalsContact CD1-CD2 3.46Å; V245-L261 HydrophobicContact CG1-CD1 4.33Å; L246-L261 HydrophobicContact CD2-CD2 3.61Å; Y249-L261 HydrophobicContact CE2-CD1 4.1Å; D257-L261 WeakPolarHBondContact O-CB 3.42Å; D257-L261 PolarHBondContact O-N 3.18Å; Y258-L261 PolarHBondContact O-N 3.29Å; L261-T263 VanDerWaalsContact C-N 3.32Å; L261-T263 PolarHBondContact O-N 3.44Å; L261-K264 PolarHBondContact O-N 3.04Å; L261-C265 PolarHBondContact O-N 3.39Å; L261-C265 VanDerWaalsContact O-N 3.11Å; L261-C265 PolarHBondContact O-SG 3Å; L261-C265 VanDerWaalsContact O-SG 3.34Å
262	I	78.1	Confident	72.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.5	-43.4	177	-62.8	164.4	0	0	0	110.9	L246 Y258 V259 K264 C265 I266 L299 A302 R303 L306	L246-I262 HydrophobicContact CD1-CD1 4.19Å; L246-I262 HydrophobicContact CD1-CG1 3.79Å; L246-I262 HydrophobicContact CD2-CD1 4.46Å; L246-I262 HydrophobicContact CD2-CG1 3.66Å; L246-I262 HydrophobicContact CG-CG1 4.34Å; Y258-I262 HydrophobicContact CD2-CD1 3.66Å; Y258-I262 HydrophobicContact CD2-CG1 3.98Å; Y258-I262 HydrophobicContact CE1-CD1 4.49Å; Y258-I262 HydrophobicContact CE2-CD1 3.32Å; Y258-I262 HydrophobicContact CE2-CG1 3.8Å; Y258-I262 HydrophobicContact CG-CD1 4.31Å; Y258-I262 VanDerWaalsContact O-CG1 3.32Å; Y258-I262 WeakPolarHBondContact O-CG1 3.38Å; Y258-I262 PolarHBondContact O-N 2.95Å; V259-I262 PolarHBondContact O-N 2.83Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 2.85Å; I262-C265 PolarHBondContact O-N 3.44Å; I262-C265 VanDerWaalsContact O-N 3.15Å; I262-I266 HydrophobicContact CG2-CD1 3.53Å; I262-I266 HydrophobicContact CG2-CG1 4.02Å; I262-I266 WeakPolarHBondContact O-CG1 3.45Å; I262-I266 PolarHBondContact O-N 3.29Å; I262-L299 HydrophobicContact CG2-CB 4.45Å; I262-A302 HydrophobicContact CD1-CB 4.18Å; I262-R303 HydrophobicContact CD1-CB 4.48Å; I262-R303 HydrophobicContact CG2-CB 3.79Å; I262-R303 HydrophobicContact CG2-CG 4.38Å; I262-L306 HydrophobicContact CD1-CD1 3.57Å
263	T	81	Confident	71.6	Confident	41 Å²	41	72 Å²	72	25%	0.252	36%	0.36	S	S	.	.	H	α-helix	trans	-63.1	-41.6	-177.8	-62.4	0	0	0	0	112	V259 N260 L261 C265 I266 N267 R303	V259-T263 VanDerWaalsContact O-CB 3.3Å; V259-T263 WeakPolarHBondContact O-CB 3.23Å; V259-T263 PolarHBondContact O-N 3.33Å; V259-T263 PolarHBondContact O-OG1 3.48Å; N260-T263 PolarHBondContact O-N 3.15Å; L261-T263 VanDerWaalsContact C-N 3.32Å; L261-T263 PolarHBondContact O-N 3.44Å; T263-C265 VanDerWaalsContact C-N 3.34Å; T263-I266 PolarHBondContact O-N 3.25Å; T263-N267 VanDerWaalsContact O-CG 3.28Å; T263-N267 PolarHBondContact O-N 3.04Å; T263-N267 VanDerWaalsContact O-N 3.08Å; T263-N267 PolarHBondContact O-ND2 3.34Å; T263-R303 WeakPolarHBondContact OG1-CD 3.28Å; T263-R303 PolarHBondContact OG1-NH1 2.68Å
264	K	76.8	Confident	70.9	Confident	132 Å²	132	66 Å²	66	57%	0.574	33%	0.333	S	S	*	.	H	α-helix	trans	-58.9	-48.7	173	-173.2	178	177.6	-176.6	0	110.6	N260 L261 I262 I266 N267 D268	N260-K264 PolarHBondContact O-N 2.93Å; L261-K264 PolarHBondContact O-N 3.04Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 2.85Å; K264-I266 PolarHBondContact O-N 2.83Å; K264-N267 PolarHBondContact O-N 2.73Å; K264-D268 WeakPolarHBondContact O-CB 3.29Å; K264-D268 PolarHBondContact O-N 3.43Å; K264-D268 VanDerWaalsContact O-N 3.07Å; K264-D268 VanDerWaalsContact O-OD2 3.13Å
265	C	74.3	Confident	70.4	Confident	7 Å²	7	68.3 Å²	68.3	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-39.8	-179.9	-67	0	0	0	0	113.7	L242 L261 I262 T263 L269	L242-C265 HydrophobicContact CD1-CB 4.41Å; L242-C265 VanDerWaalsContact CD1-SG 3.54Å; L242-C265 HydrophobicContact CD2-CB 3.93Å; L261-C265 PolarHBondContact O-N 3.39Å; L261-C265 VanDerWaalsContact O-N 3.11Å; L261-C265 PolarHBondContact O-SG 3Å; L261-C265 VanDerWaalsContact O-SG 3.34Å; I262-C265 PolarHBondContact O-N 3.44Å; I262-C265 VanDerWaalsContact O-N 3.15Å; T263-C265 VanDerWaalsContact C-N 3.34Å; C265-L269 WeakPolarHBondContact O-CB 3.32Å; C265-L269 WeakPolarHBondContact O-CG 3.33Å; C265-L269 PolarHBondContact O-N 3.45Å
266	I	77.6	Confident	69.9	Low	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-48.9	176.7	-71.7	169.4	0	0	0	110.6	I262 T263 K264 D268 L269 E270 L296 L299 L300 R303	I262-I266 HydrophobicContact CG2-CD1 3.53Å; I262-I266 HydrophobicContact CG2-CG1 4.02Å; I262-I266 WeakPolarHBondContact O-CG1 3.45Å; I262-I266 PolarHBondContact O-N 3.29Å; T263-I266 PolarHBondContact O-N 3.25Å; K264-I266 PolarHBondContact O-N 2.83Å; I266-D268 VanDerWaalsContact C-N 3.29Å; I266-D268 PolarHBondContact O-N 2.76Å; I266-L269 PolarHBondContact O-N 3.27Å; I266-E270 HydrophobicContact CG2-CG 4.38Å; I266-E270 WeakPolarHBondContact CG2-OE1 3.21Å; I266-E270 WeakPolarHBondContact O-CG 3.46Å; I266-E270 PolarHBondContact O-N 3.02Å; I266-L296 HydrophobicContact CG2-CD1 4.39Å; I266-L299 HydrophobicContact CD1-CB 4.44Å; I266-L299 HydrophobicContact CG1-CB 4.04Å; I266-L300 HydrophobicContact CD1-CD2 3.96Å; I266-L300 HydrophobicContact CD1-CG 4.4Å; I266-L300 HydrophobicContact CG2-CD2 4.24Å; I266-R303 HydrophobicContact CD1-CB 4.25Å
267	N	77.2	Confident	69.3	Low	80 Å²	80	63.7 Å²	63.7	43%	0.428	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-41.2	-178.6	-70.7	-15.6	0	0	0	111.8	T263 K264 N271	T263-N267 VanDerWaalsContact O-CG 3.28Å; T263-N267 PolarHBondContact O-N 3.04Å; T263-N267 VanDerWaalsContact O-N 3.08Å; T263-N267 PolarHBondContact O-ND2 3.34Å; K264-N267 PolarHBondContact O-N 2.73Å; N267-N271 VanDerWaalsContact O-CG 3.26Å; N267-N271 PolarHBondContact O-N 2.76Å; N267-N271 PolarHBondContact O-ND2 2.88Å
268	D	70.1	Confident	69	Low	25 Å²	25	67 Å²	67	13%	0.134	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-44.2	178.8	-67.4	-30.1	0	0	0	111.2	S233 I234 K264 I266 E270 N271 E272	S233-D268 PolarHBondContact OG-OD1 3.26Å; S233-D268 PolarHBondContact OG-OD2 2.95Å; I234-D268 HydrophobicContact CD1-CB 3.24Å; I234-D268 HydrophobicContact CG1-CB 3.48Å; I234-D268 VanDerWaalsContact CG1-CB 3.48Å; K264-D268 WeakPolarHBondContact O-CB 3.29Å; K264-D268 PolarHBondContact O-N 3.43Å; K264-D268 VanDerWaalsContact O-N 3.07Å; K264-D268 VanDerWaalsContact O-OD2 3.13Å; I266-D268 VanDerWaalsContact C-N 3.29Å; I266-D268 PolarHBondContact O-N 2.76Å; D268-E270 VanDerWaalsContact C-N 3.34Å; D268-E270 PolarHBondContact O-N 3.1Å; D268-N271 PolarHBondContact O-N 3.5Å; D268-E272 PolarHBondContact O-N 2.86Å
269	L	69.6	Low	68.8	Low	36 Å²	36	71.5 Å²	71.5	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-29.1	176.8	-79.1	170.3	0	0	0	114	I234 L239 C265 I266 L296 L299	I234-L269 HydrophobicContact CD1-CD2 4.48Å; I234-L269 HydrophobicContact CD1-CG 3.94Å; L239-L269 HydrophobicContact CD2-CD1 4.34Å; L239-L269 HydrophobicContact CD2-CD2 3.99Å; L239-L269 HydrophobicContact CD2-CG 4.45Å; C265-L269 WeakPolarHBondContact O-CB 3.32Å; C265-L269 WeakPolarHBondContact O-CG 3.33Å; C265-L269 PolarHBondContact O-N 3.45Å; I266-L269 PolarHBondContact O-N 3.27Å; L269-L296 HydrophobicContact CB-CD1 4.28Å; L269-L299 HydrophobicContact CD1-CD1 3.36Å
270	E	71.5	Confident	68.3	Low	75 Å²	75	70.8 Å²	70.8	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-73.8	-28.8	176.4	-76.5	179.7	-160.3	0	0	112.8	I266 D268 L296 K324	I266-E270 HydrophobicContact CG2-CG 4.38Å; I266-E270 WeakPolarHBondContact CG2-OE1 3.21Å; I266-E270 WeakPolarHBondContact O-CG 3.46Å; I266-E270 PolarHBondContact O-N 3.02Å; D268-E270 VanDerWaalsContact C-N 3.34Å; D268-E270 PolarHBondContact O-N 3.1Å; E270-L296 HydrophobicContact CG-CD2 4.34Å; E270-K324 VanDerWaalsContact OE1-CE 3.32Å; E270-K324 WeakPolarHBondContact OE1-CE 3.44Å; E270-K324 IonicContact OE1-NZ 2.68Å; E270-K324 PolarHBondContact OE1-NZ 3.14Å; E270-K324 IonicContact OE2-NZ 2.68Å; E270-K324 PolarHBondContact OE2-NZ 3.38Å
271	N	67	Low	67.7	Low	133 Å²	133	69 Å²	69	71%	0.711	35%	0.346	S	S	*	.	H	α-helix	trans	-85.2	-18.8	-177	-70.6	-32.2	0	0	0	113	N267 D268	N267-N271 VanDerWaalsContact O-CG 3.26Å; N267-N271 PolarHBondContact O-N 2.76Å; N267-N271 PolarHBondContact O-ND2 2.88Å; D268-N271 PolarHBondContact O-N 3.5Å
272	E	59.8	Low	66.9	Low	70 Å²	70	73.6 Å²	73.6	33%	0.327	37%	0.368	S	S	.	.			trans	-137	131.6	-168.8	-61.8	-177.1	160.3	0	0	112.2	S232 D268 L274	S232-E272 WeakPolarHBondContact CB-OE2 3.49Å; D268-E272 PolarHBondContact O-N 2.86Å; E272-L274 HydrophobicContact CB-CD1 3.66Å; E272-L274 PolarHBondContact O-N 3.13Å; E272-L274 VanDerWaalsContact OE2-CD1 3.23Å; E272-L274 WeakPolarHBondContact OE2-CD1 3.13Å
273	N	54.8	Low	66.1	Low	177 Å²	177	74.3 Å²	74.3	95%	0.947	38%	0.375	S	S	*	.			trans	-72.1	79.8	165.1	-81.4	-10.8	0	0	0	108.7	E275	N273-E275 PolarHBondContact O-N 2.96Å
274	L	54.4	Low	65.1	Low	40 Å²	40	73.9 Å²	73.9	21%	0.209	37%	0.371	C	S	.	.			trans	-77.1	104	171.4	-107.2	90.6	0	0	0	109.6	I234 L239 E272	I234-L274 HydrophobicContact CB-CD2 4.26Å; I234-L274 HydrophobicContact CG2-CD2 3.96Å; L239-L274 HydrophobicContact CD1-CB 4.47Å; L239-L274 HydrophobicContact CD1-CD2 3.57Å; L239-L274 HydrophobicContact CG-CD2 4.5Å; E272-L274 HydrophobicContact CB-CD1 3.66Å; E272-L274 PolarHBondContact O-N 3.13Å; E272-L274 VanDerWaalsContact OE2-CD1 3.23Å; E272-L274 WeakPolarHBondContact OE2-CD1 3.13Å
275	E	55.6	Low	64.2	Low	182 Å²	182	72.2 Å²	72.2	85%	0.85	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-87	124.1	160.7	-72.4	-176.4	173.3	0	0	108.7	N273 P277	N273-E275 PolarHBondContact O-N 2.96Å; E275-P277 WeakPolarHBondContact O-CD 3.35Å
276	I	55.4	Low	63.5	Low	32 Å²	32	75.1 Å²	75.1	16%	0.164	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-77.7	121.8	170.9	-56.2	177.2	0	0	0	107	L239 E278 I280 L281 V293	L239-I276 HydrophobicContact CB-CD1 4.01Å; L239-I276 HydrophobicContact CD1-CD1 3.83Å; L239-I276 HydrophobicContact CD1-CG1 3.76Å; I276-E278 PolarHBondContact O-N 3.15Å; I276-I280 HydrophobicContact CG2-CB 4.13Å; I276-I280 HydrophobicContact CG2-CD1 4.42Å; I276-I280 HydrophobicContact CG2-CG2 4.39Å; I276-L281 HydrophobicContact CG2-CG 4.31Å; I276-V293 HydrophobicContact CD1-CB 4.47Å; I276-V293 HydrophobicContact CD1-CG1 3.52Å; I276-V293 HydrophobicContact CD1-CG2 4.03Å
277	P	60.4	Low	62.7	Low	34 Å²	34	75.1 Å²	75.1	22%	0.221	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-54.7	129.6	176.5	-26.1	35.2	0	0	0	111	L228 E275 E279 I280	L228-P277 HydrophobicContact CB-CG 4.17Å; L228-P277 HydrophobicContact CD1-CB 3.93Å; L228-P277 HydrophobicContact CD1-CG 3.87Å; L228-P277 HydrophobicContact CD2-CB 4.06Å; L228-P277 HydrophobicContact CD2-CG 3.68Å; L228-P277 HydrophobicContact CG-CG 4.09Å; E275-P277 WeakPolarHBondContact O-CD 3.35Å; P277-E279 PolarHBondContact O-N 2.89Å; P277-I280 HydrophobicContact CB-CG1 4.48Å; P277-I280 HydrophobicContact CG-CD1 4.33Å; P277-I280 PolarHBondContact O-N 3.06Å
278	E	64.2	Low	61.9	Low	158 Å²	158	73.2 Å²	73.2	74%	0.738	38%	0.38	S	S	*	.	H	α-helix	trans	-52.4	-29.2	-179.6	-73.1	-174.2	167.9	0	0	112.3	I276 I280 L281 M282	I276-E278 PolarHBondContact O-N 3.15Å; E278-I280 VanDerWaalsContact C-N 3.29Å; E278-I280 PolarHBondContact O-N 3.13Å; E278-L281 CarbonylContact O-C 3.55Å; E278-L281 WeakPolarHBondContact O-CA 3.35Å; E278-L281 WeakPolarHBondContact O-CB 3.46Å; E278-L281 PolarHBondContact O-N 3.34Å; E278-M282 WeakPolarHBondContact O-CB 3.36Å; E278-M282 WeakPolarHBondContact O-CG 3.49Å; E278-M282 PolarHBondContact O-N 2.82Å
279	E	68.1	Low	61.3	Low	102 Å²	102	76.8 Å²	76.8	48%	0.477	41%	0.406	S	S	.	.	H	α-helix	trans	-57.3	-36.9	176	-62.2	-171.8	178.5	0	0	113.6	P277 L281 M282	P277-E279 PolarHBondContact O-N 2.89Å; E279-L281 VanDerWaalsContact C-N 3.27Å; E279-L281 PolarHBondContact O-N 2.78Å; E279-M282 PolarHBondContact O-N 3.28Å
280	I	67.5	Low	60.8	Low	1 Å²	1	79.9 Å²	79.9	1%	0.005	42%	0.416	C	S	.	.	H	α-helix	trans	-71.3	-28.5	177.8	-57.7	179.8	0	0	0	110.2	H190 I219 Y222 A223 L228 P236 V240 I276 P277 E278	H190-I280 PolarHBondContact CE1-O 3.03Å; H190-I280 PolarHBondContact NE2-O 3.1Å; I219-I280 HydrophobicContact CG2-CG2 4Å; Y222-I280 HydrophobicContact CD1-CG1 4.34Å; Y222-I280 HydrophobicContact CE1-CG1 4.16Å; A223-I280 HydrophobicContact CB-CD1 4.44Å; L228-I280 HydrophobicContact CD1-CD1 4.41Å; L228-I280 HydrophobicContact CD1-CG1 4.47Å; P236-I280 HydrophobicContact CB-CD1 3.49Å; P236-I280 VanDerWaalsContact CB-CD1 3.49Å; P236-I280 HydrophobicContact CG-CD1 4Å; V240-I280 HydrophobicContact CG2-CG2 4.32Å; I276-I280 HydrophobicContact CG2-CB 4.13Å; I276-I280 HydrophobicContact CG2-CD1 4.42Å; I276-I280 HydrophobicContact CG2-CG2 4.39Å; P277-I280 HydrophobicContact CB-CG1 4.48Å; P277-I280 HydrophobicContact CG-CD1 4.33Å; P277-I280 PolarHBondContact O-N 3.06Å; E278-I280 VanDerWaalsContact C-N 3.29Å; E278-I280 PolarHBondContact O-N 3.13Å
281	L	65.9	Low	59.9	Low	69 Å²	69	77.5 Å²	77.5	36%	0.361	41%	0.405	S	S	.	.	H	α-helix	trans	-85.4	-18.9	176.9	-61.4	174.8	0	0	0	113	I276 E278 E279 G283 T288 V293	I276-L281 HydrophobicContact CG2-CG 4.31Å; E278-L281 CarbonylContact O-C 3.55Å; E278-L281 WeakPolarHBondContact O-CA 3.35Å; E278-L281 WeakPolarHBondContact O-CB 3.46Å; E278-L281 PolarHBondContact O-N 3.34Å; E279-L281 VanDerWaalsContact C-N 3.27Å; E279-L281 PolarHBondContact O-N 2.78Å; L281-G283 VanDerWaalsContact C-N 3.33Å; L281-G283 PolarHBondContact O-N 3.49Å; L281-T288 WeakPolarHBondContact O-CB 3.43Å; L281-T288 WeakPolarHBondContact O-CG2 3.3Å; L281-V293 HydrophobicContact CD2-CG2 3.67Å
282	M	54.9	Low	59.5	Low	152 Å²	152	76.8 Å²	76.8	75%	0.749	39%	0.394	S	S	*	.			trans	-92.1	23.5	-174.6	-75.8	-69.9	-69.7	0	0	114.1	E278 E279	E278-M282 WeakPolarHBondContact O-CB 3.36Å; E278-M282 WeakPolarHBondContact O-CG 3.49Å; E278-M282 PolarHBondContact O-N 2.82Å; E279-M282 PolarHBondContact O-N 3.28Å
283	G	61.8	Low	59.4	Low	14 Å²	14	75.7 Å²	75.7	14%	0.144	39%	0.392	C	S	.	.	S	Bend	trans	-55.9	-176.2	168.3	0	0	0	0	0	113.3	L281 P285 T288	L281-G283 VanDerWaalsContact C-N 3.33Å; L281-G283 PolarHBondContact O-N 3.49Å; G283-P285 VanDerWaalsContact O-N 3.11Å; G283-T288 VanDerWaalsContact C-CG2 3.46Å; G283-T288 WeakPolarHBondContact O-CG2 3.47Å
284	N	59.7	Low	59.8	Low	32 Å²	32	67.7 Å²	67.7	17%	0.171	35%	0.349	C	S	.	.			trans	-47.1	123.8	178.7	-176	-27.9	0	0	0	110.7	M187 I286 L287 T288	M187-N284 HydrophobicContact SD-CB 3.76Å; N284-I286 PolarHBondContact O-N 3.08Å; N284-I286 PolarHBondContact OD1-N 3.08Å; N284-L287 HydrophobicContact CB-CD1 4Å; N284-L287 HydrophobicContact CB-CG 4.1Å; N284-L287 WeakPolarHBondContact O-CA 3.39Å; N284-L287 WeakPolarHBondContact O-CB 3.45Å; N284-L287 PolarHBondContact O-N 3.46Å; N284-T288 PolarHBondContact O-N 3.27Å; N284-T288 VanDerWaalsContact O-N 3.08Å
285	P	59	Low	60.6	Low	97 Å²	97	71.1 Å²	71.1	63%	0.63	36%	0.364	S	S	*	.	H	α-helix	trans	-53.4	-29.9	-170.9	-28.2	32.7	0	0	0	114.4	G283 L287 T288 S289	G283-P285 VanDerWaalsContact O-N 3.11Å; P285-L287 VanDerWaalsContact C-N 3.31Å; P285-T288 WeakPolarHBondContact CA-OG1 3.48Å; P285-T288 PolarHBondContact O-OG1 3.08Å; P285-S289 PolarHBondContact O-N 3.05Å; P285-S289 PolarHBondContact O-OG 3.4Å
286	I	59.4	Low	61.6	Low	68 Å²	68	64 Å²	64	35%	0.349	33%	0.332	S	S	.	.	H	α-helix	trans	-64.8	-38	176.9	-60.2	172.5	0	0	0	110.9	K130 N284 S289	K130-I286 HydrophobicContact CG-CD1 4.19Å; N284-I286 PolarHBondContact O-N 3.08Å; N284-I286 PolarHBondContact OD1-N 3.08Å; I286-S289 PolarHBondContact O-OG 2.85Å
287	L	60.6	Low	62.7	Low	1 Å²	1	62.7 Å²	62.7	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-80.1	-40.4	179.1	-55.8	177.9	0	0	0	111.2	I129 M187 H190 L191 V194 N284 P285 S289 R290 L291	I129-L287 HydrophobicContact CD1-CD1 4.46Å; I129-L287 HydrophobicContact CG2-CD2 4.07Å; M187-L287 HydrophobicContact SD-CD1 4.11Å; H190-L287 HydrophobicContact CB-CB 4.42Å; H190-L287 HydrophobicContact CB-CD1 3.95Å; L191-L287 HydrophobicContact CD2-CD2 4.08Å; L191-L287 HydrophobicContact CG-CD1 4.25Å; V194-L287 HydrophobicContact CG2-CD2 4.03Å; N284-L287 HydrophobicContact CB-CD1 4Å; N284-L287 HydrophobicContact CB-CG 4.1Å; N284-L287 WeakPolarHBondContact O-CA 3.39Å; N284-L287 WeakPolarHBondContact O-CB 3.45Å; N284-L287 PolarHBondContact O-N 3.46Å; P285-L287 VanDerWaalsContact C-N 3.31Å; L287-S289 PolarHBondContact O-N 3.43Å; L287-R290 WeakPolarHBondContact O-CB 3.49Å; L287-R290 PolarHBondContact O-N 3.44Å; L287-R290 VanDerWaalsContact O-N 3.08Å; L287-L291 HydrophobicContact CB-CD1 4.43Å; L287-L291 WeakPolarHBondContact O-CD1 3.38Å; L287-L291 WeakPolarHBondContact O-CG 3.44Å; L287-L291 PolarHBondContact O-N 3.41Å
288	T	59.4	Low	63.6	Low	40 Å²	40	62.1 Å²	62.1	25%	0.245	32%	0.32	C	S	.	.	H	α-helix	trans	-66.1	-38	-177.6	62.2	0	0	0	0	112.4	L281 G283 N284 P285 R290 L291	L281-T288 WeakPolarHBondContact O-CB 3.43Å; L281-T288 WeakPolarHBondContact O-CG2 3.3Å; G283-T288 VanDerWaalsContact C-CG2 3.46Å; G283-T288 WeakPolarHBondContact O-CG2 3.47Å; N284-T288 PolarHBondContact O-N 3.27Å; N284-T288 VanDerWaalsContact O-N 3.08Å; P285-T288 WeakPolarHBondContact CA-OG1 3.48Å; P285-T288 PolarHBondContact O-OG1 3.08Å; T288-R290 PolarHBondContact O-N 3.31Å; T288-L291 PolarHBondContact O-N 2.91Å
289	S	57.6	Low	64.4	Low	99 Å²	99	54.6 Å²	54.6	69%	0.692	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.3	173.2	66.9	0	0	0	0	114.5	P285 I286 L287	P285-S289 PolarHBondContact O-N 3.05Å; P285-S289 PolarHBondContact O-OG 3.4Å; I286-S289 PolarHBondContact O-OG 2.85Å; L287-S289 PolarHBondContact O-N 3.43Å
290	R	59.4	Low	65.2	Low	101 Å²	101	49.8 Å²	49.8	38%	0.381	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-14.8	177.3	-61.8	-174.5	179.4	-179.8	1.5	113.6	Y134 L287 T288 Y292	Y134-R290 PolarHBondContact OH-NH1 3.08Å; L287-R290 WeakPolarHBondContact O-CB 3.49Å; L287-R290 PolarHBondContact O-N 3.44Å; L287-R290 VanDerWaalsContact O-N 3.08Å; T288-R290 PolarHBondContact O-N 3.31Å; R290-Y292 PolarHBondContact O-N 3.43Å
291	L	52.4	Low	66.1	Low	26 Å²	26	52.4 Å²	52.4	14%	0.136	27%	0.273	C	S	.	.			trans	-90.9	105.9	-174.4	-72.6	156.2	0	0	0	109.6	H190 I193 V240 L287 T288	H190-L291 HydrophobicContact CB-CD1 4.18Å; H190-L291 WeakPolarHBondContact ND1-CD1 3.36Å; I193-L291 HydrophobicContact CB-CD2 4.1Å; I193-L291 HydrophobicContact CD1-CD2 3.92Å; I193-L291 HydrophobicContact CG2-CD2 3.49Å; I193-L291 VanDerWaalsContact CG2-CD2 3.49Å; V240-L291 HydrophobicContact CG1-CD2 3.69Å; L287-L291 HydrophobicContact CB-CD1 4.43Å; L287-L291 WeakPolarHBondContact O-CD1 3.38Å; L287-L291 WeakPolarHBondContact O-CG 3.44Å; L287-L291 PolarHBondContact O-N 3.41Å; T288-L291 PolarHBondContact O-N 2.91Å
292	Y	59.3	Low	66.9	Low	118 Å²	118	49.9 Å²	49.9	46%	0.463	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-93.4	132.3	176.7	-174.3	-85.7	0	0	0	110.6	M243 R290 D298	M243-Y292 HydrophobicContact CE-CD1 3.46Å; M243-Y292 VanDerWaalsContact CE-CD1 3.46Å; M243-Y292 HydrophobicContact CE-CE1 3.58Å; M243-Y292 HydrophobicContact CE-CG 4.33Å; M243-Y292 HydrophobicContact SD-CD1 3.18Å; M243-Y292 WeakPolarHBondContact SD-CD1 3.34Å; M243-Y292 HydrophobicContact SD-CE1 3.25Å; M243-Y292 WeakPolarHBondContact SD-CE1 3.23Å; M243-Y292 HydrophobicContact SD-CG 4.42Å; R290-Y292 PolarHBondContact O-N 3.43Å; Y292-D298 WeakPolarHBondContact CE1-OD2 3.26Å; Y292-D298 PolarHBondContact OH-OD2 3.44Å
293	V	58.6	Low	68.3	Low	47 Å²	47	44 Å²	44	29%	0.285	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-93.8	120.5	173.9	179.8	0	0	0	0	109	I276 L281 Q295	I276-V293 HydrophobicContact CD1-CB 4.47Å; I276-V293 HydrophobicContact CD1-CG1 3.52Å; I276-V293 HydrophobicContact CD1-CG2 4.03Å; L281-V293 HydrophobicContact CD2-CG2 3.67Å; V293-Q295 PolarHBondContact O-N 3.15Å
294	P	62.5	Low	69.5	Low	9 Å²	9	43.3 Å²	43.3	6%	0.058	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-58.9	124.6	176.4	1.2	-2.2	0	0	0	111.5	L239 L242 M243 L299	L239-P294 WeakPolarHBondContact O-CD 3.47Å; L242-P294 HydrophobicContact CB-CG 3.93Å; L242-P294 HydrophobicContact CD2-CG 4.12Å; L242-P294 HydrophobicContact CG-CG 4.35Å; M243-P294 HydrophobicContact CB-CG 4.33Å; M243-P294 HydrophobicContact CG-CB 3.74Å; M243-P294 HydrophobicContact CG-CG 3.78Å; M243-P294 HydrophobicContact SD-CB 3.63Å; M243-P294 HydrophobicContact SD-CG 4.07Å; P294-L299 HydrophobicContact CB-CD1 4.42Å; P294-L299 HydrophobicContact CB-CD2 3.92Å; P294-L299 HydrophobicContact CB-CG 4.03Å
295	Q	71	Confident	70.8	Confident	111 Å²	111	43 Å²	43	52%	0.519	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-79.2	152	164.7	-63.5	-176.6	0.5	0	0	109.2	V293 S297 D298 L299	V293-Q295 PolarHBondContact O-N 3.15Å; Q295-S297 PolarHBondContact O-N 3.14Å; Q295-S297 VanDerWaalsContact O-N 3.12Å; Q295-D298 PolarHBondContact N-OD2 3.45Å; Q295-D298 WeakPolarHBondContact O-CB 3.45Å; Q295-D298 PolarHBondContact O-N 3.26Å; Q295-L299 PolarHBondContact O-N 3.33Å
296	L	77.1	Confident	71.9	Confident	33 Å²	33	38.5 Å²	38.5	17%	0.173	19%	0.193	C	C	.	.	H	α-helix	trans	-53.7	-35.1	178	-179.6	61.3	0	0	0	112.2	I266 L269 E270 D298 L299 L300 Y328	I266-L296 HydrophobicContact CG2-CD1 4.39Å; L269-L296 HydrophobicContact CB-CD1 4.28Å; E270-L296 HydrophobicContact CG-CD2 4.34Å; L296-D298 VanDerWaalsContact C-N 3.29Å; L296-D298 PolarHBondContact O-N 3Å; L296-L299 PolarHBondContact O-N 3.1Å; L296-L300 HydrophobicContact CD1-CD1 4.45Å; L296-L300 HydrophobicContact CD1-CG 4.49Å; L296-L300 HydrophobicContact CG-CD1 4.05Å; L296-L300 WeakPolarHBondContact O-CG 3.38Å; L296-L300 PolarHBondContact O-N 3.21Å; L296-Y328 HydrophobicContact CD2-CD2 4.13Å; L296-Y328 HydrophobicContact CD2-CE1 4.14Å; L296-Y328 HydrophobicContact CD2-CE2 3.6Å; L296-Y328 HydrophobicContact CG-CD2 4.49Å; L296-Y328 HydrophobicContact CG-CE2 4.31Å
297	S	77.6	Confident	73.1	Confident	4 Å²	4	35.4 Å²	35.4	3%	0.028	18%	0.177	C	C	.	.	H	α-helix	trans	-58.3	-38.4	173.9	52.2	0	0	0	0	113.2	Q295 Y301	Q295-S297 PolarHBondContact O-N 3.14Å; Q295-S297 VanDerWaalsContact O-N 3.12Å; S297-Y301 WeakPolarHBondContact O-CB 3.35Å; S297-Y301 PolarHBondContact O-N 3.36Å
298	D	80.8	Confident	74.3	Confident	22 Å²	22	36.7 Å²	36.7	12%	0.118	19%	0.187	C	C	.	.	H	α-helix	trans	-74.9	-36.2	-176.3	-56.7	-21.5	0	0	0	111	Y292 Q295 L296 Y301 A302 H332	Y292-D298 WeakPolarHBondContact CE1-OD2 3.26Å; Y292-D298 PolarHBondContact OH-OD2 3.44Å; Q295-D298 PolarHBondContact N-OD2 3.45Å; Q295-D298 WeakPolarHBondContact O-CB 3.45Å; Q295-D298 PolarHBondContact O-N 3.26Å; L296-D298 VanDerWaalsContact C-N 3.29Å; L296-D298 PolarHBondContact O-N 3Å; D298-Y301 PolarHBondContact O-N 2.64Å; D298-A302 WeakPolarHBondContact O-CB 3.28Å; D298-A302 PolarHBondContact O-N 2.75Å; D298-H332 IonicContact OD1-CE1 3.94Å; D298-H332 PolarHBondContact OD1-CE1 3.42Å; D298-H332 VanDerWaalsContact OD1-CE1 3.25Å; D298-H332 IonicContact OD1-ND1 3.13Å; D298-H332 PolarHBondContact OD1-ND1 3.04Å
299	L	80.2	Confident	75.3	Confident	1 Å²	1	40 Å²	40	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-67.8	-42.8	174.7	-63.6	178	0	0	0	111.7	L242 L246 I262 I266 L269 P294 Q295 L296 Y301 A302 R303	L242-L299 HydrophobicContact CD2-CD1 3.71Å; L242-L299 HydrophobicContact CD2-CD2 3.51Å; L242-L299 HydrophobicContact CD2-CG 4.26Å; L242-L299 HydrophobicContact CG-CD2 3.98Å; L246-L299 HydrophobicContact CD1-CD2 3.52Å; I262-L299 HydrophobicContact CG2-CB 4.45Å; I266-L299 HydrophobicContact CD1-CB 4.44Å; I266-L299 HydrophobicContact CG1-CB 4.04Å; L269-L299 HydrophobicContact CD1-CD1 3.36Å; P294-L299 HydrophobicContact CB-CD1 4.42Å; P294-L299 HydrophobicContact CB-CD2 3.92Å; P294-L299 HydrophobicContact CB-CG 4.03Å; Q295-L299 PolarHBondContact O-N 3.33Å; L296-L299 PolarHBondContact O-N 3.1Å; L299-Y301 VanDerWaalsContact C-N 3.33Å; L299-A302 PolarHBondContact O-N 2.93Å; L299-R303 PolarHBondContact O-N 3.21Å
300	L	85.1	Confident	76.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.7	-44.1	173.8	-73.5	166.1	0	0	0	110.9	I266 L296 R303 A304 D321 K324 A325 Y328	I266-L300 HydrophobicContact CD1-CD2 3.96Å; I266-L300 HydrophobicContact CD1-CG 4.4Å; I266-L300 HydrophobicContact CG2-CD2 4.24Å; L296-L300 HydrophobicContact CD1-CD1 4.45Å; L296-L300 HydrophobicContact CD1-CG 4.49Å; L296-L300 HydrophobicContact CG-CD1 4.05Å; L296-L300 WeakPolarHBondContact O-CG 3.38Å; L296-L300 PolarHBondContact O-N 3.21Å; L300-R303 PolarHBondContact O-N 3Å; L300-A304 WeakPolarHBondContact O-CB 3.15Å; L300-A304 PolarHBondContact O-N 2.74Å; L300-D321 HydrophobicContact CD2-CB 4.24Å; L300-K324 HydrophobicContact CD1-CB 4.05Å; L300-K324 HydrophobicContact CD1-CD 4.07Å; L300-K324 HydrophobicContact CD1-CG 3.78Å; L300-K324 HydrophobicContact CD2-CD 4.14Å; L300-A325 HydrophobicContact CB-CB 3.9Å; L300-A325 HydrophobicContact CD1-CB 4.42Å; L300-Y328 HydrophobicContact CD1-CD2 4.09Å; L300-Y328 HydrophobicContact CD1-CE2 4.18Å
301	Y	86.3	Confident	76.7	Confident	57 Å²	57	41.2 Å²	41.2	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-59.9	-47.8	173.6	171.8	-105.4	0	0	0	112.4	S297 D298 L299 R303 A304 N305 L322 H332 E334 S335 L338	S297-Y301 WeakPolarHBondContact O-CB 3.35Å; S297-Y301 PolarHBondContact O-N 3.36Å; D298-Y301 PolarHBondContact O-N 2.64Å; L299-Y301 VanDerWaalsContact C-N 3.33Å; Y301-R303 VanDerWaalsContact C-N 3.32Å; Y301-R303 PolarHBondContact O-N 3.41Å; Y301-A304 PolarHBondContact O-N 3.32Å; Y301-N305 WeakPolarHBondContact O-CB 3.13Å; Y301-N305 PolarHBondContact O-N 3.44Å; Y301-L322 HydrophobicContact CD2-CD2 4.07Å; Y301-H332 AromaticContact CD2-NE2 3.93Å; Y301-H332 AromaticContact CG-NE2 3.62Å; Y301-E334 HydrophobicContact CD2-CB 4.27Å; Y301-E334 HydrophobicContact CE1-CB 4.08Å; Y301-E334 HydrophobicContact CE2-CB 3.72Å; Y301-S335 WeakPolarHBondContact CB-OG 3.32Å; Y301-S335 WeakPolarHBondContact CD2-OG 3.49Å; Y301-L338 HydrophobicContact CE2-CB 4.29Å; Y301-L338 HydrophobicContact CE2-CD2 4Å
302	A	82	Confident	78	Confident	15 Å²	15	41.4 Å²	41.4	12%	0.124	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-44.3	179.9	0	0	0	0	0	111.4	L246 I262 D298 L299 N305 L306	L246-A302 HydrophobicContact CD1-CB 4.18Å; I262-A302 HydrophobicContact CD1-CB 4.18Å; D298-A302 WeakPolarHBondContact O-CB 3.28Å; D298-A302 PolarHBondContact O-N 2.75Å; L299-A302 PolarHBondContact O-N 2.93Å; A302-N305 PolarHBondContact O-N 3.21Å; A302-L306 WeakPolarHBondContact O-CG 3.43Å; A302-L306 PolarHBondContact O-N 3.34Å
303	R	85.2	Confident	79.1	Confident	28 Å²	28	42.2 Å²	42.2	11%	0.106	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-46.5	174.6	-166.4	169.1	68.8	-175.7	-2.8	111.3	I262 T263 I266 L299 L300 Y301 N305 L306 L307 D321	I262-R303 HydrophobicContact CD1-CB 4.48Å; I262-R303 HydrophobicContact CG2-CB 3.79Å; I262-R303 HydrophobicContact CG2-CG 4.38Å; T263-R303 WeakPolarHBondContact OG1-CD 3.28Å; T263-R303 PolarHBondContact OG1-NH1 2.68Å; I266-R303 HydrophobicContact CD1-CB 4.25Å; L299-R303 PolarHBondContact O-N 3.21Å; L300-R303 PolarHBondContact O-N 3Å; Y301-R303 VanDerWaalsContact C-N 3.32Å; Y301-R303 PolarHBondContact O-N 3.41Å; R303-N305 PolarHBondContact O-N 3.43Å; R303-L306 PolarHBondContact O-N 2.77Å; R303-L307 HydrophobicContact CG-CD1 3.75Å; R303-L307 HydrophobicContact CG-CG 4.18Å; R303-L307 WeakPolarHBondContact O-CB 3.46Å; R303-L307 VanDerWaalsContact O-CG 3.29Å; R303-L307 WeakPolarHBondContact O-CG 3.47Å; R303-L307 PolarHBondContact O-N 3.38Å; R303-D321 IonicContact CZ-OD1 2.67Å; R303-D321 IonicContact CZ-OD2 2.82Å; R303-D321 VanDerWaalsContact CZ-OD2 3.31Å; R303-D321 IonicContact NE-OD1 3.66Å; R303-D321 IonicContact NE-OD2 3.74Å; R303-D321 PolarHBondContact NE-OD2 2.83Å; R303-D321 VanDerWaalsContact NH2-CG 3.26Å; R303-D321 IonicContact NH2-OD1 3.56Å; R303-D321 PolarHBondContact NH2-OD1 3.49Å; R303-D321 IonicContact NH2-OD2 3.71Å; R303-D321 PolarHBondContact NH2-OD2 3.34Å; R303-D321 VanDerWaalsContact NH2-OD2 3.15Å
304	A	87	Confident	80.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-43.2	179.1	0	0	0	0	0	112.9	L300 Y301 L306 L307 S308 A318 D321 L322	L300-A304 WeakPolarHBondContact O-CB 3.15Å; L300-A304 PolarHBondContact O-N 2.74Å; Y301-A304 PolarHBondContact O-N 3.32Å; A304-L306 VanDerWaalsContact C-N 3.32Å; A304-L306 PolarHBondContact O-N 2.92Å; A304-L307 PolarHBondContact O-N 2.78Å; A304-S308 VanDerWaalsContact O-CB 3.23Å; A304-S308 WeakPolarHBondContact O-CB 3.46Å; A304-S308 PolarHBondContact O-N 2.69Å; A304-S308 PolarHBondContact O-OG 2.9Å; A304-A318 HydrophobicContact CB-CB 4.14Å; A304-A318 WeakPolarHBondContact CB-O 3.19Å; A304-A318 WeakPolarHBondContact O-CB 3.44Å; A304-D321 HydrophobicContact CB-CB 3.95Å; A304-L322 HydrophobicContact CB-CD1 4.24Å; A304-L322 HydrophobicContact CB-CD2 3.85Å; A304-L322 HydrophobicContact CB-CG 3.61Å
305	N	85.6	Confident	81.6	Confident	26 Å²	26	42.1 Å²	42.1	14%	0.139	21%	0.212	C	C	.	.	H	α-helix	trans	-60	-42.3	178.1	-173.3	22.2	0	0	0	111.2	Y301 A302 R303 S308 K309 L338	Y301-N305 WeakPolarHBondContact O-CB 3.13Å; Y301-N305 PolarHBondContact O-N 3.44Å; A302-N305 PolarHBondContact O-N 3.21Å; R303-N305 PolarHBondContact O-N 3.43Å; N305-S308 PolarHBondContact O-OG 3.26Å; N305-K309 WeakPolarHBondContact O-CG 3.41Å; N305-K309 PolarHBondContact O-N 3.37Å; N305-L338 HydrophobicContact CB-CD2 4.1Å
306	L	82.6	Confident	82.6	Confident	2 Å²	2	39 Å²	39	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-50.5	175.4	-67.4	164.6	0	0	0	113	Y258 V259 I262 A302 R303 A304 S308 K309 Q310	Y258-L306 HydrophobicContact CD1-CD1 3.1Å; Y258-L306 HydrophobicContact CD1-CD2 3.41Å; Y258-L306 VanDerWaalsContact CD1-CD2 3.41Å; Y258-L306 HydrophobicContact CD1-CG 3.77Å; Y258-L306 HydrophobicContact CD2-CD1 4.19Å; Y258-L306 HydrophobicContact CE1-CD1 3.18Å; Y258-L306 HydrophobicContact CE1-CD2 3.45Å; Y258-L306 VanDerWaalsContact CE1-CD2 3.45Å; Y258-L306 HydrophobicContact CE1-CG 3.64Å; Y258-L306 HydrophobicContact CE2-CD1 4.18Å; Y258-L306 HydrophobicContact CG-CD1 3.62Å; V259-L306 HydrophobicContact CG2-CB 3.99Å; V259-L306 HydrophobicContact CG2-CD1 3.89Å; I262-L306 HydrophobicContact CD1-CD1 3.57Å; A302-L306 WeakPolarHBondContact O-CG 3.43Å; A302-L306 PolarHBondContact O-N 3.34Å; R303-L306 PolarHBondContact O-N 2.77Å; A304-L306 VanDerWaalsContact C-N 3.32Å; A304-L306 PolarHBondContact O-N 2.92Å; L306-S308 PolarHBondContact O-N 2.88Å; L306-K309 WeakPolarHBondContact O-CB 3.5Å; L306-K309 PolarHBondContact O-N 2.91Å; L306-Q310 PolarHBondContact O-N 3.31Å
307	L	85.1	Confident	83.1	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-29.9	-178.5	-68.4	178.3	0	0	0	111.5	V259 R303 A304 K309 Q310 Q317 A318	V259-L307 HydrophobicContact CG1-CD2 4.01Å; V259-L307 HydrophobicContact CG2-CD2 4.11Å; R303-L307 HydrophobicContact CG-CD1 3.75Å; R303-L307 HydrophobicContact CG-CG 4.18Å; R303-L307 WeakPolarHBondContact O-CB 3.46Å; R303-L307 VanDerWaalsContact O-CG 3.29Å; R303-L307 WeakPolarHBondContact O-CG 3.47Å; R303-L307 PolarHBondContact O-N 3.38Å; A304-L307 PolarHBondContact O-N 2.78Å; L307-K309 VanDerWaalsContact C-N 3.3Å; L307-K309 PolarHBondContact O-N 2.88Å; L307-Q310 PolarHBondContact O-N 2.97Å; L307-Q317 HydrophobicContact CD1-CB 3.77Å; L307-A318 HydrophobicContact CB-CB 3.85Å
308	S	85	Confident	83.6	Confident	29 Å²	29	42.7 Å²	42.7	20%	0.203	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-28.6	174.6	78.4	0	0	0	0	113.4	A304 N305 L306 Q310	A304-S308 VanDerWaalsContact O-CB 3.23Å; A304-S308 WeakPolarHBondContact O-CB 3.46Å; A304-S308 PolarHBondContact O-N 2.69Å; A304-S308 PolarHBondContact O-OG 2.9Å; N305-S308 PolarHBondContact O-OG 3.26Å; L306-S308 PolarHBondContact O-N 2.88Å; S308-Q310 VanDerWaalsContact C-N 3.35Å
309	K	80.5	Confident	84.2	Confident	110 Å²	110	41.8 Å²	41.8	48%	0.478	21%	0.21	S	C	.	.	H	α-helix	trans	-79.4	-21.1	175.5	-66	170.7	-174.5	173.6	0	111.8	E250 N305 L306 L307	E250-K309 IonicContact OE1-NZ 2.64Å; E250-K309 PolarHBondContact OE1-NZ 3.34Å; N305-K309 WeakPolarHBondContact O-CG 3.41Å; N305-K309 PolarHBondContact O-N 3.37Å; L306-K309 WeakPolarHBondContact O-CB 3.5Å; L306-K309 PolarHBondContact O-N 2.91Å; L307-K309 VanDerWaalsContact C-N 3.3Å; L307-K309 PolarHBondContact O-N 2.88Å
310	Q	76.9	Confident	84.7	Confident	37 Å²	37	46.4 Å²	46.4	17%	0.173	23%	0.228	C	C	.	.	S	Bend	trans	-77.6	139.3	174.3	-64	-176.3	-12.2	0	0	110.6	D256 L306 L307 S308 S314 I315	D256-Q310 PolarHBondContact OD1-NE2 3.41Å; L306-Q310 PolarHBondContact O-N 3.31Å; L307-Q310 PolarHBondContact O-N 2.97Å; S308-Q310 VanDerWaalsContact C-N 3.35Å; Q310-S314 PolarHBondContact OE1-OG 3.44Å; Q310-I315 WeakPolarHBondContact O-CG1 3.45Å
311	H	70.4	Confident	84.9	Confident	188 Å²	188	46.9 Å²	46.9	87%	0.87	23%	0.23	S	C	*	.			trans	-82.3	134.8	176	-65.9	-50.4	0	0	0	111.4
312	G	80	Confident	85.1	Confident	29 Å²	29	44.1 Å²	44.1	30%	0.299	22%	0.219	S	C	.	.	S	Bend	trans	115.7	-142	168.8	0	0	0	0	0	114.4	S314 I315 Y374	G312-S314 VanDerWaalsContact C-N 3.27Å; G312-S314 PolarHBondContact O-N 3.07Å; G312-I315 WeakPolarHBondContact O-CG1 3.36Å; G312-I315 PolarHBondContact O-N 3.32Å; G312-Y374 WeakPolarHBondContact O-CD2 3.47Å
313	Q	82.7	Confident	85.5	Confident	136 Å²	136	46.3 Å²	46.3	64%	0.636	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-19.2	-173.3	-66.8	179.3	-1.4	0	0	113.5	I315 I316 Y374	Q313-I315 PolarHBondContact O-N 3.38Å; Q313-I315 VanDerWaalsContact O-N 3.16Å; Q313-I316 WeakPolarHBondContact O-CB 3.42Å; Q313-I316 PolarHBondContact O-N 2.99Å; Q313-I316 VanDerWaalsContact O-N 3.08Å; Q313-Y374 HydrophobicContact CG-CE1 4.19Å; Q313-Y374 HydrophobicContact CG-CE2 4.3Å
314	S	84.5	Confident	85.5	Confident	34 Å²	34	47.9 Å²	47.9	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-55.1	-30.1	175.2	-59.1	0	0	0	0	113.2	Q310 G312 I316 Q317 A318	Q310-S314 PolarHBondContact OE1-OG 3.44Å; G312-S314 VanDerWaalsContact C-N 3.27Å; G312-S314 PolarHBondContact O-N 3.07Å; S314-I316 PolarHBondContact O-N 3.46Å; S314-Q317 WeakPolarHBondContact O-CB 3.48Å; S314-Q317 PolarHBondContact O-N 3.26Å; S314-Q317 VanDerWaalsContact O-N 3.13Å; S314-A318 PolarHBondContact O-N 3.32Å
315	I	88.5	Confident	85.4	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.097	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-30	-180	-55.6	172.2	0	0	0	111.5	Q310 G312 Q313 Q317 A318 Y319 L342 Y374 T375	Q310-I315 WeakPolarHBondContact O-CG1 3.45Å; G312-I315 WeakPolarHBondContact O-CG1 3.36Å; G312-I315 PolarHBondContact O-N 3.32Å; Q313-I315 PolarHBondContact O-N 3.38Å; Q313-I315 VanDerWaalsContact O-N 3.16Å; I315-Q317 VanDerWaalsContact C-N 3.32Å; I315-Q317 PolarHBondContact O-N 2.88Å; I315-A318 WeakPolarHBondContact O-CB 3.46Å; I315-A318 PolarHBondContact O-N 3.29Å; I315-Y319 PolarHBondContact O-N 3.42Å; I315-L342 HydrophobicContact CG2-CD2 4.34Å; I315-Y374 CarbonylContact C-O 3.57Å; I315-Y374 WeakPolarHBondContact CG2-O 3.28Å; I315-T375 HydrophobicContact CG2-CG2 4.05Å
316	I	90.6	Very high	85.4	Confident	47 Å²	47	48.1 Å²	48.1	24%	0.241	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-44.5	177	-61	171.6	0	0	0	110.1	Q313 S314 A318 Y319 Y320 Y374 P377	Q313-I316 WeakPolarHBondContact O-CB 3.42Å; Q313-I316 PolarHBondContact O-N 2.99Å; Q313-I316 VanDerWaalsContact O-N 3.08Å; S314-I316 PolarHBondContact O-N 3.46Å; I316-A318 VanDerWaalsContact C-N 3.34Å; I316-Y319 PolarHBondContact O-N 2.93Å; I316-Y320 HydrophobicContact CG2-CD2 3.91Å; I316-Y320 HydrophobicContact CG2-CE2 3.62Å; I316-Y320 WeakPolarHBondContact O-CD2 3.47Å; I316-Y320 PolarHBondContact O-N 3.4Å; I316-Y374 HydrophobicContact CD1-CD1 3.72Å; I316-Y374 HydrophobicContact CD1-CE1 4.1Å; I316-Y374 HydrophobicContact CG1-CD1 4Å; I316-Y374 HydrophobicContact CG1-CG 4.43Å; I316-P377 HydrophobicContact CG2-CB 4.35Å; I316-P377 HydrophobicContact CG2-CG 4.22Å
317	Q	88.2	Confident	85.3	Confident	114 Å²	114	57.6 Å²	57.6	53%	0.533	27%	0.27	S	S	.	.	H	α-helix	trans	-64.9	-40.7	177.2	-70.2	-179.8	-13.8	0	0	110.9	L307 S314 I315 Y319 Y320 D321	L307-Q317 HydrophobicContact CD1-CB 3.77Å; S314-Q317 WeakPolarHBondContact O-CB 3.48Å; S314-Q317 PolarHBondContact O-N 3.26Å; S314-Q317 VanDerWaalsContact O-N 3.13Å; I315-Q317 VanDerWaalsContact C-N 3.32Å; I315-Q317 PolarHBondContact O-N 2.88Å; Q317-Y319 VanDerWaalsContact C-N 3.31Å; Q317-Y319 PolarHBondContact O-N 3.14Å; Q317-Y320 PolarHBondContact O-N 3.2Å; Q317-D321 WeakPolarHBondContact O-CB 3.48Å; Q317-D321 VanDerWaalsContact O-CG 3.25Å; Q317-D321 PolarHBondContact O-N 2.97Å
318	A	89.1	Confident	85	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-56.2	-44.2	174.5	0	0	0	0	0	112.4	A304 L307 S314 I315 I316 D321 L322	A304-A318 HydrophobicContact CB-CB 4.14Å; A304-A318 WeakPolarHBondContact CB-O 3.19Å; A304-A318 WeakPolarHBondContact O-CB 3.44Å; L307-A318 HydrophobicContact CB-CB 3.85Å; S314-A318 PolarHBondContact O-N 3.32Å; I315-A318 WeakPolarHBondContact O-CB 3.46Å; I315-A318 PolarHBondContact O-N 3.29Å; I316-A318 VanDerWaalsContact C-N 3.34Å; A318-D321 PolarHBondContact O-N 3.23Å; A318-L322 VanDerWaalsContact O-CG 3.29Å; A318-L322 WeakPolarHBondContact O-CG 3.37Å; A318-L322 PolarHBondContact O-N 2.86Å
319	Y	92.6	Very high	84.7	Confident	3 Å²	3	64 Å²	64	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-47	177.7	175.6	-90.1	0	0	0	112.3	I315 I316 Q317 D321 L322 K323 L339 T375 Q376 P377 E378	I315-Y319 PolarHBondContact O-N 3.42Å; I316-Y319 PolarHBondContact O-N 2.93Å; Q317-Y319 VanDerWaalsContact C-N 3.31Å; Q317-Y319 PolarHBondContact O-N 3.14Å; Y319-D321 VanDerWaalsContact C-N 3.35Å; Y319-L322 PolarHBondContact O-N 3.36Å; Y319-K323 HydrophobicContact CE1-CD 3.84Å; Y319-K323 HydrophobicContact CE1-CG 4.26Å; Y319-K323 VanDerWaalsContact CZ-CE 3.44Å; Y319-K323 PolarHBondContact O-N 2.89Å; Y319-K323 WeakPolarHBondContact OH-CE 3.44Å; Y319-K323 PolarHBondContact OH-NZ 3.32Å; Y319-L339 HydrophobicContact CD2-CD1 3.69Å; Y319-L339 HydrophobicContact CE2-CD1 3.7Å; Y319-T375 VanDerWaalsContact CD2-O 3.31Å; Y319-T375 WeakPolarHBondContact CD2-O 3.42Å; Y319-Q376 HydrophobicContact CE2-CG 3.97Å; Y319-P377 HydrophobicContact CD1-CG 3.45Å; Y319-P377 VanDerWaalsContact CD1-CG 3.45Å; Y319-P377 HydrophobicContact CE1-CG 3.83Å; Y319-P377 HydrophobicContact CG-CG 3.98Å; Y319-E378 HydrophobicContact CE1-CB 4.38Å; Y319-E378 HydrophobicContact CE1-CG 3.96Å; Y319-E378 PolarHBondContact OH-OE2 2.84Å; Y319-E378 VanDerWaalsContact OH-OE2 3.14Å
320	Y	91.2	Very high	84.7	Confident	97 Å²	97	63.3 Å²	63.3	38%	0.38	30%	0.303	S	S	.	.	H	α-helix	trans	-67.8	-35.9	179.2	-74.1	-61.7	0	0	0	112.6	I316 Q317 K323 K324 P377 E378	I316-Y320 HydrophobicContact CG2-CD2 3.91Å; I316-Y320 HydrophobicContact CG2-CE2 3.62Å; I316-Y320 WeakPolarHBondContact O-CD2 3.47Å; I316-Y320 PolarHBondContact O-N 3.4Å; Q317-Y320 PolarHBondContact O-N 3.2Å; Y320-K323 PolarHBondContact O-N 3.17Å; Y320-K324 VanDerWaalsContact O-CB 3.3Å; Y320-K324 WeakPolarHBondContact O-CB 3.25Å; Y320-K324 PolarHBondContact O-N 3.39Å; Y320-P377 HydrophobicContact CE2-CB 4.44Å; Y320-P377 HydrophobicContact CE2-CG 3.9Å; Y320-E378 HydrophobicContact CE1-CG 4.27Å
321	D	88.1	Confident	84.9	Confident	10 Å²	10	68.8 Å²	68.8	5%	0.053	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-42.6	174.6	-74.5	-14.9	0	0	0	111.9	L300 R303 A304 Q317 A318 Y319 K324 A325	L300-D321 HydrophobicContact CD2-CB 4.24Å; R303-D321 IonicContact CZ-OD1 2.67Å; R303-D321 IonicContact CZ-OD2 2.82Å; R303-D321 VanDerWaalsContact CZ-OD2 3.31Å; R303-D321 IonicContact NE-OD1 3.66Å; R303-D321 IonicContact NE-OD2 3.74Å; R303-D321 PolarHBondContact NE-OD2 2.83Å; R303-D321 VanDerWaalsContact NH2-CG 3.26Å; R303-D321 IonicContact NH2-OD1 3.56Å; R303-D321 PolarHBondContact NH2-OD1 3.49Å; R303-D321 IonicContact NH2-OD2 3.71Å; R303-D321 PolarHBondContact NH2-OD2 3.34Å; R303-D321 VanDerWaalsContact NH2-OD2 3.15Å; A304-D321 HydrophobicContact CB-CB 3.95Å; Q317-D321 WeakPolarHBondContact O-CB 3.48Å; Q317-D321 VanDerWaalsContact O-CG 3.25Å; Q317-D321 PolarHBondContact O-N 2.97Å; A318-D321 PolarHBondContact O-N 3.23Å; Y319-D321 VanDerWaalsContact C-N 3.35Å; D321-K324 PolarHBondContact O-N 2.92Å; D321-A325 WeakPolarHBondContact O-CB 3.33Å; D321-A325 PolarHBondContact O-N 3.01Å
322	L	91.6	Very high	85.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-43.8	175.2	-70.6	165.8	0	0	0	111.7	Y301 A304 A318 Y319 K324 A325 L326 L338 L339 L342	Y301-L322 HydrophobicContact CD2-CD2 4.07Å; A304-L322 HydrophobicContact CB-CD1 4.24Å; A304-L322 HydrophobicContact CB-CD2 3.85Å; A304-L322 HydrophobicContact CB-CG 3.61Å; A318-L322 VanDerWaalsContact O-CG 3.29Å; A318-L322 WeakPolarHBondContact O-CG 3.37Å; A318-L322 PolarHBondContact O-N 2.86Å; Y319-L322 PolarHBondContact O-N 3.36Å; L322-K324 VanDerWaalsContact C-N 3.31Å; L322-K324 PolarHBondContact O-N 3.15Å; L322-A325 PolarHBondContact O-N 2.87Å; L322-L326 WeakPolarHBondContact O-CG 3.35Å; L322-L326 PolarHBondContact O-N 3.47Å; L322-L338 HydrophobicContact CD1-CB 4.31Å; L322-L338 HydrophobicContact CD1-CD2 4.1Å; L322-L338 HydrophobicContact CD1-CG 3.95Å; L322-L338 HydrophobicContact CD2-CB 4.25Å; L322-L338 HydrophobicContact CD2-CD2 4.1Å; L322-L338 HydrophobicContact CD2-CG 4.43Å; L322-L339 HydrophobicContact CB-CB 4.46Å; L322-L339 HydrophobicContact CB-CD1 4.44Å; L322-L339 HydrophobicContact CD1-CB 4.33Å; L322-L342 HydrophobicContact CD1-CD1 3.73Å
323	K	89.8	Confident	85.8	Confident	61 Å²	61	64.3 Å²	64.3	27%	0.265	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-40.8	174.5	-76.9	-151.7	164	-169.8	0	112.1	Y319 Y320 L326 R327 E378	Y319-K323 HydrophobicContact CE1-CD 3.84Å; Y319-K323 HydrophobicContact CE1-CG 4.26Å; Y319-K323 VanDerWaalsContact CZ-CE 3.44Å; Y319-K323 PolarHBondContact O-N 2.89Å; Y319-K323 WeakPolarHBondContact OH-CE 3.44Å; Y319-K323 PolarHBondContact OH-NZ 3.32Å; Y320-K323 PolarHBondContact O-N 3.17Å; K323-L326 PolarHBondContact O-N 3.21Å; K323-R327 WeakPolarHBondContact O-CG 3.25Å; K323-R327 PolarHBondContact O-N 3.1Å; K323-E378 WeakPolarHBondContact CE-OE2 3.21Å; K323-E378 IonicContact NZ-OE2 3.71Å; K323-E378 PolarHBondContact NZ-OE2 3.14Å
324	K	85.8	Confident	86	Confident	61 Å²	61	62.5 Å²	62.5	27%	0.265	30%	0.299	S	S	.	.	H	α-helix	trans	-65.7	-43.1	177.1	-168.3	174.3	-172.4	172.2	0	110.9	E270 L300 Y320 D321 L322 L326 R327 Y328	E270-K324 VanDerWaalsContact OE1-CE 3.32Å; E270-K324 WeakPolarHBondContact OE1-CE 3.44Å; E270-K324 IonicContact OE1-NZ 2.68Å; E270-K324 PolarHBondContact OE1-NZ 3.14Å; E270-K324 IonicContact OE2-NZ 2.68Å; E270-K324 PolarHBondContact OE2-NZ 3.38Å; L300-K324 HydrophobicContact CD1-CB 4.05Å; L300-K324 HydrophobicContact CD1-CD 4.07Å; L300-K324 HydrophobicContact CD1-CG 3.78Å; L300-K324 HydrophobicContact CD2-CD 4.14Å; Y320-K324 VanDerWaalsContact O-CB 3.3Å; Y320-K324 WeakPolarHBondContact O-CB 3.25Å; Y320-K324 PolarHBondContact O-N 3.39Å; D321-K324 PolarHBondContact O-N 2.92Å; L322-K324 VanDerWaalsContact C-N 3.31Å; L322-K324 PolarHBondContact O-N 3.15Å; K324-L326 PolarHBondContact O-N 3.48Å; K324-R327 WeakPolarHBondContact O-CB 3.13Å; K324-R327 PolarHBondContact O-N 3.1Å; K324-R327 VanDerWaalsContact O-N 3.16Å; K324-Y328 HydrophobicContact CD-CE2 4.35Å; K324-Y328 HydrophobicContact CG-CD2 4.21Å; K324-Y328 HydrophobicContact CG-CE2 3.69Å; K324-Y328 WeakPolarHBondContact O-CD2 3.19Å; K324-Y328 PolarHBondContact O-N 3.28Å
325	A	84.5	Confident	86.1	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-45.7	175.3	0	0	0	0	0	111.8	L300 D321 L322 R327 Y328 C329	L300-A325 HydrophobicContact CB-CB 3.9Å; L300-A325 HydrophobicContact CD1-CB 4.42Å; D321-A325 WeakPolarHBondContact O-CB 3.33Å; D321-A325 PolarHBondContact O-N 3.01Å; L322-A325 PolarHBondContact O-N 2.87Å; A325-R327 VanDerWaalsContact C-N 3.31Å; A325-R327 PolarHBondContact O-N 2.73Å; A325-Y328 PolarHBondContact O-N 3.36Å; A325-C329 PolarHBondContact O-N 2.62Å
326	L	85.7	Confident	86.1	Confident	30 Å²	30	65.7 Å²	65.7	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-69.2	-25	178	-69.5	172.3	0	0	0	113.6	L322 K323 K324 C329 P330 L339	L322-L326 WeakPolarHBondContact O-CG 3.35Å; L322-L326 PolarHBondContact O-N 3.47Å; K323-L326 PolarHBondContact O-N 3.21Å; K324-L326 PolarHBondContact O-N 3.48Å; L326-C329 CarbonylContact O-C 3.55Å; L326-P330 VanDerWaalsContact O-CA 3.32Å; L326-P330 WeakPolarHBondContact O-CA 2.89Å; L326-L339 HydrophobicContact CD1-CD2 3.63Å
327	R	80.9	Confident	86.2	Confident	201 Å²	201	66.9 Å²	66.9	76%	0.758	31%	0.312	S	S	*	.	H	α-helix	trans	-68	-38.1	171.2	-75.2	174.8	-178.4	-173.5	2.4	111.9	K323 K324 A325	K323-R327 WeakPolarHBondContact O-CG 3.25Å; K323-R327 PolarHBondContact O-N 3.1Å; K324-R327 WeakPolarHBondContact O-CB 3.13Å; K324-R327 PolarHBondContact O-N 3.1Å; K324-R327 VanDerWaalsContact O-N 3.16Å; A325-R327 VanDerWaalsContact C-N 3.31Å; A325-R327 PolarHBondContact O-N 2.73Å
328	Y	77.4	Confident	86.3	Confident	133 Å²	133	62.1 Å²	62.1	52%	0.522	29%	0.29	S	S	.	.	H	α-helix	trans	-77.6	-43.8	177	-70.2	-70.1	0	0	0	112.2	L296 L300 K324 A325	L296-Y328 HydrophobicContact CD2-CD2 4.13Å; L296-Y328 HydrophobicContact CD2-CE1 4.14Å; L296-Y328 HydrophobicContact CD2-CE2 3.6Å; L296-Y328 HydrophobicContact CG-CD2 4.49Å; L296-Y328 HydrophobicContact CG-CE2 4.31Å; L300-Y328 HydrophobicContact CD1-CD2 4.09Å; L300-Y328 HydrophobicContact CD1-CE2 4.18Å; K324-Y328 HydrophobicContact CD-CE2 4.35Å; K324-Y328 HydrophobicContact CG-CD2 4.21Å; K324-Y328 HydrophobicContact CG-CE2 3.69Å; K324-Y328 WeakPolarHBondContact O-CD2 3.19Å; K324-Y328 PolarHBondContact O-N 3.28Å; A325-Y328 PolarHBondContact O-N 3.36Å
329	C	79.5	Confident	86.5	Confident	35 Å²	35	62.8 Å²	62.8	24%	0.236	29%	0.294	C	S	.	.			trans	-131.3	91.9	179.3	-169.8	0	0	0	0	110.7	A325 L326 N331 H332	A325-C329 PolarHBondContact O-N 2.62Å; L326-C329 CarbonylContact O-C 3.55Å; C329-N331 PolarHBondContact O-N 3.18Å; C329-N331 VanDerWaalsContact O-N 3.17Å; C329-H332 HydrophobicContact CB-CB 4.05Å; C329-H332 WeakPolarHBondContact O-CB 3.39Å; C329-H332 PolarHBondContact O-N 3.44Å; C329-H332 VanDerWaalsContact O-N 3.16Å
330	P	81	Confident	86.5	Confident	95 Å²	95	66.8 Å²	66.8	62%	0.617	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.1	-179.7	-26.5	35.1	0	0	0	114.4	L326	L326-P330 VanDerWaalsContact O-CA 3.32Å; L326-P330 WeakPolarHBondContact O-CA 2.89Å
331	N	81.5	Confident	86.5	Confident	152 Å²	152	67.3 Å²	67.3	81%	0.813	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	8.5	-178.1	-66.9	-12.9	0	0	0	113.5	C329 L333	C329-N331 PolarHBondContact O-N 3.18Å; C329-N331 VanDerWaalsContact O-N 3.17Å; N331-L333 PolarHBondContact O-N 3.25Å
332	H	83.3	Confident	86.7	Confident	19 Å²	19	67.3 Å²	67.3	9%	0.088	32%	0.318	C	S	.	.			trans	-73.1	100.2	178.9	-174.7	106.9	0	0	0	109.7	D298 Y301 C329 E334 S335 Y336	D298-H332 IonicContact OD1-CE1 3.94Å; D298-H332 PolarHBondContact OD1-CE1 3.42Å; D298-H332 VanDerWaalsContact OD1-CE1 3.25Å; D298-H332 IonicContact OD1-ND1 3.13Å; D298-H332 PolarHBondContact OD1-ND1 3.04Å; Y301-H332 AromaticContact CD2-NE2 3.93Å; Y301-H332 AromaticContact CG-NE2 3.62Å; C329-H332 HydrophobicContact CB-CB 4.05Å; C329-H332 WeakPolarHBondContact O-CB 3.39Å; C329-H332 PolarHBondContact O-N 3.44Å; C329-H332 VanDerWaalsContact O-N 3.16Å; H332-E334 IonicContact CD2-OE2 2.92Å; H332-E334 IonicContact NE2-OE2 3.98Å; H332-E334 PolarHBondContact O-N 3.44Å; H332-S335 WeakPolarHBondContact CD2-CB 3.39Å; H332-S335 PolarHBondContact CD2-N 2.88Å; H332-S335 PolarHBondContact CD2-OG 3.27Å; H332-S335 PolarHBondContact NE2-N 3.5Å; H332-S335 PolarHBondContact NE2-OG 3.46Å; H332-Y336 PolarHBondContact O-N 3.08Å
333	L	86.2	Confident	86.7	Confident	104 Å²	104	70.6 Å²	70.6	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-38.9	-168.5	-179.7	61.9	0	0	0	112.7	N331 Y336 N337	N331-L333 PolarHBondContact O-N 3.25Å; L333-Y336 PolarHBondContact O-N 3.33Å; L333-N337 WeakPolarHBondContact O-CB 3.43Å; L333-N337 PolarHBondContact O-N 3.24Å; L333-N337 PolarHBondContact O-ND2 3.05Å
334	E	85.8	Confident	86.9	Confident	97 Å²	97	71.3 Å²	71.3	45%	0.453	34%	0.34	S	S	.	.	H	α-helix	trans	-67.8	-47	-176	-65	81	177.5	0	0	111.7	Y301 H332 N337 L338	Y301-E334 HydrophobicContact CD2-CB 4.27Å; Y301-E334 HydrophobicContact CE1-CB 4.08Å; Y301-E334 HydrophobicContact CE2-CB 3.72Å; H332-E334 IonicContact CD2-OE2 2.92Å; H332-E334 IonicContact NE2-OE2 3.98Å; H332-E334 PolarHBondContact O-N 3.44Å; E334-N337 PolarHBondContact O-N 3.44Å; E334-L338 WeakPolarHBondContact O-CB 3.29Å; E334-L338 PolarHBondContact O-N 3.35Å
335	S	86.6	Confident	87.2	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.7	-42.7	171.7	-65.7	0	0	0	0	112.2	Y301 H332 L338 L339	Y301-S335 WeakPolarHBondContact CB-OG 3.32Å; Y301-S335 WeakPolarHBondContact CD2-OG 3.49Å; H332-S335 WeakPolarHBondContact CD2-CB 3.39Å; H332-S335 PolarHBondContact CD2-N 2.88Å; H332-S335 PolarHBondContact CD2-OG 3.27Å; H332-S335 PolarHBondContact NE2-N 3.5Å; H332-S335 PolarHBondContact NE2-OG 3.46Å; S335-L338 PolarHBondContact O-N 3.1Å; S335-L339 VanDerWaalsContact O-CB 3.31Å; S335-L339 WeakPolarHBondContact O-CB 3.5Å; S335-L339 PolarHBondContact O-N 2.93Å
336	Y	89.2	Confident	87.6	Confident	120 Å²	120	72.1 Å²	72.1	47%	0.471	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-46.6	176.1	-178.2	-95.2	0	0	0	111.5	H332 L333 L338 L339 H340	H332-Y336 PolarHBondContact O-N 3.08Å; L333-Y336 PolarHBondContact O-N 3.33Å; Y336-L338 PolarHBondContact O-N 3.25Å; Y336-L339 PolarHBondContact O-N 2.97Å; Y336-H340 WeakPolarHBondContact O-CB 3.23Å; Y336-H340 PolarHBondContact O-N 2.9Å
337	N	92.2	Very high	88	Confident	73 Å²	73	73.3 Å²	73.3	39%	0.39	36%	0.357	S	S	.	.	H	α-helix	trans	-62.3	-43.2	178.6	-72.4	-23.6	0	0	0	112.2	L333 E334 H340 Q341	L333-N337 WeakPolarHBondContact O-CB 3.43Å; L333-N337 PolarHBondContact O-N 3.24Å; L333-N337 PolarHBondContact O-ND2 3.05Å; E334-N337 PolarHBondContact O-N 3.44Å; N337-H340 PolarHBondContact O-N 3.26Å; N337-Q341 VanDerWaalsContact O-CG 3.31Å; N337-Q341 WeakPolarHBondContact O-CG 3.38Å; N337-Q341 PolarHBondContact O-N 3.3Å
338	L	90.4	Very high	88.7	Confident	14 Å²	14	68.1 Å²	68.1	7%	0.073	34%	0.344	C	S	.	.	H	α-helix	trans	-67.9	-40.5	178.8	-174.6	59.1	0	0	0	111.6	Y301 N305 L322 E334 S335 Y336 H340 Q341 L342	Y301-L338 HydrophobicContact CE2-CB 4.29Å; Y301-L338 HydrophobicContact CE2-CD2 4Å; N305-L338 HydrophobicContact CB-CD2 4.1Å; L322-L338 HydrophobicContact CD1-CB 4.31Å; L322-L338 HydrophobicContact CD1-CD2 4.1Å; L322-L338 HydrophobicContact CD1-CG 3.95Å; L322-L338 HydrophobicContact CD2-CB 4.25Å; L322-L338 HydrophobicContact CD2-CD2 4.1Å; L322-L338 HydrophobicContact CD2-CG 4.43Å; E334-L338 WeakPolarHBondContact O-CB 3.29Å; E334-L338 PolarHBondContact O-N 3.35Å; S335-L338 PolarHBondContact O-N 3.1Å; Y336-L338 PolarHBondContact O-N 3.25Å; L338-H340 PolarHBondContact O-N 3.44Å; L338-Q341 WeakPolarHBondContact O-CB 3.48Å; L338-Q341 PolarHBondContact O-N 2.74Å; L338-L342 WeakPolarHBondContact O-CG 3.36Å; L338-L342 PolarHBondContact O-N 3.47Å
339	L	92.6	Very high	89.5	Confident	14 Å²	14	64.4 Å²	64.4	7%	0.073	33%	0.331	C	S	.	.	H	α-helix	trans	-60.4	-46.2	174.4	-177.8	62.9	0	0	0	111	Y319 L322 L326 S335 Y336 Q341 L342 E343	Y319-L339 HydrophobicContact CD2-CD1 3.69Å; Y319-L339 HydrophobicContact CE2-CD1 3.7Å; L322-L339 HydrophobicContact CB-CB 4.46Å; L322-L339 HydrophobicContact CB-CD1 4.44Å; L322-L339 HydrophobicContact CD1-CB 4.33Å; L326-L339 HydrophobicContact CD1-CD2 3.63Å; S335-L339 VanDerWaalsContact O-CB 3.31Å; S335-L339 WeakPolarHBondContact O-CB 3.5Å; S335-L339 PolarHBondContact O-N 2.93Å; Y336-L339 PolarHBondContact O-N 2.97Å; L339-Q341 VanDerWaalsContact C-N 3.31Å; L339-Q341 PolarHBondContact O-N 3.42Å; L339-L342 WeakPolarHBondContact O-CB 3.45Å; L339-L342 PolarHBondContact O-N 3.44Å; L339-L342 VanDerWaalsContact O-N 3.15Å; L339-E343 WeakPolarHBondContact O-CG 3.4Å; L339-E343 PolarHBondContact O-N 3.02Å
340	H	92.7	Very high	90.2	Very high	87 Å²	87	63.9 Å²	63.9	40%	0.403	33%	0.325	S	S	.	.	H	α-helix	trans	-62.9	-36.1	177	-175.4	-92.8	0	0	0	112.4	Y336 N337 L338 E343 I344	Y336-H340 WeakPolarHBondContact O-CB 3.23Å; Y336-H340 PolarHBondContact O-N 2.9Å; N337-H340 PolarHBondContact O-N 3.26Å; L338-H340 PolarHBondContact O-N 3.44Å; H340-E343 PolarHBondContact O-N 3.03Å; H340-I344 VanDerWaalsContact CE1-CD1 3.42Å; H340-I344 WeakPolarHBondContact CE1-CD1 3.38Å; H340-I344 WeakPolarHBondContact ND1-CD1 3.41Å; H340-I344 WeakPolarHBondContact O-CG1 3.03Å; H340-I344 PolarHBondContact O-N 2.97Å
341	Q	92	Very high	90.8	Very high	108 Å²	108	62.4 Å²	62.4	51%	0.505	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-43.6	172.4	-74.5	173.7	7.1	0	0	111.9	N337 L338 L339 E343 I344 I345	N337-Q341 VanDerWaalsContact O-CG 3.31Å; N337-Q341 WeakPolarHBondContact O-CG 3.38Å; N337-Q341 PolarHBondContact O-N 3.3Å; L338-Q341 WeakPolarHBondContact O-CB 3.48Å; L338-Q341 PolarHBondContact O-N 2.74Å; L339-Q341 VanDerWaalsContact C-N 3.31Å; L339-Q341 PolarHBondContact O-N 3.42Å; Q341-E343 VanDerWaalsContact C-N 3.33Å; Q341-E343 PolarHBondContact O-N 2.91Å; Q341-I344 PolarHBondContact O-N 3.19Å; Q341-I345 VanDerWaalsContact O-CG1 3.26Å; Q341-I345 WeakPolarHBondContact O-CG1 3.49Å; Q341-I345 PolarHBondContact O-N 3.27Å
342	L	91.2	Very high	91.5	Very high	9 Å²	9	58.5 Å²	58.5	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-63.1	-38.8	176	-67.2	176.3	0	0	0	112	I315 L322 L338 L339 I345 S346 T375	I315-L342 HydrophobicContact CG2-CD2 4.34Å; L322-L342 HydrophobicContact CD1-CD1 3.73Å; L338-L342 WeakPolarHBondContact O-CG 3.36Å; L338-L342 PolarHBondContact O-N 3.47Å; L339-L342 WeakPolarHBondContact O-CB 3.45Å; L339-L342 PolarHBondContact O-N 3.44Å; L339-L342 VanDerWaalsContact O-N 3.15Å; L342-I345 PolarHBondContact O-N 3.35Å; L342-S346 WeakPolarHBondContact O-CB 3.38Å; L342-S346 PolarHBondContact O-N 3.12Å; L342-T375 HydrophobicContact CD2-CG2 4.31Å
343	E	92.3	Very high	92	Very high	69 Å²	69	57.6 Å²	57.6	32%	0.322	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.5	-70.9	178	167.3	0	0	112.4	L339 H340 Q341 S346 S347	L339-E343 WeakPolarHBondContact O-CG 3.4Å; L339-E343 PolarHBondContact O-N 3.02Å; H340-E343 PolarHBondContact O-N 3.03Å; Q341-E343 VanDerWaalsContact C-N 3.33Å; Q341-E343 PolarHBondContact O-N 2.91Å; E343-S346 WeakPolarHBondContact O-CB 3.33Å; E343-S346 PolarHBondContact O-N 3.02Å; E343-S347 PolarHBondContact O-N 3.45Å
344	I	93.5	Very high	92.3	Very high	77 Å²	77	54.2 Å²	54.2	40%	0.395	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-45.1	173.8	-68.4	164.2	0	0	0	110.5	H340 Q341 S346 S347 N348	H340-I344 VanDerWaalsContact CE1-CD1 3.42Å; H340-I344 WeakPolarHBondContact CE1-CD1 3.38Å; H340-I344 WeakPolarHBondContact ND1-CD1 3.41Å; H340-I344 WeakPolarHBondContact O-CG1 3.03Å; H340-I344 PolarHBondContact O-N 2.97Å; Q341-I344 PolarHBondContact O-N 3.19Å; I344-S346 VanDerWaalsContact C-N 3.34Å; I344-S346 PolarHBondContact O-N 3.32Å; I344-S347 PolarHBondContact O-N 2.97Å; I344-N348 WeakPolarHBondContact O-CB 3.37Å; I344-N348 VanDerWaalsContact O-CG 3.25Å; I344-N348 PolarHBondContact O-N 3Å; I344-N348 PolarHBondContact O-ND2 3.33Å
345	I	91.7	Very high	92.7	Very high	78 Å²	78	52.7 Å²	52.7	40%	0.4	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-44.7	178.7	-66.4	163.6	0	0	0	110.3	Q341 L342 N348 K349 T375	Q341-I345 VanDerWaalsContact O-CG1 3.26Å; Q341-I345 WeakPolarHBondContact O-CG1 3.49Å; Q341-I345 PolarHBondContact O-N 3.27Å; L342-I345 PolarHBondContact O-N 3.35Å; I345-N348 PolarHBondContact O-N 3.44Å; I345-K349 HydrophobicContact CG2-CG 4.43Å; I345-K349 WeakPolarHBondContact O-CB 3.43Å; I345-K349 WeakPolarHBondContact O-CG 3.28Å; I345-K349 PolarHBondContact O-N 3.36Å; I345-T375 HydrophobicContact CG2-CG2 4.04Å
346	S	93.4	Very high	93	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55.8	-51.3	175.8	179.9	0	0	0	0	111.5	L342 E343 I344 N348 K349 Q350 A372 T375 Q376	L342-S346 WeakPolarHBondContact O-CB 3.38Å; L342-S346 PolarHBondContact O-N 3.12Å; E343-S346 WeakPolarHBondContact O-CB 3.33Å; E343-S346 PolarHBondContact O-N 3.02Å; I344-S346 VanDerWaalsContact C-N 3.34Å; I344-S346 PolarHBondContact O-N 3.32Å; S346-N348 PolarHBondContact O-N 3.1Å; S346-K349 PolarHBondContact O-N 2.81Å; S346-Q350 WeakPolarHBondContact O-CB 3.26Å; S346-Q350 PolarHBondContact O-N 3.13Å; S346-A372 PolarHBondContact OG-O 3.2Å; S346-T375 WeakPolarHBondContact CA-OG1 3.43Å; S346-T375 VanDerWaalsContact CB-OG1 3.24Å; S346-T375 WeakPolarHBondContact CB-OG1 3.36Å; S346-Q376 WeakPolarHBondContact OG-CB 3.45Å; S346-Q376 PolarHBondContact OG-OE1 3.3Å
347	S	94	Very high	93	Very high	55 Å²	55	50.8 Å²	50.8	39%	0.385	25%	0.254	S	S	.	.	H	α-helix	trans	-60.8	-47.5	-180	-176.3	0	0	0	0	111.7	E343 I344 K349 Q350 E351	E343-S347 PolarHBondContact O-N 3.45Å; I344-S347 PolarHBondContact O-N 2.97Å; S347-K349 VanDerWaalsContact C-N 3.31Å; S347-K349 PolarHBondContact O-N 3.45Å; S347-Q350 WeakPolarHBondContact O-CB 3.3Å; S347-Q350 PolarHBondContact O-N 3.45Å; S347-E351 WeakPolarHBondContact O-CG 3.33Å; S347-E351 PolarHBondContact O-N 3.08Å
348	N	95.3	Very high	93	Very high	92 Å²	92	51.5 Å²	51.5	49%	0.492	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-41.6	177.7	-70	-20.4	0	0	0	111.9	I344 I345 S346 E351 E352	I344-N348 WeakPolarHBondContact O-CB 3.37Å; I344-N348 VanDerWaalsContact O-CG 3.25Å; I344-N348 PolarHBondContact O-N 3Å; I344-N348 PolarHBondContact O-ND2 3.33Å; I345-N348 PolarHBondContact O-N 3.44Å; S346-N348 PolarHBondContact O-N 3.1Å; N348-E351 PolarHBondContact O-N 2.96Å; N348-E352 WeakPolarHBondContact O-CB 3.26Å; N348-E352 PolarHBondContact O-N 3.07Å
349	K	94.4	Very high	93.1	Very high	55 Å²	55	56 Å²	56	24%	0.239	28%	0.276	C	S	.	.	H	α-helix	trans	-71.3	-32.2	178.5	-76	-71	172.6	-164.3	0	113.1	I345 S346 S347 E352 A353 I371 A372	I345-K349 HydrophobicContact CG2-CG 4.43Å; I345-K349 WeakPolarHBondContact O-CB 3.43Å; I345-K349 WeakPolarHBondContact O-CG 3.28Å; I345-K349 PolarHBondContact O-N 3.36Å; S346-K349 PolarHBondContact O-N 2.81Å; S347-K349 VanDerWaalsContact C-N 3.31Å; S347-K349 PolarHBondContact O-N 3.45Å; K349-E352 WeakPolarHBondContact CD-OE2 3.43Å; K349-E352 WeakPolarHBondContact CE-OE2 3.41Å; K349-E352 IonicContact NZ-OE1 3.8Å; K349-E352 PolarHBondContact NZ-OE1 3.41Å; K349-E352 IonicContact NZ-OE2 3.25Å; K349-E352 PolarHBondContact NZ-OE2 3.49Å; K349-A353 WeakPolarHBondContact O-CB 3.47Å; K349-A353 PolarHBondContact O-N 2.93Å; K349-I371 HydrophobicContact CD-CG2 4.39Å; K349-I371 HydrophobicContact CG-CG2 4.1Å; K349-A372 HydrophobicContact CB-CB 3.99Å
350	Q	94.9	Very high	92.9	Very high	23 Å²	23	61 Å²	61	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-43.8	170.8	-173.9	-177.8	14.8	0	0	111.3	S346 S347 A353 I354 I369 S381 L382 D385	S346-Q350 WeakPolarHBondContact O-CB 3.26Å; S346-Q350 PolarHBondContact O-N 3.13Å; S347-Q350 WeakPolarHBondContact O-CB 3.3Å; S347-Q350 PolarHBondContact O-N 3.45Å; Q350-A353 PolarHBondContact O-N 2.87Å; Q350-I354 HydrophobicContact CG-CD1 4.23Å; Q350-I354 WeakPolarHBondContact O-CG1 3.41Å; Q350-I354 PolarHBondContact O-N 3.38Å; Q350-I369 HydrophobicContact CB-CD1 4.49Å; Q350-I369 HydrophobicContact CG-CD1 4.18Å; Q350-S381 PolarHBondContact NE2-OG 3.42Å; Q350-L382 HydrophobicContact CB-CD2 3.73Å; Q350-L382 HydrophobicContact CG-CD2 3.59Å; Q350-D385 PolarHBondContact NE2-OD2 3.13Å
351	E	94.5	Very high	92.9	Very high	64 Å²	64	64 Å²	64	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-45.7	175.6	-64.1	-155.6	151.2	0	0	112	S347 N348 A353 I354 E355 R753	S347-E351 WeakPolarHBondContact O-CG 3.33Å; S347-E351 PolarHBondContact O-N 3.08Å; N348-E351 PolarHBondContact O-N 2.96Å; E351-A353 VanDerWaalsContact C-N 3.33Å; E351-A353 PolarHBondContact O-N 2.91Å; E351-I354 PolarHBondContact O-N 3.45Å; E351-E355 PolarHBondContact O-N 3.5Å; E351-R753 IonicContact OE1-NH1 3.43Å; E351-R753 PolarHBondContact OE1-NH1 3.47Å; E351-R753 VanDerWaalsContact OE1-NH1 3.12Å
352	E	94.3	Very high	93	Very high	70 Å²	70	61 Å²	61	33%	0.327	30%	0.297	S	S	.	.	H	α-helix	trans	-58.3	-44.1	174.8	-170.7	-168.6	130.7	0	0	111.5	N348 K349 I354 E355 L356 S368	N348-E352 WeakPolarHBondContact O-CB 3.26Å; N348-E352 PolarHBondContact O-N 3.07Å; K349-E352 WeakPolarHBondContact CD-OE2 3.43Å; K349-E352 WeakPolarHBondContact CE-OE2 3.41Å; K349-E352 IonicContact NZ-OE1 3.8Å; K349-E352 PolarHBondContact NZ-OE1 3.41Å; K349-E352 IonicContact NZ-OE2 3.25Å; K349-E352 PolarHBondContact NZ-OE2 3.49Å; E352-I354 VanDerWaalsContact C-N 3.34Å; E352-I354 PolarHBondContact O-N 3.26Å; E352-E355 PolarHBondContact O-N 3.04Å; E352-L356 HydrophobicContact CG-CD1 3.99Å; E352-L356 WeakPolarHBondContact O-CB 3.13Å; E352-L356 VanDerWaalsContact O-CG 3.25Å; E352-L356 WeakPolarHBondContact O-CG 3.44Å; E352-L356 PolarHBondContact O-N 3.37Å; E352-S368 PolarHBondContact OE1-OG 3.24Å
353	A	93.8	Very high	93.1	Very high	1 Å²	1	67.8 Å²	67.8	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-42.4	178.2	0	0	0	0	0	112	K349 Q350 E351 L356 M357 S365 I369	K349-A353 WeakPolarHBondContact O-CB 3.47Å; K349-A353 PolarHBondContact O-N 2.93Å; Q350-A353 PolarHBondContact O-N 2.87Å; E351-A353 VanDerWaalsContact C-N 3.33Å; E351-A353 PolarHBondContact O-N 2.91Å; A353-L356 PolarHBondContact O-N 2.9Å; A353-M357 WeakPolarHBondContact O-CB 3.43Å; A353-M357 PolarHBondContact O-N 3.36Å; A353-S365 WeakPolarHBondContact O-CB 3.45Å; A353-S365 PolarHBondContact O-OG 3.4Å; A353-I369 HydrophobicContact CB-CB 3.88Å; A353-I369 HydrophobicContact CB-CD1 4.22Å
354	I	93	Very high	93.1	Very high	33 Å²	33	68.2 Å²	68.2	17%	0.169	33%	0.331	C	S	.	.	H	α-helix	trans	-68.1	-41.7	178.1	-67.4	167	0	0	0	110.7	Q350 E351 E352 L356 M357 L358	Q350-I354 HydrophobicContact CG-CD1 4.23Å; Q350-I354 WeakPolarHBondContact O-CG1 3.41Å; Q350-I354 PolarHBondContact O-N 3.38Å; E351-I354 PolarHBondContact O-N 3.45Å; E352-I354 VanDerWaalsContact C-N 3.34Å; E352-I354 PolarHBondContact O-N 3.26Å; I354-L356 PolarHBondContact O-N 3.03Å; I354-M357 WeakPolarHBondContact O-CB 3.44Å; I354-M357 PolarHBondContact O-N 3.34Å; I354-L358 HydrophobicContact CG2-CD1 4.4Å; I354-L358 WeakPolarHBondContact O-CG 3.45Å; I354-L358 PolarHBondContact O-N 3.49Å
355	E	93.7	Very high	93.2	Very high	65 Å²	65	64.6 Å²	64.6	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-45.7	174.4	167.9	165.9	-173.7	0	0	111.9	E351 E352 M357 L358 K359 Y742	E351-E355 PolarHBondContact O-N 3.5Å; E352-E355 PolarHBondContact O-N 3.04Å; E355-M357 VanDerWaalsContact C-N 3.31Å; E355-M357 PolarHBondContact O-N 3.42Å; E355-L358 PolarHBondContact O-N 3.42Å; E355-K359 HydrophobicContact CG-CD 4.14Å; E355-K359 WeakPolarHBondContact O-CG 3.49Å; E355-K359 PolarHBondContact O-N 2.9Å; E355-K359 WeakPolarHBondContact OE1-CE 3.42Å; E355-K359 IonicContact OE1-NZ 3.58Å; E355-K359 PolarHBondContact OE1-NZ 3.49Å; E355-Y742 WeakPolarHBondContact CB-OH 3.43Å; E355-Y742 VanDerWaalsContact CD-OH 3.31Å; E355-Y742 WeakPolarHBondContact CG-OH 3.3Å
356	L	93.3	Very high	93.4	Very high	22 Å²	22	61.8 Å²	61.8	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-36.6	176.3	-70.6	167.9	0	0	0	111.9	E352 A353 I354 K359 N360 R361 D364	E352-L356 HydrophobicContact CG-CD1 3.99Å; E352-L356 WeakPolarHBondContact O-CB 3.13Å; E352-L356 VanDerWaalsContact O-CG 3.25Å; E352-L356 WeakPolarHBondContact O-CG 3.44Å; E352-L356 PolarHBondContact O-N 3.37Å; A353-L356 PolarHBondContact O-N 2.9Å; I354-L356 PolarHBondContact O-N 3.03Å; L356-K359 CarbonylContact O-C 3.43Å; L356-K359 PolarHBondContact O-N 3.48Å; L356-N360 PolarHBondContact O-N 3.46Å; L356-R361 HydrophobicContact CB-CB 4.45Å; L356-R361 HydrophobicContact CD2-CB 4.25Å; L356-R361 PolarHBondContact O-N 2.92Å; L356-D364 HydrophobicContact CD1-CB 3.85Å; L356-D364 HydrophobicContact CD2-CB 4.24Å
357	M	90.7	Very high	93.4	Very high	57 Å²	57	67.6 Å²	67.6	28%	0.281	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-44.1	174.3	-169.8	-173.2	76.6	0	0	111.3	A353 I354 E355 K359 N360 F362 I389	A353-M357 WeakPolarHBondContact O-CB 3.43Å; A353-M357 PolarHBondContact O-N 3.36Å; I354-M357 WeakPolarHBondContact O-CB 3.44Å; I354-M357 PolarHBondContact O-N 3.34Å; E355-M357 VanDerWaalsContact C-N 3.31Å; E355-M357 PolarHBondContact O-N 3.42Å; M357-K359 VanDerWaalsContact C-N 3.27Å; M357-K359 PolarHBondContact O-N 3.24Å; M357-N360 PolarHBondContact O-N 3.38Å; M357-N360 VanDerWaalsContact O-N 3.08Å; M357-F362 HydrophobicContact CG-CD1 4.23Å; M357-F362 HydrophobicContact CG-CE1 3.99Å; M357-I389 HydrophobicContact CG-CG1 4.29Å; M357-I389 HydrophobicContact SD-CG1 3.93Å
358	L	90.9	Very high	93.4	Very high	88 Å²	88	65.1 Å²	65.1	46%	0.461	31%	0.307	S	S	.	.	H	α-helix	trans	-66	-30.1	176.9	-67.9	173.7	0	0	0	112.4	I354 E355 N360 Y742	I354-L358 HydrophobicContact CG2-CD1 4.4Å; I354-L358 WeakPolarHBondContact O-CG 3.45Å; I354-L358 PolarHBondContact O-N 3.49Å; E355-L358 PolarHBondContact O-N 3.42Å; L358-N360 PolarHBondContact O-N 3.29Å; L358-Y742 HydrophobicContact CB-CE2 4.38Å; L358-Y742 HydrophobicContact CD1-CE2 4.03Å
359	K	92.2	Very high	93.5	Very high	109 Å²	109	60.8 Å²	60.8	47%	0.474	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	8.6	173	-69.7	172	173.2	173.5	0	113.6	E355 L356 M357 R361	E355-K359 HydrophobicContact CG-CD 4.14Å; E355-K359 WeakPolarHBondContact O-CG 3.49Å; E355-K359 PolarHBondContact O-N 2.9Å; E355-K359 WeakPolarHBondContact OE1-CE 3.42Å; E355-K359 IonicContact OE1-NZ 3.58Å; E355-K359 PolarHBondContact OE1-NZ 3.49Å; L356-K359 CarbonylContact O-C 3.43Å; L356-K359 PolarHBondContact O-N 3.48Å; M357-K359 VanDerWaalsContact C-N 3.27Å; M357-K359 PolarHBondContact O-N 3.24Å; K359-R361 PolarHBondContact O-N 3.12Å
360	N	89.4	Confident	93.5	Very high	120 Å²	120	59.2 Å²	59.2	64%	0.642	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	20.1	-175.1	-67.3	-34.6	0	0	0	115	L356 M357 L358 F362	L356-N360 PolarHBondContact O-N 3.46Å; M357-N360 PolarHBondContact O-N 3.38Å; M357-N360 VanDerWaalsContact O-N 3.08Å; L358-N360 PolarHBondContact O-N 3.29Å; N360-F362 HydrophobicContact CB-CE2 4.24Å; N360-F362 HydrophobicContact CB-CZ 4.41Å; N360-F362 PolarHBondContact O-N 3.5Å
361	R	93.1	Very high	93.3	Very high	150 Å²	150	60.3 Å²	60.3	57%	0.566	29%	0.285	S	S	*	.			trans	-93	72	175.1	-64.9	-170.4	-175.3	-174.2	0.9	110.7	L356 K359 F363 D364 S365	L356-R361 HydrophobicContact CB-CB 4.45Å; L356-R361 HydrophobicContact CD2-CB 4.25Å; L356-R361 PolarHBondContact O-N 2.92Å; K359-R361 PolarHBondContact O-N 3.12Å; R361-F363 PolarHBondContact O-N 3.37Å; R361-D364 HydrophobicContact CB-CB 4.4Å; R361-S365 VanDerWaalsContact O-CB 3.27Å; R361-S365 WeakPolarHBondContact O-CB 3.34Å; R361-S365 PolarHBondContact O-N 3.23Å
362	F	92.5	Very high	93.3	Very high	45 Å²	45	57.3 Å²	57.3	20%	0.197	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-33	-170.8	-60.1	-66.6	0	0	0	114.6	M357 N360 L366 K392 L393	M357-F362 HydrophobicContact CG-CD1 4.23Å; M357-F362 HydrophobicContact CG-CE1 3.99Å; N360-F362 HydrophobicContact CB-CE2 4.24Å; N360-F362 HydrophobicContact CB-CZ 4.41Å; N360-F362 PolarHBondContact O-N 3.5Å; F362-L366 WeakPolarHBondContact O-CB 3.41Å; F362-L366 PolarHBondContact O-N 2.99Å; F362-K392 HydrophobicContact CD1-CB 3.82Å; F362-K392 HydrophobicContact CE1-CB 3.6Å; F362-K392 HydrophobicContact CE1-CG 3.93Å; F362-K392 HydrophobicContact CG-CB 4.43Å; F362-K392 HydrophobicContact CZ-CB 4.03Å; F362-K392 HydrophobicContact CZ-CG 4.4Å; F362-L393 HydrophobicContact CB-CD1 4.17Å; F362-L393 HydrophobicContact CB-CD2 3.46Å; F362-L393 VanDerWaalsContact CB-CD2 3.46Å; F362-L393 HydrophobicContact CB-CG 3.71Å; F362-L393 HydrophobicContact CG-CD2 4.31Å; F362-L393 HydrophobicContact CG-CG 4.49Å
363	F	93.2	Very high	93.3	Very high	151 Å²	151	54.4 Å²	54.4	66%	0.662	26%	0.258	S	S	*	.	H	α-helix	trans	-68.6	-45.9	178.3	-70.5	-75.9	0	0	0	112.1	R361 S365 L366 H367 L393	R361-F363 PolarHBondContact O-N 3.37Å; F363-S365 VanDerWaalsContact C-N 3.33Å; F363-L366 WeakPolarHBondContact O-CB 3.45Å; F363-L366 PolarHBondContact O-N 3.46Å; F363-H367 PolarHBondContact O-N 3.23Å; F363-L393 HydrophobicContact CD1-CD2 4.49Å; F363-L393 HydrophobicContact CD2-CD2 4.39Å; F363-L393 HydrophobicContact CE1-CD2 4.2Å; F363-L393 HydrophobicContact CE2-CD2 4.08Å; F363-L393 HydrophobicContact CZ-CD2 3.98Å
364	D	94.2	Very high	93.3	Very high	78 Å²	78	57 Å²	57	42%	0.417	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-42.2	175.9	-55.7	-23	0	0	0	110.3	L356 R361 L366 H367 S368	L356-D364 HydrophobicContact CD1-CB 3.85Å; L356-D364 HydrophobicContact CD2-CB 4.24Å; R361-D364 HydrophobicContact CB-CB 4.4Å; D364-L366 VanDerWaalsContact C-N 3.33Å; D364-L366 PolarHBondContact O-N 2.93Å; D364-H367 WeakPolarHBondContact O-CB 3.48Å; D364-H367 PolarHBondContact O-N 3.37Å; D364-H367 VanDerWaalsContact O-N 3.13Å; D364-S368 PolarHBondContact O-N 3.48Å; D364-S368 PolarHBondContact O-OG 2.96Å
365	S	94.7	Very high	93.2	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-43.4	174	-179.6	0	0	0	0	112.1	A353 R361 F363 H367 S368 I369 I389	A353-S365 WeakPolarHBondContact O-CB 3.45Å; A353-S365 PolarHBondContact O-OG 3.4Å; R361-S365 VanDerWaalsContact O-CB 3.27Å; R361-S365 WeakPolarHBondContact O-CB 3.34Å; R361-S365 PolarHBondContact O-N 3.23Å; F363-S365 VanDerWaalsContact C-N 3.33Å; S365-H367 VanDerWaalsContact C-N 3.32Å; S365-H367 PolarHBondContact O-N 3.41Å; S365-S368 PolarHBondContact O-N 3.24Å; S365-I369 WeakPolarHBondContact O-CG2 3.38Å; S365-I369 PolarHBondContact O-N 3.45Å; S365-I389 WeakPolarHBondContact OG-CD1 3.36Å
366	L	95.3	Very high	93.1	Very high	20 Å²	20	54.1 Å²	54.1	11%	0.105	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-36.7	176.2	-177.1	63.7	0	0	0	112	F362 F363 D364 I369 T370 K386 I389 L390 L393	F362-L366 WeakPolarHBondContact O-CB 3.41Å; F362-L366 PolarHBondContact O-N 2.99Å; F363-L366 WeakPolarHBondContact O-CB 3.45Å; F363-L366 PolarHBondContact O-N 3.46Å; D364-L366 VanDerWaalsContact C-N 3.33Å; D364-L366 PolarHBondContact O-N 2.93Å; L366-I369 HydrophobicContact CD1-CG2 4.24Å; L366-I369 WeakPolarHBondContact O-CG2 3.48Å; L366-T370 VanDerWaalsContact O-CB 3.29Å; L366-T370 WeakPolarHBondContact O-CB 3.44Å; L366-T370 PolarHBondContact O-N 2.96Å; L366-T370 VanDerWaalsContact O-N 3.1Å; L366-T370 PolarHBondContact O-OG1 2.96Å; L366-K386 HydrophobicContact CD1-CD 4.46Å; L366-K386 HydrophobicContact CD1-CG 4Å; L366-I389 HydrophobicContact CB-CG2 4.05Å; L366-I389 HydrophobicContact CD1-CG2 4.46Å; L366-L390 HydrophobicContact CD1-CD2 3.83Å; L366-L390 HydrophobicContact CD1-CG 3.99Å; L366-L390 HydrophobicContact CD2-CD2 3.91Å; L366-L393 HydrophobicContact CB-CD1 4.43Å; L366-L393 HydrophobicContact CD2-CD1 3.96Å
367	H	94.4	Very high	93	Very high	121 Å²	121	53.2 Å²	53.2	56%	0.56	25%	0.25	S	C	*	.	H	α-helix	trans	-66	-49.8	175.4	-176.1	67.4	0	0	0	111.1	F363 D364 S365 I369 T370 I371	F363-H367 PolarHBondContact O-N 3.23Å; D364-H367 WeakPolarHBondContact O-CB 3.48Å; D364-H367 PolarHBondContact O-N 3.37Å; D364-H367 VanDerWaalsContact O-N 3.13Å; S365-H367 VanDerWaalsContact C-N 3.32Å; S365-H367 PolarHBondContact O-N 3.41Å; H367-I369 PolarHBondContact O-N 3.49Å; H367-T370 WeakPolarHBondContact O-CB 3.3Å; H367-T370 PolarHBondContact O-N 3.01Å; H367-T370 VanDerWaalsContact O-N 3.14Å; H367-I371 PolarHBondContact O-N 3.03Å
368	S	94.5	Very high	92.8	Very high	4 Å²	4	52.6 Å²	52.6	3%	0.028	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-40.6	-179.3	-58.6	0	0	0	0	112.5	E352 D364 S365 T370 I371 A372	E352-S368 PolarHBondContact OE1-OG 3.24Å; D364-S368 PolarHBondContact O-N 3.48Å; D364-S368 PolarHBondContact O-OG 2.96Å; S365-S368 PolarHBondContact O-N 3.24Å; S368-T370 VanDerWaalsContact C-N 3.31Å; S368-T370 PolarHBondContact O-N 2.9Å; S368-I371 PolarHBondContact O-N 3.29Å; S368-A372 PolarHBondContact O-N 3.01Å; S368-A372 VanDerWaalsContact O-N 3.07Å
369	I	96	Very high	92.7	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.4	-31.5	175.3	-160.9	65.3	0	0	0	112.2	Q350 A353 S365 L366 H367 A372 I373 L382 D385 K386 I389	Q350-I369 HydrophobicContact CB-CD1 4.49Å; Q350-I369 HydrophobicContact CG-CD1 4.18Å; A353-I369 HydrophobicContact CB-CB 3.88Å; A353-I369 HydrophobicContact CB-CD1 4.22Å; S365-I369 WeakPolarHBondContact O-CG2 3.38Å; S365-I369 PolarHBondContact O-N 3.45Å; L366-I369 HydrophobicContact CD1-CG2 4.24Å; L366-I369 WeakPolarHBondContact O-CG2 3.48Å; H367-I369 PolarHBondContact O-N 3.49Å; I369-A372 HydrophobicContact CD1-CB 4.4Å; I369-A372 WeakPolarHBondContact O-CB 3.19Å; I369-A372 PolarHBondContact O-N 3.11Å; I369-I373 WeakPolarHBondContact O-CG1 3.41Å; I369-I373 PolarHBondContact O-N 3.23Å; I369-L382 HydrophobicContact CD1-CB 4.35Å; I369-L382 HydrophobicContact CD1-CD2 3.85Å; I369-D385 HydrophobicContact CD1-CB 3.97Å; I369-D385 HydrophobicContact CG1-CB 4.34Å; I369-K386 HydrophobicContact CG1-CB 4.08Å; I369-K386 HydrophobicContact CG2-CB 3.97Å; I369-K386 HydrophobicContact CG2-CD 4.46Å; I369-K386 HydrophobicContact CG2-CG 4.11Å; I369-I389 HydrophobicContact CB-CD1 4.11Å; I369-I389 HydrophobicContact CG1-CD1 4.46Å; I369-I389 HydrophobicContact CG2-CD1 3.9Å
370	T	94.4	Very high	92.5	Very high	23 Å²	23	44.9 Å²	44.9	14%	0.141	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-39.7	176.6	-62.5	0	0	0	0	111	L366 H367 S368 A372 I373 Y374	L366-T370 VanDerWaalsContact O-CB 3.29Å; L366-T370 WeakPolarHBondContact O-CB 3.44Å; L366-T370 PolarHBondContact O-N 2.96Å; L366-T370 VanDerWaalsContact O-N 3.1Å; L366-T370 PolarHBondContact O-OG1 2.96Å; H367-T370 WeakPolarHBondContact O-CB 3.3Å; H367-T370 PolarHBondContact O-N 3.01Å; H367-T370 VanDerWaalsContact O-N 3.14Å; S368-T370 VanDerWaalsContact C-N 3.31Å; S368-T370 PolarHBondContact O-N 2.9Å; T370-A372 VanDerWaalsContact C-N 3.34Å; T370-I373 PolarHBondContact O-N 3.32Å; T370-Y374 HydrophobicContact CG2-CD1 4.41Å; T370-Y374 HydrophobicContact CG2-CD2 4.32Å; T370-Y374 HydrophobicContact CG2-CE1 3.79Å; T370-Y374 HydrophobicContact CG2-CE2 3.67Å; T370-Y374 WeakPolarHBondContact CG2-OH 3.47Å; T370-Y374 WeakPolarHBondContact O-CD1 3.29Å; T370-Y374 VanDerWaalsContact O-CG 3.26Å; T370-Y374 PolarHBondContact O-N 3.09Å
371	I	92.4	Very high	92.6	Very high	46 Å²	46	40.6 Å²	40.6	24%	0.236	19%	0.19	C	C	.	.	H	α-helix	trans	-61.2	-43.9	171.7	-64.8	168.5	0	0	0	110.5	K349 H367 S368 I373 Y374 T375	K349-I371 HydrophobicContact CD-CG2 4.39Å; K349-I371 HydrophobicContact CG-CG2 4.1Å; H367-I371 PolarHBondContact O-N 3.03Å; S368-I371 PolarHBondContact O-N 3.29Å; I371-I373 VanDerWaalsContact C-N 3.33Å; I371-I373 PolarHBondContact O-N 3.03Å; I371-Y374 PolarHBondContact O-N 3.29Å; I371-Y374 VanDerWaalsContact O-N 3.14Å; I371-T375 PolarHBondContact O-N 3.24Å; I371-T375 PolarHBondContact O-OG1 3.37Å
372	A	94.5	Very high	92.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-43.3	177.4	0	0	0	0	0	112.1	S346 K349 S368 I369 T370 Y374 T375 Q376 L382	S346-A372 PolarHBondContact OG-O 3.2Å; K349-A372 HydrophobicContact CB-CB 3.99Å; S368-A372 PolarHBondContact O-N 3.01Å; S368-A372 VanDerWaalsContact O-N 3.07Å; I369-A372 HydrophobicContact CD1-CB 4.4Å; I369-A372 WeakPolarHBondContact O-CB 3.19Å; I369-A372 PolarHBondContact O-N 3.11Å; T370-A372 VanDerWaalsContact C-N 3.34Å; A372-Y374 VanDerWaalsContact C-N 3.35Å; A372-Y374 PolarHBondContact O-N 3.2Å; A372-T375 WeakPolarHBondContact CA-OG1 3.29Å; A372-T375 PolarHBondContact O-N 3.11Å; A372-T375 PolarHBondContact O-OG1 3.42Å; A372-Q376 PolarHBondContact O-N 2.76Å; A372-L382 HydrophobicContact CB-CD1 4.08Å; A372-L382 HydrophobicContact CB-CD2 3.97Å; A372-L382 WeakPolarHBondContact O-CD1 3.31Å
373	I	93.8	Very high	92.6	Very high	9 Å²	9	32.4 Å²	32.4	5%	0.046	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-39.8	176.1	-67.2	167.9	0	0	0	111.1	I369 T370 I371 T375 Q376 P377 L382 Y383 K386	I369-I373 WeakPolarHBondContact O-CG1 3.41Å; I369-I373 PolarHBondContact O-N 3.23Å; T370-I373 PolarHBondContact O-N 3.32Å; I371-I373 VanDerWaalsContact C-N 3.33Å; I371-I373 PolarHBondContact O-N 3.03Å; I373-T375 VanDerWaalsContact C-N 3.28Å; I373-T375 PolarHBondContact O-N 2.99Å; I373-Q376 CarbonylContact O-C 3.55Å; I373-Q376 VanDerWaalsContact O-C 3.25Å; I373-Q376 PolarHBondContact O-N 3.06Å; I373-P377 VanDerWaalsContact O-CA 3.26Å; I373-P377 WeakPolarHBondContact O-CA 3.37Å; I373-L382 HydrophobicContact CD1-CB 4.4Å; I373-L382 HydrophobicContact CG1-CB 3.61Å; I373-L382 HydrophobicContact CG1-CD1 4.25Å; I373-Y383 HydrophobicContact CD1-CD1 4.4Å; I373-Y383 HydrophobicContact CD1-CE1 4.47Å; I373-Y383 HydrophobicContact CG2-CE1 4.06Å; I373-Y383 HydrophobicContact CG2-CE2 4.34Å; I373-K386 HydrophobicContact CD1-CB 4.02Å; I373-K386 HydrophobicContact CD1-CD 3.42Å; I373-K386 VanDerWaalsContact CD1-CD 3.42Å; I373-K386 HydrophobicContact CD1-CG 4.35Å
374	Y	92.5	Very high	92.6	Very high	55 Å²	55	25.3 Å²	25.3	22%	0.216	13%	0.127	C	C	.	.	H	α-helix	trans	-62.9	-36.9	176.9	-65	-14.7	0	0	0	112.1	G312 Q313 I315 I316 T370 I371 A372	G312-Y374 WeakPolarHBondContact O-CD2 3.47Å; Q313-Y374 HydrophobicContact CG-CE1 4.19Å; Q313-Y374 HydrophobicContact CG-CE2 4.3Å; I315-Y374 CarbonylContact C-O 3.57Å; I315-Y374 WeakPolarHBondContact CG2-O 3.28Å; I316-Y374 HydrophobicContact CD1-CD1 3.72Å; I316-Y374 HydrophobicContact CD1-CE1 4.1Å; I316-Y374 HydrophobicContact CG1-CD1 4Å; I316-Y374 HydrophobicContact CG1-CG 4.43Å; T370-Y374 HydrophobicContact CG2-CD1 4.41Å; T370-Y374 HydrophobicContact CG2-CD2 4.32Å; T370-Y374 HydrophobicContact CG2-CE1 3.79Å; T370-Y374 HydrophobicContact CG2-CE2 3.67Å; T370-Y374 WeakPolarHBondContact CG2-OH 3.47Å; T370-Y374 WeakPolarHBondContact O-CD1 3.29Å; T370-Y374 VanDerWaalsContact O-CG 3.26Å; T370-Y374 PolarHBondContact O-N 3.09Å; I371-Y374 PolarHBondContact O-N 3.29Å; I371-Y374 VanDerWaalsContact O-N 3.14Å; A372-Y374 VanDerWaalsContact C-N 3.35Å; A372-Y374 PolarHBondContact O-N 3.2Å
375	T	91.1	Very high	92.5	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-75.4	-29.6	176.7	49.1	0	0	0	0	113.9	I315 Y319 L342 I345 S346 I371 A372 I373	I315-T375 HydrophobicContact CG2-CG2 4.05Å; Y319-T375 VanDerWaalsContact CD2-O 3.31Å; Y319-T375 WeakPolarHBondContact CD2-O 3.42Å; L342-T375 HydrophobicContact CD2-CG2 4.31Å; I345-T375 HydrophobicContact CG2-CG2 4.04Å; S346-T375 WeakPolarHBondContact CA-OG1 3.43Å; S346-T375 VanDerWaalsContact CB-OG1 3.24Å; S346-T375 WeakPolarHBondContact CB-OG1 3.36Å; I371-T375 PolarHBondContact O-N 3.24Å; I371-T375 PolarHBondContact O-OG1 3.37Å; A372-T375 WeakPolarHBondContact CA-OG1 3.29Å; A372-T375 PolarHBondContact O-N 3.11Å; A372-T375 PolarHBondContact O-OG1 3.42Å; I373-T375 VanDerWaalsContact C-N 3.28Å; I373-T375 PolarHBondContact O-N 2.99Å
376	Q	91.9	Very high	92.5	Very high	34 Å²	34	25.4 Å²	25.4	16%	0.159	13%	0.125	C	C	.	.			trans	-143.5	76.5	-178.8	-161.1	-176.4	15.6	0	0	111.7	Y319 S346 A372 I373 E378 N379 L382	Y319-Q376 HydrophobicContact CE2-CG 3.97Å; S346-Q376 WeakPolarHBondContact OG-CB 3.45Å; S346-Q376 PolarHBondContact OG-OE1 3.3Å; A372-Q376 PolarHBondContact O-N 2.76Å; I373-Q376 CarbonylContact O-C 3.55Å; I373-Q376 VanDerWaalsContact O-C 3.25Å; I373-Q376 PolarHBondContact O-N 3.06Å; Q376-E378 PolarHBondContact O-N 2.65Å; Q376-N379 HydrophobicContact CB-CB 4.24Å; Q376-N379 HydrophobicContact CG-CB 3.76Å; Q376-N379 PolarHBondContact O-N 2.9Å; Q376-N379 VanDerWaalsContact O-N 3.16Å; Q376-N379 PolarHBondContact OE1-ND2 3.08Å; Q376-L382 HydrophobicContact CB-CD1 4.34Å
377	P	91.1	Very high	92.5	Very high	4 Å²	4	24.5 Å²	24.5	3%	0.026	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.1	-173.6	27.6	-37.2	0	0	0	114.3	I316 Y319 Y320 I373 Y383	I316-P377 HydrophobicContact CG2-CB 4.35Å; I316-P377 HydrophobicContact CG2-CG 4.22Å; Y319-P377 HydrophobicContact CD1-CG 3.45Å; Y319-P377 VanDerWaalsContact CD1-CG 3.45Å; Y319-P377 HydrophobicContact CE1-CG 3.83Å; Y319-P377 HydrophobicContact CG-CG 3.98Å; Y320-P377 HydrophobicContact CE2-CB 4.44Å; Y320-P377 HydrophobicContact CE2-CG 3.9Å; I373-P377 VanDerWaalsContact O-CA 3.26Å; I373-P377 WeakPolarHBondContact O-CA 3.37Å; P377-Y383 WeakPolarHBondContact O-CE2 3.4Å; P377-Y383 PolarHBondContact O-OH 3.1Å
378	E	87.3	Confident	92.4	Very high	44 Å²	44	19.2 Å²	19.2	21%	0.206	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.7	176.8	-66.9	176.6	171.6	0	0	113	Y319 Y320 K323 Q376 I380	Y319-E378 HydrophobicContact CE1-CB 4.38Å; Y319-E378 HydrophobicContact CE1-CG 3.96Å; Y319-E378 PolarHBondContact OH-OE2 2.84Å; Y319-E378 VanDerWaalsContact OH-OE2 3.14Å; Y320-E378 HydrophobicContact CE1-CG 4.27Å; K323-E378 WeakPolarHBondContact CE-OE2 3.21Å; K323-E378 IonicContact NZ-OE2 3.71Å; K323-E378 PolarHBondContact NZ-OE2 3.14Å; Q376-E378 PolarHBondContact O-N 2.65Å; E378-I380 PolarHBondContact O-N 3.28Å; E378-I380 VanDerWaalsContact O-N 3.13Å
379	N	87.7	Confident	92.3	Very high	34 Å²	34	19.2 Å²	19.2	18%	0.182	10%	0.097	C	C	.	.			trans	-80.5	100.1	178.6	-176.7	-13.6	0	0	0	110.8	Q376 S381 L382 Y383	Q376-N379 HydrophobicContact CB-CB 4.24Å; Q376-N379 HydrophobicContact CG-CB 3.76Å; Q376-N379 PolarHBondContact O-N 2.9Å; Q376-N379 VanDerWaalsContact O-N 3.16Å; Q376-N379 PolarHBondContact OE1-ND2 3.08Å; N379-S381 PolarHBondContact O-N 2.88Å; N379-S381 WeakPolarHBondContact OD1-CB 3.37Å; N379-S381 PolarHBondContact OD1-N 3.4Å; N379-S381 VanDerWaalsContact OD1-N 3.12Å; N379-S381 PolarHBondContact OD1-OG 2.89Å; N379-L382 HydrophobicContact CB-CD1 3.76Å; N379-L382 HydrophobicContact CB-CG 3.96Å; N379-L382 WeakPolarHBondContact O-CB 3.48Å; N379-L382 PolarHBondContact O-N 3.04Å; N379-Y383 WeakPolarHBondContact O-CD2 3.41Å
380	I	89.2	Confident	92.3	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-56	-37	-177.8	-60.6	169.1	0	0	0	112.3	E378 L382 Y383 F384 L409 F410 W413 L424	E378-I380 PolarHBondContact O-N 3.28Å; E378-I380 VanDerWaalsContact O-N 3.13Å; I380-L382 PolarHBondContact O-N 2.92Å; I380-Y383 PolarHBondContact O-N 3.36Å; I380-Y383 VanDerWaalsContact O-N 3.16Å; I380-F384 HydrophobicContact CG2-CD2 4.07Å; I380-F384 HydrophobicContact CG2-CE1 4.33Å; I380-F384 HydrophobicContact CG2-CE2 3.37Å; I380-F384 HydrophobicContact CG2-CZ 3.5Å; I380-F384 PolarHBondContact O-N 3.28Å; I380-L409 HydrophobicContact CG1-CB 4.07Å; I380-F410 HydrophobicContact CD1-CB 3.82Å; I380-F410 HydrophobicContact CD1-CD2 3.87Å; I380-F410 HydrophobicContact CD1-CG 4.35Å; I380-W413 HydrophobicContact CD1-CD2 3.89Å; I380-W413 HydrophobicContact CD1-CE3 3.79Å; I380-W413 HydrophobicContact CD1-CH2 3.41Å; I380-W413 VanDerWaalsContact CD1-CH2 3.41Å; I380-W413 HydrophobicContact CD1-CZ2 3.48Å; I380-W413 VanDerWaalsContact CD1-CZ2 3.48Å; I380-W413 HydrophobicContact CD1-CZ3 3.56Å; I380-W413 HydrophobicContact CG1-CH2 4.04Å; I380-W413 HydrophobicContact CG1-CZ2 3.89Å; I380-L424 HydrophobicContact CB-CD2 3.91Å; I380-L424 HydrophobicContact CD1-CD2 4.19Å; I380-L424 HydrophobicContact CG2-CD2 4Å; I380-L424 HydrophobicContact CG2-CG 4.14Å
381	S	90.2	Very high	92.2	Very high	30 Å²	30	20.5 Å²	20.5	21%	0.21	10%	0.099	C	C	.	.	H	α-helix	trans	-60.7	-34.7	-177.2	71.4	0	0	0	0	112.6	Q350 N379 Y383 F384 D385	Q350-S381 PolarHBondContact NE2-OG 3.42Å; N379-S381 PolarHBondContact O-N 2.88Å; N379-S381 WeakPolarHBondContact OD1-CB 3.37Å; N379-S381 PolarHBondContact OD1-N 3.4Å; N379-S381 VanDerWaalsContact OD1-N 3.12Å; N379-S381 PolarHBondContact OD1-OG 2.89Å; S381-Y383 VanDerWaalsContact C-N 3.31Å; S381-Y383 PolarHBondContact O-N 2.97Å; S381-F384 PolarHBondContact O-N 3.27Å; S381-D385 PolarHBondContact O-N 3.5Å
382	L	92.9	Very high	92.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.8	-35.2	179.8	-57.5	177.4	0	0	0	112.4	Q350 I369 A372 I373 Q376 N379 I380 D385 K386	Q350-L382 HydrophobicContact CB-CD2 3.73Å; Q350-L382 HydrophobicContact CG-CD2 3.59Å; I369-L382 HydrophobicContact CD1-CB 4.35Å; I369-L382 HydrophobicContact CD1-CD2 3.85Å; A372-L382 HydrophobicContact CB-CD1 4.08Å; A372-L382 HydrophobicContact CB-CD2 3.97Å; A372-L382 WeakPolarHBondContact O-CD1 3.31Å; I373-L382 HydrophobicContact CD1-CB 4.4Å; I373-L382 HydrophobicContact CG1-CB 3.61Å; I373-L382 HydrophobicContact CG1-CD1 4.25Å; Q376-L382 HydrophobicContact CB-CD1 4.34Å; N379-L382 HydrophobicContact CB-CD1 3.76Å; N379-L382 HydrophobicContact CB-CG 3.96Å; N379-L382 WeakPolarHBondContact O-CB 3.48Å; N379-L382 PolarHBondContact O-N 3.04Å; I380-L382 PolarHBondContact O-N 2.92Å; L382-D385 PolarHBondContact O-N 3.01Å; L382-K386 VanDerWaalsContact O-CB 3.31Å; L382-K386 WeakPolarHBondContact O-CB 3.47Å; L382-K386 PolarHBondContact O-N 3.36Å
383	Y	93.8	Very high	92	Very high	23 Å²	23	25.6 Å²	25.6	9%	0.09	12%	0.122	C	C	.	.	H	α-helix	trans	-69	-38	177.3	-70.3	-86.9	0	0	0	112	I373 P377 N379 I380 S381 G387 H405 L409	I373-Y383 HydrophobicContact CD1-CD1 4.4Å; I373-Y383 HydrophobicContact CD1-CE1 4.47Å; I373-Y383 HydrophobicContact CG2-CE1 4.06Å; I373-Y383 HydrophobicContact CG2-CE2 4.34Å; P377-Y383 WeakPolarHBondContact O-CE2 3.4Å; P377-Y383 PolarHBondContact O-OH 3.1Å; N379-Y383 WeakPolarHBondContact O-CD2 3.41Å; I380-Y383 PolarHBondContact O-N 3.36Å; I380-Y383 VanDerWaalsContact O-N 3.16Å; S381-Y383 VanDerWaalsContact C-N 3.31Å; S381-Y383 PolarHBondContact O-N 2.97Å; Y383-G387 PolarHBondContact O-N 3Å; Y383-H405 HydrophobicContact CD1-CB 4.36Å; Y383-H405 AromaticContact CD1-CD2 3.68Å; Y383-H405 AromaticContact CE1-CD2 3.16Å; Y383-H405 WeakPolarHBondContact CE1-CD2 3.47Å; Y383-H405 AromaticContact CE1-NE2 3.83Å; Y383-H405 AromaticContact CZ-CD2 3.44Å; Y383-H405 VanDerWaalsContact CZ-CD2 3.44Å; Y383-H405 AromaticContact CZ-NE2 3.78Å; Y383-L409 HydrophobicContact CD2-CD1 4.09Å; Y383-L409 HydrophobicContact CE2-CD1 3.62Å
384	F	92.9	Very high	91.8	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-69.1	-40.6	175.5	-60.5	-29	0	0	0	112	I380 S381 G387 A388 I403 I407 L424 L427 Q431	I380-F384 HydrophobicContact CG2-CD2 4.07Å; I380-F384 HydrophobicContact CG2-CE1 4.33Å; I380-F384 HydrophobicContact CG2-CE2 3.37Å; I380-F384 HydrophobicContact CG2-CZ 3.5Å; I380-F384 PolarHBondContact O-N 3.28Å; S381-F384 PolarHBondContact O-N 3.27Å; F384-G387 PolarHBondContact O-N 3.21Å; F384-A388 PolarHBondContact O-N 3.48Å; F384-I403 HydrophobicContact CD1-CG2 4.18Å; F384-I403 HydrophobicContact CE1-CG2 4.14Å; F384-I407 HydrophobicContact CE1-CG1 4.11Å; F384-I407 HydrophobicContact CZ-CG1 4.22Å; F384-L424 HydrophobicContact CD2-CD1 4.11Å; F384-L424 HydrophobicContact CE2-CD1 4.06Å; F384-L424 HydrophobicContact CE2-CG 4.17Å; F384-L424 WeakPolarHBondContact CE2-O 3.33Å; F384-L427 HydrophobicContact CB-CD2 3.65Å; F384-L427 HydrophobicContact CD2-CD2 3.58Å; F384-L427 HydrophobicContact CE2-CD2 4.5Å; F384-L427 HydrophobicContact CG-CD2 3.9Å; F384-Q431 HydrophobicContact CB-CG 4.5Å
385	D	92.3	Very high	91.9	Very high	38 Å²	38	31.1 Å²	31.1	20%	0.203	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-45.2	173.7	-72.6	-21.2	0	0	0	111.1	Q350 I369 S381 L382 G387 A388 I389	Q350-D385 PolarHBondContact NE2-OD2 3.13Å; I369-D385 HydrophobicContact CD1-CB 3.97Å; I369-D385 HydrophobicContact CG1-CB 4.34Å; S381-D385 PolarHBondContact O-N 3.5Å; L382-D385 PolarHBondContact O-N 3.01Å; D385-G387 VanDerWaalsContact C-N 3.35Å; D385-G387 PolarHBondContact O-N 3.17Å; D385-A388 WeakPolarHBondContact O-CB 3.09Å; D385-A388 PolarHBondContact O-N 3.45Å; D385-I389 WeakPolarHBondContact O-CD1 3.48Å; D385-I389 WeakPolarHBondContact O-CG1 3.23Å; D385-I389 PolarHBondContact O-N 3.36Å
386	K	94.8	Very high	91.9	Very high	42 Å²	42	31.1 Å²	31.1	18%	0.183	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-43.4	174.2	179.8	170.9	174.7	179.4	0	112	L366 I369 I373 L382 A388 I389 L390	L366-K386 HydrophobicContact CD1-CD 4.46Å; L366-K386 HydrophobicContact CD1-CG 4Å; I369-K386 HydrophobicContact CG1-CB 4.08Å; I369-K386 HydrophobicContact CG2-CB 3.97Å; I369-K386 HydrophobicContact CG2-CD 4.46Å; I369-K386 HydrophobicContact CG2-CG 4.11Å; I373-K386 HydrophobicContact CD1-CB 4.02Å; I373-K386 HydrophobicContact CD1-CD 3.42Å; I373-K386 VanDerWaalsContact CD1-CD 3.42Å; I373-K386 HydrophobicContact CD1-CG 4.35Å; L382-K386 VanDerWaalsContact O-CB 3.31Å; L382-K386 WeakPolarHBondContact O-CB 3.47Å; L382-K386 PolarHBondContact O-N 3.36Å; K386-A388 PolarHBondContact O-N 3.4Å; K386-I389 PolarHBondContact O-N 2.89Å; K386-L390 HydrophobicContact CG-CD1 3.88Å; K386-L390 HydrophobicContact CG-CG 4.33Å; K386-L390 WeakPolarHBondContact O-CB 3.42Å; K386-L390 WeakPolarHBondContact O-CG 3.15Å; K386-L390 PolarHBondContact O-N 3.5Å
387	G	94.1	Very high	92	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-46.5	173.5	0	0	0	0	0	111.9	Y383 F384 D385 I389 L390 R391 S399	Y383-G387 PolarHBondContact O-N 3Å; F384-G387 PolarHBondContact O-N 3.21Å; D385-G387 VanDerWaalsContact C-N 3.35Å; D385-G387 PolarHBondContact O-N 3.17Å; G387-I389 VanDerWaalsContact C-N 3.33Å; G387-I389 PolarHBondContact O-N 2.78Å; G387-L390 PolarHBondContact O-N 2.99Å; G387-R391 WeakPolarHBondContact O-CB 3.25Å; G387-R391 PolarHBondContact O-N 2.9Å; G387-S399 PolarHBondContact O-OG 2.86Å
388	A	92.3	Very high	92.1	Very high	11 Å²	11	36.6 Å²	36.6	9%	0.091	18%	0.178	C	C	.	.	H	α-helix	trans	-59.8	-41.2	176.9	0	0	0	0	0	112.7	F384 D385 K386 K392	F384-A388 PolarHBondContact O-N 3.48Å; D385-A388 WeakPolarHBondContact O-CB 3.09Å; D385-A388 PolarHBondContact O-N 3.45Å; K386-A388 PolarHBondContact O-N 3.4Å; A388-K392 WeakPolarHBondContact O-CG 3.27Å; A388-K392 PolarHBondContact O-N 2.99Å
389	I	93.6	Very high	92.4	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-47	176.1	-65	158	0	0	0	111	M357 S365 L366 I369 D385 K386 G387 R391 K392 L393	M357-I389 HydrophobicContact CG-CG1 4.29Å; M357-I389 HydrophobicContact SD-CG1 3.93Å; S365-I389 WeakPolarHBondContact OG-CD1 3.36Å; L366-I389 HydrophobicContact CB-CG2 4.05Å; L366-I389 HydrophobicContact CD1-CG2 4.46Å; I369-I389 HydrophobicContact CB-CD1 4.11Å; I369-I389 HydrophobicContact CG1-CD1 4.46Å; I369-I389 HydrophobicContact CG2-CD1 3.9Å; D385-I389 WeakPolarHBondContact O-CD1 3.48Å; D385-I389 WeakPolarHBondContact O-CG1 3.23Å; D385-I389 PolarHBondContact O-N 3.36Å; K386-I389 PolarHBondContact O-N 2.89Å; G387-I389 VanDerWaalsContact C-N 3.33Å; G387-I389 PolarHBondContact O-N 2.78Å; I389-R391 VanDerWaalsContact C-N 3.31Å; I389-R391 PolarHBondContact O-N 3.19Å; I389-K392 WeakPolarHBondContact O-CB 3.41Å; I389-K392 PolarHBondContact O-N 3.44Å; I389-K392 VanDerWaalsContact O-N 3.08Å; I389-L393 HydrophobicContact CG2-CD1 4.37Å; I389-L393 PolarHBondContact O-N 3.31Å; I389-L393 VanDerWaalsContact O-N 3.11Å
390	L	95	Very high	92.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.3	-37.8	178.8	-74.9	169.8	0	0	0	112.4	L366 K386 G387 K392 L393 D394 R395 E398	L366-L390 HydrophobicContact CD1-CD2 3.83Å; L366-L390 HydrophobicContact CD1-CG 3.99Å; L366-L390 HydrophobicContact CD2-CD2 3.91Å; K386-L390 HydrophobicContact CG-CD1 3.88Å; K386-L390 HydrophobicContact CG-CG 4.33Å; K386-L390 WeakPolarHBondContact O-CB 3.42Å; K386-L390 WeakPolarHBondContact O-CG 3.15Å; K386-L390 PolarHBondContact O-N 3.5Å; G387-L390 PolarHBondContact O-N 2.99Å; L390-K392 VanDerWaalsContact C-N 3.29Å; L390-K392 PolarHBondContact O-N 2.86Å; L390-L393 CarbonylContact O-C 3.49Å; L390-L393 WeakPolarHBondContact O-CA 3.42Å; L390-L393 WeakPolarHBondContact O-CB 3.44Å; L390-L393 PolarHBondContact O-N 2.88Å; L390-L393 VanDerWaalsContact O-N 3.11Å; L390-D394 PolarHBondContact O-N 2.87Å; L390-R395 HydrophobicContact CB-CB 4.48Å; L390-R395 HydrophobicContact CD2-CB 4.02Å; L390-R395 PolarHBondContact O-N 3.5Å; L390-E398 HydrophobicContact CD1-CB 3.98Å
391	R	93.6	Very high	93	Very high	50 Å²	50	39.8 Å²	39.8	19%	0.189	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-37.6	173.4	-178.7	172.8	59.7	83.1	-1.6	112.2	G387 I389 L393 D394 L396	G387-R391 WeakPolarHBondContact O-CB 3.25Å; G387-R391 PolarHBondContact O-N 2.9Å; I389-R391 VanDerWaalsContact C-N 3.31Å; I389-R391 PolarHBondContact O-N 3.19Å; R391-L393 VanDerWaalsContact C-N 3.31Å; R391-D394 PolarHBondContact O-N 2.88Å; R391-L396 HydrophobicContact CB-CD2 4.37Å; R391-L396 HydrophobicContact CG-CD2 3.95Å
392	K	90.3	Very high	93.1	Very high	120 Å²	120	39.1 Å²	39.1	52%	0.522	19%	0.192	S	C	.	.	H	α-helix	trans	-69.6	-28.2	174.6	-68.3	-67.9	-175.7	173.8	0	112.8	F362 A388 I389 L390 D394	F362-K392 HydrophobicContact CD1-CB 3.82Å; F362-K392 HydrophobicContact CE1-CB 3.6Å; F362-K392 HydrophobicContact CE1-CG 3.93Å; F362-K392 HydrophobicContact CG-CB 4.43Å; F362-K392 HydrophobicContact CZ-CB 4.03Å; F362-K392 HydrophobicContact CZ-CG 4.4Å; A388-K392 WeakPolarHBondContact O-CG 3.27Å; A388-K392 PolarHBondContact O-N 2.99Å; I389-K392 WeakPolarHBondContact O-CB 3.41Å; I389-K392 PolarHBondContact O-N 3.44Å; I389-K392 VanDerWaalsContact O-N 3.08Å; L390-K392 VanDerWaalsContact C-N 3.29Å; L390-K392 PolarHBondContact O-N 2.86Å; K392-D394 VanDerWaalsContact C-N 3.27Å; K392-D394 PolarHBondContact O-N 3.36Å
393	L	91.9	Very high	93.1	Very high	34 Å²	34	39.1 Å²	39.1	18%	0.178	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	3.9	172	-71.5	170.9	0	0	0	114.1	F362 F363 L366 I389 L390 R391 R395	F362-L393 HydrophobicContact CB-CD1 4.17Å; F362-L393 HydrophobicContact CB-CD2 3.46Å; F362-L393 VanDerWaalsContact CB-CD2 3.46Å; F362-L393 HydrophobicContact CB-CG 3.71Å; F362-L393 HydrophobicContact CG-CD2 4.31Å; F362-L393 HydrophobicContact CG-CG 4.49Å; F363-L393 HydrophobicContact CD1-CD2 4.49Å; F363-L393 HydrophobicContact CD2-CD2 4.39Å; F363-L393 HydrophobicContact CE1-CD2 4.2Å; F363-L393 HydrophobicContact CE2-CD2 4.08Å; F363-L393 HydrophobicContact CZ-CD2 3.98Å; L366-L393 HydrophobicContact CB-CD1 4.43Å; L366-L393 HydrophobicContact CD2-CD1 3.96Å; I389-L393 HydrophobicContact CG2-CD1 4.37Å; I389-L393 PolarHBondContact O-N 3.31Å; I389-L393 VanDerWaalsContact O-N 3.11Å; L390-L393 CarbonylContact O-C 3.49Å; L390-L393 WeakPolarHBondContact O-CA 3.42Å; L390-L393 WeakPolarHBondContact O-CB 3.44Å; L390-L393 PolarHBondContact O-N 2.88Å; L390-L393 VanDerWaalsContact O-N 3.11Å; R391-L393 VanDerWaalsContact C-N 3.31Å; L393-R395 HydrophobicContact CB-CG 4.36Å; L393-R395 PolarHBondContact O-N 2.72Å; L393-R395 VanDerWaalsContact O-N 3.14Å
394	D	90	Very high	92.9	Very high	85 Å²	85	41.6 Å²	41.6	46%	0.455	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	18.5	-174.1	-165.4	40.4	0	0	0	115	L390 R391 K392 L396 K442	L390-D394 PolarHBondContact O-N 2.87Å; R391-D394 PolarHBondContact O-N 2.88Å; K392-D394 VanDerWaalsContact C-N 3.27Å; K392-D394 PolarHBondContact O-N 3.36Å; D394-L396 VanDerWaalsContact C-N 3.29Å; D394-L396 PolarHBondContact O-N 3.32Å; D394-L396 VanDerWaalsContact O-N 3.16Å; D394-K442 PolarHBondContact O-NZ 3Å; D394-K442 IonicContact OD1-NZ 2.68Å; D394-K442 PolarHBondContact OD1-NZ 3.25Å; D394-K442 IonicContact OD2-NZ 3.64Å; D394-K442 PolarHBondContact OD2-NZ 3.44Å
395	R	93.1	Very high	92.8	Very high	95 Å²	95	45.7 Å²	45.7	36%	0.358	22%	0.224	S	C	.	.			trans	-88.2	64.7	173	-68.1	173.5	71.6	177.5	7.7	110.2	L390 L393 E398 S399	L390-R395 HydrophobicContact CB-CB 4.48Å; L390-R395 HydrophobicContact CD2-CB 4.02Å; L390-R395 PolarHBondContact O-N 3.5Å; L393-R395 HydrophobicContact CB-CG 4.36Å; L393-R395 PolarHBondContact O-N 2.72Å; L393-R395 VanDerWaalsContact O-N 3.14Å; R395-E398 IonicContact CZ-OE1 3.82Å; R395-E398 IonicContact CZ-OE2 3.3Å; R395-E398 VanDerWaalsContact NE-CD 3.32Å; R395-E398 IonicContact NE-OE1 3.59Å; R395-E398 PolarHBondContact NE-OE1 3.2Å; R395-E398 IonicContact NE-OE2 2.58Å; R395-E398 PolarHBondContact NE-OE2 3.23Å; R395-E398 IonicContact NH2-OE1 3.72Å; R395-E398 PolarHBondContact NH2-OE1 3.38Å; R395-E398 IonicContact NH2-OE2 2.73Å; R395-E398 PolarHBondContact NH2-OE2 3.16Å; R395-S399 WeakPolarHBondContact O-CB 3.49Å; R395-S399 PolarHBondContact O-N 2.99Å
396	L	92.7	Very high	92.7	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-69.5	-36.1	-166.6	-60.2	179.5	0	0	0	114.5	R391 D394 S399 L400 T435 Y439 K442	R391-L396 HydrophobicContact CB-CD2 4.37Å; R391-L396 HydrophobicContact CG-CD2 3.95Å; D394-L396 VanDerWaalsContact C-N 3.29Å; D394-L396 PolarHBondContact O-N 3.32Å; D394-L396 VanDerWaalsContact O-N 3.16Å; L396-S399 WeakPolarHBondContact O-CB 3.44Å; L396-S399 PolarHBondContact O-N 3.42Å; L396-L400 WeakPolarHBondContact O-CG 3.4Å; L396-L400 PolarHBondContact O-N 3.34Å; L396-T435 HydrophobicContact CD2-CG2 4.48Å; L396-Y439 HydrophobicContact CB-CD2 3.88Å; L396-Y439 HydrophobicContact CD1-CD2 3.97Å; L396-Y439 HydrophobicContact CD1-CG 4.5Å; L396-K442 HydrophobicContact CD1-CB 4Å; L396-K442 HydrophobicContact CD1-CD 3.65Å; L396-K442 HydrophobicContact CG-CD 4.48Å
397	T	92.4	Very high	92.3	Very high	83 Å²	83	42.5 Å²	42.5	51%	0.509	21%	0.209	S	C	.	.	H	α-helix	trans	-62.1	-51	177.7	48.3	0	0	0	0	110.7	S399 L400 D401 Y439	T397-S399 VanDerWaalsContact C-N 3.26Å; T397-S399 PolarHBondContact O-N 3.4Å; T397-L400 WeakPolarHBondContact O-CB 3.49Å; T397-L400 PolarHBondContact O-N 2.74Å; T397-L400 VanDerWaalsContact O-N 3.08Å; T397-D401 PolarHBondContact O-N 2.67Å; T397-Y439 HydrophobicContact CG2-CE2 4.49Å
398	E	94.1	Very high	92	Very high	69 Å²	69	46.6 Å²	46.6	32%	0.322	23%	0.231	S	C	.	.	H	α-helix	trans	-63	-34	176.6	-60.9	178.6	-135.2	0	0	112.5	L390 R395 D401 C402	L390-E398 HydrophobicContact CD1-CB 3.98Å; R395-E398 IonicContact CZ-OE1 3.82Å; R395-E398 IonicContact CZ-OE2 3.3Å; R395-E398 VanDerWaalsContact NE-CD 3.32Å; R395-E398 IonicContact NE-OE1 3.59Å; R395-E398 PolarHBondContact NE-OE1 3.2Å; R395-E398 IonicContact NE-OE2 2.58Å; R395-E398 PolarHBondContact NE-OE2 3.23Å; R395-E398 IonicContact NH2-OE1 3.72Å; R395-E398 PolarHBondContact NH2-OE1 3.38Å; R395-E398 IonicContact NH2-OE2 2.73Å; R395-E398 PolarHBondContact NH2-OE2 3.16Å; E398-D401 PolarHBondContact O-N 2.98Å; E398-C402 WeakPolarHBondContact O-CB 3.46Å; E398-C402 PolarHBondContact O-N 3.25Å; E398-C402 PolarHBondContact O-SG 3Å
399	S	94.6	Very high	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-44.4	173.3	-179.6	0	0	0	0	111.5	G387 R395 L396 T397 C402 I403 T435	G387-S399 PolarHBondContact O-OG 2.86Å; R395-S399 WeakPolarHBondContact O-CB 3.49Å; R395-S399 PolarHBondContact O-N 2.99Å; L396-S399 WeakPolarHBondContact O-CB 3.44Å; L396-S399 PolarHBondContact O-N 3.42Å; T397-S399 VanDerWaalsContact C-N 3.26Å; T397-S399 PolarHBondContact O-N 3.4Å; S399-C402 PolarHBondContact O-N 3.12Å; S399-I403 WeakPolarHBondContact O-CD1 3.35Å; S399-I403 VanDerWaalsContact O-CG1 3.22Å; S399-I403 WeakPolarHBondContact O-CG1 3.47Å; S399-I403 PolarHBondContact O-N 3.29Å; S399-T435 WeakPolarHBondContact OG-CG2 3.14Å
400	L	93.7	Very high	91.1	Very high	35 Å²	35	48.6 Å²	48.6	18%	0.183	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-46.1	177.1	-70.7	170.3	0	0	0	110.6	L396 T397 C402 I403 M404 L432 T435 I436	L396-L400 WeakPolarHBondContact O-CG 3.4Å; L396-L400 PolarHBondContact O-N 3.34Å; T397-L400 WeakPolarHBondContact O-CB 3.49Å; T397-L400 PolarHBondContact O-N 2.74Å; T397-L400 VanDerWaalsContact O-N 3.08Å; L400-C402 VanDerWaalsContact C-N 3.34Å; L400-C402 PolarHBondContact O-N 2.93Å; L400-I403 PolarHBondContact O-N 3.24Å; L400-M404 WeakPolarHBondContact O-CB 3.47Å; L400-M404 WeakPolarHBondContact O-CG 3.33Å; L400-M404 PolarHBondContact O-N 2.9Å; L400-L432 HydrophobicContact CD2-CD1 3.71Å; L400-T435 HydrophobicContact CD2-CG2 3.59Å; L400-T435 HydrophobicContact CG-CG2 3.75Å; L400-I436 HydrophobicContact CD2-CG1 3.81Å
401	D	93.8	Very high	90.4	Very high	111 Å²	111	53.3 Å²	53.3	59%	0.594	26%	0.264	S	S	*	.	H	α-helix	trans	-60	-43.7	178.6	-64.1	-27.4	0	0	0	111.6	T397 E398 M404 H405	T397-D401 PolarHBondContact O-N 2.67Å; E398-D401 PolarHBondContact O-N 2.98Å; D401-M404 PolarHBondContact O-N 3.14Å; D401-H405 VanDerWaalsContact O-CB 3.3Å; D401-H405 WeakPolarHBondContact O-CB 3.41Å; D401-H405 PolarHBondContact O-N 3.29Å
402	C	92.6	Very high	89.8	Confident	17 Å²	17	55.6 Å²	55.6	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-45.4	176.6	-69.7	0	0	0	0	111.9	E398 S399 L400 H405 G406	E398-C402 WeakPolarHBondContact O-CB 3.46Å; E398-C402 PolarHBondContact O-N 3.25Å; E398-C402 PolarHBondContact O-SG 3Å; S399-C402 PolarHBondContact O-N 3.12Å; L400-C402 VanDerWaalsContact C-N 3.34Å; L400-C402 PolarHBondContact O-N 2.93Å; C402-H405 PolarHBondContact O-N 3.13Å; C402-G406 PolarHBondContact O-N 3.41Å; C402-G406 VanDerWaalsContact O-N 3.07Å
403	I	92.7	Very high	88.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.8	-43.4	-179.7	-66.2	163.1	0	0	0	110.7	F384 S399 L400 H405 G406 I407 Q431 L432 T435	F384-I403 HydrophobicContact CD1-CG2 4.18Å; F384-I403 HydrophobicContact CE1-CG2 4.14Å; S399-I403 WeakPolarHBondContact O-CD1 3.35Å; S399-I403 VanDerWaalsContact O-CG1 3.22Å; S399-I403 WeakPolarHBondContact O-CG1 3.47Å; S399-I403 PolarHBondContact O-N 3.29Å; L400-I403 PolarHBondContact O-N 3.24Å; I403-H405 VanDerWaalsContact C-N 3.3Å; I403-H405 PolarHBondContact O-N 3.45Å; I403-G406 PolarHBondContact O-N 3.07Å; I403-I407 HydrophobicContact CG2-CD1 4.02Å; I403-I407 WeakPolarHBondContact O-CG1 3.39Å; I403-I407 PolarHBondContact O-N 3.46Å; I403-Q431 HydrophobicContact CD1-CB 4Å; I403-Q431 HydrophobicContact CG1-CB 4.44Å; I403-L432 HydrophobicContact CG2-CB 3.91Å; I403-L432 HydrophobicContact CG2-CD1 4.28Å; I403-T435 HydrophobicContact CD1-CG2 4.45Å; I403-T435 VanDerWaalsContact CD1-OG1 3.23Å; I403-T435 WeakPolarHBondContact CD1-OG1 3.29Å
404	M	91.4	Very high	87.2	Confident	75 Å²	75	60.8 Å²	60.8	37%	0.369	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-37.5	176.5	-73.7	-54.4	-56.4	0	0	111.8	L400 D401 I407 N408 L432	L400-M404 WeakPolarHBondContact O-CB 3.47Å; L400-M404 WeakPolarHBondContact O-CG 3.33Å; L400-M404 PolarHBondContact O-N 2.9Å; D401-M404 PolarHBondContact O-N 3.14Å; M404-I407 PolarHBondContact O-N 2.68Å; M404-I407 HydrophobicContact SD-CD1 4.23Å; M404-N408 WeakPolarHBondContact O-CB 3.33Å; M404-N408 PolarHBondContact O-N 3.07Å; M404-N408 PolarHBondContact O-ND2 2.71Å; M404-L432 HydrophobicContact SD-CD1 4.29Å; M404-L432 HydrophobicContact SD-CD2 4.14Å
405	H	90.8	Very high	85.5	Confident	87 Å²	87	59.4 Å²	59.4	40%	0.403	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-44.3	173	-168.1	82.2	0	0	0	111.7	Y383 D401 C402 I403 I407 N408 L409	Y383-H405 HydrophobicContact CD1-CB 4.36Å; Y383-H405 AromaticContact CD1-CD2 3.68Å; Y383-H405 AromaticContact CE1-CD2 3.16Å; Y383-H405 WeakPolarHBondContact CE1-CD2 3.47Å; Y383-H405 AromaticContact CE1-NE2 3.83Å; Y383-H405 AromaticContact CZ-CD2 3.44Å; Y383-H405 VanDerWaalsContact CZ-CD2 3.44Å; Y383-H405 AromaticContact CZ-NE2 3.78Å; D401-H405 VanDerWaalsContact O-CB 3.3Å; D401-H405 WeakPolarHBondContact O-CB 3.41Å; D401-H405 PolarHBondContact O-N 3.29Å; C402-H405 PolarHBondContact O-N 3.13Å; I403-H405 VanDerWaalsContact C-N 3.3Å; I403-H405 PolarHBondContact O-N 3.45Å; H405-I407 PolarHBondContact O-N 3.1Å; H405-N408 PolarHBondContact O-N 2.95Å; H405-L409 WeakPolarHBondContact O-CG 3.31Å; H405-L409 PolarHBondContact O-N 3.34Å
406	G	88.8	Confident	83.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-40.7	174.2	0	0	0	0	0	113.4	C402 I403 L409 F410	C402-G406 PolarHBondContact O-N 3.41Å; C402-G406 VanDerWaalsContact O-N 3.07Å; I403-G406 PolarHBondContact O-N 3.07Å; G406-L409 PolarHBondContact O-N 3.44Å; G406-F410 PolarHBondContact O-N 3.39Å
407	I	86.7	Confident	81.8	Confident	13 Å²	13	66.2 Å²	66.2	7%	0.067	35%	0.351	C	S	.	.	H	α-helix	trans	-67.8	-39.2	176.3	-66.8	168.3	0	0	0	111.3	F384 I403 M404 H405 F410 N411 Y425 L432	F384-I407 HydrophobicContact CE1-CG1 4.11Å; F384-I407 HydrophobicContact CZ-CG1 4.22Å; I403-I407 HydrophobicContact CG2-CD1 4.02Å; I403-I407 WeakPolarHBondContact O-CG1 3.39Å; I403-I407 PolarHBondContact O-N 3.46Å; M404-I407 PolarHBondContact O-N 2.68Å; M404-I407 HydrophobicContact SD-CD1 4.23Å; H405-I407 PolarHBondContact O-N 3.1Å; I407-F410 WeakPolarHBondContact O-CB 3.48Å; I407-F410 PolarHBondContact O-N 3.25Å; I407-N411 VanDerWaalsContact O-CG 3.31Å; I407-N411 PolarHBondContact O-N 3.38Å; I407-N411 PolarHBondContact O-ND2 3.06Å; I407-Y425 HydrophobicContact CG2-CE2 4.26Å; I407-L432 HydrophobicContact CD1-CD2 4.08Å
408	N	87.3	Confident	80.1	Confident	86 Å²	86	70.6 Å²	70.6	46%	0.46	36%	0.363	S	S	.	.	H	α-helix	trans	-65.6	-42.8	177.1	-71	-17.6	0	0	0	111.2	M404 H405 F410 N411 T412	M404-N408 WeakPolarHBondContact O-CB 3.33Å; M404-N408 PolarHBondContact O-N 3.07Å; M404-N408 PolarHBondContact O-ND2 2.71Å; H405-N408 PolarHBondContact O-N 2.95Å; N408-F410 VanDerWaalsContact C-N 3.3Å; N408-F410 PolarHBondContact O-N 2.95Å; N408-N411 PolarHBondContact O-N 2.86Å; N408-N411 VanDerWaalsContact O-N 3.14Å; N408-T412 WeakPolarHBondContact O-CG2 3.48Å; N408-T412 PolarHBondContact O-N 3.16Å; N408-T412 VanDerWaalsContact O-N 3.11Å
409	L	85.2	Confident	78.3	Confident	26 Å²	26	75.8 Å²	75.8	14%	0.136	38%	0.384	C	S	.	.	H	α-helix	trans	-57.7	-43.6	173.1	-74.1	173.1	0	0	0	111.3	I380 Y383 H405 G406 N411 T412 W413	I380-L409 HydrophobicContact CG1-CB 4.07Å; Y383-L409 HydrophobicContact CD2-CD1 4.09Å; Y383-L409 HydrophobicContact CE2-CD1 3.62Å; H405-L409 WeakPolarHBondContact O-CG 3.31Å; H405-L409 PolarHBondContact O-N 3.34Å; G406-L409 PolarHBondContact O-N 3.44Å; L409-N411 VanDerWaalsContact C-N 3.34Å; L409-N411 PolarHBondContact O-N 3.01Å; L409-T412 PolarHBondContact O-N 3.3Å; L409-T412 VanDerWaalsContact O-N 3.13Å; L409-T412 PolarHBondContact O-OG1 3.37Å; L409-W413 PolarHBondContact O-N 3.49Å
410	F	82.7	Confident	76.6	Confident	30 Å²	30	80.6 Å²	80.6	13%	0.132	41%	0.41	C	S	.	.	H	α-helix	trans	-56.4	-46.3	174	-172.6	-92.7	0	0	0	112.3	I380 G406 I407 N408 T412 W413 S421 Y425	I380-F410 HydrophobicContact CD1-CB 3.82Å; I380-F410 HydrophobicContact CD1-CD2 3.87Å; I380-F410 HydrophobicContact CD1-CG 4.35Å; G406-F410 PolarHBondContact O-N 3.39Å; I407-F410 WeakPolarHBondContact O-CB 3.48Å; I407-F410 PolarHBondContact O-N 3.25Å; N408-F410 VanDerWaalsContact C-N 3.3Å; N408-F410 PolarHBondContact O-N 2.95Å; F410-T412 PolarHBondContact O-N 3.27Å; F410-W413 WeakPolarHBondContact O-CB 3.48Å; F410-W413 PolarHBondContact O-N 2.98Å; F410-W413 VanDerWaalsContact O-N 3.1Å; F410-S421 WeakPolarHBondContact CE2-O 3.45Å; F410-S421 VanDerWaalsContact CZ-O 3.23Å; F410-S421 WeakPolarHBondContact CZ-O 3.49Å; F410-Y425 AromaticContact CD1-CD2 3.4Å; F410-Y425 HydrophobicContact CD1-CD2 3.4Å; F410-Y425 VanDerWaalsContact CD1-CD2 3.4Å; F410-Y425 HydrophobicContact CD1-CE2 4.03Å; F410-Y425 HydrophobicContact CD1-CG 4.22Å; F410-Y425 AromaticContact CE1-CD2 3.51Å; F410-Y425 HydrophobicContact CE1-CD2 3.51Å; F410-Y425 HydrophobicContact CE1-CE2 4.28Å; F410-Y425 AromaticContact CE1-CG 3.89Å; F410-Y425 HydrophobicContact CE1-CG 3.89Å; F410-Y425 HydrophobicContact CG-CD2 4.03Å; F410-Y425 HydrophobicContact CZ-CD2 4.22Å; F410-Y425 HydrophobicContact CZ-CG 4.24Å
411	N	80.6	Confident	75.4	Confident	99 Å²	99	79.7 Å²	79.7	53%	0.529	41%	0.407	S	S	.	.	H	α-helix	trans	-67.3	-22.1	-179.9	-65	-25.8	0	0	0	113.3	I407 N408 L409 W413	I407-N411 VanDerWaalsContact O-CG 3.31Å; I407-N411 PolarHBondContact O-N 3.38Å; I407-N411 PolarHBondContact O-ND2 3.06Å; N408-N411 PolarHBondContact O-N 2.86Å; N408-N411 VanDerWaalsContact O-N 3.14Å; L409-N411 VanDerWaalsContact C-N 3.34Å; L409-N411 PolarHBondContact O-N 3.01Å; N411-W413 VanDerWaalsContact C-N 3.34Å
412	T	80	Confident	74.5	Confident	98 Å²	98	76.9 Å²	76.9	60%	0.601	40%	0.399	S	S	*	.	H	α-helix	trans	-81.6	-13	174.3	61.8	0	0	0	0	113.7	N408 L409 F410 N414	N408-T412 WeakPolarHBondContact O-CG2 3.48Å; N408-T412 PolarHBondContact O-N 3.16Å; N408-T412 VanDerWaalsContact O-N 3.11Å; L409-T412 PolarHBondContact O-N 3.3Å; L409-T412 VanDerWaalsContact O-N 3.13Å; L409-T412 PolarHBondContact O-OG1 3.37Å; F410-T412 PolarHBondContact O-N 3.27Å; T412-N414 PolarHBondContact O-N 3.08Å
413	W	71.7	Confident	74	Confident	98 Å²	98	81.9 Å²	81.9	37%	0.371	43%	0.425	S	S	.	.			trans	-73.4	121	172.5	-69.2	-0.2	0	0	0	109.4	I380 L409 F410 N411 D415	I380-W413 HydrophobicContact CD1-CD2 3.89Å; I380-W413 HydrophobicContact CD1-CE3 3.79Å; I380-W413 HydrophobicContact CD1-CH2 3.41Å; I380-W413 VanDerWaalsContact CD1-CH2 3.41Å; I380-W413 HydrophobicContact CD1-CZ2 3.48Å; I380-W413 VanDerWaalsContact CD1-CZ2 3.48Å; I380-W413 HydrophobicContact CD1-CZ3 3.56Å; I380-W413 HydrophobicContact CG1-CH2 4.04Å; I380-W413 HydrophobicContact CG1-CZ2 3.89Å; L409-W413 PolarHBondContact O-N 3.49Å; F410-W413 WeakPolarHBondContact O-CB 3.48Å; F410-W413 PolarHBondContact O-N 2.98Å; F410-W413 VanDerWaalsContact O-N 3.1Å; N411-W413 VanDerWaalsContact C-N 3.34Å; W413-D415 WeakPolarHBondContact CB-OD1 3.23Å; W413-D415 PolarHBondContact O-N 3.14Å
414	N	55.9	Low	73.5	Confident	166 Å²	166	83.7 Å²	83.7	89%	0.888	43%	0.434	S	S	*	.			trans	-75.2	44	176.8	-76.6	-21.2	0	0	0	112.1	T412 T416	T412-N414 PolarHBondContact O-N 3.08Å; N414-T416 PolarHBondContact O-N 2.95Å
415	D	54.9	Low	73.1	Confident	56 Å²	56	84.1 Å²	84.1	30%	0.299	43%	0.432	S	S	.	.			trans	-53.1	116.5	-150.4	-94.1	-18	0	0	0	117	W413 S421	W413-D415 WeakPolarHBondContact CB-OD1 3.23Å; W413-D415 PolarHBondContact O-N 3.14Å; D415-S421 WeakPolarHBondContact OD2-CB 3.35Å
416	T	54.7	Low	72.8	Confident	126 Å²	126	83.9 Å²	83.9	77%	0.773	43%	0.431	S	S	*	.	S	Bend	trans	-74.8	-21.1	162.7	45.8	0	0	0	0	112.7	N414	N414-T416 PolarHBondContact O-N 2.95Å
417	D	54.3	Low	72.7	Confident	116 Å²	116	87.4 Å²	87.4	62%	0.62	45%	0.449	S	S	*	.			trans	-109.4	70.1	-169.2	-69.8	-21.5	0	0	0	113.3	K419 S421	D417-K419 VanDerWaalsContact C-N 3.27Å; D417-K419 PolarHBondContact O-N 3.05Å; D417-S421 WeakPolarHBondContact O-CB 3.41Å; D417-S421 PolarHBondContact O-OG 3.48Å
418	K	56	Low	72.7	Confident	174 Å²	174	86.8 Å²	86.8	76%	0.757	45%	0.446	S	S	*	.	H	α-helix	trans	-56.8	-21.3	-169.9	-67	-177.9	178.5	178.7	0	117.8	S421	K418-S421 VanDerWaalsContact C-OG 3.29Å; K418-S421 WeakPolarHBondContact CA-OG 3.43Å; K418-S421 PolarHBondContact O-OG 3.48Å
419	K	55	Low	72.6	Confident	178 Å²	178	87.8 Å²	87.8	77%	0.774	44%	0.444	S	S	*	.	H	α-helix	trans	-88.4	-54.9	-170.6	-77	-173.9	178.4	179.1	0	113.3	D417 S421 A422	D417-K419 VanDerWaalsContact C-N 3.27Å; D417-K419 PolarHBondContact O-N 3.05Å; K419-S421 PolarHBondContact O-N 3.31Å; K419-A422 PolarHBondContact O-N 3.31Å
420	N	60.1	Low	72.9	Confident	102 Å²	102	90.4 Å²	90.4	55%	0.545	46%	0.458	S	S	.	.	H	α-helix	trans	-67.2	-28.9	178.8	-68.4	-12.3	0	0	0	111.5	L424 F757	N420-L424 PolarHBondContact O-N 3.31Å; N420-F757 WeakPolarHBondContact ND2-CE1 3.2Å
421	S	68.6	Low	73.3	Confident	15 Å²	15	90.8 Å²	90.8	11%	0.105	46%	0.46	C	S	.	.	H	α-helix	trans	-66.7	-37.1	176.8	65.7	0	0	0	0	112.2	F410 D415 D417 K418 K419 L424 Y425	F410-S421 WeakPolarHBondContact CE2-O 3.45Å; F410-S421 VanDerWaalsContact CZ-O 3.23Å; F410-S421 WeakPolarHBondContact CZ-O 3.49Å; D415-S421 WeakPolarHBondContact OD2-CB 3.35Å; D417-S421 WeakPolarHBondContact O-CB 3.41Å; D417-S421 PolarHBondContact O-OG 3.48Å; K418-S421 VanDerWaalsContact C-OG 3.29Å; K418-S421 WeakPolarHBondContact CA-OG 3.43Å; K418-S421 PolarHBondContact O-OG 3.48Å; K419-S421 PolarHBondContact O-N 3.31Å; S421-L424 PolarHBondContact O-N 3.37Å; S421-Y425 WeakPolarHBondContact O-CB 3.48Å; S421-Y425 PolarHBondContact O-N 2.96Å
422	A	75.6	Confident	73.8	Confident	52 Å²	52	87.8 Å²	87.8	43%	0.43	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-44.7	179.7	0	0	0	0	0	113.2	K419 L424 Y425 Q426	K419-A422 PolarHBondContact O-N 3.31Å; A422-L424 VanDerWaalsContact C-N 3.35Å; A422-L424 PolarHBondContact O-N 3.47Å; A422-Y425 PolarHBondContact O-N 2.98Å; A422-Q426 WeakPolarHBondContact O-CB 3.44Å; A422-Q426 PolarHBondContact O-N 2.96Å
423	D	81.7	Confident	74.3	Confident	123 Å²	123	84.7 Å²	84.7	66%	0.658	42%	0.422	S	S	*	.	H	α-helix	trans	-65.6	-40.1	179.9	-71.1	-18.7	0	0	0	111.4	Q426 L427	D423-Q426 PolarHBondContact O-N 2.98Å; D423-L427 PolarHBondContact O-N 3.03Å
424	L	81.5	Confident	75.3	Confident	38 Å²	38	83.4 Å²	83.4	20%	0.199	42%	0.422	C	S	.	.	H	α-helix	trans	-67.5	-42.2	178	-172.3	61.7	0	0	0	111.7	I380 F384 N420 S421 A422 Q426 L427 G428	I380-L424 HydrophobicContact CB-CD2 3.91Å; I380-L424 HydrophobicContact CD1-CD2 4.19Å; I380-L424 HydrophobicContact CG2-CD2 4Å; I380-L424 HydrophobicContact CG2-CG 4.14Å; F384-L424 HydrophobicContact CD2-CD1 4.11Å; F384-L424 HydrophobicContact CE2-CD1 4.06Å; F384-L424 HydrophobicContact CE2-CG 4.17Å; F384-L424 WeakPolarHBondContact CE2-O 3.33Å; N420-L424 PolarHBondContact O-N 3.31Å; S421-L424 PolarHBondContact O-N 3.37Å; A422-L424 VanDerWaalsContact C-N 3.35Å; A422-L424 PolarHBondContact O-N 3.47Å; L424-Q426 VanDerWaalsContact C-N 3.32Å; L424-Q426 PolarHBondContact O-N 3.36Å; L424-L427 WeakPolarHBondContact O-CB 3.49Å; L424-L427 PolarHBondContact O-N 2.95Å; L424-G428 PolarHBondContact O-N 3.49Å
425	Y	82.4	Confident	77	Confident	84 Å²	84	75.5 Å²	75.5	33%	0.329	38%	0.38	S	S	.	.	H	α-helix	trans	-61.3	-42.9	174.3	-174	-105.5	0	0	0	111.5	I407 F410 S421 A422 L427 G428 R429	I407-Y425 HydrophobicContact CG2-CE2 4.26Å; F410-Y425 AromaticContact CD1-CD2 3.4Å; F410-Y425 HydrophobicContact CD1-CD2 3.4Å; F410-Y425 VanDerWaalsContact CD1-CD2 3.4Å; F410-Y425 HydrophobicContact CD1-CE2 4.03Å; F410-Y425 HydrophobicContact CD1-CG 4.22Å; F410-Y425 AromaticContact CE1-CD2 3.51Å; F410-Y425 HydrophobicContact CE1-CD2 3.51Å; F410-Y425 HydrophobicContact CE1-CE2 4.28Å; F410-Y425 AromaticContact CE1-CG 3.89Å; F410-Y425 HydrophobicContact CE1-CG 3.89Å; F410-Y425 HydrophobicContact CG-CD2 4.03Å; F410-Y425 HydrophobicContact CZ-CD2 4.22Å; F410-Y425 HydrophobicContact CZ-CG 4.24Å; S421-Y425 WeakPolarHBondContact O-CB 3.48Å; S421-Y425 PolarHBondContact O-N 2.96Å; A422-Y425 PolarHBondContact O-N 2.98Å; Y425-L427 VanDerWaalsContact C-N 3.33Å; Y425-L427 PolarHBondContact O-N 3.26Å; Y425-G428 PolarHBondContact O-N 2.84Å; Y425-R429 HydrophobicContact CD1-CG 4.34Å; Y425-R429 VanDerWaalsContact CE1-CD 3.46Å; Y425-R429 HydrophobicContact CE1-CG 4.06Å; Y425-R429 WeakPolarHBondContact O-CG 3.45Å; Y425-R429 PolarHBondContact O-N 3.29Å
426	Q	85	Confident	78.8	Confident	82 Å²	82	74.5 Å²	74.5	38%	0.383	37%	0.374	S	S	.	.	H	α-helix	trans	-64.8	-37.1	176.1	-170.8	58.6	39.8	0	0	112	A422 D423 L424 R429 N430	A422-Q426 WeakPolarHBondContact O-CB 3.44Å; A422-Q426 PolarHBondContact O-N 2.96Å; D423-Q426 PolarHBondContact O-N 2.98Å; L424-Q426 VanDerWaalsContact C-N 3.32Å; L424-Q426 PolarHBondContact O-N 3.36Å; Q426-R429 PolarHBondContact O-N 3.22Å; Q426-N430 PolarHBondContact NE2-OD1 3.28Å; Q426-N430 WeakPolarHBondContact O-CB 3.5Å; Q426-N430 PolarHBondContact O-N 3.16Å; Q426-N430 PolarHBondContact O-ND2 3.13Å; Q426-N430 PolarHBondContact O-OD1 3.45Å
427	L	86.6	Confident	80.5	Confident	73 Å²	73	69.8 Å²	69.8	38%	0.382	34%	0.344	S	S	.	.	H	α-helix	trans	-59.8	-46.8	172.7	-169.7	156	0	0	0	111	F384 D423 L424 Y425 R429 N430 Q431	F384-L427 HydrophobicContact CB-CD2 3.65Å; F384-L427 HydrophobicContact CD2-CD2 3.58Å; F384-L427 HydrophobicContact CE2-CD2 4.5Å; F384-L427 HydrophobicContact CG-CD2 3.9Å; D423-L427 PolarHBondContact O-N 3.03Å; L424-L427 WeakPolarHBondContact O-CB 3.49Å; L424-L427 PolarHBondContact O-N 2.95Å; Y425-L427 VanDerWaalsContact C-N 3.33Å; Y425-L427 PolarHBondContact O-N 3.26Å; L427-R429 PolarHBondContact O-N 3.23Å; L427-N430 PolarHBondContact O-N 3.07Å; L427-Q431 HydrophobicContact CD2-CG 3.99Å; L427-Q431 WeakPolarHBondContact O-CG 3.39Å; L427-Q431 PolarHBondContact O-N 3.36Å
428	G	86.2	Confident	82.4	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.8	-47.2	175.6	0	0	0	0	0	112.7	L424 Y425 N430 Q431 L432	L424-G428 PolarHBondContact O-N 3.49Å; Y425-G428 PolarHBondContact O-N 2.84Å; G428-N430 VanDerWaalsContact C-N 3.33Å; G428-N430 PolarHBondContact O-N 3.23Å; G428-Q431 PolarHBondContact O-N 2.98Å; G428-L432 WeakPolarHBondContact O-CB 3.35Å; G428-L432 PolarHBondContact O-N 3.49Å
429	R	87.1	Confident	84.2	Confident	107 Å²	107	61 Å²	61	40%	0.404	30%	0.304	S	S	.	.	H	α-helix	trans	-60.2	-41.7	175.8	-71.1	-175.5	70.3	-168.2	6.6	112.5	Y425 Q426 L427 L432 F433	Y425-R429 HydrophobicContact CD1-CG 4.34Å; Y425-R429 VanDerWaalsContact CE1-CD 3.46Å; Y425-R429 HydrophobicContact CE1-CG 4.06Å; Y425-R429 WeakPolarHBondContact O-CG 3.45Å; Y425-R429 PolarHBondContact O-N 3.29Å; Q426-R429 PolarHBondContact O-N 3.22Å; L427-R429 PolarHBondContact O-N 3.23Å; R429-L432 PolarHBondContact O-N 3.18Å; R429-F433 WeakPolarHBondContact O-CB 3.46Å; R429-F433 PolarHBondContact O-N 2.95Å
430	N	90	Very high	85.9	Confident	82 Å²	82	52.5 Å²	52.5	44%	0.439	27%	0.267	S	S	.	.	H	α-helix	trans	-65.2	-42.9	177.6	-68.4	-13.2	0	0	0	111.3	Q426 L427 G428 F433 L434	Q426-N430 PolarHBondContact NE2-OD1 3.28Å; Q426-N430 WeakPolarHBondContact O-CB 3.5Å; Q426-N430 PolarHBondContact O-N 3.16Å; Q426-N430 PolarHBondContact O-ND2 3.13Å; Q426-N430 PolarHBondContact O-OD1 3.45Å; L427-N430 PolarHBondContact O-N 3.07Å; G428-N430 VanDerWaalsContact C-N 3.33Å; G428-N430 PolarHBondContact O-N 3.23Å; N430-F433 PolarHBondContact O-N 3.41Å; N430-L434 VanDerWaalsContact O-CG 3.3Å; N430-L434 WeakPolarHBondContact O-CG 3.41Å; N430-L434 PolarHBondContact O-N 2.88Å
431	Q	91.2	Very high	87.4	Confident	37 Å²	37	49.8 Å²	49.8	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-39.4	176	-68.5	-62.2	-13.8	0	0	112	F384 I403 L427 G428 L434 T435	F384-Q431 HydrophobicContact CB-CG 4.5Å; I403-Q431 HydrophobicContact CD1-CB 4Å; I403-Q431 HydrophobicContact CG1-CB 4.44Å; L427-Q431 HydrophobicContact CD2-CG 3.99Å; L427-Q431 WeakPolarHBondContact O-CG 3.39Å; L427-Q431 PolarHBondContact O-N 3.36Å; G428-Q431 PolarHBondContact O-N 2.98Å; Q431-L434 PolarHBondContact O-N 3.05Å; Q431-T435 WeakPolarHBondContact O-CB 3.34Å; Q431-T435 PolarHBondContact O-N 3.44Å; Q431-T435 PolarHBondContact O-OG1 2.7Å
432	L	91.3	Very high	88.4	Confident	36 Å²	36	51.8 Å²	51.8	19%	0.188	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-49.3	174.8	-176.6	60.7	0	0	0	110.7	L400 I403 M404 I407 G428 R429 L434 T435 I436	L400-L432 HydrophobicContact CD2-CD1 3.71Å; I403-L432 HydrophobicContact CG2-CB 3.91Å; I403-L432 HydrophobicContact CG2-CD1 4.28Å; M404-L432 HydrophobicContact SD-CD1 4.29Å; M404-L432 HydrophobicContact SD-CD2 4.14Å; I407-L432 HydrophobicContact CD1-CD2 4.08Å; G428-L432 WeakPolarHBondContact O-CB 3.35Å; G428-L432 PolarHBondContact O-N 3.49Å; R429-L432 PolarHBondContact O-N 3.18Å; L432-L434 VanDerWaalsContact C-N 3.34Å; L432-L434 PolarHBondContact O-N 3.27Å; L432-T435 PolarHBondContact O-N 3.41Å; L432-T435 VanDerWaalsContact O-N 3.1Å; L432-I436 HydrophobicContact CD1-CD1 3.87Å; L432-I436 HydrophobicContact CD1-CG1 4.09Å; L432-I436 HydrophobicContact CD2-CD1 4.45Å; L432-I436 HydrophobicContact CG-CD1 3.77Å; L432-I436 HydrophobicContact CG-CG1 4.37Å; L432-I436 WeakPolarHBondContact O-CG1 3.48Å; L432-I436 PolarHBondContact O-N 3.37Å
433	F	91.7	Very high	89.2	Confident	34 Å²	34	49.5 Å²	49.5	15%	0.149	24%	0.239	C	C	.	.	H	α-helix	trans	-54.8	-47.6	176.7	-179.8	-86.3	0	0	0	112	R429 N430 T435 N437 L459 V462 D463 L469	R429-F433 WeakPolarHBondContact O-CB 3.46Å; R429-F433 PolarHBondContact O-N 2.95Å; N430-F433 PolarHBondContact O-N 3.41Å; F433-T435 VanDerWaalsContact C-N 3.33Å; F433-T435 PolarHBondContact O-N 2.86Å; F433-N437 VanDerWaalsContact O-CB 3.29Å; F433-N437 WeakPolarHBondContact O-CB 3.43Å; F433-N437 PolarHBondContact O-N 3.14Å; F433-L459 HydrophobicContact CD2-CD2 3.5Å; F433-L459 HydrophobicContact CE2-CB 4.12Å; F433-L459 HydrophobicContact CE2-CD2 3.85Å; F433-L459 HydrophobicContact CG-CD2 4.08Å; F433-V462 HydrophobicContact CD2-CG1 4.41Å; F433-D463 HydrophobicContact CE2-CB 4.02Å; F433-D463 HydrophobicContact CZ-CB 4.12Å; F433-L469 HydrophobicContact CE2-CD1 4.05Å; F433-L469 HydrophobicContact CZ-CD1 3.69Å
434	L	91.9	Very high	89.6	Confident	70 Å²	70	43.8 Å²	43.8	37%	0.366	21%	0.208	S	C	.	.	H	α-helix	trans	-64.9	-35.6	178	-68.5	174.9	0	0	0	112.8	N430 Q431 L432 S438	N430-L434 VanDerWaalsContact O-CG 3.3Å; N430-L434 WeakPolarHBondContact O-CG 3.41Å; N430-L434 PolarHBondContact O-N 2.88Å; Q431-L434 PolarHBondContact O-N 3.05Å; L432-L434 VanDerWaalsContact C-N 3.34Å; L432-L434 PolarHBondContact O-N 3.27Å; L434-S438 WeakPolarHBondContact O-CB 3.49Å; L434-S438 PolarHBondContact O-N 3.11Å; L434-S438 PolarHBondContact O-OG 3.1Å
435	T	91.7	Very high	90	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-73.4	-45.7	-179.1	-52.4	0	0	0	0	111.3	L396 S399 L400 I403 Q431 L432 F433 N437 S438 Y439	L396-T435 HydrophobicContact CD2-CG2 4.48Å; S399-T435 WeakPolarHBondContact OG-CG2 3.14Å; L400-T435 HydrophobicContact CD2-CG2 3.59Å; L400-T435 HydrophobicContact CG-CG2 3.75Å; I403-T435 HydrophobicContact CD1-CG2 4.45Å; I403-T435 VanDerWaalsContact CD1-OG1 3.23Å; I403-T435 WeakPolarHBondContact CD1-OG1 3.29Å; Q431-T435 WeakPolarHBondContact O-CB 3.34Å; Q431-T435 PolarHBondContact O-N 3.44Å; Q431-T435 PolarHBondContact O-OG1 2.7Å; L432-T435 PolarHBondContact O-N 3.41Å; L432-T435 VanDerWaalsContact O-N 3.1Å; F433-T435 VanDerWaalsContact C-N 3.33Å; F433-T435 PolarHBondContact O-N 2.86Å; T435-N437 VanDerWaalsContact C-N 3.31Å; T435-N437 PolarHBondContact O-N 3.02Å; T435-S438 WeakPolarHBondContact O-CB 3.4Å; T435-S438 PolarHBondContact O-N 3.37Å; T435-Y439 WeakPolarHBondContact O-CB 3.46Å; T435-Y439 PolarHBondContact O-N 3.27Å
436	I	92.2	Very high	90.5	Very high	35 Å²	35	47.5 Å²	47.5	18%	0.179	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-41.8	174.7	-63.1	171.2	0	0	0	110.2	L400 L432 S438 Y439 A440 L455 L459	L400-I436 HydrophobicContact CD2-CG1 3.81Å; L432-I436 HydrophobicContact CD1-CD1 3.87Å; L432-I436 HydrophobicContact CD1-CG1 4.09Å; L432-I436 HydrophobicContact CD2-CD1 4.45Å; L432-I436 HydrophobicContact CG-CD1 3.77Å; L432-I436 HydrophobicContact CG-CG1 4.37Å; L432-I436 WeakPolarHBondContact O-CG1 3.48Å; L432-I436 PolarHBondContact O-N 3.37Å; I436-S438 VanDerWaalsContact C-N 3.35Å; I436-S438 PolarHBondContact O-N 3.4Å; I436-Y439 CarbonylContact O-C 3.5Å; I436-Y439 WeakPolarHBondContact O-CB 3.33Å; I436-Y439 PolarHBondContact O-N 3.13Å; I436-Y439 VanDerWaalsContact O-N 3.13Å; I436-A440 PolarHBondContact O-N 3.41Å; I436-L455 HydrophobicContact CG2-CB 4.26Å; I436-L455 HydrophobicContact CG2-CD2 4.28Å; I436-L459 HydrophobicContact CB-CD1 4.36Å; I436-L459 HydrophobicContact CB-CD2 4.03Å; I436-L459 HydrophobicContact CB-CG 4.5Å; I436-L459 HydrophobicContact CG2-CD1 3.85Å; I436-L459 HydrophobicContact CG2-CD2 3.93Å; I436-L459 HydrophobicContact CG2-CG 3.91Å
437	N	91.6	Very high	90.8	Very high	27 Å²	27	50.4 Å²	50.4	14%	0.144	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-44.5	175.7	-172.9	6.5	0	0	0	111.5	F433 T435 Y439 A440 I441 L459	F433-N437 VanDerWaalsContact O-CB 3.29Å; F433-N437 WeakPolarHBondContact O-CB 3.43Å; F433-N437 PolarHBondContact O-N 3.14Å; T435-N437 VanDerWaalsContact C-N 3.31Å; T435-N437 PolarHBondContact O-N 3.02Å; N437-Y439 VanDerWaalsContact C-N 3.26Å; N437-Y439 PolarHBondContact O-N 3.42Å; N437-A440 PolarHBondContact O-N 3.29Å; N437-I441 WeakPolarHBondContact O-CG1 3.47Å; N437-I441 PolarHBondContact O-N 2.77Å; N437-L459 HydrophobicContact CB-CD1 3.86Å
438	S	92.9	Very high	91.2	Very high	36 Å²	36	51.3 Å²	51.3	25%	0.252	24%	0.241	S	C	.	.	H	α-helix	trans	-61.5	-37.1	175.1	-55.2	0	0	0	0	111.8	L434 T435 I436 I441 K442	L434-S438 WeakPolarHBondContact O-CB 3.49Å; L434-S438 PolarHBondContact O-N 3.11Å; L434-S438 PolarHBondContact O-OG 3.1Å; T435-S438 WeakPolarHBondContact O-CB 3.4Å; T435-S438 PolarHBondContact O-N 3.37Å; I436-S438 VanDerWaalsContact C-N 3.35Å; I436-S438 PolarHBondContact O-N 3.4Å; S438-I441 PolarHBondContact O-N 2.83Å; S438-K442 PolarHBondContact O-N 2.86Å
439	Y	93.2	Very high	91.5	Very high	70 Å²	70	53.7 Å²	53.7	28%	0.275	25%	0.25	S	S	.	.	H	α-helix	trans	-69.5	-42.4	177.4	-171.5	-107.4	0	0	0	112.3	L396 T397 T435 I436 N437 I441 K442 L443 L455	L396-Y439 HydrophobicContact CB-CD2 3.88Å; L396-Y439 HydrophobicContact CD1-CD2 3.97Å; L396-Y439 HydrophobicContact CD1-CG 4.5Å; T397-Y439 HydrophobicContact CG2-CE2 4.49Å; T435-Y439 WeakPolarHBondContact O-CB 3.46Å; T435-Y439 PolarHBondContact O-N 3.27Å; I436-Y439 CarbonylContact O-C 3.5Å; I436-Y439 WeakPolarHBondContact O-CB 3.33Å; I436-Y439 PolarHBondContact O-N 3.13Å; I436-Y439 VanDerWaalsContact O-N 3.13Å; N437-Y439 VanDerWaalsContact C-N 3.26Å; N437-Y439 PolarHBondContact O-N 3.42Å; Y439-I441 VanDerWaalsContact C-N 3.34Å; Y439-I441 PolarHBondContact O-N 2.72Å; Y439-K442 WeakPolarHBondContact O-CB 3.36Å; Y439-K442 PolarHBondContact O-N 3.14Å; Y439-K442 VanDerWaalsContact O-N 3.1Å; Y439-L443 HydrophobicContact CD1-CD1 3.94Å; Y439-L443 HydrophobicContact CD1-CG 4.34Å; Y439-L443 HydrophobicContact CE1-CD1 3.62Å; Y439-L443 HydrophobicContact CE1-CD2 4.34Å; Y439-L443 HydrophobicContact CE1-CG 4.04Å; Y439-L443 WeakPolarHBondContact O-CG 3.35Å; Y439-L443 PolarHBondContact O-N 3.48Å; Y439-L455 HydrophobicContact CD1-CD1 3.53Å; Y439-L455 HydrophobicContact CE1-CD1 3.93Å
440	A	91.3	Very high	91.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-46.3	172.3	0	0	0	0	0	111.1	I436 N437 K442 L443 L444 S452 L455 I456	I436-A440 PolarHBondContact O-N 3.41Å; N437-A440 PolarHBondContact O-N 3.29Å; A440-K442 VanDerWaalsContact C-N 3.28Å; A440-K442 PolarHBondContact O-N 3.05Å; A440-L443 PolarHBondContact O-N 3.14Å; A440-L444 WeakPolarHBondContact O-CB 3.38Å; A440-L444 PolarHBondContact O-N 2.67Å; A440-S452 PolarHBondContact O-OG 3.24Å; A440-L455 HydrophobicContact CB-CB 4.3Å; A440-I456 HydrophobicContact CB-CD1 4.34Å; A440-I456 HydrophobicContact CB-CG1 3.87Å
441	I	91.3	Very high	91.9	Very high	45 Å²	45	54.9 Å²	54.9	23%	0.231	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-38.6	175.7	-65.5	165.6	0	0	0	111.5	N437 S438 Y439 L444 K445 L472	N437-I441 WeakPolarHBondContact O-CG1 3.47Å; N437-I441 PolarHBondContact O-N 2.77Å; S438-I441 PolarHBondContact O-N 2.83Å; Y439-I441 VanDerWaalsContact C-N 3.34Å; Y439-I441 PolarHBondContact O-N 2.72Å; I441-L444 PolarHBondContact O-N 3.17Å; I441-K445 WeakPolarHBondContact O-CG 3.31Å; I441-K445 PolarHBondContact O-N 3.15Å; I441-L472 HydrophobicContact CD1-CD1 4.16Å; I441-L472 HydrophobicContact CG1-CD1 3.91Å; I441-L472 HydrophobicContact CG1-CD2 4.08Å
442	K	90.9	Very high	92	Very high	57 Å²	57	53.1 Å²	53.1	25%	0.248	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-43.9	176.1	-175.6	172.5	-175.8	148.3	0	112	D394 L396 S438 Y439 A440 L444 K445 Q446	D394-K442 PolarHBondContact O-NZ 3Å; D394-K442 IonicContact OD1-NZ 2.68Å; D394-K442 PolarHBondContact OD1-NZ 3.25Å; D394-K442 IonicContact OD2-NZ 3.64Å; D394-K442 PolarHBondContact OD2-NZ 3.44Å; L396-K442 HydrophobicContact CD1-CB 4Å; L396-K442 HydrophobicContact CD1-CD 3.65Å; L396-K442 HydrophobicContact CG-CD 4.48Å; S438-K442 PolarHBondContact O-N 2.86Å; Y439-K442 WeakPolarHBondContact O-CB 3.36Å; Y439-K442 PolarHBondContact O-N 3.14Å; Y439-K442 VanDerWaalsContact O-N 3.1Å; A440-K442 VanDerWaalsContact C-N 3.28Å; A440-K442 PolarHBondContact O-N 3.05Å; K442-L444 VanDerWaalsContact C-N 3.33Å; K442-L444 PolarHBondContact O-N 3.33Å; K442-K445 PolarHBondContact O-N 3.24Å; K442-Q446 WeakPolarHBondContact O-CG 3.22Å; K442-Q446 PolarHBondContact O-N 2.96Å; K442-Q446 VanDerWaalsContact O-N 3.09Å
443	L	91.8	Very high	92	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-40.5	175.4	-69.4	175.2	0	0	0	111.9	Y439 A440 K445 Q446 E447 K448 E451 L455	Y439-L443 HydrophobicContact CD1-CD1 3.94Å; Y439-L443 HydrophobicContact CD1-CG 4.34Å; Y439-L443 HydrophobicContact CE1-CD1 3.62Å; Y439-L443 HydrophobicContact CE1-CD2 4.34Å; Y439-L443 HydrophobicContact CE1-CG 4.04Å; Y439-L443 WeakPolarHBondContact O-CG 3.35Å; Y439-L443 PolarHBondContact O-N 3.48Å; A440-L443 PolarHBondContact O-N 3.14Å; L443-K445 VanDerWaalsContact C-N 3.33Å; L443-K445 PolarHBondContact O-N 3.39Å; L443-Q446 CarbonylContact O-C 3.44Å; L443-Q446 WeakPolarHBondContact O-CA 3.42Å; L443-Q446 WeakPolarHBondContact O-CB 3.39Å; L443-Q446 PolarHBondContact O-N 3.49Å; L443-E447 PolarHBondContact O-N 3.41Å; L443-K448 HydrophobicContact CB-CB 4.31Å; L443-K448 HydrophobicContact CD2-CB 4.41Å; L443-K448 HydrophobicContact CD2-CD 3.83Å; L443-K448 PolarHBondContact O-N 3.4Å; L443-E451 HydrophobicContact CD1-CB 4.07Å; L443-L455 HydrophobicContact CD1-CD1 3.68Å
444	L	90.6	Very high	92.1	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-43.3	175.5	-163.7	164	0	0	0	110.9	A440 I441 K442 Q446 E447 L472 D475 C476 F479 F723	A440-L444 WeakPolarHBondContact O-CB 3.38Å; A440-L444 PolarHBondContact O-N 2.67Å; I441-L444 PolarHBondContact O-N 3.17Å; K442-L444 VanDerWaalsContact C-N 3.33Å; K442-L444 PolarHBondContact O-N 3.33Å; L444-Q446 VanDerWaalsContact C-N 3.25Å; L444-Q446 PolarHBondContact O-N 3.01Å; L444-E447 PolarHBondContact O-N 3.03Å; L444-E447 VanDerWaalsContact O-N 3.1Å; L444-L472 HydrophobicContact CD1-CD2 4.19Å; L444-D475 HydrophobicContact CD1-CB 4.33Å; L444-C476 VanDerWaalsContact CD1-SG 3.53Å; L444-F479 HydrophobicContact CD2-CE2 4.34Å; L444-F723 HydrophobicContact CD2-CD1 4.46Å; L444-F723 HydrophobicContact CD2-CE1 3.25Å; L444-F723 HydrophobicContact CD2-CE2 4.24Å; L444-F723 HydrophobicContact CD2-CZ 3.11Å
445	K	89.1	Confident	92.1	Very high	98 Å²	98	54.2 Å²	54.2	43%	0.426	25%	0.254	S	S	.	.	H	α-helix	trans	-64.6	-26.3	173.4	-71.4	179.5	179.5	-172.7	0	113.8	I441 K442 L443 F723	I441-K445 WeakPolarHBondContact O-CG 3.31Å; I441-K445 PolarHBondContact O-N 3.15Å; K442-K445 PolarHBondContact O-N 3.24Å; L443-K445 VanDerWaalsContact C-N 3.33Å; L443-K445 PolarHBondContact O-N 3.39Å; K445-F723 HydrophobicContact CG-CD2 3.95Å; K445-F723 HydrophobicContact CG-CE2 4.15Å; K445-F723 HydrophobicContact CG-CG 4.3Å
446	Q	93.6	Very high	92.2	Very high	101 Å²	101	54.2 Å²	54.2	47%	0.472	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	9.5	175.1	-68.3	176.8	-5.9	0	0	113	K442 L443 L444 K448	K442-Q446 WeakPolarHBondContact O-CG 3.22Å; K442-Q446 PolarHBondContact O-N 2.96Å; K442-Q446 VanDerWaalsContact O-N 3.09Å; L443-Q446 CarbonylContact O-C 3.44Å; L443-Q446 WeakPolarHBondContact O-CA 3.42Å; L443-Q446 WeakPolarHBondContact O-CB 3.39Å; L443-Q446 PolarHBondContact O-N 3.49Å; L444-Q446 VanDerWaalsContact C-N 3.25Å; L444-Q446 PolarHBondContact O-N 3.01Å; Q446-K448 HydrophobicContact CB-CG 4.4Å; Q446-K448 PolarHBondContact O-N 3.3Å
447	E	91.7	Very high	92.2	Very high	143 Å²	143	57.1 Å²	57.1	67%	0.668	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	16.9	-178.2	-50	-174.5	173.6	0	0	114.3	L443 L444 Y449	L443-E447 PolarHBondContact O-N 3.41Å; L444-E447 PolarHBondContact O-N 3.03Å; L444-E447 VanDerWaalsContact O-N 3.1Å; E447-Y449 VanDerWaalsContact C-N 3.34Å; E447-Y449 HydrophobicContact CB-CE1 4.45Å; E447-Y449 HydrophobicContact CB-CE2 4.03Å; E447-Y449 WeakPolarHBondContact CB-OH 3.42Å; E447-Y449 WeakPolarHBondContact CG-OH 3.44Å; E447-Y449 VanDerWaalsContact O-CD2 3.31Å; E447-Y449 WeakPolarHBondContact O-CD2 3.36Å; E447-Y449 WeakPolarHBondContact O-CE2 3.44Å; E447-Y449 PolarHBondContact O-N 3.48Å; E447-Y449 VanDerWaalsContact O-N 3.17Å
448	K	93.5	Very high	92.2	Very high	92 Å²	92	61 Å²	61	40%	0.4	28%	0.28	S	S	.	.			trans	-89	67.4	176.1	-66	-176.1	169.9	-161.7	0	111.3	L443 Q446 Q450 E451 S452	L443-K448 HydrophobicContact CB-CB 4.31Å; L443-K448 HydrophobicContact CD2-CB 4.41Å; L443-K448 HydrophobicContact CD2-CD 3.83Å; L443-K448 PolarHBondContact O-N 3.4Å; Q446-K448 HydrophobicContact CB-CG 4.4Å; Q446-K448 PolarHBondContact O-N 3.3Å; K448-Q450 PolarHBondContact O-N 2.96Å; K448-E451 IonicContact NZ-OE2 2.76Å; K448-S452 WeakPolarHBondContact O-CB 3.39Å; K448-S452 PolarHBondContact O-N 3.25Å; K448-S452 VanDerWaalsContact O-N 3.13Å
449	Y	92.6	Very high	92.2	Very high	51 Å²	51	59.6 Å²	59.6	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-37.8	-168.9	-50.1	-62	0	0	0	114.3	E447 N453 F479 M480	E447-Y449 VanDerWaalsContact C-N 3.34Å; E447-Y449 HydrophobicContact CB-CE1 4.45Å; E447-Y449 HydrophobicContact CB-CE2 4.03Å; E447-Y449 WeakPolarHBondContact CB-OH 3.42Å; E447-Y449 WeakPolarHBondContact CG-OH 3.44Å; E447-Y449 VanDerWaalsContact O-CD2 3.31Å; E447-Y449 WeakPolarHBondContact O-CD2 3.36Å; E447-Y449 WeakPolarHBondContact O-CE2 3.44Å; E447-Y449 PolarHBondContact O-N 3.48Å; E447-Y449 VanDerWaalsContact O-N 3.17Å; Y449-N453 VanDerWaalsContact O-CB 3.28Å; Y449-N453 WeakPolarHBondContact O-CB 3.47Å; Y449-N453 PolarHBondContact O-N 2.93Å; Y449-F479 HydrophobicContact CD1-CB 3.61Å; Y449-F479 HydrophobicContact CD1-CD2 4.01Å; Y449-F479 HydrophobicContact CD1-CG 4.1Å; Y449-F479 HydrophobicContact CD2-CB 3.87Å; Y449-F479 HydrophobicContact CE1-CB 3.46Å; Y449-F479 VanDerWaalsContact CE1-CB 3.46Å; Y449-F479 HydrophobicContact CE1-CD1 4.4Å; Y449-F479 AromaticContact CE1-CD2 3.62Å; Y449-F479 HydrophobicContact CE1-CD2 3.62Å; Y449-F479 HydrophobicContact CE1-CE2 4.48Å; Y449-F479 AromaticContact CE1-CG 3.58Å; Y449-F479 HydrophobicContact CE1-CG 3.58Å; Y449-F479 HydrophobicContact CE2-CB 3.75Å; Y449-F479 HydrophobicContact CG-CB 3.81Å; Y449-F479 AromaticContact CZ-CG 3.82Å; Y449-M480 HydrophobicContact CG-CG 4.42Å
450	Q	92.9	Very high	92.1	Very high	122 Å²	122	57 Å²	57	57%	0.57	26%	0.26	S	S	*	.	H	α-helix	trans	-66.9	-52.6	-177.7	-175.4	177.1	-18.9	0	0	111.4	K448 S452 N453 E454 M480	K448-Q450 PolarHBondContact O-N 2.96Å; Q450-S452 VanDerWaalsContact C-N 3.29Å; Q450-S452 PolarHBondContact O-N 3.33Å; Q450-N453 PolarHBondContact O-N 3.14Å; Q450-N453 VanDerWaalsContact O-N 3.08Å; Q450-E454 PolarHBondContact NE2-OE1 3.16Å; Q450-E454 WeakPolarHBondContact O-CG 3.35Å; Q450-E454 PolarHBondContact O-N 2.92Å; Q450-M480 HydrophobicContact CB-CE 4.22Å; Q450-M480 HydrophobicContact CB-SD 4.48Å; Q450-M480 HydrophobicContact CG-CE 4.47Å
451	E	92.8	Very high	92	Very high	91 Å²	91	64.8 Å²	64.8	43%	0.425	30%	0.296	S	S	.	.	H	α-helix	trans	-57.3	-43.1	176.1	-64	175.2	-155	0	0	111.1	L443 K448 N453 E454 L455	L443-E451 HydrophobicContact CD1-CB 4.07Å; K448-E451 IonicContact NZ-OE2 2.76Å; E451-N453 VanDerWaalsContact C-N 3.34Å; E451-N453 PolarHBondContact O-N 3.05Å; E451-E454 PolarHBondContact O-N 3.46Å; E451-L455 PolarHBondContact O-N 3.43Å
452	S	92.7	Very high	91.8	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-42.8	175.9	-178	0	0	0	0	112.1	A440 K448 Q450 L455 I456 C476	A440-S452 PolarHBondContact O-OG 3.24Å; K448-S452 WeakPolarHBondContact O-CB 3.39Å; K448-S452 PolarHBondContact O-N 3.25Å; K448-S452 VanDerWaalsContact O-N 3.13Å; Q450-S452 VanDerWaalsContact C-N 3.29Å; Q450-S452 PolarHBondContact O-N 3.33Å; S452-L455 PolarHBondContact O-N 2.91Å; S452-I456 VanDerWaalsContact O-CD1 3.29Å; S452-I456 WeakPolarHBondContact O-CD1 3.2Å; S452-I456 WeakPolarHBondContact O-CG1 3.46Å; S452-I456 PolarHBondContact O-N 2.95Å; S452-C476 PolarHBondContact OG-SG 3.38Å
453	N	92.7	Very high	91.6	Very high	25 Å²	25	67 Å²	67	13%	0.134	31%	0.314	C	S	.	.	H	α-helix	trans	-68.2	-38.8	-178.2	-166.6	36.1	0	0	0	111.7	Y449 Q450 E451 L455 I456 R457 S473 C476	Y449-N453 VanDerWaalsContact O-CB 3.28Å; Y449-N453 WeakPolarHBondContact O-CB 3.47Å; Y449-N453 PolarHBondContact O-N 2.93Å; Q450-N453 PolarHBondContact O-N 3.14Å; Q450-N453 VanDerWaalsContact O-N 3.08Å; E451-N453 VanDerWaalsContact C-N 3.34Å; E451-N453 PolarHBondContact O-N 3.05Å; N453-L455 PolarHBondContact O-N 3.37Å; N453-I456 PolarHBondContact O-N 2.74Å; N453-R457 VanDerWaalsContact O-CG 3.31Å; N453-R457 WeakPolarHBondContact O-CG 3.44Å; N453-R457 PolarHBondContact O-N 3Å; N453-S473 PolarHBondContact OD1-OG 3.18Å; N453-C476 HydrophobicContact CB-CB 3.93Å
454	E	93	Very high	91.4	Very high	103 Å²	103	70.9 Å²	70.9	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-45.6	175.7	-72.5	172.8	-171.2	0	0	111.6	Q450 E451 I456 R457 Q458	Q450-E454 PolarHBondContact NE2-OE1 3.16Å; Q450-E454 WeakPolarHBondContact O-CG 3.35Å; Q450-E454 PolarHBondContact O-N 2.92Å; E451-E454 PolarHBondContact O-N 3.46Å; E454-I456 PolarHBondContact O-N 3.43Å; E454-R457 PolarHBondContact O-N 3.45Å; E454-Q458 WeakPolarHBondContact O-CG 3.39Å; E454-Q458 PolarHBondContact O-N 2.62Å; E454-Q458 VanDerWaalsContact O-N 3.12Å
455	L	92.6	Very high	91	Very high	35 Å²	35	78.3 Å²	78.3	18%	0.183	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-39.6	175.2	-68.2	176.6	0	0	0	112.6	I436 Y439 A440 L443 E451 S452 N453 R457 Q458 L459	I436-L455 HydrophobicContact CG2-CB 4.26Å; I436-L455 HydrophobicContact CG2-CD2 4.28Å; Y439-L455 HydrophobicContact CD1-CD1 3.53Å; Y439-L455 HydrophobicContact CE1-CD1 3.93Å; A440-L455 HydrophobicContact CB-CB 4.3Å; L443-L455 HydrophobicContact CD1-CD1 3.68Å; E451-L455 PolarHBondContact O-N 3.43Å; S452-L455 PolarHBondContact O-N 2.91Å; N453-L455 PolarHBondContact O-N 3.37Å; L455-R457 VanDerWaalsContact C-N 3.32Å; L455-R457 PolarHBondContact O-N 3.49Å; L455-Q458 PolarHBondContact O-N 3.37Å; L455-L459 WeakPolarHBondContact O-CG 3.4Å; L455-L459 PolarHBondContact O-N 3.08Å
456	I	93.5	Very high	90.7	Very high	1 Å²	1	75.1 Å²	75.1	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-38.6	177.3	-68.3	160	0	0	0	110.8	A440 S452 N453 E454 L459 L460 L469 L472	A440-I456 HydrophobicContact CB-CD1 4.34Å; A440-I456 HydrophobicContact CB-CG1 3.87Å; S452-I456 VanDerWaalsContact O-CD1 3.29Å; S452-I456 WeakPolarHBondContact O-CD1 3.2Å; S452-I456 WeakPolarHBondContact O-CG1 3.46Å; S452-I456 PolarHBondContact O-N 2.95Å; N453-I456 PolarHBondContact O-N 2.74Å; E454-I456 PolarHBondContact O-N 3.43Å; I456-L459 PolarHBondContact O-N 3.21Å; I456-L460 HydrophobicContact CG2-CD1 4Å; I456-L460 HydrophobicContact CG2-CG 4.34Å; I456-L460 WeakPolarHBondContact O-CG 3.46Å; I456-L460 PolarHBondContact O-N 3.43Å; I456-L469 HydrophobicContact CG2-CB 4.28Å; I456-L469 WeakPolarHBondContact CG2-O 3.45Å; I456-L472 HydrophobicContact CD1-CB 3.7Å; I456-L472 HydrophobicContact CG1-CB 4.44Å
457	R	92.2	Very high	90.3	Very high	96 Å²	96	72.7 Å²	72.7	36%	0.362	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-45	175.2	-71.9	-66.1	-171.9	-166.8	0.4	111.6	N453 E454 L455 L459 L460 E461 E489	N453-R457 VanDerWaalsContact O-CG 3.31Å; N453-R457 WeakPolarHBondContact O-CG 3.44Å; N453-R457 PolarHBondContact O-N 3Å; E454-R457 PolarHBondContact O-N 3.45Å; L455-R457 VanDerWaalsContact C-N 3.32Å; L455-R457 PolarHBondContact O-N 3.49Å; R457-L459 VanDerWaalsContact C-N 3.28Å; R457-L459 PolarHBondContact O-N 3.26Å; R457-L460 PolarHBondContact O-N 3.14Å; R457-L460 VanDerWaalsContact O-N 3.15Å; R457-E461 PolarHBondContact O-N 3.38Å; R457-E461 VanDerWaalsContact O-N 3.1Å; R457-E489 IonicContact CZ-OE1 3.31Å; R457-E489 IonicContact NH1-OE1 2.69Å; R457-E489 PolarHBondContact NH1-OE1 2.73Å; R457-E489 IonicContact NH1-OE2 3.37Å; R457-E489 IonicContact NH2-OE1 3.15Å; R457-E489 PolarHBondContact NH2-OE1 3.42Å
458	Q	92.1	Very high	90	Very high	109 Å²	109	73 Å²	73	51%	0.509	34%	0.342	S	S	.	.	H	α-helix	trans	-59.2	-38.7	173.4	-67.2	174.8	2.6	0	0	112.1	E454 L455 E461	E454-Q458 WeakPolarHBondContact O-CG 3.39Å; E454-Q458 PolarHBondContact O-N 2.62Å; E454-Q458 VanDerWaalsContact O-N 3.12Å; L455-Q458 PolarHBondContact O-N 3.37Å; Q458-E461 PolarHBondContact O-N 3Å
459	L	92.1	Very high	89.8	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-69.6	-34.9	175.9	-68.2	173	0	0	0	113.3	F433 I436 N437 L455 I456 R457 E461 V462 D463 L469	F433-L459 HydrophobicContact CD2-CD2 3.5Å; F433-L459 HydrophobicContact CE2-CB 4.12Å; F433-L459 HydrophobicContact CE2-CD2 3.85Å; F433-L459 HydrophobicContact CG-CD2 4.08Å; I436-L459 HydrophobicContact CB-CD1 4.36Å; I436-L459 HydrophobicContact CB-CD2 4.03Å; I436-L459 HydrophobicContact CB-CG 4.5Å; I436-L459 HydrophobicContact CG2-CD1 3.85Å; I436-L459 HydrophobicContact CG2-CD2 3.93Å; I436-L459 HydrophobicContact CG2-CG 3.91Å; N437-L459 HydrophobicContact CB-CD1 3.86Å; L455-L459 WeakPolarHBondContact O-CG 3.4Å; L455-L459 PolarHBondContact O-N 3.08Å; I456-L459 PolarHBondContact O-N 3.21Å; R457-L459 VanDerWaalsContact C-N 3.28Å; R457-L459 PolarHBondContact O-N 3.26Å; L459-E461 VanDerWaalsContact C-N 3.32Å; L459-V462 PolarHBondContact O-N 3.23Å; L459-D463 PolarHBondContact O-N 3.07Å; L459-L469 HydrophobicContact CB-CD1 3.6Å; L459-L469 HydrophobicContact CB-CD2 4.31Å; L459-L469 HydrophobicContact CD1-CD2 4.03Å
460	L	90.5	Very high	89.7	Confident	15 Å²	15	66.8 Å²	66.8	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-68.8	-28.4	176.5	-78	168.3	0	0	0	112.7	I456 R457 V462 D463 P464 L469 L470	I456-L460 HydrophobicContact CG2-CD1 4Å; I456-L460 HydrophobicContact CG2-CG 4.34Å; I456-L460 WeakPolarHBondContact O-CG 3.46Å; I456-L460 PolarHBondContact O-N 3.43Å; R457-L460 PolarHBondContact O-N 3.14Å; R457-L460 VanDerWaalsContact O-N 3.15Å; L460-V462 VanDerWaalsContact C-N 3.26Å; L460-V462 PolarHBondContact O-N 3.21Å; L460-D463 CarbonylContact O-C 3.46Å; L460-P464 WeakPolarHBondContact O-CA 3.34Å; L460-P464 VanDerWaalsContact O-N 3.08Å; L460-L469 HydrophobicContact CD2-CB 3.55Å; L460-L469 HydrophobicContact CD2-CD1 4.27Å; L460-L469 HydrophobicContact CG-CB 3.89Å; L460-L469 HydrophobicContact CG-CD1 4.38Å; L460-L470 HydrophobicContact CD1-CD2 3.93Å; L460-L470 HydrophobicContact CD2-CD2 3.67Å; L460-L470 HydrophobicContact CD2-CG 3.93Å; L460-L470 HydrophobicContact CG-CD2 4.48Å
461	E	90.2	Very high	89.4	Confident	163 Å²	163	61.8 Å²	61.8	76%	0.762	29%	0.293	S	S	*	.	H	α-helix	trans	-64.4	-33.2	171.3	-70	177	-179.4	0	0	111.9	R457 Q458 L459	R457-E461 PolarHBondContact O-N 3.38Å; R457-E461 VanDerWaalsContact O-N 3.1Å; Q458-E461 PolarHBondContact O-N 3Å; L459-E461 VanDerWaalsContact C-N 3.32Å
462	V	87.3	Confident	89.3	Confident	90 Å²	90	58.8 Å²	58.8	55%	0.545	28%	0.28	S	S	.	.	H	α-helix	trans	-79.3	-44.3	177.9	-178.4	0	0	0	0	111.7	F433 L459 L460	F433-V462 HydrophobicContact CD2-CG1 4.41Å; L459-V462 PolarHBondContact O-N 3.23Å; L460-V462 VanDerWaalsContact C-N 3.26Å; L460-V462 PolarHBondContact O-N 3.21Å
463	D	87.2	Confident	89.2	Confident	58 Å²	58	58.8 Å²	58.8	31%	0.31	28%	0.28	S	S	.	.			trans	-131.1	82	179.6	-175.3	11	0	0	0	111.5	F433 L459 L460 K465 N466	F433-D463 HydrophobicContact CE2-CB 4.02Å; F433-D463 HydrophobicContact CZ-CB 4.12Å; L459-D463 PolarHBondContact O-N 3.07Å; L460-D463 CarbonylContact O-C 3.46Å; D463-K465 PolarHBondContact O-N 3.32Å; D463-K465 PolarHBondContact OD1-N 3.35Å; D463-N466 HydrophobicContact CB-CB 4.25Å; D463-N466 WeakPolarHBondContact O-CB 3.38Å; D463-N466 PolarHBondContact O-N 3.03Å; D463-N466 WeakPolarHBondContact OD2-CB 3.3Å; D463-N466 PolarHBondContact OD2-ND2 2.93Å
464	P	86.5	Confident	89.2	Confident	86 Å²	86	57.6 Å²	57.6	56%	0.558	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-14.4	-176.3	27	-35.1	0	0	0	113.1	L460 N466	L460-P464 WeakPolarHBondContact O-CA 3.34Å; L460-P464 VanDerWaalsContact O-N 3.08Å; P464-N466 VanDerWaalsContact C-N 3.31Å
465	K	81.6	Confident	89.1	Confident	160 Å²	160	53.5 Å²	53.5	70%	0.696	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	0.8	178.8	-66.6	-176.9	179.8	178.9	0	112.3	D463 Y467	D463-K465 PolarHBondContact O-N 3.32Å; D463-K465 PolarHBondContact OD1-N 3.35Å; K465-Y467 PolarHBondContact O-N 3.39Å
466	N	84.2	Confident	89	Confident	31 Å²	31	51.9 Å²	51.9	17%	0.166	25%	0.246	C	C	.	.			trans	-78.1	92.7	-178.3	-153.4	-47.2	0	0	0	112.3	D463 P464 R468 L469 L470	D463-N466 HydrophobicContact CB-CB 4.25Å; D463-N466 WeakPolarHBondContact O-CB 3.38Å; D463-N466 PolarHBondContact O-N 3.03Å; D463-N466 WeakPolarHBondContact OD2-CB 3.3Å; D463-N466 PolarHBondContact OD2-ND2 2.93Å; P464-N466 VanDerWaalsContact C-N 3.31Å; N466-R468 PolarHBondContact O-N 3.06Å; N466-R468 VanDerWaalsContact O-N 3.08Å; N466-R468 WeakPolarHBondContact OD1-CB 3.42Å; N466-R468 PolarHBondContact OD1-N 3.46Å; N466-L469 HydrophobicContact CB-CB 4.19Å; N466-L469 HydrophobicContact CB-CD1 3.88Å; N466-L469 HydrophobicContact CB-CG 3.96Å; N466-L469 PolarHBondContact O-N 3.46Å; N466-L469 VanDerWaalsContact O-N 3.08Å; N466-L470 PolarHBondContact O-N 3.33Å
467	Y	84.4	Confident	89	Confident	50 Å²	50	52 Å²	52	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-57.8	-26.9	178.9	72.1	-98.1	0	0	0	113.2	K465 L470 I471 I497	K465-Y467 PolarHBondContact O-N 3.39Å; Y467-L470 PolarHBondContact O-N 3.45Å; Y467-I471 HydrophobicContact CD2-CD1 3.9Å; Y467-I471 HydrophobicContact CE2-CD1 4.43Å; Y467-I471 VanDerWaalsContact O-CG1 3.25Å; Y467-I471 WeakPolarHBondContact O-CG1 3.47Å; Y467-I471 PolarHBondContact O-N 3.05Å; Y467-I497 HydrophobicContact CD1-CD1 4.45Å; Y467-I497 HydrophobicContact CD1-CG1 3.85Å; Y467-I497 HydrophobicContact CD2-CD1 3.53Å; Y467-I497 HydrophobicContact CD2-CG1 3.85Å; Y467-I497 HydrophobicContact CE1-CG1 4.36Å; Y467-I497 HydrophobicContact CE2-CD1 4.03Å; Y467-I497 HydrophobicContact CE2-CG1 4.37Å; Y467-I497 HydrophobicContact CG-CD1 3.78Å; Y467-I497 HydrophobicContact CG-CG1 3.57Å
468	R	86.3	Confident	89.1	Confident	148 Å²	148	49.8 Å²	49.8	56%	0.558	24%	0.239	S	C	*	.	H	α-helix	trans	-70	-35.9	179.5	-62.5	-178.2	176.5	176.8	-3.5	111.8	N466 I471 L472	N466-R468 PolarHBondContact O-N 3.06Å; N466-R468 VanDerWaalsContact O-N 3.08Å; N466-R468 WeakPolarHBondContact OD1-CB 3.42Å; N466-R468 PolarHBondContact OD1-N 3.46Å; R468-I471 PolarHBondContact O-N 2.96Å; R468-L472 WeakPolarHBondContact O-CG 3.42Å; R468-L472 PolarHBondContact O-N 3.43Å; R468-L472 VanDerWaalsContact O-N 3.08Å
469	L	88.4	Confident	89	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70	-39	175.2	-66.9	-178.9	0	0	0	111.5	F433 I456 L459 L460 N466 I471 L472 S473	F433-L469 HydrophobicContact CE2-CD1 4.05Å; F433-L469 HydrophobicContact CZ-CD1 3.69Å; I456-L469 HydrophobicContact CG2-CB 4.28Å; I456-L469 WeakPolarHBondContact CG2-O 3.45Å; L459-L469 HydrophobicContact CB-CD1 3.6Å; L459-L469 HydrophobicContact CB-CD2 4.31Å; L459-L469 HydrophobicContact CD1-CD2 4.03Å; L460-L469 HydrophobicContact CD2-CB 3.55Å; L460-L469 HydrophobicContact CD2-CD1 4.27Å; L460-L469 HydrophobicContact CG-CB 3.89Å; L460-L469 HydrophobicContact CG-CD1 4.38Å; N466-L469 HydrophobicContact CB-CB 4.19Å; N466-L469 HydrophobicContact CB-CD1 3.88Å; N466-L469 HydrophobicContact CB-CG 3.96Å; N466-L469 PolarHBondContact O-N 3.46Å; N466-L469 VanDerWaalsContact O-N 3.08Å; L469-I471 VanDerWaalsContact C-N 3.3Å; L469-I471 PolarHBondContact O-N 3.36Å; L469-L472 HydrophobicContact CD2-CD1 4.44Å; L469-L472 PolarHBondContact O-N 3.21Å; L469-S473 WeakPolarHBondContact O-CB 3.41Å; L469-S473 PolarHBondContact O-N 3.41Å
470	L	89.7	Confident	89	Confident	13 Å²	13	51.4 Å²	51.4	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-39.9	173.6	-64.7	174.7	0	0	0	111.7	L460 N466 Y467 S473 G474 E489 N492 A493 I496	L460-L470 HydrophobicContact CD1-CD2 3.93Å; L460-L470 HydrophobicContact CD2-CD2 3.67Å; L460-L470 HydrophobicContact CD2-CG 3.93Å; L460-L470 HydrophobicContact CG-CD2 4.48Å; N466-L470 PolarHBondContact O-N 3.33Å; Y467-L470 PolarHBondContact O-N 3.45Å; L470-S473 PolarHBondContact O-N 2.85Å; L470-G474 PolarHBondContact O-N 3.24Å; L470-E489 WeakPolarHBondContact CD2-OE2 3.43Å; L470-N492 HydrophobicContact CD1-CB 4.18Å; L470-A493 HydrophobicContact CB-CB 3.88Å; L470-A493 HydrophobicContact CD1-CB 4.29Å; L470-I496 HydrophobicContact CD1-CD1 3.47Å; L470-I496 VanDerWaalsContact CD1-CD1 3.47Å
471	I	88.4	Confident	89	Confident	18 Å²	18	58 Å²	58	9%	0.092	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-47.2	173.4	-70.4	167.5	0	0	0	111.3	Y467 R468 L469 S473 G474 D475 A493 I523	Y467-I471 HydrophobicContact CD2-CD1 3.9Å; Y467-I471 HydrophobicContact CE2-CD1 4.43Å; Y467-I471 VanDerWaalsContact O-CG1 3.25Å; Y467-I471 WeakPolarHBondContact O-CG1 3.47Å; Y467-I471 PolarHBondContact O-N 3.05Å; R468-I471 PolarHBondContact O-N 2.96Å; L469-I471 VanDerWaalsContact C-N 3.3Å; L469-I471 PolarHBondContact O-N 3.36Å; I471-S473 VanDerWaalsContact C-N 3.35Å; I471-S473 PolarHBondContact O-N 3.16Å; I471-G474 PolarHBondContact O-N 3.17Å; I471-D475 PolarHBondContact O-N 2.88Å; I471-A493 HydrophobicContact CG1-CB 4.01Å; I471-I523 HydrophobicContact CD1-CD1 3.69Å; I471-I523 HydrophobicContact CD1-CG1 3.68Å; I471-I523 HydrophobicContact CG1-CD1 4.21Å; I471-I523 HydrophobicContact CG1-CG1 4.03Å
472	L	89	Confident	89.1	Confident	28 Å²	28	54 Å²	54	15%	0.147	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-39	178.7	-70.6	168.2	0	0	0	111.9	I441 L444 I456 R468 L469 D475 C476	I441-L472 HydrophobicContact CD1-CD1 4.16Å; I441-L472 HydrophobicContact CG1-CD1 3.91Å; I441-L472 HydrophobicContact CG1-CD2 4.08Å; L444-L472 HydrophobicContact CD1-CD2 4.19Å; I456-L472 HydrophobicContact CD1-CB 3.7Å; I456-L472 HydrophobicContact CG1-CB 4.44Å; R468-L472 WeakPolarHBondContact O-CG 3.42Å; R468-L472 PolarHBondContact O-N 3.43Å; R468-L472 VanDerWaalsContact O-N 3.08Å; L469-L472 HydrophobicContact CD2-CD1 4.44Å; L469-L472 PolarHBondContact O-N 3.21Å; L472-D475 PolarHBondContact O-N 3.31Å; L472-C476 PolarHBondContact O-N 3.29Å; L472-C476 PolarHBondContact O-SG 3.26Å; L472-C476 VanDerWaalsContact O-SG 3.4Å
473	S	92.3	Very high	89.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-47.4	172.4	174.6	0	0	0	0	110.9	N453 L469 L470 I471 D475 C476 Q477	N453-S473 PolarHBondContact OD1-OG 3.18Å; L469-S473 WeakPolarHBondContact O-CB 3.41Å; L469-S473 PolarHBondContact O-N 3.41Å; L470-S473 PolarHBondContact O-N 2.85Å; I471-S473 VanDerWaalsContact C-N 3.35Å; I471-S473 PolarHBondContact O-N 3.16Å; S473-D475 VanDerWaalsContact C-N 3.33Å; S473-D475 PolarHBondContact O-N 3.24Å; S473-C476 PolarHBondContact O-N 3.15Å; S473-Q477 VanDerWaalsContact O-CG 3.28Å; S473-Q477 WeakPolarHBondContact O-CG 3.48Å; S473-Q477 PolarHBondContact O-N 3.37Å; S473-Q477 PolarHBondContact OG-NE2 3.22Å; S473-Q477 VanDerWaalsContact OG-NE2 3.1Å
474	G	90.9	Very high	89.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-40.9	175.5	0	0	0	0	0	112.6	L470 I471 Q477 Y478 S486 Y490	L470-G474 PolarHBondContact O-N 3.24Å; I471-G474 PolarHBondContact O-N 3.17Å; G474-Q477 PolarHBondContact O-N 3.16Å; G474-Y478 WeakPolarHBondContact O-CB 3.48Å; G474-Y478 PolarHBondContact O-N 3.37Å; G474-S486 PolarHBondContact O-OG 3.15Å; G474-Y490 VanDerWaalsContact C-CZ 3.43Å; G474-Y490 PolarHBondContact O-OH 3.39Å; G474-Y490 VanDerWaalsContact O-OH 3.14Å
475	D	90.8	Very high	90	Very high	17 Å²	17	53 Å²	53	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-47.7	176.6	-75	-25.6	0	0	0	110.4	L444 I471 L472 S473 Q477 Y478 F479 Y490 R526	L444-D475 HydrophobicContact CD1-CB 4.33Å; I471-D475 PolarHBondContact O-N 2.88Å; L472-D475 PolarHBondContact O-N 3.31Å; S473-D475 VanDerWaalsContact C-N 3.33Å; S473-D475 PolarHBondContact O-N 3.24Å; D475-Q477 VanDerWaalsContact C-N 3.35Å; D475-Q477 PolarHBondContact O-N 3.05Å; D475-Y478 WeakPolarHBondContact O-CB 3.26Å; D475-Y478 PolarHBondContact O-N 3.44Å; D475-F479 WeakPolarHBondContact O-CD2 3.24Å; D475-F479 PolarHBondContact O-N 3.46Å; D475-Y490 VanDerWaalsContact CA-OH 3.28Å; D475-Y490 WeakPolarHBondContact CA-OH 3.05Å; D475-Y490 PolarHBondContact N-OH 3.42Å; D475-Y490 VanDerWaalsContact N-OH 3.1Å; D475-Y490 PolarHBondContact OD1-OH 2.66Å; D475-R526 WeakPolarHBondContact OD1-CD 3.42Å; D475-R526 IonicContact OD1-CZ 3.67Å; D475-R526 IonicContact OD1-NE 2.58Å; D475-R526 PolarHBondContact OD1-NE 3.08Å; D475-R526 IonicContact OD1-NH2 3.91Å; D475-R526 IonicContact OD2-CZ 2.8Å; D475-R526 IonicContact OD2-NE 3.66Å; D475-R526 PolarHBondContact OD2-NE 3Å; D475-R526 IonicContact OD2-NH2 2.69Å; D475-R526 PolarHBondContact OD2-NH2 3.04Å
476	C	92	Very high	90.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.6	-47.6	175.1	-72.7	0	0	0	0	111.8	L444 S452 N453 L472 S473 Y478 F479 M480	L444-C476 VanDerWaalsContact CD1-SG 3.53Å; S452-C476 PolarHBondContact OG-SG 3.38Å; N453-C476 HydrophobicContact CB-CB 3.93Å; L472-C476 PolarHBondContact O-N 3.29Å; L472-C476 PolarHBondContact O-SG 3.26Å; L472-C476 VanDerWaalsContact O-SG 3.4Å; S473-C476 PolarHBondContact O-N 3.15Å; C476-Y478 VanDerWaalsContact C-N 3.33Å; C476-Y478 PolarHBondContact O-N 3.45Å; C476-F479 PolarHBondContact O-N 3.21Å; C476-M480 VanDerWaalsContact O-CG 3.3Å; C476-M480 WeakPolarHBondContact O-CG 3.45Å; C476-M480 PolarHBondContact O-N 2.83Å
477	Q	93.8	Very high	90.9	Very high	5 Å²	5	44.6 Å²	44.6	2%	0.023	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-35.3	-179.5	-68.7	172.7	24.9	0	0	112.5	S473 G474 D475 M480 K481 N482 N485	S473-Q477 VanDerWaalsContact O-CG 3.28Å; S473-Q477 WeakPolarHBondContact O-CG 3.48Å; S473-Q477 PolarHBondContact O-N 3.37Å; S473-Q477 PolarHBondContact OG-NE2 3.22Å; S473-Q477 VanDerWaalsContact OG-NE2 3.1Å; G474-Q477 PolarHBondContact O-N 3.16Å; D475-Q477 VanDerWaalsContact C-N 3.35Å; D475-Q477 PolarHBondContact O-N 3.05Å; Q477-M480 CarbonylContact O-C 3.57Å; Q477-M480 PolarHBondContact O-N 2.94Å; Q477-K481 PolarHBondContact O-N 3.4Å; Q477-N482 HydrophobicContact CB-CB 4.46Å; Q477-N482 PolarHBondContact O-N 3.28Å; Q477-N485 PolarHBondContact OE1-O 2.86Å
478	Y	93	Very high	91.2	Very high	48 Å²	48	47.9 Å²	47.9	19%	0.188	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-49.3	173.2	178.3	-96.4	0	0	0	111	G474 D475 C476 M480 K481 Y483 T530 Q533	G474-Y478 WeakPolarHBondContact O-CB 3.48Å; G474-Y478 PolarHBondContact O-N 3.37Å; D475-Y478 WeakPolarHBondContact O-CB 3.26Å; D475-Y478 PolarHBondContact O-N 3.44Å; C476-Y478 VanDerWaalsContact C-N 3.33Å; C476-Y478 PolarHBondContact O-N 3.45Å; Y478-M480 VanDerWaalsContact C-N 3.3Å; Y478-M480 PolarHBondContact O-N 3.49Å; Y478-K481 WeakPolarHBondContact O-CA 3.31Å; Y478-K481 PolarHBondContact O-N 2.82Å; Y478-Y483 AromaticContact CD2-CD1 3.71Å; Y478-Y483 HydrophobicContact CD2-CD1 3.71Å; Y478-Y483 AromaticContact CD2-CE1 3.75Å; Y478-Y483 HydrophobicContact CD2-CE1 3.75Å; Y478-Y483 AromaticContact CE2-CD1 3.99Å; Y478-Y483 HydrophobicContact CE2-CD1 3.99Å; Y478-Y483 AromaticContact CE2-CE1 3.75Å; Y478-Y483 HydrophobicContact CE2-CE1 3.75Å; Y478-Y483 HydrophobicContact CG-CE1 4.41Å; Y478-T530 HydrophobicContact CD2-CG2 3.57Å; Y478-T530 HydrophobicContact CE2-CG2 4.14Å; Y478-Q533 HydrophobicContact CE2-CG 3.95Å
479	F	91.3	Very high	91.4	Very high	85 Å²	85	41.5 Å²	41.5	37%	0.373	20%	0.196	S	C	.	.	H	α-helix	trans	-67.2	-30.3	178.4	-68.9	-61.1	0	0	0	112.9	L444 Y449 D475 C476 K481 F723	L444-F479 HydrophobicContact CD2-CE2 4.34Å; Y449-F479 HydrophobicContact CD1-CB 3.61Å; Y449-F479 HydrophobicContact CD1-CD2 4.01Å; Y449-F479 HydrophobicContact CD1-CG 4.1Å; Y449-F479 HydrophobicContact CD2-CB 3.87Å; Y449-F479 HydrophobicContact CE1-CB 3.46Å; Y449-F479 VanDerWaalsContact CE1-CB 3.46Å; Y449-F479 HydrophobicContact CE1-CD1 4.4Å; Y449-F479 AromaticContact CE1-CD2 3.62Å; Y449-F479 HydrophobicContact CE1-CD2 3.62Å; Y449-F479 HydrophobicContact CE1-CE2 4.48Å; Y449-F479 AromaticContact CE1-CG 3.58Å; Y449-F479 HydrophobicContact CE1-CG 3.58Å; Y449-F479 HydrophobicContact CE2-CB 3.75Å; Y449-F479 HydrophobicContact CG-CB 3.81Å; Y449-F479 AromaticContact CZ-CG 3.82Å; D475-F479 WeakPolarHBondContact O-CD2 3.24Å; D475-F479 PolarHBondContact O-N 3.46Å; C476-F479 PolarHBondContact O-N 3.21Å; F479-K481 PolarHBondContact O-N 3.13Å; F479-F723 HydrophobicContact CE2-CZ 4.5Å
480	M	91.9	Very high	91.5	Very high	65 Å²	65	41.6 Å²	41.6	32%	0.32	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	0	170.5	-67.8	177.4	70.8	0	0	114	Y449 Q450 C476 Q477 Y478 N482	Y449-M480 HydrophobicContact CG-CG 4.42Å; Q450-M480 HydrophobicContact CB-CE 4.22Å; Q450-M480 HydrophobicContact CB-SD 4.48Å; Q450-M480 HydrophobicContact CG-CE 4.47Å; C476-M480 VanDerWaalsContact O-CG 3.3Å; C476-M480 WeakPolarHBondContact O-CG 3.45Å; C476-M480 PolarHBondContact O-N 2.83Å; Q477-M480 CarbonylContact O-C 3.57Å; Q477-M480 PolarHBondContact O-N 2.94Å; Y478-M480 VanDerWaalsContact C-N 3.3Å; Y478-M480 PolarHBondContact O-N 3.49Å; M480-N482 PolarHBondContact O-N 3.17Å
481	K	90.5	Very high	91.5	Very high	154 Å²	154	43.5 Å²	43.5	67%	0.67	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.8	15.6	-176.4	-54.2	174.2	-179.6	171	0	115	Q477 Y478 F479 Y483	Q477-K481 PolarHBondContact O-N 3.4Å; Y478-K481 WeakPolarHBondContact O-CA 3.31Å; Y478-K481 PolarHBondContact O-N 2.82Å; F479-K481 PolarHBondContact O-N 3.13Å; K481-Y483 VanDerWaalsContact C-N 3.29Å; K481-Y483 HydrophobicContact CB-CE2 4.26Å; K481-Y483 PolarHBondContact O-N 2.9Å; K481-Y483 VanDerWaalsContact O-N 3.14Å
482	N	92.8	Very high	91.5	Very high	79 Å²	79	46 Å²	46	42%	0.422	22%	0.218	S	C	.	.			trans	-88.6	67.4	174.7	-68.7	-17.9	0	0	0	109.9	Q477 M480 E484 S486	Q477-N482 HydrophobicContact CB-CB 4.46Å; Q477-N482 PolarHBondContact O-N 3.28Å; M480-N482 PolarHBondContact O-N 3.17Å; N482-E484 VanDerWaalsContact C-N 3.35Å; N482-E484 PolarHBondContact O-N 3.3Å; N482-S486 WeakPolarHBondContact O-CB 3.26Å; N482-S486 PolarHBondContact O-N 2.96Å; N482-S486 VanDerWaalsContact O-N 3.1Å
483	Y	92.7	Very high	91.5	Very high	29 Å²	29	44.6 Å²	44.6	11%	0.114	21%	0.211	C	C	.	.	H	α-helix	trans	-68.7	-27.8	-168.5	-55.2	-61.4	0	0	0	114.7	Y478 K481 L487 Q533 N537	Y478-Y483 AromaticContact CD2-CD1 3.71Å; Y478-Y483 HydrophobicContact CD2-CD1 3.71Å; Y478-Y483 AromaticContact CD2-CE1 3.75Å; Y478-Y483 HydrophobicContact CD2-CE1 3.75Å; Y478-Y483 AromaticContact CE2-CD1 3.99Å; Y478-Y483 HydrophobicContact CE2-CD1 3.99Å; Y478-Y483 AromaticContact CE2-CE1 3.75Å; Y478-Y483 HydrophobicContact CE2-CE1 3.75Å; Y478-Y483 HydrophobicContact CG-CE1 4.41Å; K481-Y483 VanDerWaalsContact C-N 3.29Å; K481-Y483 HydrophobicContact CB-CE2 4.26Å; K481-Y483 PolarHBondContact O-N 2.9Å; K481-Y483 VanDerWaalsContact O-N 3.14Å; Y483-L487 WeakPolarHBondContact O-CB 3.45Å; Y483-L487 PolarHBondContact O-N 2.69Å; Y483-Q533 HydrophobicContact CD1-CB 3.99Å; Y483-Q533 HydrophobicContact CD2-CB 4.08Å; Y483-Q533 HydrophobicContact CE1-CB 3.8Å; Y483-Q533 HydrophobicContact CE1-CG 3.97Å; Y483-Q533 HydrophobicContact CE2-CB 3.88Å; Y483-Q533 HydrophobicContact CG-CB 4.12Å; Y483-N537 WeakPolarHBondContact CD2-ND2 3.47Å; Y483-N537 WeakPolarHBondContact CE2-ND2 3.45Å
484	E	92.7	Very high	91	Very high	99 Å²	99	47 Å²	47	46%	0.463	22%	0.221	S	C	.	.	H	α-helix	trans	-66.9	-49.9	178.6	-64.2	-172.6	161.2	0	0	110.9	N482 S486 L487 E488 L534 R538	N482-E484 VanDerWaalsContact C-N 3.35Å; N482-E484 PolarHBondContact O-N 3.3Å; E484-S486 VanDerWaalsContact C-N 3.32Å; E484-S486 PolarHBondContact O-N 3.43Å; E484-L487 WeakPolarHBondContact O-CB 3.16Å; E484-L487 PolarHBondContact O-N 2.68Å; E484-E488 PolarHBondContact O-N 3.3Å; E484-E488 VanDerWaalsContact O-N 3.14Å; E484-L534 HydrophobicContact CG-CD2 3.62Å; E484-R538 IonicContact OE1-CZ 3.43Å; E484-R538 IonicContact OE1-NH2 3.57Å; E484-R538 PolarHBondContact OE1-NH2 3.17Å
485	N	93	Very high	90.7	Very high	83 Å²	83	49.2 Å²	49.2	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-63.5	-41	176.1	-59	1.7	0	0	0	110.7	Q477 L487 E488 E489	Q477-N485 PolarHBondContact OE1-O 2.86Å; N485-L487 VanDerWaalsContact C-N 3.28Å; N485-L487 PolarHBondContact O-N 2.9Å; N485-E488 WeakPolarHBondContact O-CB 3.48Å; N485-E488 PolarHBondContact O-N 2.88Å; N485-E488 VanDerWaalsContact O-N 3.15Å; N485-E489 WeakPolarHBondContact O-CG 3.31Å; N485-E489 PolarHBondContact O-N 3.4Å
486	S	91.9	Very high	90.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-41.8	177.3	-178.3	0	0	0	0	111.9	G474 N482 E484 E489 Y490 T530	G474-S486 PolarHBondContact O-OG 3.15Å; N482-S486 WeakPolarHBondContact O-CB 3.26Å; N482-S486 PolarHBondContact O-N 2.96Å; N482-S486 VanDerWaalsContact O-N 3.1Å; E484-S486 VanDerWaalsContact C-N 3.32Å; E484-S486 PolarHBondContact O-N 3.43Å; S486-E489 PolarHBondContact O-N 3.43Å; S486-Y490 WeakPolarHBondContact O-CD2 3.41Å; S486-Y490 VanDerWaalsContact O-CG 3.3Å; S486-Y490 PolarHBondContact O-N 3.47Å; S486-Y490 VanDerWaalsContact O-N 3.08Å; S486-Y490 WeakPolarHBondContact OG-CE2 3.31Å; S486-T530 WeakPolarHBondContact OG-CG2 3.38Å
487	L	92.3	Very high	89.8	Confident	15 Å²	15	50.4 Å²	50.4	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-42.2	176.7	-179.6	64.5	0	0	0	112.2	Y483 E484 N485 Y490 E491 I527 L534 Y550	Y483-L487 WeakPolarHBondContact O-CB 3.45Å; Y483-L487 PolarHBondContact O-N 2.69Å; E484-L487 WeakPolarHBondContact O-CB 3.16Å; E484-L487 PolarHBondContact O-N 2.68Å; N485-L487 VanDerWaalsContact C-N 3.28Å; N485-L487 PolarHBondContact O-N 2.9Å; L487-Y490 PolarHBondContact O-N 3.25Å; L487-E491 WeakPolarHBondContact O-CG 3.47Å; L487-E491 PolarHBondContact O-N 3.12Å; L487-I527 HydrophobicContact CD1-CG2 3.75Å; L487-L534 HydrophobicContact CB-CD1 4.34Å; L487-L534 HydrophobicContact CD2-CD1 3.79Å; L487-Y550 HydrophobicContact CD2-CE1 3.95Å
488	E	92.4	Very high	88.9	Confident	119 Å²	119	52.5 Å²	52.5	56%	0.556	26%	0.259	S	S	*	.	H	α-helix	trans	-61.5	-46.3	176.7	-171.5	-177.9	172.4	0	0	111.4	E484 N485 Y490 E491 N492	E484-E488 PolarHBondContact O-N 3.3Å; E484-E488 VanDerWaalsContact O-N 3.14Å; N485-E488 WeakPolarHBondContact O-CB 3.48Å; N485-E488 PolarHBondContact O-N 2.88Å; N485-E488 VanDerWaalsContact O-N 3.15Å; E488-Y490 PolarHBondContact O-N 3.22Å; E488-E491 PolarHBondContact O-N 3.3Å; E488-N492 WeakPolarHBondContact O-CB 3.47Å; E488-N492 PolarHBondContact O-N 3.05Å; E488-N492 PolarHBondContact O-ND2 3.4Å
489	E	90.7	Very high	88.2	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.065	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-42.5	177.9	-66.3	-66.4	169.5	0	0	112.3	R457 L470 N485 S486 N492 A493	R457-E489 IonicContact CZ-OE1 3.31Å; R457-E489 IonicContact NH1-OE1 2.69Å; R457-E489 PolarHBondContact NH1-OE1 2.73Å; R457-E489 IonicContact NH1-OE2 3.37Å; R457-E489 IonicContact NH2-OE1 3.15Å; R457-E489 PolarHBondContact NH2-OE1 3.42Å; L470-E489 WeakPolarHBondContact CD2-OE2 3.43Å; N485-E489 WeakPolarHBondContact O-CG 3.31Å; N485-E489 PolarHBondContact O-N 3.4Å; S486-E489 PolarHBondContact O-N 3.43Å; E489-N492 PolarHBondContact O-N 3.39Å; E489-A493 WeakPolarHBondContact O-CB 3.49Å; E489-A493 PolarHBondContact O-N 2.77Å
490	Y	90.2	Very high	87.2	Confident	3 Å²	3	56.9 Å²	56.9	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-37.8	176.8	-64.6	-36.9	0	0	0	113.1	G474 D475 S486 L487 E488 A493 K494 R526 I527 T530	G474-Y490 VanDerWaalsContact C-CZ 3.43Å; G474-Y490 PolarHBondContact O-OH 3.39Å; G474-Y490 VanDerWaalsContact O-OH 3.14Å; D475-Y490 VanDerWaalsContact CA-OH 3.28Å; D475-Y490 WeakPolarHBondContact CA-OH 3.05Å; D475-Y490 PolarHBondContact N-OH 3.42Å; D475-Y490 VanDerWaalsContact N-OH 3.1Å; D475-Y490 PolarHBondContact OD1-OH 2.66Å; S486-Y490 WeakPolarHBondContact O-CD2 3.41Å; S486-Y490 VanDerWaalsContact O-CG 3.3Å; S486-Y490 PolarHBondContact O-N 3.47Å; S486-Y490 VanDerWaalsContact O-N 3.08Å; S486-Y490 WeakPolarHBondContact OG-CE2 3.31Å; L487-Y490 PolarHBondContact O-N 3.25Å; E488-Y490 PolarHBondContact O-N 3.22Å; Y490-A493 PolarHBondContact O-N 2.95Å; Y490-K494 WeakPolarHBondContact O-CB 3.46Å; Y490-K494 PolarHBondContact O-N 3.39Å; Y490-R526 HydrophobicContact CD1-CB 4.41Å; Y490-R526 HydrophobicContact CD2-CB 4.05Å; Y490-R526 HydrophobicContact CE1-CB 4.15Å; Y490-R526 HydrophobicContact CE1-CG 4.47Å; Y490-R526 HydrophobicContact CE2-CB 3.76Å; Y490-R526 HydrophobicContact CG-CB 4.37Å; Y490-I527 HydrophobicContact CD2-CG1 4.39Å; Y490-I527 HydrophobicContact CG-CG1 4.36Å; Y490-T530 HydrophobicContact CD2-CG2 3.99Å; Y490-T530 HydrophobicContact CE2-CG2 3.56Å
491	E	89.1	Confident	86	Confident	53 Å²	53	56 Å²	56	25%	0.248	28%	0.276	C	S	.	.	H	α-helix	trans	-69.4	-37.7	175.2	-75.8	-61.4	160.8	0	0	112.1	L487 E488 A493 K494 S495 I527 R553	L487-E491 WeakPolarHBondContact O-CG 3.47Å; L487-E491 PolarHBondContact O-N 3.12Å; E488-E491 PolarHBondContact O-N 3.3Å; E491-A493 VanDerWaalsContact C-N 3.34Å; E491-A493 PolarHBondContact O-N 2.58Å; E491-K494 PolarHBondContact O-N 3.48Å; E491-S495 WeakPolarHBondContact O-CB 3.23Å; E491-S495 PolarHBondContact O-N 3.38Å; E491-I527 WeakPolarHBondContact OE1-CD1 3.14Å; E491-R553 IonicContact OE1-CZ 3.44Å; E491-R553 IonicContact OE1-NH2 3.59Å; E491-R553 PolarHBondContact OE1-NH2 3.43Å
492	N	89.3	Confident	84.7	Confident	69 Å²	69	53.1 Å²	53.1	37%	0.369	27%	0.271	S	S	.	.	H	α-helix	trans	-60.3	-45.4	171.3	-71.4	-22.2	0	0	0	110.8	L470 E488 E489 K494 S495 I496	L470-N492 HydrophobicContact CD1-CB 4.18Å; E488-N492 WeakPolarHBondContact O-CB 3.47Å; E488-N492 PolarHBondContact O-N 3.05Å; E488-N492 PolarHBondContact O-ND2 3.4Å; E489-N492 PolarHBondContact O-N 3.39Å; N492-K494 PolarHBondContact O-N 3.05Å; N492-S495 PolarHBondContact O-N 2.94Å; N492-I496 WeakPolarHBondContact O-CG1 3.35Å; N492-I496 PolarHBondContact O-N 3.31Å; N492-I496 VanDerWaalsContact O-N 3.08Å
493	A	87.2	Confident	83	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-44.5	174.9	0	0	0	0	0	112.1	L470 I471 E489 Y490 E491 I496 I497 I523	L470-A493 HydrophobicContact CB-CB 3.88Å; L470-A493 HydrophobicContact CD1-CB 4.29Å; I471-A493 HydrophobicContact CG1-CB 4.01Å; E489-A493 WeakPolarHBondContact O-CB 3.49Å; E489-A493 PolarHBondContact O-N 2.77Å; Y490-A493 PolarHBondContact O-N 2.95Å; E491-A493 VanDerWaalsContact C-N 3.34Å; E491-A493 PolarHBondContact O-N 2.58Å; A493-I496 PolarHBondContact O-N 3.27Å; A493-I497 WeakPolarHBondContact O-CG1 3.39Å; A493-I497 PolarHBondContact O-N 3.06Å; A493-I497 VanDerWaalsContact O-N 3.09Å; A493-I523 HydrophobicContact CB-CD1 4.41Å
494	K	82.8	Confident	81.1	Confident	49 Å²	49	57.4 Å²	57.4	21%	0.213	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-41.2	177.5	-176.9	175.6	173.3	175.5	0	112.3	Y490 E491 N492 I496 I497 S498 I523 N524 I527	Y490-K494 WeakPolarHBondContact O-CB 3.46Å; Y490-K494 PolarHBondContact O-N 3.39Å; E491-K494 PolarHBondContact O-N 3.48Å; N492-K494 PolarHBondContact O-N 3.05Å; K494-I496 VanDerWaalsContact C-N 3.34Å; K494-I497 PolarHBondContact O-N 3.09Å; K494-S498 WeakPolarHBondContact O-CB 3.35Å; K494-S498 PolarHBondContact O-N 3.13Å; K494-S498 PolarHBondContact O-OG 3.03Å; K494-I523 HydrophobicContact CB-CG2 4.16Å; K494-N524 WeakPolarHBondContact CE-OD1 3.43Å; K494-N524 PolarHBondContact NZ-OD1 3.07Å; K494-I527 HydrophobicContact CD-CD1 3.94Å
495	S	84.9	Confident	78.7	Confident	48 Å²	48	60 Å²	60	34%	0.336	32%	0.319	S	S	.	.	H	α-helix	trans	-62.6	-38.8	176.3	-178.2	0	0	0	0	112.3	E491 N492 S498 K499	E491-S495 WeakPolarHBondContact O-CB 3.23Å; E491-S495 PolarHBondContact O-N 3.38Å; N492-S495 PolarHBondContact O-N 2.94Å; S495-S498 WeakPolarHBondContact CA-OG 3.47Å; S495-S498 PolarHBondContact O-OG 3.16Å; S495-K499 VanDerWaalsContact O-CG 3.25Å; S495-K499 WeakPolarHBondContact O-CG 3.29Å; S495-K499 PolarHBondContact O-N 3.36Å; S495-K499 VanDerWaalsContact O-N 3.16Å
496	I	83.8	Confident	76.3	Confident	35 Å²	35	61.4 Å²	61.4	18%	0.179	32%	0.322	C	S	.	.	H	α-helix	trans	-68.1	-45.7	176.5	-67.7	170.2	0	0	0	110.9	L470 N492 A493 K494 K499 Q500	L470-I496 HydrophobicContact CD1-CD1 3.47Å; L470-I496 VanDerWaalsContact CD1-CD1 3.47Å; N492-I496 WeakPolarHBondContact O-CG1 3.35Å; N492-I496 PolarHBondContact O-N 3.31Å; N492-I496 VanDerWaalsContact O-N 3.08Å; A493-I496 PolarHBondContact O-N 3.27Å; K494-I496 VanDerWaalsContact C-N 3.34Å; I496-K499 PolarHBondContact O-N 3.42Å; I496-Q500 WeakPolarHBondContact O-CG 3.45Å; I496-Q500 PolarHBondContact O-N 3.37Å
497	I	78.6	Confident	74.1	Confident	7 Å²	7	62.8 Å²	62.8	4%	0.036	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-41.4	-180	-64.8	164.1	0	0	0	110.9	Y467 A493 K494 K499 Q500 L501 I520 I523	Y467-I497 HydrophobicContact CD1-CD1 4.45Å; Y467-I497 HydrophobicContact CD1-CG1 3.85Å; Y467-I497 HydrophobicContact CD2-CD1 3.53Å; Y467-I497 HydrophobicContact CD2-CG1 3.85Å; Y467-I497 HydrophobicContact CE1-CG1 4.36Å; Y467-I497 HydrophobicContact CE2-CD1 4.03Å; Y467-I497 HydrophobicContact CE2-CG1 4.37Å; Y467-I497 HydrophobicContact CG-CD1 3.78Å; Y467-I497 HydrophobicContact CG-CG1 3.57Å; A493-I497 WeakPolarHBondContact O-CG1 3.39Å; A493-I497 PolarHBondContact O-N 3.06Å; A493-I497 VanDerWaalsContact O-N 3.09Å; K494-I497 PolarHBondContact O-N 3.09Å; I497-K499 VanDerWaalsContact C-N 3.32Å; I497-K499 PolarHBondContact O-N 2.67Å; I497-Q500 PolarHBondContact O-N 3.38Å; I497-L501 HydrophobicContact CG2-CD1 3.89Å; I497-L501 HydrophobicContact CG2-CG 4.42Å; I497-L501 WeakPolarHBondContact O-CG 3.21Å; I497-L501 PolarHBondContact O-N 2.94Å; I497-I520 HydrophobicContact CB-CG1 4.48Å; I497-I520 HydrophobicContact CG2-CD1 3.93Å; I497-I520 HydrophobicContact CG2-CG1 3.62Å; I497-I523 HydrophobicContact CD1-CD1 3.1Å
498	S	75.8	Confident	71.9	Confident	49 Å²	49	66.2 Å²	66.2	34%	0.343	35%	0.349	S	S	.	.	H	α-helix	trans	-62	-41.3	178.2	66.8	0	0	0	0	111.5	K494 S495 L501 T502	K494-S498 WeakPolarHBondContact O-CB 3.35Å; K494-S498 PolarHBondContact O-N 3.13Å; K494-S498 PolarHBondContact O-OG 3.03Å; S495-S498 WeakPolarHBondContact CA-OG 3.47Å; S495-S498 PolarHBondContact O-OG 3.16Å; S498-L501 PolarHBondContact O-N 3.46Å; S498-T502 WeakPolarHBondContact O-CG2 3.25Å; S498-T502 PolarHBondContact O-N 3.35Å; S498-T502 PolarHBondContact O-OG1 3.05Å
499	K	77.4	Confident	69.7	Low	126 Å²	126	63 Å²	63	55%	0.548	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-47.2	172.9	-72.9	172.1	-175.8	178.3	0	112.4	S495 I496 I497 L501 T502 D503	S495-K499 VanDerWaalsContact O-CG 3.25Å; S495-K499 WeakPolarHBondContact O-CG 3.29Å; S495-K499 PolarHBondContact O-N 3.36Å; S495-K499 VanDerWaalsContact O-N 3.16Å; I496-K499 PolarHBondContact O-N 3.42Å; I497-K499 VanDerWaalsContact C-N 3.32Å; I497-K499 PolarHBondContact O-N 2.67Å; K499-L501 PolarHBondContact O-N 3.44Å; K499-T502 WeakPolarHBondContact CA-OG1 3.34Å; K499-T502 PolarHBondContact O-N 3.33Å; K499-T502 PolarHBondContact O-OG1 3.11Å; K499-D503 VanDerWaalsContact O-CG 3.28Å; K499-D503 PolarHBondContact O-N 3.39Å; K499-D503 VanDerWaalsContact O-N 3.08Å
500	Q	71.9	Confident	67.3	Low	99 Å²	99	68.1 Å²	68.1	46%	0.463	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-34.2	177.4	-73.7	179.1	-9.5	0	0	112.7	I496 I497	I496-Q500 WeakPolarHBondContact O-CG 3.45Å; I496-Q500 PolarHBondContact O-N 3.37Å; I497-Q500 PolarHBondContact O-N 3.38Å
501	L	65.4	Low	64.7	Low	47 Å²	47	73 Å²	73	25%	0.246	39%	0.394	C	S	.	.	H	α-helix	trans	-76.2	-39.7	175.9	-69.5	164.4	0	0	0	112.4	I497 S498 K499 D503 S504 P517 I520	I497-L501 HydrophobicContact CG2-CD1 3.89Å; I497-L501 HydrophobicContact CG2-CG 4.42Å; I497-L501 WeakPolarHBondContact O-CG 3.21Å; I497-L501 PolarHBondContact O-N 2.94Å; S498-L501 PolarHBondContact O-N 3.46Å; K499-L501 PolarHBondContact O-N 3.44Å; L501-D503 VanDerWaalsContact C-N 3.29Å; L501-D503 PolarHBondContact O-N 3.26Å; L501-S504 WeakPolarHBondContact O-CB 3.35Å; L501-S504 PolarHBondContact O-N 3.03Å; L501-S504 VanDerWaalsContact O-N 3.15Å; L501-S504 PolarHBondContact O-OG 3.2Å; L501-P517 HydrophobicContact CD1-CG 3.76Å; L501-P517 HydrophobicContact CD2-CG 3.99Å; L501-I520 HydrophobicContact CD1-CD1 3.39Å; L501-I520 HydrophobicContact CD1-CG1 4.36Å
502	T	63.7	Low	62.2	Low	92 Å²	92	78.2 Å²	78.2	56%	0.564	42%	0.423	S	S	*	.	H	α-helix	trans	-63.8	-35.5	177.6	49.3	0	0	0	0	112.3	S498 K499 S504 N505	S498-T502 WeakPolarHBondContact O-CG2 3.25Å; S498-T502 PolarHBondContact O-N 3.35Å; S498-T502 PolarHBondContact O-OG1 3.05Å; K499-T502 WeakPolarHBondContact CA-OG1 3.34Å; K499-T502 PolarHBondContact O-N 3.33Å; K499-T502 PolarHBondContact O-OG1 3.11Å; T502-S504 PolarHBondContact O-N 3.25Å; T502-N505 PolarHBondContact O-N 3.42Å; T502-N505 VanDerWaalsContact O-N 3.12Å
503	D	57.2	Low	59.6	Low	130 Å²	130	79.5 Å²	79.5	70%	0.695	43%	0.428	S	S	*	.	H	α-helix	trans	-63.9	-24.6	177	-66.8	-18.1	0	0	0	112.4	K499 L501 N505	K499-D503 VanDerWaalsContact O-CG 3.28Å; K499-D503 PolarHBondContact O-N 3.39Å; K499-D503 VanDerWaalsContact O-N 3.08Å; L501-D503 VanDerWaalsContact C-N 3.29Å; L501-D503 PolarHBondContact O-N 3.26Å; D503-N505 PolarHBondContact O-N 3.01Å
504	S	52.2	Low	57.3	Low	68 Å²	68	83.2 Å²	83.2	48%	0.476	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	3.8	176.2	74.4	0	0	0	0	114.2	L501 T502 H506	L501-S504 WeakPolarHBondContact O-CB 3.35Å; L501-S504 PolarHBondContact O-N 3.03Å; L501-S504 VanDerWaalsContact O-N 3.15Å; L501-S504 PolarHBondContact O-OG 3.2Å; T502-S504 PolarHBondContact O-N 3.25Å; S504-H506 PolarHBondContact O-N 2.95Å
505	N	43.9	Very low	55.4	Low	154 Å²	154	88.7 Å²	88.7	82%	0.824	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	8.9	-178.7	-85.8	-23.4	0	0	0	115.5	T502 D503 C507	T502-N505 PolarHBondContact O-N 3.42Å; T502-N505 VanDerWaalsContact O-N 3.12Å; D503-N505 PolarHBondContact O-N 3.01Å; N505-C507 PolarHBondContact O-N 3.46Å
506	H	42.3	Very low	53.7	Low	112 Å²	112	87.8 Å²	87.8	52%	0.519	46%	0.461	S	S	.	.			trans	-80.5	100.2	171.8	-118.2	75.5	0	0	0	108.5	S504 I508 N511	S504-H506 PolarHBondContact O-N 2.95Å; H506-I508 PolarHBondContact O-N 3.22Å; H506-N511 PolarHBondContact NE2-ND2 2.77Å
507	C	44.3	Very low	52.5	Low	29 Å²	29	88 Å²	88	20%	0.196	47%	0.465	C	S	.	.			trans	-53.4	115.5	154.2	-160.2	0	0	0	0	105	N505 C509 N510	N505-C507 PolarHBondContact O-N 3.46Å; C507-C509 HydrophobicContact CB-CB 4.2Å; C507-C509 WeakPolarHBondContact CB-SG 3.32Å; C507-C509 PolarHBondContact O-N 2.97Å; C507-C509 WeakPolarHBondContact SG-CB 3.35Å; C507-C509 CovalentContact SG-SG 2.07Å; C507-C509 PolarHBondContact SG-SG 3.01Å; C507-N510 HydrophobicContact CB-CB 4.1Å; C507-N510 PolarHBondContact O-N 3.03Å
508	I	47.3	Very low	51.7	Low	87 Å²	87	96 Å²	96	45%	0.446	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-11.8	172.7	-60.7	168.7	0	0	0	111.1	H506	H506-I508 PolarHBondContact O-N 3.22Å
509	C	46.8	Very low	51.2	Low	53 Å²	53	95.6 Å²	95.6	36%	0.358	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-26	-176	3.2	0	0	0	0	115.8	C507 C669 C672	C507-C509 HydrophobicContact CB-CB 4.2Å; C507-C509 WeakPolarHBondContact CB-SG 3.32Å; C507-C509 PolarHBondContact O-N 2.97Å; C507-C509 WeakPolarHBondContact SG-CB 3.35Å; C507-C509 CovalentContact SG-SG 2.07Å; C507-C509 PolarHBondContact SG-SG 3.01Å; C509-C669 PolarHBondContact SG-SG 3.35Å; C509-C672 WeakPolarHBondContact CB-SG 3.3Å; C509-C672 PolarHBondContact SG-SG 3.45Å
510	N	38.4	Very low	50.8	Low	121 Å²	121	90.4 Å²	90.4	65%	0.647	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-14.7	-165.4	-90.9	6.9	0	0	0	115.2	C507	C507-N510 HydrophobicContact CB-CB 4.1Å; C507-N510 PolarHBondContact O-N 3.03Å
511	N	36.5	Very low	50.7	Low	106 Å²	106	87.5 Å²	87.5	57%	0.567	47%	0.465	S	S	*	.	S	Bend	trans	-114.9	120.7	168.5	-72.9	-9.6	0	0	0	107	H506 M513	H506-N511 PolarHBondContact NE2-ND2 2.77Å; N511-M513 PolarHBondContact O-N 3.47Å
512	N	35.7	Very low	51.1	Low	161 Å²	161	88 Å²	88	86%	0.861	47%	0.473	S	S	*	.	S	Bend	trans	-20.9	127.7	173.2	-71.1	-25	0	0	0	113
513	M	34.7	Very low	51.9	Low	96 Å²	96	83.7 Å²	83.7	47%	0.473	45%	0.446	S	S	.	.	S	Bend	trans	94.3	114.7	175.6	-51.5	-67.3	-74.2	0	0	114.4	N511 K515	N511-M513 PolarHBondContact O-N 3.47Å; M513-K515 HydrophobicContact CB-CG 4.01Å; M513-K515 PolarHBondContact O-N 3.47Å
514	M	39.7	Very low	53	Low	79 Å²	79	77.8 Å²	77.8	39%	0.389	42%	0.415	S	S	.	.			trans	-64.2	48.3	163.1	-159	-174.9	172.1	0	0	110.9	I516 F707	M514-I516 HydrophobicContact CE-CD1 4.31Å; M514-I516 PolarHBondContact O-N 2.9Å; M514-F707 HydrophobicContact CE-CZ 4.37Å
515	K	43	Very low	54.4	Low	164 Å²	164	74.9 Å²	74.9	71%	0.713	40%	0.396	S	S	*	.			trans	-73.6	80.8	170.3	-76.1	-171.7	-179.3	-174	0	107.1	M513	M513-K515 HydrophobicContact CB-CG 4.01Å; M513-K515 PolarHBondContact O-N 3.47Å
516	I	49.7	Very low	56.3	Low	28 Å²	28	70.6 Å²	70.6	14%	0.144	37%	0.368	C	S	.	.			trans	-48.6	126.9	163.3	-63.2	162.5	0	0	0	106.3	M514 E518 I520 N521 F707	M514-I516 HydrophobicContact CE-CD1 4.31Å; M514-I516 PolarHBondContact O-N 2.9Å; I516-E518 PolarHBondContact O-N 3.13Å; I516-I520 HydrophobicContact CG2-CB 3.47Å; I516-I520 VanDerWaalsContact CG2-CB 3.47Å; I516-I520 HydrophobicContact CG2-CG2 3.39Å; I516-N521 WeakPolarHBondContact CB-OD1 3.43Å; I516-N521 WeakPolarHBondContact CG2-OD1 3.29Å; I516-F707 HydrophobicContact CD1-CD1 3.77Å; I516-F707 HydrophobicContact CD1-CE1 3.18Å; I516-F707 HydrophobicContact CD1-CZ 3.85Å
517	P	58	Low	58.5	Low	39 Å²	39	65.2 Å²	65.2	25%	0.253	34%	0.343	S	S	.	.			trans	-49.7	136.2	177.8	-30.5	37.3	0	0	0	110.3	L501 S519 I520 N521	L501-P517 HydrophobicContact CD1-CG 3.76Å; L501-P517 HydrophobicContact CD2-CG 3.99Å; P517-S519 PolarHBondContact O-N 3.13Å; P517-I520 PolarHBondContact O-N 3.32Å; P517-N521 PolarHBondContact O-N 3.42Å; P517-N521 VanDerWaalsContact O-N 3.13Å
518	E	62.2	Low	60.5	Low	175 Å²	175	63.9 Å²	63.9	82%	0.818	33%	0.334	S	S	*	.	H	α-helix	trans	-51	-30.1	-177.8	-70.6	173.2	177.5	0	0	112.3	I516 N521 S522	I516-E518 PolarHBondContact O-N 3.13Å; E518-N521 PolarHBondContact O-N 3.08Å; E518-S522 WeakPolarHBondContact O-CB 3.44Å; E518-S522 PolarHBondContact O-N 2.81Å
519	S	65.9	Low	62.5	Low	41 Å²	41	62 Å²	62	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-46	172.6	55	0	0	0	0	113.7	P517 S522 I523	P517-S519 PolarHBondContact O-N 3.13Å; S519-S522 PolarHBondContact O-N 3.38Å; S519-I523 WeakPolarHBondContact O-CD1 3.38Å; S519-I523 VanDerWaalsContact O-CG1 3.29Å; S519-I523 WeakPolarHBondContact O-CG1 3.49Å; S519-I523 PolarHBondContact O-N 3.34Å; S519-I523 VanDerWaalsContact O-N 3.12Å
520	I	69.2	Low	64.6	Low	17 Å²	17	59.5 Å²	59.5	9%	0.087	31%	0.307	C	S	.	.	H	α-helix	trans	-69	-39.2	177	-67	-178.7	0	0	0	110.1	I497 L501 I516 P517 I523 N524	I497-I520 HydrophobicContact CB-CG1 4.48Å; I497-I520 HydrophobicContact CG2-CD1 3.93Å; I497-I520 HydrophobicContact CG2-CG1 3.62Å; L501-I520 HydrophobicContact CD1-CD1 3.39Å; L501-I520 HydrophobicContact CD1-CG1 4.36Å; I516-I520 HydrophobicContact CG2-CB 3.47Å; I516-I520 VanDerWaalsContact CG2-CB 3.47Å; I516-I520 HydrophobicContact CG2-CG2 3.39Å; P517-I520 PolarHBondContact O-N 3.32Å; I520-I523 PolarHBondContact O-N 3.44Å; I520-N524 WeakPolarHBondContact O-CB 3.46Å; I520-N524 VanDerWaalsContact O-CG 3.3Å; I520-N524 PolarHBondContact O-N 3.38Å; I520-N524 PolarHBondContact O-ND2 3.04Å
521	N	68.2	Low	67.1	Low	38 Å²	38	53.7 Å²	53.7	20%	0.203	28%	0.277	C	S	.	.	H	α-helix	trans	-60.6	-47.7	174.6	-79.8	-14.6	0	0	0	110.8	I516 P517 E518 I523 N524 G525 L709	I516-N521 WeakPolarHBondContact CB-OD1 3.43Å; I516-N521 WeakPolarHBondContact CG2-OD1 3.29Å; P517-N521 PolarHBondContact O-N 3.42Å; P517-N521 VanDerWaalsContact O-N 3.13Å; E518-N521 PolarHBondContact O-N 3.08Å; N521-I523 VanDerWaalsContact C-N 3.27Å; N521-I523 PolarHBondContact O-N 3.44Å; N521-N524 PolarHBondContact O-N 3.44Å; N521-G525 PolarHBondContact O-N 3.41Å; N521-L709 HydrophobicContact CB-CD2 4.46Å; N521-L709 WeakPolarHBondContact O-CD2 3.41Å
522	S	75	Confident	69.8	Low	59 Å²	59	50.2 Å²	50.2	41%	0.413	26%	0.256	S	S	.	.	H	α-helix	trans	-55.1	-42.2	175.8	-178.7	0	0	0	0	112.6	E518 S519 G525 R526	E518-S522 WeakPolarHBondContact O-CB 3.44Å; E518-S522 PolarHBondContact O-N 2.81Å; S519-S522 PolarHBondContact O-N 3.38Å; S522-G525 PolarHBondContact O-N 2.86Å; S522-R526 PolarHBondContact O-N 3.15Å; S522-R526 PolarHBondContact OG-NH1 3.11Å
523	I	80.3	Confident	72.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-71.9	-42.8	179	-64.8	163.8	0	0	0	111.7	I471 A493 K494 I497 S519 I520 N521 G525 R526 I527	I471-I523 HydrophobicContact CD1-CD1 3.69Å; I471-I523 HydrophobicContact CD1-CG1 3.68Å; I471-I523 HydrophobicContact CG1-CD1 4.21Å; I471-I523 HydrophobicContact CG1-CG1 4.03Å; A493-I523 HydrophobicContact CB-CD1 4.41Å; K494-I523 HydrophobicContact CB-CG2 4.16Å; I497-I523 HydrophobicContact CD1-CD1 3.1Å; S519-I523 WeakPolarHBondContact O-CD1 3.38Å; S519-I523 VanDerWaalsContact O-CG1 3.29Å; S519-I523 WeakPolarHBondContact O-CG1 3.49Å; S519-I523 PolarHBondContact O-N 3.34Å; S519-I523 VanDerWaalsContact O-N 3.12Å; I520-I523 PolarHBondContact O-N 3.44Å; N521-I523 VanDerWaalsContact C-N 3.27Å; N521-I523 PolarHBondContact O-N 3.44Å; I523-G525 PolarHBondContact O-N 3.32Å; I523-R526 WeakPolarHBondContact O-CB 3.44Å; I523-R526 PolarHBondContact O-N 3.42Å; I523-R526 VanDerWaalsContact O-N 3.1Å; I523-I527 HydrophobicContact CG2-CD1 3.66Å; I523-I527 HydrophobicContact CG2-CG1 4.21Å; I523-I527 WeakPolarHBondContact O-CG1 3.33Å; I523-I527 PolarHBondContact O-N 3.34Å
524	N	80.7	Confident	75.2	Confident	7 Å²	7	40.5 Å²	40.5	4%	0.037	20%	0.204	C	C	.	.	H	α-helix	trans	-58.4	-35.7	174.7	-76.8	-22.2	0	0	0	111.3	K494 I520 N521 I527 C528 L557 L709	K494-N524 WeakPolarHBondContact CE-OD1 3.43Å; K494-N524 PolarHBondContact NZ-OD1 3.07Å; I520-N524 WeakPolarHBondContact O-CB 3.46Å; I520-N524 VanDerWaalsContact O-CG 3.3Å; I520-N524 PolarHBondContact O-N 3.38Å; I520-N524 PolarHBondContact O-ND2 3.04Å; N521-N524 PolarHBondContact O-N 3.44Å; N524-I527 PolarHBondContact O-N 3.47Å; N524-C528 VanDerWaalsContact O-CB 3.26Å; N524-C528 WeakPolarHBondContact O-CB 3.45Å; N524-C528 PolarHBondContact O-N 3.37Å; N524-L557 HydrophobicContact CB-CD2 4.09Å; N524-L709 HydrophobicContact CB-CD2 4.2Å
525	G	80	Confident	77.8	Confident	7 Å²	7	36.8 Å²	36.8	7%	0.072	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-47.9	173.2	0	0	0	0	0	112.4	N521 S522 I523 C528 L529 L709	N521-G525 PolarHBondContact O-N 3.41Å; S522-G525 PolarHBondContact O-N 2.86Å; I523-G525 PolarHBondContact O-N 3.32Å; G525-C528 PolarHBondContact O-N 2.94Å; G525-L529 WeakPolarHBondContact O-CG 3.34Å; G525-L529 PolarHBondContact O-N 3.29Å; G525-L709 VanDerWaalsContact CA-CD2 3.49Å; G525-L709 VanDerWaalsContact N-CD2 3.26Å
526	R	85.3	Confident	80.1	Confident	63 Å²	63	32.6 Å²	32.6	24%	0.238	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-45.4	174.8	-70.4	176.9	163.8	119.1	-12.4	112.3	D475 Y490 S522 I523 C528 L529 T530	D475-R526 WeakPolarHBondContact OD1-CD 3.42Å; D475-R526 IonicContact OD1-CZ 3.67Å; D475-R526 IonicContact OD1-NE 2.58Å; D475-R526 PolarHBondContact OD1-NE 3.08Å; D475-R526 IonicContact OD1-NH2 3.91Å; D475-R526 IonicContact OD2-CZ 2.8Å; D475-R526 IonicContact OD2-NE 3.66Å; D475-R526 PolarHBondContact OD2-NE 3Å; D475-R526 IonicContact OD2-NH2 2.69Å; D475-R526 PolarHBondContact OD2-NH2 3.04Å; Y490-R526 HydrophobicContact CD1-CB 4.41Å; Y490-R526 HydrophobicContact CD2-CB 4.05Å; Y490-R526 HydrophobicContact CE1-CB 4.15Å; Y490-R526 HydrophobicContact CE1-CG 4.47Å; Y490-R526 HydrophobicContact CE2-CB 3.76Å; Y490-R526 HydrophobicContact CG-CB 4.37Å; S522-R526 PolarHBondContact O-N 3.15Å; S522-R526 PolarHBondContact OG-NH1 3.11Å; I523-R526 WeakPolarHBondContact O-CB 3.44Å; I523-R526 PolarHBondContact O-N 3.42Å; I523-R526 VanDerWaalsContact O-N 3.1Å; R526-C528 VanDerWaalsContact C-N 3.35Å; R526-C528 PolarHBondContact O-N 3.35Å; R526-L529 PolarHBondContact O-N 2.96Å; R526-T530 PolarHBondContact O-N 3.01Å; R526-T530 PolarHBondContact O-OG1 3.22Å; R526-T530 VanDerWaalsContact O-OG1 3.11Å
527	I	87.5	Confident	82	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.5	-47.6	176	-68.5	162.1	0	0	0	110.4	L487 Y490 E491 K494 I523 N524 L529 T530 C531 L557	L487-I527 HydrophobicContact CD1-CG2 3.75Å; Y490-I527 HydrophobicContact CD2-CG1 4.39Å; Y490-I527 HydrophobicContact CG-CG1 4.36Å; E491-I527 WeakPolarHBondContact OE1-CD1 3.14Å; K494-I527 HydrophobicContact CD-CD1 3.94Å; I523-I527 HydrophobicContact CG2-CD1 3.66Å; I523-I527 HydrophobicContact CG2-CG1 4.21Å; I523-I527 WeakPolarHBondContact O-CG1 3.33Å; I523-I527 PolarHBondContact O-N 3.34Å; N524-I527 PolarHBondContact O-N 3.47Å; I527-L529 VanDerWaalsContact C-N 3.34Å; I527-L529 PolarHBondContact O-N 3.34Å; I527-T530 VanDerWaalsContact C-OG1 3.26Å; I527-T530 WeakPolarHBondContact CA-OG1 3.39Å; I527-T530 PolarHBondContact O-N 3.47Å; I527-T530 PolarHBondContact O-OG1 3.16Å; I527-C531 WeakPolarHBondContact O-CB 3.35Å; I527-C531 PolarHBondContact O-N 3.17Å; I527-C531 PolarHBondContact O-SG 3.02Å; I527-C531 VanDerWaalsContact O-SG 3.33Å; I527-L557 HydrophobicContact CB-CD1 4.07Å; I527-L557 HydrophobicContact CG2-CD1 3.62Å
528	C	87.5	Confident	83.7	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-45.2	178.7	-170.7	0	0	0	0	111.5	N524 G525 R526 C531 Y532 C554 L557 F564	N524-C528 VanDerWaalsContact O-CB 3.26Å; N524-C528 WeakPolarHBondContact O-CB 3.45Å; N524-C528 PolarHBondContact O-N 3.37Å; G525-C528 PolarHBondContact O-N 2.94Å; R526-C528 VanDerWaalsContact C-N 3.35Å; R526-C528 PolarHBondContact O-N 3.35Å; C528-C531 PolarHBondContact O-N 3.43Å; C528-Y532 WeakPolarHBondContact O-CB 3.44Å; C528-Y532 PolarHBondContact O-N 3.39Å; C528-C554 PolarHBondContact O-SG 3.31Å; C528-C554 VanDerWaalsContact O-SG 3.33Å; C528-L557 HydrophobicContact CB-CB 4.31Å; C528-L557 HydrophobicContact CB-CD1 4.12Å; C528-F564 VanDerWaalsContact SG-CE2 3.52Å; C528-F564 VanDerWaalsContact SG-CZ 3.53Å
529	L	88.5	Confident	85	Confident	47 Å²	47	28.6 Å²	28.6	25%	0.246	15%	0.145	C	C	.	.	H	α-helix	trans	-62.8	-44.6	175.7	-70.2	173.2	0	0	0	112	G525 R526 I527 Y532 Q533 F710	G525-L529 WeakPolarHBondContact O-CG 3.34Å; G525-L529 PolarHBondContact O-N 3.29Å; R526-L529 PolarHBondContact O-N 2.96Å; I527-L529 VanDerWaalsContact C-N 3.34Å; I527-L529 PolarHBondContact O-N 3.34Å; L529-Y532 PolarHBondContact O-N 3.14Å; L529-Q533 WeakPolarHBondContact O-CG 3.37Å; L529-Q533 PolarHBondContact O-N 2.89Å; L529-F710 HydrophobicContact CD1-CE1 4.26Å; L529-F710 HydrophobicContact CD1-CZ 3.98Å; L529-F710 HydrophobicContact CD2-CZ 3.94Å; L529-F710 HydrophobicContact CG-CZ 4Å
530	T	90.5	Very high	86.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-47.6	175.6	41.8	0	0	0	0	112.8	Y478 S486 Y490 R526 I527 Y532 Q533 L534	Y478-T530 HydrophobicContact CD2-CG2 3.57Å; Y478-T530 HydrophobicContact CE2-CG2 4.14Å; S486-T530 WeakPolarHBondContact OG-CG2 3.38Å; Y490-T530 HydrophobicContact CD2-CG2 3.99Å; Y490-T530 HydrophobicContact CE2-CG2 3.56Å; R526-T530 PolarHBondContact O-N 3.01Å; R526-T530 PolarHBondContact O-OG1 3.22Å; R526-T530 VanDerWaalsContact O-OG1 3.11Å; I527-T530 VanDerWaalsContact C-OG1 3.26Å; I527-T530 WeakPolarHBondContact CA-OG1 3.39Å; I527-T530 PolarHBondContact O-N 3.47Å; I527-T530 PolarHBondContact O-OG1 3.16Å; T530-Y532 PolarHBondContact O-N 3.05Å; T530-Q533 PolarHBondContact O-N 3.27Å; T530-L534 WeakPolarHBondContact O-CG 3.18Å; T530-L534 PolarHBondContact O-N 2.94Å
531	C	91.9	Very high	87.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-37.1	178.8	-70.7	0	0	0	0	110.9	I527 C528 L534 S535 Y550 C554	I527-C531 WeakPolarHBondContact O-CB 3.35Å; I527-C531 PolarHBondContact O-N 3.17Å; I527-C531 PolarHBondContact O-SG 3.02Å; I527-C531 VanDerWaalsContact O-SG 3.33Å; C528-C531 PolarHBondContact O-N 3.43Å; C531-L534 PolarHBondContact O-N 3.32Å; C531-S535 WeakPolarHBondContact O-CB 3.43Å; C531-S535 PolarHBondContact O-N 3.02Å; C531-Y550 HydrophobicContact CB-CD1 4.18Å; C531-Y550 WeakPolarHBondContact O-CB 3.25Å; C531-C554 WeakPolarHBondContact CB-SG 3.37Å
532	Y	92	Very high	88.2	Confident	33 Å²	33	41.3 Å²	41.3	13%	0.129	20%	0.204	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176.2	-174	-124	0	0	0	112.6	C528 L529 T530 S535 K536 L551 C554 F564 T567	C528-Y532 WeakPolarHBondContact O-CB 3.44Å; C528-Y532 PolarHBondContact O-N 3.39Å; L529-Y532 PolarHBondContact O-N 3.14Å; T530-Y532 PolarHBondContact O-N 3.05Å; Y532-S535 PolarHBondContact O-N 3.44Å; Y532-K536 HydrophobicContact CE1-CD 4.26Å; Y532-K536 PolarHBondContact O-N 2.93Å; Y532-K536 WeakPolarHBondContact OH-CE 3.41Å; Y532-K536 PolarHBondContact OH-NZ 3.08Å; Y532-L551 HydrophobicContact CD2-CD2 4.05Å; Y532-L551 HydrophobicContact CE2-CD2 4.31Å; Y532-C554 PolarHBondContact N-SG 3.47Å; Y532-C554 VanDerWaalsContact N-SG 3.41Å; Y532-F564 HydrophobicContact CD1-CE1 4.13Å; Y532-F564 AromaticContact CD2-CD1 3.54Å; Y532-F564 HydrophobicContact CD2-CD1 3.54Å; Y532-F564 AromaticContact CD2-CE1 3.63Å; Y532-F564 HydrophobicContact CD2-CE1 3.63Å; Y532-F564 HydrophobicContact CE1-CE1 4.47Å; Y532-F564 AromaticContact CE2-CD1 3.73Å; Y532-F564 HydrophobicContact CE2-CD1 3.73Å; Y532-F564 HydrophobicContact CE2-CE1 4.04Å; Y532-F564 HydrophobicContact CG-CD1 4.1Å; Y532-F564 AromaticContact CG-CE1 3.68Å; Y532-F564 HydrophobicContact CG-CE1 3.68Å; Y532-T567 HydrophobicContact CE2-CG2 3.89Å
533	Q	92.1	Very high	89	Confident	47 Å²	47	40.3 Å²	40.3	22%	0.22	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-40.3	174.1	-64.4	-60.4	-15.3	0	0	112.3	Y478 Y483 L529 T530 K536 N537	Y478-Q533 HydrophobicContact CE2-CG 3.95Å; Y483-Q533 HydrophobicContact CD1-CB 3.99Å; Y483-Q533 HydrophobicContact CD2-CB 4.08Å; Y483-Q533 HydrophobicContact CE1-CB 3.8Å; Y483-Q533 HydrophobicContact CE1-CG 3.97Å; Y483-Q533 HydrophobicContact CE2-CB 3.88Å; Y483-Q533 HydrophobicContact CG-CB 4.12Å; L529-Q533 WeakPolarHBondContact O-CG 3.37Å; L529-Q533 PolarHBondContact O-N 2.89Å; T530-Q533 PolarHBondContact O-N 3.27Å; Q533-K536 PolarHBondContact O-N 2.92Å; Q533-N537 PolarHBondContact O-N 3.4Å
534	L	93.1	Very high	89.4	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-46.1	173.2	-77.3	168	0	0	0	111.3	E484 L487 T530 C531 K536 N537 R538 Y550	E484-L534 HydrophobicContact CG-CD2 3.62Å; L487-L534 HydrophobicContact CB-CD1 4.34Å; L487-L534 HydrophobicContact CD2-CD1 3.79Å; T530-L534 WeakPolarHBondContact O-CG 3.18Å; T530-L534 PolarHBondContact O-N 2.94Å; C531-L534 PolarHBondContact O-N 3.32Å; L534-K536 PolarHBondContact O-N 2.88Å; L534-N537 WeakPolarHBondContact O-CB 3.14Å; L534-N537 PolarHBondContact O-N 3.3Å; L534-N537 VanDerWaalsContact O-N 3.13Å; L534-R538 WeakPolarHBondContact O-CG 3.41Å; L534-R538 PolarHBondContact O-N 3.31Å; L534-Y550 HydrophobicContact CB-CD1 4.29Å; L534-Y550 HydrophobicContact CB-CD2 4Å; L534-Y550 HydrophobicContact CB-CE1 4.29Å; L534-Y550 HydrophobicContact CB-CE2 4.01Å; L534-Y550 HydrophobicContact CB-CG 4.16Å; L534-Y550 HydrophobicContact CD1-CD1 4.33Å; L534-Y550 HydrophobicContact CD1-CE1 3.77Å
535	S	92.5	Very high	89.9	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-57.3	-48.2	175.1	-177.3	0	0	0	0	111.3	C531 Y532 N537 R538 I539 A547 L551	C531-S535 WeakPolarHBondContact O-CB 3.43Å; C531-S535 PolarHBondContact O-N 3.02Å; Y532-S535 PolarHBondContact O-N 3.44Å; S535-N537 VanDerWaalsContact C-N 3.29Å; S535-N537 PolarHBondContact O-N 3.18Å; S535-R538 PolarHBondContact O-N 3.12Å; S535-R538 VanDerWaalsContact O-N 3.13Å; S535-I539 WeakPolarHBondContact O-CB 3.13Å; S535-I539 VanDerWaalsContact O-CG1 3.23Å; S535-I539 WeakPolarHBondContact O-CG1 3.32Å; S535-I539 PolarHBondContact O-N 3.48Å; S535-A547 PolarHBondContact OG-O 3.34Å; S535-L551 WeakPolarHBondContact OG-CD1 3.33Å; S535-L551 VanDerWaalsContact OG-CG 3.25Å; S535-L551 WeakPolarHBondContact OG-CG 3.32Å
536	K	91.4	Very high	90.3	Very high	76 Å²	76	49.5 Å²	49.5	33%	0.33	24%	0.242	S	C	.	.	H	α-helix	trans	-57.1	-40.2	175.2	-76	-178.2	174.9	175.8	0	112.9	Y532 Q533 L534 K540	Y532-K536 HydrophobicContact CE1-CD 4.26Å; Y532-K536 PolarHBondContact O-N 2.93Å; Y532-K536 WeakPolarHBondContact OH-CE 3.41Å; Y532-K536 PolarHBondContact OH-NZ 3.08Å; Q533-K536 PolarHBondContact O-N 2.92Å; L534-K536 PolarHBondContact O-N 2.88Å; K536-K540 WeakPolarHBondContact O-CG 3.49Å; K536-K540 PolarHBondContact O-N 3.33Å; K536-K540 VanDerWaalsContact O-N 3.15Å
537	N	91.4	Very high	90.6	Very high	53 Å²	53	46.5 Å²	46.5	28%	0.283	23%	0.231	S	C	.	.	H	α-helix	trans	-67.1	-42.3	176.5	-76	-7.2	0	0	0	112	Y483 Q533 L534 S535 K540 Q541	Y483-N537 WeakPolarHBondContact CD2-ND2 3.47Å; Y483-N537 WeakPolarHBondContact CE2-ND2 3.45Å; Q533-N537 PolarHBondContact O-N 3.4Å; L534-N537 WeakPolarHBondContact O-CB 3.14Å; L534-N537 PolarHBondContact O-N 3.3Å; L534-N537 VanDerWaalsContact O-N 3.13Å; S535-N537 VanDerWaalsContact C-N 3.29Å; S535-N537 PolarHBondContact O-N 3.18Å; N537-K540 WeakPolarHBondContact O-CB 3.47Å; N537-K540 PolarHBondContact O-N 2.8Å; N537-Q541 WeakPolarHBondContact O-CG 3.48Å; N537-Q541 PolarHBondContact O-N 3.46Å; N537-Q541 VanDerWaalsContact O-N 3.15Å
538	R	91.9	Very high	90.7	Very high	57 Å²	57	47.8 Å²	47.8	22%	0.215	24%	0.237	C	C	.	.	H	α-helix	trans	-66.6	-36.7	176.4	-63.7	-56.6	177	174.9	5.7	112.4	E484 L534 S535 K540 Q541 S542 D543 N546 A547 Y550	E484-R538 IonicContact OE1-CZ 3.43Å; E484-R538 IonicContact OE1-NH2 3.57Å; E484-R538 PolarHBondContact OE1-NH2 3.17Å; L534-R538 WeakPolarHBondContact O-CG 3.41Å; L534-R538 PolarHBondContact O-N 3.31Å; S535-R538 PolarHBondContact O-N 3.12Å; S535-R538 VanDerWaalsContact O-N 3.13Å; R538-K540 VanDerWaalsContact C-N 3.34Å; R538-K540 PolarHBondContact O-N 3.17Å; R538-Q541 CarbonylContact O-C 3.49Å; R538-Q541 WeakPolarHBondContact O-CA 3.24Å; R538-Q541 WeakPolarHBondContact O-CB 3.24Å; R538-Q541 PolarHBondContact O-N 3.43Å; R538-S542 PolarHBondContact O-N 2.94Å; R538-S542 VanDerWaalsContact O-N 3.13Å; R538-D543 HydrophobicContact CB-CB 4.26Å; R538-D543 PolarHBondContact O-N 3.42Å; R538-N546 HydrophobicContact CG-CB 4.3Å; R538-A547 HydrophobicContact CB-CB 4.09Å; R538-Y550 HydrophobicContact CG-CD2 4.39Å; R538-Y550 HydrophobicContact CG-CE2 4.21Å
539	I	90.9	Very high	90.9	Very high	47 Å²	47	52.6 Å²	52.6	24%	0.241	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-45.1	171.1	-70.7	169	0	0	0	111	S535 Q541 S542 W544 A547 V571	S535-I539 WeakPolarHBondContact O-CB 3.13Å; S535-I539 VanDerWaalsContact O-CG1 3.23Å; S535-I539 WeakPolarHBondContact O-CG1 3.32Å; S535-I539 PolarHBondContact O-N 3.48Å; I539-Q541 PolarHBondContact O-N 3.39Å; I539-S542 PolarHBondContact O-N 3.03Å; I539-W544 HydrophobicContact CG2-CZ3 4.1Å; I539-A547 HydrophobicContact CD1-CB 4.5Å; I539-A547 HydrophobicContact CG1-CB 3.71Å; I539-V571 HydrophobicContact CD1-CG2 3.51Å; I539-V571 HydrophobicContact CG1-CG2 3.59Å
540	K	90.1	Very high	91	Very high	169 Å²	169	52.7 Å²	52.7	74%	0.735	26%	0.26	S	S	*	.	H	α-helix	trans	-63.8	-29.6	176	-69.2	174.4	-175.5	178.6	0	112.7	K536 N537 R538 S542	K536-K540 WeakPolarHBondContact O-CG 3.49Å; K536-K540 PolarHBondContact O-N 3.33Å; K536-K540 VanDerWaalsContact O-N 3.15Å; N537-K540 WeakPolarHBondContact O-CB 3.47Å; N537-K540 PolarHBondContact O-N 2.8Å; R538-K540 VanDerWaalsContact C-N 3.34Å; R538-K540 PolarHBondContact O-N 3.17Å; K540-S542 VanDerWaalsContact C-N 3.27Å
541	Q	91.9	Very high	91.1	Very high	120 Å²	120	52.7 Å²	52.7	56%	0.561	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	1.1	175.6	-66.6	171.9	-6.5	0	0	113.1	N537 R538 I539 D543	N537-Q541 WeakPolarHBondContact O-CG 3.48Å; N537-Q541 PolarHBondContact O-N 3.46Å; N537-Q541 VanDerWaalsContact O-N 3.15Å; R538-Q541 CarbonylContact O-C 3.49Å; R538-Q541 WeakPolarHBondContact O-CA 3.24Å; R538-Q541 WeakPolarHBondContact O-CB 3.24Å; R538-Q541 PolarHBondContact O-N 3.43Å; I539-Q541 PolarHBondContact O-N 3.39Å; Q541-D543 PolarHBondContact O-N 2.96Å
542	S	88	Confident	90.9	Very high	75 Å²	75	54.6 Å²	54.6	52%	0.524	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	22.1	-172.5	-48.8	0	0	0	0	114.3	R538 I539 K540 W544	R538-S542 PolarHBondContact O-N 2.94Å; R538-S542 VanDerWaalsContact O-N 3.13Å; I539-S542 PolarHBondContact O-N 3.03Å; K540-S542 VanDerWaalsContact C-N 3.27Å; S542-W544 PolarHBondContact O-N 3.19Å; S542-W544 PolarHBondContact O-NE1 3.3Å
543	D	90.9	Very high	90.6	Very high	38 Å²	38	56.9 Å²	56.9	20%	0.203	28%	0.279	C	S	.	.			trans	-89.6	80.1	176.5	-176.5	3.6	0	0	0	109.9	R538 Q541 S545 N546 A547	R538-D543 HydrophobicContact CB-CB 4.26Å; R538-D543 PolarHBondContact O-N 3.42Å; Q541-D543 PolarHBondContact O-N 2.96Å; D543-S545 PolarHBondContact OD1-OG 3.18Å; D543-N546 PolarHBondContact OD1-ND2 2.68Å; D543-N546 WeakPolarHBondContact OD2-CB 3.36Å; D543-N546 PolarHBondContact OD2-ND2 3.32Å; D543-A547 WeakPolarHBondContact O-CB 3.5Å; D543-A547 PolarHBondContact O-N 2.94Å
544	W	89.5	Confident	90.4	Very high	72 Å²	72	54.7 Å²	54.7	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-68.2	-37.4	-170.1	-50.8	117.1	0	0	0	113.6	I539 S542 A547 I548 V571 Q574	I539-W544 HydrophobicContact CG2-CZ3 4.1Å; S542-W544 PolarHBondContact O-N 3.19Å; S542-W544 PolarHBondContact O-NE1 3.3Å; W544-A547 PolarHBondContact O-N 3.24Å; W544-I548 WeakPolarHBondContact O-CD1 3.32Å; W544-I548 VanDerWaalsContact O-CG1 3.28Å; W544-I548 WeakPolarHBondContact O-CG1 3.07Å; W544-I548 PolarHBondContact O-N 3.08Å; W544-V571 HydrophobicContact CB-CG1 4.09Å; W544-V571 HydrophobicContact CE3-CB 4.49Å; W544-V571 HydrophobicContact CE3-CG1 3.9Å; W544-V571 HydrophobicContact CE3-CG2 4.29Å; W544-V571 HydrophobicContact CZ3-CG2 4.49Å; W544-Q574 HydrophobicContact CD2-CB 4.3Å; W544-Q574 HydrophobicContact CE3-CB 4.28Å; W544-Q574 HydrophobicContact CH2-CB 3.92Å; W544-Q574 HydrophobicContact CH2-CG 3.97Å; W544-Q574 HydrophobicContact CZ2-CB 3.96Å; W544-Q574 HydrophobicContact CZ2-CG 4.4Å; W544-Q574 HydrophobicContact CZ3-CB 4.07Å; W544-Q574 HydrophobicContact CZ3-CG 4.22Å
545	S	90.2	Very high	90	Very high	71 Å²	71	54.4 Å²	54.4	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-47.2	-176.6	53.1	0	0	0	0	111.5	D543 A547 I548 N549	D543-S545 PolarHBondContact OD1-OG 3.18Å; S545-A547 VanDerWaalsContact C-N 3.34Å; S545-A547 PolarHBondContact O-N 3.23Å; S545-I548 PolarHBondContact O-N 2.75Å; S545-N549 PolarHBondContact O-N 3.37Å
546	N	89.4	Confident	89.4	Confident	64 Å²	64	57.5 Å²	57.5	34%	0.342	28%	0.279	S	S	.	.	H	α-helix	trans	-67.7	-36	176.9	-71.9	-32.3	0	0	0	111.8	R538 D543 I548 N549 Y550	R538-N546 HydrophobicContact CG-CB 4.3Å; D543-N546 PolarHBondContact OD1-ND2 2.68Å; D543-N546 WeakPolarHBondContact OD2-CB 3.36Å; D543-N546 PolarHBondContact OD2-ND2 3.32Å; N546-I548 VanDerWaalsContact C-N 3.32Å; N546-I548 PolarHBondContact O-N 3.16Å; N546-N549 PolarHBondContact O-N 2.89Å; N546-Y550 WeakPolarHBondContact O-CD2 3.26Å; N546-Y550 PolarHBondContact O-N 3.42Å; N546-Y550 VanDerWaalsContact O-N 3.08Å
547	A	90.9	Very high	88.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-42.5	173.4	0	0	0	0	0	112.4	S535 R538 I539 D543 W544 S545 L551 V571	S535-A547 PolarHBondContact OG-O 3.34Å; R538-A547 HydrophobicContact CB-CB 4.09Å; I539-A547 HydrophobicContact CD1-CB 4.5Å; I539-A547 HydrophobicContact CG1-CB 3.71Å; D543-A547 WeakPolarHBondContact O-CB 3.5Å; D543-A547 PolarHBondContact O-N 2.94Å; W544-A547 PolarHBondContact O-N 3.24Å; S545-A547 VanDerWaalsContact C-N 3.34Å; S545-A547 PolarHBondContact O-N 3.23Å; A547-L551 WeakPolarHBondContact O-CD1 3.48Å; A547-L551 VanDerWaalsContact O-CG 3.27Å; A547-L551 WeakPolarHBondContact O-CG 3.3Å; A547-L551 PolarHBondContact O-N 3Å; A547-L551 VanDerWaalsContact O-N 3.11Å; A547-V571 HydrophobicContact CB-CG1 4.43Å
548	I	91.2	Very high	88.1	Confident	26 Å²	26	51.8 Å²	51.8	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-45.4	175.6	-67.7	162	0	0	0	110.5	W544 S545 N546 Y550 L551 D552 V571	W544-I548 WeakPolarHBondContact O-CD1 3.32Å; W544-I548 VanDerWaalsContact O-CG1 3.28Å; W544-I548 WeakPolarHBondContact O-CG1 3.07Å; W544-I548 PolarHBondContact O-N 3.08Å; S545-I548 PolarHBondContact O-N 2.75Å; N546-I548 VanDerWaalsContact C-N 3.32Å; N546-I548 PolarHBondContact O-N 3.16Å; I548-Y550 VanDerWaalsContact C-N 3.31Å; I548-Y550 PolarHBondContact O-N 3.48Å; I548-L551 PolarHBondContact O-N 2.93Å; I548-D552 PolarHBondContact O-N 3.25Å; I548-V571 HydrophobicContact CD1-CG1 3.9Å; I548-V571 HydrophobicContact CG1-CB 4.42Å; I548-V571 HydrophobicContact CG1-CG1 3.54Å
549	N	90.8	Very high	87.6	Confident	102 Å²	102	49.1 Å²	49.1	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-57.5	-43.8	179.7	-70.5	-20.5	0	0	0	112.3	S545 N546 R553	S545-N549 PolarHBondContact O-N 3.37Å; N546-N549 PolarHBondContact O-N 2.89Å; N549-R553 PolarHBondContact O-N 3.22Å
550	Y	91.1	Very high	87.1	Confident	49 Å²	49	48.6 Å²	48.6	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-37.9	175.3	-73.5	-58.7	0	0	0	112.6	L487 C531 L534 R538 N546 I548 R553 C554	L487-Y550 HydrophobicContact CD2-CE1 3.95Å; C531-Y550 HydrophobicContact CB-CD1 4.18Å; C531-Y550 WeakPolarHBondContact O-CB 3.25Å; L534-Y550 HydrophobicContact CB-CD1 4.29Å; L534-Y550 HydrophobicContact CB-CD2 4Å; L534-Y550 HydrophobicContact CB-CE1 4.29Å; L534-Y550 HydrophobicContact CB-CE2 4.01Å; L534-Y550 HydrophobicContact CB-CG 4.16Å; L534-Y550 HydrophobicContact CD1-CD1 4.33Å; L534-Y550 HydrophobicContact CD1-CE1 3.77Å; R538-Y550 HydrophobicContact CG-CD2 4.39Å; R538-Y550 HydrophobicContact CG-CE2 4.21Å; N546-Y550 WeakPolarHBondContact O-CD2 3.26Å; N546-Y550 PolarHBondContact O-N 3.42Å; N546-Y550 VanDerWaalsContact O-N 3.08Å; I548-Y550 VanDerWaalsContact C-N 3.31Å; I548-Y550 PolarHBondContact O-N 3.48Å; Y550-R553 WeakPolarHBondContact O-CB 3.48Å; Y550-R553 PolarHBondContact O-N 3.43Å; Y550-C554 PolarHBondContact O-N 2.99Å; Y550-C554 PolarHBondContact O-SG 3.36Å
551	L	91.4	Very high	86.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.2	-39.4	177.2	-72.4	165.9	0	0	0	112.4	Y532 S535 A547 I548 R553 C554 I555 T567 R568 V571	Y532-L551 HydrophobicContact CD2-CD2 4.05Å; Y532-L551 HydrophobicContact CE2-CD2 4.31Å; S535-L551 WeakPolarHBondContact OG-CD1 3.33Å; S535-L551 VanDerWaalsContact OG-CG 3.25Å; S535-L551 WeakPolarHBondContact OG-CG 3.32Å; A547-L551 WeakPolarHBondContact O-CD1 3.48Å; A547-L551 VanDerWaalsContact O-CG 3.27Å; A547-L551 WeakPolarHBondContact O-CG 3.3Å; A547-L551 PolarHBondContact O-N 3Å; A547-L551 VanDerWaalsContact O-N 3.11Å; I548-L551 PolarHBondContact O-N 2.93Å; L551-R553 PolarHBondContact O-N 2.99Å; L551-C554 WeakPolarHBondContact O-CB 3.44Å; L551-C554 PolarHBondContact O-N 3.27Å; L551-C554 VanDerWaalsContact O-N 3.14Å; L551-I555 WeakPolarHBondContact O-CB 3.5Å; L551-I555 VanDerWaalsContact O-CG1 3.3Å; L551-I555 WeakPolarHBondContact O-CG1 3.33Å; L551-I555 PolarHBondContact O-N 3.17Å; L551-T567 WeakPolarHBondContact CD2-OG1 3.05Å; L551-R568 HydrophobicContact CB-CB 4.31Å; L551-R568 HydrophobicContact CB-CG 4.29Å; L551-R568 HydrophobicContact CD1-CB 3.86Å; L551-R568 HydrophobicContact CD1-CG 4.19Å; L551-V571 HydrophobicContact CD1-CG2 4.47Å
552	D	88.5	Confident	86.4	Confident	40 Å²	40	37.9 Å²	37.9	21%	0.214	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-38.4	173.5	-91.3	30.4	0	0	0	110.9	I548 I555 Y556 R568 R662	I548-D552 PolarHBondContact O-N 3.25Å; D552-I555 PolarHBondContact O-N 3.29Å; D552-Y556 WeakPolarHBondContact O-CB 3.17Å; D552-Y556 PolarHBondContact O-N 3.46Å; D552-R568 WeakPolarHBondContact OD1-CD 3.47Å; D552-R568 IonicContact OD1-CZ 3.46Å; D552-R568 IonicContact OD1-NE 3.58Å; D552-R568 IonicContact OD1-NH1 3.47Å; D552-R568 PolarHBondContact OD1-NH1 3.05Å; D552-R662 IonicContact OD2-CZ 3.82Å; D552-R662 IonicContact OD2-NH1 3.71Å; D552-R662 IonicContact OD2-NH2 2.96Å; D552-R662 PolarHBondContact OD2-NH2 2.77Å
553	R	86	Confident	86.3	Confident	82 Å²	82	38.2 Å²	38.2	31%	0.309	19%	0.185	S	C	.	.	H	α-helix	trans	-67.9	-40.5	173.2	-170.2	170.5	176.5	178.8	-2.7	113	E491 N549 Y550 L551 I555 Y556 L557	E491-R553 IonicContact OE1-CZ 3.44Å; E491-R553 IonicContact OE1-NH2 3.59Å; E491-R553 PolarHBondContact OE1-NH2 3.43Å; N549-R553 PolarHBondContact O-N 3.22Å; Y550-R553 WeakPolarHBondContact O-CB 3.48Å; Y550-R553 PolarHBondContact O-N 3.43Å; L551-R553 PolarHBondContact O-N 2.99Å; R553-I555 VanDerWaalsContact C-N 3.35Å; R553-Y556 WeakPolarHBondContact O-CB 3.35Å; R553-Y556 PolarHBondContact O-N 2.91Å; R553-L557 WeakPolarHBondContact O-CG 3.37Å; R553-L557 PolarHBondContact O-N 2.93Å; R553-L557 VanDerWaalsContact O-N 3.15Å
554	C	87.2	Confident	86.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-45.8	173.1	-64.5	0	0	0	0	111.4	C528 C531 Y532 Y550 L551 Y556 L557 A558 F564	C528-C554 PolarHBondContact O-SG 3.31Å; C528-C554 VanDerWaalsContact O-SG 3.33Å; C531-C554 WeakPolarHBondContact CB-SG 3.37Å; Y532-C554 PolarHBondContact N-SG 3.47Å; Y532-C554 VanDerWaalsContact N-SG 3.41Å; Y550-C554 PolarHBondContact O-N 2.99Å; Y550-C554 PolarHBondContact O-SG 3.36Å; L551-C554 WeakPolarHBondContact O-CB 3.44Å; L551-C554 PolarHBondContact O-N 3.27Å; L551-C554 VanDerWaalsContact O-N 3.14Å; C554-Y556 VanDerWaalsContact C-N 3.31Å; C554-Y556 PolarHBondContact O-N 3.13Å; C554-L557 PolarHBondContact O-N 3.32Å; C554-L557 VanDerWaalsContact O-N 3.17Å; C554-A558 PolarHBondContact O-N 2.99Å; C554-F564 HydrophobicContact CB-CD1 4.19Å; C554-F564 HydrophobicContact CB-CD2 3.88Å; C554-F564 HydrophobicContact CB-CE1 4.38Å; C554-F564 HydrophobicContact CB-CE2 4.08Å; C554-F564 HydrophobicContact CB-CG 3.96Å; C554-F564 HydrophobicContact CB-CZ 4.33Å
555	I	85.2	Confident	86.2	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-36.6	179.9	-70.9	165.6	0	0	0	111.2	L551 D552 R553 L557 A558 P559 F564 Y565 R568 N659 I663	L551-I555 WeakPolarHBondContact O-CB 3.5Å; L551-I555 VanDerWaalsContact O-CG1 3.3Å; L551-I555 WeakPolarHBondContact O-CG1 3.33Å; L551-I555 PolarHBondContact O-N 3.17Å; D552-I555 PolarHBondContact O-N 3.29Å; R553-I555 VanDerWaalsContact C-N 3.35Å; I555-L557 VanDerWaalsContact C-N 3.32Å; I555-L557 PolarHBondContact O-N 3.32Å; I555-A558 CarbonylContact O-C 3.25Å; I555-P559 VanDerWaalsContact O-CA 3.24Å; I555-P559 WeakPolarHBondContact O-CA 3.48Å; I555-P559 WeakPolarHBondContact O-CB 3.35Å; I555-P559 VanDerWaalsContact O-N 3.16Å; I555-F564 HydrophobicContact CD1-CB 4.3Å; I555-F564 HydrophobicContact CG1-CB 3.76Å; I555-Y565 HydrophobicContact CD1-CD1 4.01Å; I555-Y565 HydrophobicContact CD1-CE1 3.9Å; I555-Y565 HydrophobicContact CG1-CE1 4.25Å; I555-Y565 HydrophobicContact CG2-CE1 3.99Å; I555-Y565 WeakPolarHBondContact CG2-OH 3.4Å; I555-R568 VanDerWaalsContact CD1-NH1 3.31Å; I555-N659 WeakPolarHBondContact CG2-ND2 3.37Å; I555-I663 HydrophobicContact CG2-CD1 4.39Å
556	Y	80.3	Confident	86.1	Confident	66 Å²	66	30.7 Å²	30.7	26%	0.259	14%	0.144	S	C	.	.	H	α-helix	trans	-59.8	-42.2	172.9	177.4	-92	0	0	0	112.2	D552 R553 C554 I663 E666 N667	D552-Y556 WeakPolarHBondContact O-CB 3.17Å; D552-Y556 PolarHBondContact O-N 3.46Å; R553-Y556 WeakPolarHBondContact O-CB 3.35Å; R553-Y556 PolarHBondContact O-N 2.91Å; C554-Y556 VanDerWaalsContact C-N 3.31Å; C554-Y556 PolarHBondContact O-N 3.13Å; Y556-I663 HydrophobicContact CD2-CG1 4.35Å; Y556-I663 HydrophobicContact CD2-CG2 3.99Å; Y556-I663 HydrophobicContact CE2-CG2 4.15Å; Y556-E666 WeakPolarHBondContact CD2-OE2 3.3Å; Y556-E666 HydrophobicContact CE2-CB 4.12Å; Y556-E666 WeakPolarHBondContact CE2-OE2 3.37Å; Y556-N667 VanDerWaalsContact OH-CG 3.23Å; Y556-N667 PolarHBondContact OH-ND2 3.26Å; Y556-N667 PolarHBondContact OH-OD1 3.22Å
557	L	77.2	Confident	86.1	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-80.5	-29.4	-179.3	-64.9	174	0	0	0	113.3	N524 I527 C528 R553 C554 I555 F707	N524-L557 HydrophobicContact CB-CD2 4.09Å; I527-L557 HydrophobicContact CB-CD1 4.07Å; I527-L557 HydrophobicContact CG2-CD1 3.62Å; C528-L557 HydrophobicContact CB-CB 4.31Å; C528-L557 HydrophobicContact CB-CD1 4.12Å; R553-L557 WeakPolarHBondContact O-CG 3.37Å; R553-L557 PolarHBondContact O-N 2.93Å; R553-L557 VanDerWaalsContact O-N 3.15Å; C554-L557 PolarHBondContact O-N 3.32Å; C554-L557 VanDerWaalsContact O-N 3.17Å; I555-L557 VanDerWaalsContact C-N 3.32Å; I555-L557 PolarHBondContact O-N 3.32Å; L557-F707 WeakPolarHBondContact O-CB 3.46Å; L557-F707 VanDerWaalsContact O-CG 3.22Å; L557-F707 WeakPolarHBondContact O-CG 3.44Å
558	A	77.5	Confident	86.1	Confident	4 Å²	4	29.5 Å²	29.5	3%	0.033	14%	0.137	C	C	.	.			trans	-145.6	72	-171.4	0	0	0	0	0	111	C554 I555 F560 Q561 F564 L709	C554-A558 PolarHBondContact O-N 2.99Å; I555-A558 CarbonylContact O-C 3.25Å; A558-F560 PolarHBondContact O-N 2.8Å; A558-Q561 HydrophobicContact CB-CG 3.88Å; A558-Q561 PolarHBondContact O-N 2.84Å; A558-F564 HydrophobicContact CB-CE2 3.85Å; A558-L709 HydrophobicContact CB-CD1 3.95Å
559	P	80.8	Confident	86.1	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.013	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-10.5	-170.3	28	-35.8	0	0	0	114.8	I555 Y565 L660 I663	I555-P559 VanDerWaalsContact O-CA 3.24Å; I555-P559 WeakPolarHBondContact O-CA 3.48Å; I555-P559 WeakPolarHBondContact O-CB 3.35Å; I555-P559 VanDerWaalsContact O-N 3.16Å; P559-Y565 VanDerWaalsContact O-CE2 3.27Å; P559-Y565 WeakPolarHBondContact O-CE2 3.48Å; P559-Y565 PolarHBondContact O-OH 3.44Å; P559-L660 HydrophobicContact CB-CD2 3.58Å; P559-L660 HydrophobicContact CG-CD2 3.8Å; P559-I663 HydrophobicContact CB-CD1 3.82Å; P559-I663 HydrophobicContact CG-CD1 4.46Å
560	F	81.6	Confident	86	Confident	36 Å²	36	26.9 Å²	26.9	16%	0.158	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	5	-178.9	-66.5	-75.5	0	0	0	113.5	A558 P562 L591 W596 L656 L660 I698 L701 H702	A558-F560 PolarHBondContact O-N 2.8Å; F560-P562 VanDerWaalsContact O-CD 3.32Å; F560-P562 WeakPolarHBondContact O-CD 3.47Å; F560-L591 HydrophobicContact CD1-CD2 3.92Å; F560-W596 AromaticContact CD1-CH2 3.62Å; F560-W596 HydrophobicContact CD1-CH2 3.62Å; F560-W596 HydrophobicContact CD1-CZ3 4.23Å; F560-W596 AromaticContact CE1-CH2 3.71Å; F560-W596 HydrophobicContact CE1-CH2 3.71Å; F560-W596 HydrophobicContact CE1-CZ2 4.2Å; F560-W596 HydrophobicContact CE1-CZ3 4.47Å; F560-L656 HydrophobicContact CE1-CD2 4.43Å; F560-L660 HydrophobicContact CE1-CD1 4.29Å; F560-L660 HydrophobicContact CE2-CD2 4.47Å; F560-L660 HydrophobicContact CZ-CD1 4.07Å; F560-L660 HydrophobicContact CZ-CD2 4.27Å; F560-I698 HydrophobicContact CE1-CG2 3.84Å; F560-I698 HydrophobicContact CZ-CG2 4.38Å; F560-L701 HydrophobicContact CZ-CB 4.49Å; F560-H702 HydrophobicContact CE1-CB 4.47Å; F560-H702 HydrophobicContact CE2-CB 4.19Å; F560-H702 HydrophobicContact CZ-CB 3.96Å
561	Q	82.8	Confident	85.9	Confident	58 Å²	58	24.7 Å²	24.7	27%	0.271	12%	0.115	S	C	.	.			trans	-86.9	110.8	178.6	-66.8	-63.4	-34.5	0	0	110.5	A558 E563 F564 Y565	A558-Q561 HydrophobicContact CB-CG 3.88Å; A558-Q561 PolarHBondContact O-N 2.84Å; Q561-E563 VanDerWaalsContact C-N 3.32Å; Q561-E563 PolarHBondContact O-N 3.34Å; Q561-F564 HydrophobicContact CB-CD2 3.49Å; Q561-F564 VanDerWaalsContact CB-CD2 3.49Å; Q561-F564 HydrophobicContact CB-CE2 3.4Å; Q561-F564 HydrophobicContact CB-CG 4.31Å; Q561-F564 HydrophobicContact CB-CZ 4.18Å; Q561-F564 HydrophobicContact CG-CD2 4.29Å; Q561-F564 HydrophobicContact CG-CE2 3.73Å; Q561-F564 HydrophobicContact CG-CZ 4.4Å; Q561-Y565 WeakPolarHBondContact O-CD2 3.46Å
562	P	84.4	Confident	85.8	Confident	6 Å²	6	25.6 Å²	25.6	4%	0.039	12%	0.119	C	C	.	.	H	α-helix	trans	-62.4	-37.1	-175.5	-18	28.9	0	0	0	113	F560 F564 Y565 M566 F588 L591 N592	F560-P562 VanDerWaalsContact O-CD 3.32Å; F560-P562 WeakPolarHBondContact O-CD 3.47Å; P562-F564 PolarHBondContact O-N 3.43Å; P562-F564 VanDerWaalsContact O-N 3.11Å; P562-Y565 PolarHBondContact O-N 3.27Å; P562-M566 PolarHBondContact O-N 3.24Å; P562-M566 VanDerWaalsContact O-N 3.1Å; P562-F588 HydrophobicContact CB-CD2 3.57Å; P562-F588 HydrophobicContact CB-CE2 3.72Å; P562-F588 VanDerWaalsContact O-CD2 3.3Å; P562-F588 WeakPolarHBondContact O-CD2 3.48Å; P562-L591 HydrophobicContact CB-CB 4.28Å; P562-L591 HydrophobicContact CG-CB 3.86Å; P562-N592 WeakPolarHBondContact CB-ND2 3.37Å
563	E	86.4	Confident	85.8	Confident	81 Å²	81	26.6 Å²	26.6	38%	0.379	12%	0.12	S	C	.	.	H	α-helix	trans	-57.4	-33.8	-172.6	-64.9	73.9	-161.9	0	0	112.3	Q561 M566 T567	Q561-E563 VanDerWaalsContact C-N 3.32Å; Q561-E563 PolarHBondContact O-N 3.34Å; E563-M566 PolarHBondContact O-N 2.84Å; E563-T567 WeakPolarHBondContact O-CG2 3.44Å; E563-T567 PolarHBondContact O-N 3.05Å; E563-T567 PolarHBondContact O-OG1 3.06Å; E563-T567 VanDerWaalsContact O-OG1 3.09Å
564	F	88.9	Confident	85.8	Confident	11 Å²	11	27.3 Å²	27.3	5%	0.048	13%	0.127	C	C	.	.	H	α-helix	trans	-66.8	-43.9	178.2	-55.6	-32.4	0	0	0	111.7	C528 Y532 C554 I555 A558 Q561 P562 M566 T567 R568	C528-F564 VanDerWaalsContact SG-CE2 3.52Å; C528-F564 VanDerWaalsContact SG-CZ 3.53Å; Y532-F564 HydrophobicContact CD1-CE1 4.13Å; Y532-F564 AromaticContact CD2-CD1 3.54Å; Y532-F564 HydrophobicContact CD2-CD1 3.54Å; Y532-F564 AromaticContact CD2-CE1 3.63Å; Y532-F564 HydrophobicContact CD2-CE1 3.63Å; Y532-F564 HydrophobicContact CE1-CE1 4.47Å; Y532-F564 AromaticContact CE2-CD1 3.73Å; Y532-F564 HydrophobicContact CE2-CD1 3.73Å; Y532-F564 HydrophobicContact CE2-CE1 4.04Å; Y532-F564 HydrophobicContact CG-CD1 4.1Å; Y532-F564 AromaticContact CG-CE1 3.68Å; Y532-F564 HydrophobicContact CG-CE1 3.68Å; C554-F564 HydrophobicContact CB-CD1 4.19Å; C554-F564 HydrophobicContact CB-CD2 3.88Å; C554-F564 HydrophobicContact CB-CE1 4.38Å; C554-F564 HydrophobicContact CB-CE2 4.08Å; C554-F564 HydrophobicContact CB-CG 3.96Å; C554-F564 HydrophobicContact CB-CZ 4.33Å; I555-F564 HydrophobicContact CD1-CB 4.3Å; I555-F564 HydrophobicContact CG1-CB 3.76Å; A558-F564 HydrophobicContact CB-CE2 3.85Å; Q561-F564 HydrophobicContact CB-CD2 3.49Å; Q561-F564 VanDerWaalsContact CB-CD2 3.49Å; Q561-F564 HydrophobicContact CB-CE2 3.4Å; Q561-F564 HydrophobicContact CB-CG 4.31Å; Q561-F564 HydrophobicContact CB-CZ 4.18Å; Q561-F564 HydrophobicContact CG-CD2 4.29Å; Q561-F564 HydrophobicContact CG-CE2 3.73Å; Q561-F564 HydrophobicContact CG-CZ 4.4Å; P562-F564 PolarHBondContact O-N 3.43Å; P562-F564 VanDerWaalsContact O-N 3.11Å; F564-M566 PolarHBondContact O-N 3.37Å; F564-T567 PolarHBondContact O-N 3.03Å; F564-T567 PolarHBondContact O-OG1 3.32Å; F564-R568 WeakPolarHBondContact O-CB 3.14Å; F564-R568 PolarHBondContact O-N 3.04Å
565	Y	89	Confident	85.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-41.6	175.4	-64.7	-78.7	0	0	0	111.8	I555 P559 Q561 P562 R568 A569 I587 L591 N659	I555-Y565 HydrophobicContact CD1-CD1 4.01Å; I555-Y565 HydrophobicContact CD1-CE1 3.9Å; I555-Y565 HydrophobicContact CG1-CE1 4.25Å; I555-Y565 HydrophobicContact CG2-CE1 3.99Å; I555-Y565 WeakPolarHBondContact CG2-OH 3.4Å; P559-Y565 VanDerWaalsContact O-CE2 3.27Å; P559-Y565 WeakPolarHBondContact O-CE2 3.48Å; P559-Y565 PolarHBondContact O-OH 3.44Å; Q561-Y565 WeakPolarHBondContact O-CD2 3.46Å; P562-Y565 PolarHBondContact O-N 3.27Å; Y565-R568 PolarHBondContact O-N 3.41Å; Y565-A569 VanDerWaalsContact O-CB 3.32Å; Y565-A569 WeakPolarHBondContact O-CB 3.42Å; Y565-A569 PolarHBondContact O-N 2.82Å; Y565-I587 HydrophobicContact CD1-CB 4.1Å; Y565-I587 HydrophobicContact CD1-CD1 4.08Å; Y565-I587 HydrophobicContact CD1-CG2 3.74Å; Y565-I587 HydrophobicContact CD2-CG2 3.82Å; Y565-I587 HydrophobicContact CE1-CB 4.37Å; Y565-I587 HydrophobicContact CE1-CD1 3.86Å; Y565-I587 HydrophobicContact CE1-CG2 3.73Å; Y565-I587 HydrophobicContact CE2-CG2 3.79Å; Y565-I587 HydrophobicContact CG-CB 4.31Å; Y565-I587 HydrophobicContact CG-CG2 3.79Å; Y565-L591 HydrophobicContact CD2-CD1 3.79Å; Y565-L591 HydrophobicContact CE2-CD1 3.67Å; Y565-N659 VanDerWaalsContact CE1-ND2 3.27Å; Y565-N659 WeakPolarHBondContact CE1-ND2 3.46Å; Y565-N659 PolarHBondContact OH-ND2 3.49Å
566	M	88.1	Confident	85.7	Confident	13 Å²	13	35.3 Å²	35.3	6%	0.064	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-47.6	177.6	-177.9	55.4	-173.6	0	0	111.7	P562 E563 F564 R568 A569 L570 F588 Q628 I629	P562-M566 PolarHBondContact O-N 3.24Å; P562-M566 VanDerWaalsContact O-N 3.1Å; E563-M566 PolarHBondContact O-N 2.84Å; F564-M566 PolarHBondContact O-N 3.37Å; M566-R568 VanDerWaalsContact C-N 3.32Å; M566-R568 PolarHBondContact O-N 3.36Å; M566-A569 PolarHBondContact O-N 3.37Å; M566-L570 HydrophobicContact CE-CD1 4.05Å; M566-L570 HydrophobicContact CE-CD2 4.24Å; M566-L570 HydrophobicContact CE-CG 4.07Å; M566-L570 WeakPolarHBondContact O-CG 3.47Å; M566-L570 PolarHBondContact O-N 3.3Å; M566-L570 VanDerWaalsContact O-N 3.08Å; M566-F588 HydrophobicContact CB-CD2 3.66Å; M566-F588 HydrophobicContact CB-CE2 3.73Å; M566-F588 HydrophobicContact CB-CG 4.39Å; M566-F588 HydrophobicContact CG-CE2 4.31Å; M566-Q628 HydrophobicContact CE-CB 4.41Å; M566-Q628 WeakPolarHBondContact CE-O 3.23Å; M566-I629 HydrophobicContact CE-CB 4.47Å; M566-I629 HydrophobicContact CE-CG1 4.33Å; M566-I629 HydrophobicContact SD-CG1 4.01Å; M566-I629 HydrophobicContact SD-CG2 4.44Å
567	T	88.3	Confident	86.1	Confident	23 Å²	23	36.7 Å²	36.7	14%	0.141	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-38.7	176.8	52.9	0	0	0	0	112.4	Y532 L551 E563 F564 L570 V571	Y532-T567 HydrophobicContact CE2-CG2 3.89Å; L551-T567 WeakPolarHBondContact CD2-OG1 3.05Å; E563-T567 WeakPolarHBondContact O-CG2 3.44Å; E563-T567 PolarHBondContact O-N 3.05Å; E563-T567 PolarHBondContact O-OG1 3.06Å; E563-T567 VanDerWaalsContact O-OG1 3.09Å; F564-T567 PolarHBondContact O-N 3.03Å; F564-T567 PolarHBondContact O-OG1 3.32Å; T567-L570 PolarHBondContact O-N 2.94Å; T567-V571 WeakPolarHBondContact O-CG2 3.39Å; T567-V571 PolarHBondContact O-N 2.99Å; T567-V571 VanDerWaalsContact O-N 3.1Å
568	R	92.4	Very high	86.4	Confident	16 Å²	16	40.4 Å²	40.4	6%	0.06	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-37.8	176.7	-162.5	175.6	65.9	-178.3	-3.3	112.1	L551 D552 I555 F564 Y565 M566 L570 V571 H572 D584	L551-R568 HydrophobicContact CB-CB 4.31Å; L551-R568 HydrophobicContact CB-CG 4.29Å; L551-R568 HydrophobicContact CD1-CB 3.86Å; L551-R568 HydrophobicContact CD1-CG 4.19Å; D552-R568 WeakPolarHBondContact OD1-CD 3.47Å; D552-R568 IonicContact OD1-CZ 3.46Å; D552-R568 IonicContact OD1-NE 3.58Å; D552-R568 IonicContact OD1-NH1 3.47Å; D552-R568 PolarHBondContact OD1-NH1 3.05Å; I555-R568 VanDerWaalsContact CD1-NH1 3.31Å; F564-R568 WeakPolarHBondContact O-CB 3.14Å; F564-R568 PolarHBondContact O-N 3.04Å; Y565-R568 PolarHBondContact O-N 3.41Å; M566-R568 VanDerWaalsContact C-N 3.32Å; M566-R568 PolarHBondContact O-N 3.36Å; R568-L570 VanDerWaalsContact C-N 3.34Å; R568-L570 PolarHBondContact O-N 3.46Å; R568-V571 PolarHBondContact O-N 3.37Å; R568-H572 WeakPolarHBondContact O-CB 3.26Å; R568-H572 PolarHBondContact O-CD2 3.24Å; R568-H572 PolarHBondContact O-N 3.16Å; R568-D584 WeakPolarHBondContact CG-OD2 3.41Å; R568-D584 IonicContact CZ-OD1 2.77Å; R568-D584 IonicContact CZ-OD2 3.9Å; R568-D584 IonicContact NE-OD1 2.83Å; R568-D584 PolarHBondContact NE-OD1 3.37Å; R568-D584 IonicContact NE-OD2 3.98Å; R568-D584 PolarHBondContact NE-OD2 3.05Å; R568-D584 IonicContact NH2-OD1 3.19Å; R568-D584 PolarHBondContact NH2-OD1 2.7Å; R568-D584 IonicContact NH2-OD2 2.66Å
569	A	89.6	Confident	86.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.3	-43.7	174.7	0	0	0	0	0	111.9	Y565 M566 H572 Y573 S581 D584 I585 L632	Y565-A569 VanDerWaalsContact O-CB 3.32Å; Y565-A569 WeakPolarHBondContact O-CB 3.42Å; Y565-A569 PolarHBondContact O-N 2.82Å; M566-A569 PolarHBondContact O-N 3.37Å; A569-H572 PolarHBondContact O-N 3.01Å; A569-Y573 WeakPolarHBondContact O-CB 3.44Å; A569-Y573 PolarHBondContact O-N 3.43Å; A569-S581 WeakPolarHBondContact O-CB 3.45Å; A569-S581 PolarHBondContact O-OG 3Å; A569-D584 HydrophobicContact CB-CB 3.74Å; A569-I585 HydrophobicContact CB-CG1 3.96Å; A569-L632 HydrophobicContact CB-CD2 4.19Å
570	L	88.8	Confident	87.2	Confident	73 Å²	73	52.3 Å²	52.3	38%	0.382	26%	0.256	S	S	.	.	H	α-helix	trans	-62.2	-44.2	175.1	-72.1	170.8	0	0	0	111.3	M566 T567 R568 Y573 Q574 L632	M566-L570 HydrophobicContact CE-CD1 4.05Å; M566-L570 HydrophobicContact CE-CD2 4.24Å; M566-L570 HydrophobicContact CE-CG 4.07Å; M566-L570 WeakPolarHBondContact O-CG 3.47Å; M566-L570 PolarHBondContact O-N 3.3Å; M566-L570 VanDerWaalsContact O-N 3.08Å; T567-L570 PolarHBondContact O-N 2.94Å; R568-L570 VanDerWaalsContact C-N 3.34Å; R568-L570 PolarHBondContact O-N 3.46Å; L570-Y573 WeakPolarHBondContact O-CB 3.49Å; L570-Y573 PolarHBondContact O-N 3.45Å; L570-Q574 WeakPolarHBondContact O-CG 3.49Å; L570-Q574 PolarHBondContact O-N 2.65Å; L570-L632 HydrophobicContact CD2-CD1 4.22Å; L570-L632 HydrophobicContact CD2-CD2 3.92Å; L570-L632 HydrophobicContact CD2-CG 4.47Å; L570-L632 HydrophobicContact CG-CD2 4.39Å
571	V	89.2	Confident	87.4	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-40.5	178	175	0	0	0	0	112.2	I539 W544 A547 I548 L551 T567 R568 Y573 Q574 S575	I539-V571 HydrophobicContact CD1-CG2 3.51Å; I539-V571 HydrophobicContact CG1-CG2 3.59Å; W544-V571 HydrophobicContact CB-CG1 4.09Å; W544-V571 HydrophobicContact CE3-CB 4.49Å; W544-V571 HydrophobicContact CE3-CG1 3.9Å; W544-V571 HydrophobicContact CE3-CG2 4.29Å; W544-V571 HydrophobicContact CZ3-CG2 4.49Å; A547-V571 HydrophobicContact CB-CG1 4.43Å; I548-V571 HydrophobicContact CD1-CG1 3.9Å; I548-V571 HydrophobicContact CG1-CB 4.42Å; I548-V571 HydrophobicContact CG1-CG1 3.54Å; L551-V571 HydrophobicContact CD1-CG2 4.47Å; T567-V571 WeakPolarHBondContact O-CG2 3.39Å; T567-V571 PolarHBondContact O-N 2.99Å; T567-V571 VanDerWaalsContact O-N 3.1Å; R568-V571 PolarHBondContact O-N 3.37Å; V571-Y573 VanDerWaalsContact C-N 3.31Å; V571-Y573 PolarHBondContact O-N 2.75Å; V571-Q574 PolarHBondContact O-N 2.91Å; V571-S575 PolarHBondContact O-N 3.18Å; V571-S575 PolarHBondContact O-OG 3.17Å
572	H	90.4	Very high	87.6	Confident	20 Å²	20	50.7 Å²	50.7	9%	0.093	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-38.4	173.8	-81.5	-47.7	0	0	0	112.2	R568 A569 S575 N576 H577 H580 D584	R568-H572 WeakPolarHBondContact O-CB 3.26Å; R568-H572 PolarHBondContact O-CD2 3.24Å; R568-H572 PolarHBondContact O-N 3.16Å; A569-H572 PolarHBondContact O-N 3.01Å; H572-S575 WeakPolarHBondContact CA-OG 3.27Å; H572-S575 CarbonylContact O-C 3.58Å; H572-S575 PolarHBondContact O-N 2.72Å; H572-S575 PolarHBondContact O-OG 3.42Å; H572-S575 VanDerWaalsContact O-OG 3.1Å; H572-N576 PolarHBondContact O-N 2.92Å; H572-H577 HydrophobicContact CB-CB 4.23Å; H572-H577 WeakPolarHBondContact O-CA 3.48Å; H572-H577 PolarHBondContact O-N 3.25Å; H572-H580 HydrophobicContact CB-CB 4.3Å; H572-D584 IonicContact CD2-OD2 2.62Å; H572-D584 PolarHBondContact CD2-OD2 3.45Å
573	Y	88	Confident	87.7	Confident	60 Å²	60	52.7 Å²	52.7	24%	0.235	26%	0.256	C	S	.	.	H	α-helix	trans	-63	-47.4	174.6	-179.5	-92.5	0	0	0	111.6	A569 L570 V571 S575 N576 L632 R635 L636	A569-Y573 WeakPolarHBondContact O-CB 3.44Å; A569-Y573 PolarHBondContact O-N 3.43Å; L570-Y573 WeakPolarHBondContact O-CB 3.49Å; L570-Y573 PolarHBondContact O-N 3.45Å; V571-Y573 VanDerWaalsContact C-N 3.31Å; V571-Y573 PolarHBondContact O-N 2.75Å; Y573-S575 PolarHBondContact O-N 3.32Å; Y573-N576 PolarHBondContact O-N 3.05Å; Y573-N576 VanDerWaalsContact O-N 3.1Å; Y573-L632 HydrophobicContact CD1-CD1 4.01Å; Y573-L632 HydrophobicContact CD2-CD1 3.68Å; Y573-L632 HydrophobicContact CE2-CD1 4.3Å; Y573-L632 HydrophobicContact CG-CD1 3.52Å; Y573-R635 HydrophobicContact CE2-CB 4.07Å; Y573-R635 WeakPolarHBondContact OH-CD 3.31Å; Y573-L636 HydrophobicContact CD2-CD2 3.88Å; Y573-L636 HydrophobicContact CD2-CG 4.22Å; Y573-L636 HydrophobicContact CE2-CD2 4.1Å; Y573-L636 HydrophobicContact CE2-CG 4.37Å
574	Q	85.8	Confident	87.8	Confident	97 Å²	97	49.1 Å²	49.1	45%	0.453	24%	0.24	S	C	.	.	H	α-helix	trans	-64.1	-27.9	177.9	-64.7	-60.8	-22.6	0	0	113	W544 L570 V571 N576	W544-Q574 HydrophobicContact CD2-CB 4.3Å; W544-Q574 HydrophobicContact CE3-CB 4.28Å; W544-Q574 HydrophobicContact CH2-CB 3.92Å; W544-Q574 HydrophobicContact CH2-CG 3.97Å; W544-Q574 HydrophobicContact CZ2-CB 3.96Å; W544-Q574 HydrophobicContact CZ2-CG 4.4Å; W544-Q574 HydrophobicContact CZ3-CB 4.07Å; W544-Q574 HydrophobicContact CZ3-CG 4.22Å; L570-Q574 WeakPolarHBondContact O-CG 3.49Å; L570-Q574 PolarHBondContact O-N 2.65Å; V571-Q574 PolarHBondContact O-N 2.91Å; Q574-N576 VanDerWaalsContact C-N 3.34Å
575	S	87.3	Confident	87.7	Confident	27 Å²	27	48.6 Å²	48.6	19%	0.189	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	12.9	175.4	57.7	0	0	0	0	114.3	V571 H572 Y573 H577	V571-S575 PolarHBondContact O-N 3.18Å; V571-S575 PolarHBondContact O-OG 3.17Å; H572-S575 WeakPolarHBondContact CA-OG 3.27Å; H572-S575 CarbonylContact O-C 3.58Å; H572-S575 PolarHBondContact O-N 2.72Å; H572-S575 PolarHBondContact O-OG 3.42Å; H572-S575 VanDerWaalsContact O-OG 3.1Å; Y573-S575 PolarHBondContact O-N 3.32Å; S575-H577 PolarHBondContact O-CE1 2.95Å; S575-H577 PolarHBondContact O-N 3.2Å; S575-H577 PolarHBondContact O-ND1 3.24Å; S575-H577 PolarHBondContact OG-ND1 2.78Å
576	N	83.6	Confident	87.6	Confident	143 Å²	143	48.7 Å²	48.7	77%	0.765	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	16.1	-179.1	-62.4	-36.2	0	0	0	116	H572 Y573 Q574 T578	H572-N576 PolarHBondContact O-N 2.92Å; Y573-N576 PolarHBondContact O-N 3.05Å; Y573-N576 VanDerWaalsContact O-N 3.1Å; Q574-N576 VanDerWaalsContact C-N 3.34Å; N576-T578 PolarHBondContact O-N 3.19Å
577	H	87.5	Confident	87.5	Confident	95 Å²	95	48.3 Å²	48.3	44%	0.44	24%	0.236	S	C	.	.			trans	-90.6	65.7	176.3	-63.2	101.5	0	0	0	111.5	H572 S575 K579 H580 S581	H572-H577 HydrophobicContact CB-CB 4.23Å; H572-H577 WeakPolarHBondContact O-CA 3.48Å; H572-H577 PolarHBondContact O-N 3.25Å; S575-H577 PolarHBondContact O-CE1 2.95Å; S575-H577 PolarHBondContact O-N 3.2Å; S575-H577 PolarHBondContact O-ND1 3.24Å; S575-H577 PolarHBondContact OG-ND1 2.78Å; H577-K579 VanDerWaalsContact C-N 3.33Å; H577-K579 PolarHBondContact O-N 2.81Å; H577-H580 HydrophobicContact CB-CB 4.3Å; H577-H580 PolarHBondContact O-N 3.46Å; H577-H580 VanDerWaalsContact O-N 3.17Å; H577-S581 PolarHBondContact O-N 3.32Å
578	T	85.2	Confident	87.5	Confident	81 Å²	81	47.3 Å²	47.3	50%	0.497	23%	0.23	S	C	.	.	H	α-helix	trans	-58.1	-39	-172.7	56.9	0	0	0	0	113.9	N576 H580 S581 W582 L636	N576-T578 PolarHBondContact O-N 3.19Å; T578-H580 PolarHBondContact O-N 2.78Å; T578-S581 WeakPolarHBondContact O-CB 3.33Å; T578-S581 PolarHBondContact O-N 2.72Å; T578-W582 WeakPolarHBondContact O-CB 3.37Å; T578-W582 PolarHBondContact O-N 3.35Å; T578-L636 HydrophobicContact CG2-CD2 4.15Å
579	K	86.9	Confident	87.1	Confident	158 Å²	158	46.7 Å²	46.7	69%	0.687	23%	0.228	S	C	*	.	H	α-helix	trans	-63.7	-40.3	178.6	-172.8	177.6	-178.4	178.4	0	112.7	H577 N583	H577-K579 VanDerWaalsContact C-N 3.33Å; H577-K579 PolarHBondContact O-N 2.81Å; K579-N583 VanDerWaalsContact O-CG 3.27Å; K579-N583 PolarHBondContact O-N 3.3Å; K579-N583 VanDerWaalsContact O-N 3.15Å; K579-N583 PolarHBondContact O-ND2 2.92Å
580	H	87	Confident	87	Confident	99 Å²	99	47.3 Å²	47.3	46%	0.458	23%	0.23	S	C	.	.	H	α-helix	trans	-70.9	-41.4	177	-70.2	-72.2	0	0	0	111.1	H572 H577 T578 W582 N583 D584	H572-H580 HydrophobicContact CB-CB 4.3Å; H577-H580 HydrophobicContact CB-CB 4.3Å; H577-H580 PolarHBondContact O-N 3.46Å; H577-H580 VanDerWaalsContact O-N 3.17Å; T578-H580 PolarHBondContact O-N 2.78Å; H580-W582 VanDerWaalsContact C-N 3.32Å; H580-W582 PolarHBondContact O-N 3.28Å; H580-N583 PolarHBondContact O-N 3.2Å; H580-D584 PolarHBondContact O-N 2.82Å; H580-D584 VanDerWaalsContact O-N 3.08Å
581	S	87	Confident	86.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.6	-45.7	173.3	-173.5	0	0	0	0	111.8	A569 H577 T578 D584 I585	A569-S581 WeakPolarHBondContact O-CB 3.45Å; A569-S581 PolarHBondContact O-OG 3Å; H577-S581 PolarHBondContact O-N 3.32Å; T578-S581 WeakPolarHBondContact O-CB 3.33Å; T578-S581 PolarHBondContact O-N 2.72Å; S581-D584 PolarHBondContact O-N 3.36Å; S581-I585 VanDerWaalsContact O-CG1 3.31Å; S581-I585 WeakPolarHBondContact O-CG1 3.16Å; S581-I585 PolarHBondContact O-N 3.3Å
582	W	85.9	Confident	86.6	Confident	60 Å²	60	44.7 Å²	44.7	23%	0.227	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-46.3	177.2	-172.5	-106.7	0	0	0	112.7	T578 H580 D584 I585 L586 L636 T637 I641	T578-W582 WeakPolarHBondContact O-CB 3.37Å; T578-W582 PolarHBondContact O-N 3.35Å; H580-W582 VanDerWaalsContact C-N 3.32Å; H580-W582 PolarHBondContact O-N 3.28Å; W582-D584 VanDerWaalsContact C-N 3.29Å; W582-D584 PolarHBondContact O-N 3.12Å; W582-I585 HydrophobicContact CE3-CD1 4.44Å; W582-I585 WeakPolarHBondContact O-CB 3.41Å; W582-I585 PolarHBondContact O-N 3.23Å; W582-L586 HydrophobicContact CZ2-CD2 4.23Å; W582-L586 WeakPolarHBondContact O-CG 3.43Å; W582-L586 PolarHBondContact O-N 2.92Å; W582-L636 HydrophobicContact CE3-CB 4.14Å; W582-L636 HydrophobicContact CE3-CD1 4.1Å; W582-L636 HydrophobicContact CZ3-CB 4.3Å; W582-T637 HydrophobicContact CE3-CG2 4.4Å; W582-T637 HydrophobicContact CH2-CG2 3.72Å; W582-T637 HydrophobicContact CZ2-CG2 4.36Å; W582-T637 HydrophobicContact CZ3-CG2 3.74Å; W582-I641 HydrophobicContact CH2-CD1 3.69Å; W582-I641 HydrophobicContact CZ2-CD1 4.4Å
583	N	87	Confident	86.3	Confident	47 Å²	47	43.7 Å²	43.7	25%	0.251	21%	0.212	S	C	.	.	H	α-helix	trans	-59.8	-39.2	178.2	-70	-20.1	0	0	0	112.4	K579 H580 L586 I587	K579-N583 VanDerWaalsContact O-CG 3.27Å; K579-N583 PolarHBondContact O-N 3.3Å; K579-N583 VanDerWaalsContact O-N 3.15Å; K579-N583 PolarHBondContact O-ND2 2.92Å; H580-N583 PolarHBondContact O-N 3.2Å; N583-L586 PolarHBondContact O-N 3.24Å; N583-I587 WeakPolarHBondContact O-CG1 2.83Å; N583-I587 PolarHBondContact O-N 2.9Å; N583-I587 VanDerWaalsContact O-N 3.13Å
584	D	87.5	Confident	86	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.032	20%	0.201	C	C	.	.	H	α-helix	trans	-69.6	-35.8	177.5	-76	-16.6	0	0	0	112.5	R568 A569 H572 H580 S581 W582 I587 F588	R568-D584 WeakPolarHBondContact CG-OD2 3.41Å; R568-D584 IonicContact CZ-OD1 2.77Å; R568-D584 IonicContact CZ-OD2 3.9Å; R568-D584 IonicContact NE-OD1 2.83Å; R568-D584 PolarHBondContact NE-OD1 3.37Å; R568-D584 IonicContact NE-OD2 3.98Å; R568-D584 PolarHBondContact NE-OD2 3.05Å; R568-D584 IonicContact NH2-OD1 3.19Å; R568-D584 PolarHBondContact NH2-OD1 2.7Å; R568-D584 IonicContact NH2-OD2 2.66Å; A569-D584 HydrophobicContact CB-CB 3.74Å; H572-D584 IonicContact CD2-OD2 2.62Å; H572-D584 PolarHBondContact CD2-OD2 3.45Å; H580-D584 PolarHBondContact O-N 2.82Å; H580-D584 VanDerWaalsContact O-N 3.08Å; S581-D584 PolarHBondContact O-N 3.36Å; W582-D584 VanDerWaalsContact C-N 3.29Å; W582-D584 PolarHBondContact O-N 3.12Å; D584-I587 PolarHBondContact O-N 3.48Å; D584-F588 WeakPolarHBondContact O-CB 3.23Å; D584-F588 PolarHBondContact O-N 3.1Å
585	I	87	Confident	85.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-43.4	172.4	-69	164.6	0	0	0	110.6	A569 S581 W582 I587 F588 I589 I629 L632 I633 L636	A569-I585 HydrophobicContact CB-CG1 3.96Å; S581-I585 VanDerWaalsContact O-CG1 3.31Å; S581-I585 WeakPolarHBondContact O-CG1 3.16Å; S581-I585 PolarHBondContact O-N 3.3Å; W582-I585 HydrophobicContact CE3-CD1 4.44Å; W582-I585 WeakPolarHBondContact O-CB 3.41Å; W582-I585 PolarHBondContact O-N 3.23Å; I585-I587 VanDerWaalsContact C-N 3.32Å; I585-I587 PolarHBondContact O-N 3.4Å; I585-F588 PolarHBondContact O-N 3.41Å; I585-I589 HydrophobicContact CG2-CD1 3.64Å; I585-I589 HydrophobicContact CG2-CG1 4.23Å; I585-I589 WeakPolarHBondContact O-CB 3.32Å; I585-I589 VanDerWaalsContact O-CG1 3.24Å; I585-I589 WeakPolarHBondContact O-CG1 2.85Å; I585-I589 PolarHBondContact O-N 3.02Å; I585-I629 HydrophobicContact CD1-CG2 4.31Å; I585-I629 HydrophobicContact CG1-CG2 4.15Å; I585-I629 HydrophobicContact CG2-CD1 4.23Å; I585-I629 HydrophobicContact CG2-CG2 4.04Å; I585-L632 HydrophobicContact CD1-CD2 3.61Å; I585-L632 HydrophobicContact CD1-CG 3.93Å; I585-L632 HydrophobicContact CG1-CD2 4.05Å; I585-I633 HydrophobicContact CG2-CD1 4.17Å; I585-I633 HydrophobicContact CG2-CG1 4.11Å; I585-L636 HydrophobicContact CD1-CD1 3.29Å
586	L	87.1	Confident	85.3	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-43.4	176.3	-67	178.2	0	0	0	111.5	W582 N583 I589 Y590 V646 E651 C652	W582-L586 HydrophobicContact CZ2-CD2 4.23Å; W582-L586 WeakPolarHBondContact O-CG 3.43Å; W582-L586 PolarHBondContact O-N 2.92Å; N583-L586 PolarHBondContact O-N 3.24Å; L586-I589 PolarHBondContact O-N 3.4Å; L586-Y590 WeakPolarHBondContact O-CB 3.15Å; L586-Y590 PolarHBondContact O-N 3.47Å; L586-V646 HydrophobicContact CD2-CG1 3.73Å; L586-E651 HydrophobicContact CD1-CG 4.05Å; L586-C652 PolarHBondContact O-SG 2.92Å; L586-C652 VanDerWaalsContact O-SG 3.4Å
587	I	86.5	Confident	85.2	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.026	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-44.4	175.8	-64.8	167.9	0	0	0	110.9	Y565 N583 D584 I585 I589 Y590 L591 L656 N659	Y565-I587 HydrophobicContact CD1-CB 4.1Å; Y565-I587 HydrophobicContact CD1-CD1 4.08Å; Y565-I587 HydrophobicContact CD1-CG2 3.74Å; Y565-I587 HydrophobicContact CD2-CG2 3.82Å; Y565-I587 HydrophobicContact CE1-CB 4.37Å; Y565-I587 HydrophobicContact CE1-CD1 3.86Å; Y565-I587 HydrophobicContact CE1-CG2 3.73Å; Y565-I587 HydrophobicContact CE2-CG2 3.79Å; Y565-I587 HydrophobicContact CG-CB 4.31Å; Y565-I587 HydrophobicContact CG-CG2 3.79Å; N583-I587 WeakPolarHBondContact O-CG1 2.83Å; N583-I587 PolarHBondContact O-N 2.9Å; N583-I587 VanDerWaalsContact O-N 3.13Å; D584-I587 PolarHBondContact O-N 3.48Å; I585-I587 VanDerWaalsContact C-N 3.32Å; I585-I587 PolarHBondContact O-N 3.4Å; I587-I589 PolarHBondContact O-N 3.18Å; I587-Y590 WeakPolarHBondContact O-CB 3.36Å; I587-Y590 PolarHBondContact O-N 2.72Å; I587-L591 HydrophobicContact CG2-CD1 3.83Å; I587-L591 HydrophobicContact CG2-CG 4.22Å; I587-L591 WeakPolarHBondContact O-CG 3.45Å; I587-L591 PolarHBondContact O-N 3.01Å; I587-L656 HydrophobicContact CG1-CB 4.45Å; I587-L656 HydrophobicContact CG2-CD1 3.98Å; I587-N659 HydrophobicContact CD1-CB 4.46Å
588	F	87.1	Confident	84.9	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.009	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-43.2	177.6	176.4	-86.8	0	0	0	112.5	P562 M566 D584 I585 Y590 L591 N592 V625 Q628 I629	P562-F588 HydrophobicContact CB-CD2 3.57Å; P562-F588 HydrophobicContact CB-CE2 3.72Å; P562-F588 VanDerWaalsContact O-CD2 3.3Å; P562-F588 WeakPolarHBondContact O-CD2 3.48Å; M566-F588 HydrophobicContact CB-CD2 3.66Å; M566-F588 HydrophobicContact CB-CE2 3.73Å; M566-F588 HydrophobicContact CB-CG 4.39Å; M566-F588 HydrophobicContact CG-CE2 4.31Å; D584-F588 WeakPolarHBondContact O-CB 3.23Å; D584-F588 PolarHBondContact O-N 3.1Å; I585-F588 PolarHBondContact O-N 3.41Å; F588-Y590 VanDerWaalsContact C-N 3.33Å; F588-L591 PolarHBondContact O-N 3.44Å; F588-N592 VanDerWaalsContact CE1-ND2 3.32Å; F588-N592 WeakPolarHBondContact CE1-ND2 3.2Å; F588-N592 WeakPolarHBondContact CE2-ND2 3.36Å; F588-N592 WeakPolarHBondContact CZ-ND2 3.36Å; F588-N592 PolarHBondContact O-N 3.09Å; F588-N592 PolarHBondContact O-ND2 3.5Å; F588-N592 VanDerWaalsContact O-ND2 3.08Å; F588-V625 HydrophobicContact CE1-CB 4.39Å; F588-V625 HydrophobicContact CE1-CG1 3.98Å; F588-V625 HydrophobicContact CE1-CG2 4.01Å; F588-Q628 VanDerWaalsContact CZ-OE1 3.29Å; F588-I629 HydrophobicContact CD1-CD1 3.13Å; F588-I629 HydrophobicContact CD1-CG1 3.79Å; F588-I629 HydrophobicContact CE1-CD1 3.35Å; F588-I629 HydrophobicContact CE1-CG1 3.55Å; F588-I629 HydrophobicContact CG-CD1 4.22Å; F588-I629 HydrophobicContact CZ-CG1 4.42Å
589	I	86.1	Confident	84.5	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-61.8	-45.3	176	-70.5	167.6	0	0	0	109.4	I585 L586 I587 N592 L593 I629 I633 L643 A647	I585-I589 HydrophobicContact CG2-CD1 3.64Å; I585-I589 HydrophobicContact CG2-CG1 4.23Å; I585-I589 WeakPolarHBondContact O-CB 3.32Å; I585-I589 VanDerWaalsContact O-CG1 3.24Å; I585-I589 WeakPolarHBondContact O-CG1 2.85Å; I585-I589 PolarHBondContact O-N 3.02Å; L586-I589 PolarHBondContact O-N 3.4Å; I587-I589 PolarHBondContact O-N 3.18Å; I589-N592 PolarHBondContact O-N 3.49Å; I589-L593 HydrophobicContact CG2-CD1 4.37Å; I589-L593 WeakPolarHBondContact O-CB 3.41Å; I589-L593 PolarHBondContact O-N 3.02Å; I589-I629 HydrophobicContact CG1-CD1 3.9Å; I589-I633 HydrophobicContact CD1-CD1 4.42Å; I589-L643 HydrophobicContact CD1-CD2 3.84Å; I589-L643 HydrophobicContact CG1-CD2 4.5Å; I589-A647 HydrophobicContact CG2-CB 3.56Å
590	Y	85.8	Confident	84	Confident	13 Å²	13	23.2 Å²	23.2	5%	0.051	11%	0.108	C	C	.	.	H	α-helix	trans	-57.4	-52.2	176.7	-170.5	-92.7	0	0	0	112	L586 I587 F588 N592 S594 W596 A647 C652 E653 L656 I698	L586-Y590 WeakPolarHBondContact O-CB 3.15Å; L586-Y590 PolarHBondContact O-N 3.47Å; I587-Y590 WeakPolarHBondContact O-CB 3.36Å; I587-Y590 PolarHBondContact O-N 2.72Å; F588-Y590 VanDerWaalsContact C-N 3.33Å; Y590-N592 PolarHBondContact O-N 2.75Å; Y590-N592 VanDerWaalsContact O-N 3.14Å; Y590-S594 WeakPolarHBondContact O-CB 3.36Å; Y590-S594 PolarHBondContact O-N 3.41Å; Y590-S594 VanDerWaalsContact O-N 3.15Å; Y590-S594 PolarHBondContact O-OG 3.33Å; Y590-W596 HydrophobicContact CE1-CD2 4.36Å; Y590-W596 AromaticContact CE1-CE3 3.89Å; Y590-W596 HydrophobicContact CE1-CE3 3.89Å; Y590-A647 WeakPolarHBondContact CD2-O 3.36Å; Y590-C652 HydrophobicContact CD2-CB 3.79Å; Y590-C652 HydrophobicContact CG-CB 4.31Å; Y590-E653 HydrophobicContact CD2-CB 4.48Å; Y590-E653 HydrophobicContact CE2-CB 3.89Å; Y590-E653 HydrophobicContact CE2-CG 4.2Å; Y590-L656 HydrophobicContact CD1-CD2 3.62Å; Y590-L656 HydrophobicContact CE1-CD2 3.65Å; Y590-I698 HydrophobicContact CE1-CD1 3.82Å; Y590-I698 WeakPolarHBondContact OH-CD1 3.47Å
591	L	85.3	Confident	83.4	Confident	8 Å²	8	23.3 Å²	23.3	4%	0.042	11%	0.105	C	C	.	.	H	α-helix	trans	-68.6	-12.2	-175.4	-66.6	174.1	0	0	0	114	F560 P562 Y565 I587 F588 W596 A597 L656	F560-L591 HydrophobicContact CD1-CD2 3.92Å; P562-L591 HydrophobicContact CB-CB 4.28Å; P562-L591 HydrophobicContact CG-CB 3.86Å; Y565-L591 HydrophobicContact CD2-CD1 3.79Å; Y565-L591 HydrophobicContact CE2-CD1 3.67Å; I587-L591 HydrophobicContact CG2-CD1 3.83Å; I587-L591 HydrophobicContact CG2-CG 4.22Å; I587-L591 WeakPolarHBondContact O-CG 3.45Å; I587-L591 PolarHBondContact O-N 3.01Å; F588-L591 PolarHBondContact O-N 3.44Å; L591-W596 HydrophobicContact CD2-CZ3 4.01Å; L591-A597 VanDerWaalsContact C-CB 3.49Å; L591-A597 WeakPolarHBondContact O-CB 3.41Å; L591-L656 HydrophobicContact CD2-CD1 4.46Å; L591-L656 HydrophobicContact CD2-CD2 3.95Å
592	N	84.1	Confident	82.8	Confident	12 Å²	12	24.4 Å²	24.4	6%	0.064	11%	0.111	C	C	.	.	H	α-helix	trans	-109.9	-40.4	179.1	-77.9	-54.5	0	0	0	114.4	P562 F588 I589 Y590 R601 V625	P562-N592 WeakPolarHBondContact CB-ND2 3.37Å; F588-N592 VanDerWaalsContact CE1-ND2 3.32Å; F588-N592 WeakPolarHBondContact CE1-ND2 3.2Å; F588-N592 WeakPolarHBondContact CE2-ND2 3.36Å; F588-N592 WeakPolarHBondContact CZ-ND2 3.36Å; F588-N592 PolarHBondContact O-N 3.09Å; F588-N592 PolarHBondContact O-ND2 3.5Å; F588-N592 VanDerWaalsContact O-ND2 3.08Å; I589-N592 PolarHBondContact O-N 3.49Å; Y590-N592 PolarHBondContact O-N 2.75Å; Y590-N592 VanDerWaalsContact O-N 3.14Å; N592-R601 PolarHBondContact OD1-NH2 3.34Å; N592-V625 HydrophobicContact CB-CG2 3.64Å
593	L	84.9	Confident	82.3	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-113.3	-13.4	-168.4	-63.7	177.3	0	0	0	114	I589 H618 F621 L622 V625 L643 A647	I589-L593 HydrophobicContact CG2-CD1 4.37Å; I589-L593 WeakPolarHBondContact O-CB 3.41Å; I589-L593 PolarHBondContact O-N 3.02Å; L593-H618 PolarHBondContact O-CE1 2.67Å; L593-F621 HydrophobicContact CD2-CB 3.93Å; L593-L622 HydrophobicContact CD1-CD1 3.81Å; L593-L622 HydrophobicContact CD2-CB 4.28Å; L593-V625 HydrophobicContact CD1-CB 4.23Å; L593-V625 HydrophobicContact CD1-CG1 3.86Å; L593-V625 HydrophobicContact CD1-CG2 4.35Å; L593-V625 HydrophobicContact CD2-CG2 4.21Å; L593-V625 HydrophobicContact CG-CG1 4.48Å; L593-V625 HydrophobicContact CG-CG2 4.1Å; L593-L643 HydrophobicContact CD1-CB 3.97Å; L593-A647 HydrophobicContact CB-CB 3.67Å
594	S	82.2	Confident	81.8	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.007	13%	0.134	C	C	.	.	S	Bend	trans	-63.9	150.8	177.9	67.2	0	0	0	0	110.9	Y590 W596 A597 L598 N648	Y590-S594 WeakPolarHBondContact O-CB 3.36Å; Y590-S594 PolarHBondContact O-N 3.41Å; Y590-S594 VanDerWaalsContact O-N 3.15Å; Y590-S594 PolarHBondContact O-OG 3.33Å; S594-W596 PolarHBondContact O-N 3.43Å; S594-A597 PolarHBondContact O-N 2.97Å; S594-A597 WeakPolarHBondContact OG-CB 3.48Å; S594-A597 PolarHBondContact OG-N 3.09Å; S594-A597 VanDerWaalsContact OG-N 3.09Å; S594-L598 WeakPolarHBondContact O-CG 3.26Å; S594-L598 PolarHBondContact O-N 3.11Å; S594-N648 WeakPolarHBondContact CA-OD1 3.29Å
595	D	79.2	Confident	81.3	Confident	74 Å²	74	32 Å²	32	40%	0.396	16%	0.157	S	C	.	.	H	α-helix	trans	-57.4	-31.9	173.5	-73.5	-46.1	0	0	0	111.8	F599 W606 N648	D595-F599 WeakPolarHBondContact O-CB 3.48Å; D595-F599 PolarHBondContact O-N 3.41Å; D595-W606 PolarHBondContact OD1-NE1 2.87Å; D595-W606 VanDerWaalsContact OD1-NE1 3.07Å; D595-N648 PolarHBondContact N-OD1 3.17Å; D595-N648 VanDerWaalsContact N-OD1 3.1Å; D595-N648 PolarHBondContact OD2-ND2 3.02Å
596	W	78.9	Confident	80.8	Confident	28 Å²	28	32.6 Å²	32.6	11%	0.106	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-50	172.8	177.7	83.2	0	0	0	112.1	F560 Y590 L591 S594 L598 F599 Q600 I698 D699 H702	F560-W596 AromaticContact CD1-CH2 3.62Å; F560-W596 HydrophobicContact CD1-CH2 3.62Å; F560-W596 HydrophobicContact CD1-CZ3 4.23Å; F560-W596 AromaticContact CE1-CH2 3.71Å; F560-W596 HydrophobicContact CE1-CH2 3.71Å; F560-W596 HydrophobicContact CE1-CZ2 4.2Å; F560-W596 HydrophobicContact CE1-CZ3 4.47Å; Y590-W596 HydrophobicContact CE1-CD2 4.36Å; Y590-W596 AromaticContact CE1-CE3 3.89Å; Y590-W596 HydrophobicContact CE1-CE3 3.89Å; L591-W596 HydrophobicContact CD2-CZ3 4.01Å; S594-W596 PolarHBondContact O-N 3.43Å; W596-L598 VanDerWaalsContact C-N 3.34Å; W596-L598 PolarHBondContact O-N 3.39Å; W596-F599 WeakPolarHBondContact O-CB 3.36Å; W596-F599 PolarHBondContact O-N 3.3Å; W596-Q600 HydrophobicContact CD2-CG 4.31Å; W596-Q600 HydrophobicContact CH2-CG 4.1Å; W596-Q600 HydrophobicContact CZ2-CG 3.73Å; W596-Q600 WeakPolarHBondContact O-CG 3.07Å; W596-Q600 PolarHBondContact O-N 3.43Å; W596-I698 HydrophobicContact CD2-CG2 4.02Å; W596-I698 HydrophobicContact CE3-CG2 4.43Å; W596-I698 HydrophobicContact CH2-CG2 4.01Å; W596-I698 HydrophobicContact CZ2-CG2 3.53Å; W596-I698 HydrophobicContact CZ3-CG2 4.43Å; W596-D699 PolarHBondContact NE1-OD1 3.45Å; W596-H702 HydrophobicContact CZ2-CB 4.03Å
597	A	80.1	Confident	80.3	Confident	3 Å²	3	36.8 Å²	36.8	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-40.5	-179.7	0	0	0	0	0	112.3	L591 S594 F599 Q600 R601	L591-A597 VanDerWaalsContact C-CB 3.49Å; L591-A597 WeakPolarHBondContact O-CB 3.41Å; S594-A597 PolarHBondContact O-N 2.97Å; S594-A597 WeakPolarHBondContact OG-CB 3.48Å; S594-A597 PolarHBondContact OG-N 3.09Å; S594-A597 VanDerWaalsContact OG-N 3.09Å; A597-F599 VanDerWaalsContact C-N 3.34Å; A597-Q600 PolarHBondContact O-N 3.06Å; A597-R601 WeakPolarHBondContact O-CG 3.44Å; A597-R601 PolarHBondContact O-N 3.44Å
598	L	81.3	Confident	80.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-34.8	177.3	-64.3	170.1	0	0	0	111.7	S594 W596 T602 W606 H618 F621	S594-L598 WeakPolarHBondContact O-CG 3.26Å; S594-L598 PolarHBondContact O-N 3.11Å; W596-L598 VanDerWaalsContact C-N 3.34Å; W596-L598 PolarHBondContact O-N 3.39Å; L598-T602 WeakPolarHBondContact O-CB 3.47Å; L598-T602 VanDerWaalsContact O-CG2 3.28Å; L598-T602 WeakPolarHBondContact O-CG2 3.49Å; L598-T602 PolarHBondContact O-N 2.85Å; L598-T602 VanDerWaalsContact O-N 3.15Å; L598-T602 PolarHBondContact O-OG1 2.95Å; L598-W606 HydrophobicContact CB-CD2 3.65Å; L598-W606 HydrophobicContact CB-CE3 3.94Å; L598-W606 HydrophobicContact CB-CG 4.05Å; L598-W606 HydrophobicContact CB-CH2 4.34Å; L598-W606 HydrophobicContact CB-CZ2 4.08Å; L598-W606 HydrophobicContact CB-CZ3 4.27Å; L598-W606 HydrophobicContact CD1-CH2 3.68Å; L598-W606 HydrophobicContact CD1-CZ2 3.41Å; L598-W606 VanDerWaalsContact CD1-CZ2 3.41Å; L598-W606 HydrophobicContact CD1-CZ3 4.35Å; L598-W606 HydrophobicContact CG-CH2 4.43Å; L598-W606 HydrophobicContact CG-CZ2 4.32Å; L598-H618 VanDerWaalsContact CD1-ND1 3.33Å; L598-H618 WeakPolarHBondContact CD1-ND1 3.49Å; L598-F621 HydrophobicContact CD2-CD2 3.5Å; L598-F621 HydrophobicContact CD2-CE2 3.78Å; L598-F621 HydrophobicContact CD2-CG 4.39Å
599	F	77.8	Confident	79.7	Confident	73 Å²	73	46.1 Å²	46.1	32%	0.32	23%	0.232	S	C	.	.	H	α-helix	trans	-60.5	-45.9	170.8	-174.4	-92	0	0	0	112	D595 W596 A597 T602 N603 G604 W606	D595-F599 WeakPolarHBondContact O-CB 3.48Å; D595-F599 PolarHBondContact O-N 3.41Å; W596-F599 WeakPolarHBondContact O-CB 3.36Å; W596-F599 PolarHBondContact O-N 3.3Å; A597-F599 VanDerWaalsContact C-N 3.34Å; F599-T602 PolarHBondContact O-N 3.18Å; F599-T602 PolarHBondContact O-OG1 2.92Å; F599-N603 PolarHBondContact O-N 3.05Å; F599-G604 VanDerWaalsContact CE2-CA 3.5Å; F599-G604 VanDerWaalsContact CE2-O 3.29Å; F599-G604 WeakPolarHBondContact CE2-O 3.46Å; F599-G604 VanDerWaalsContact CZ-CA 3.45Å; F599-G604 PolarHBondContact O-N 3.07Å; F599-W606 HydrophobicContact CB-CB 4.17Å; F599-W606 HydrophobicContact CD2-CB 4.21Å
600	Q	75.9	Confident	79.6	Confident	51 Å²	51	49.1 Å²	49.1	24%	0.238	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-47.2	178.1	-65.5	-59.6	-24.7	0	0	112.3	W596 A597 T602 N603 D699	W596-Q600 HydrophobicContact CD2-CG 4.31Å; W596-Q600 HydrophobicContact CH2-CG 4.1Å; W596-Q600 HydrophobicContact CZ2-CG 3.73Å; W596-Q600 WeakPolarHBondContact O-CG 3.07Å; W596-Q600 PolarHBondContact O-N 3.43Å; A597-Q600 PolarHBondContact O-N 3.06Å; Q600-T602 PolarHBondContact O-N 3.09Å; Q600-N603 PolarHBondContact O-N 3.25Å; Q600-N603 VanDerWaalsContact O-N 3.12Å; Q600-D699 PolarHBondContact NE2-OD1 3.04Å
601	R	74.7	Confident	79.3	Confident	102 Å²	102	55 Å²	55	39%	0.385	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-26.2	179.6	-73.5	-178.6	177.9	171.6	2.9	114.4	N592 A597 N603 F621	N592-R601 PolarHBondContact OD1-NH2 3.34Å; A597-R601 WeakPolarHBondContact O-CG 3.44Å; A597-R601 PolarHBondContact O-N 3.44Å; R601-N603 VanDerWaalsContact C-N 3.33Å; R601-F621 VanDerWaalsContact NH1-CD1 3.29Å
602	T	75.5	Confident	79.3	Confident	22 Å²	22	62.7 Å²	62.7	14%	0.135	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	11.7	-179.8	59.2	0	0	0	0	112.7	L598 F599 Q600 G604 K605 W606 Y609	L598-T602 WeakPolarHBondContact O-CB 3.47Å; L598-T602 VanDerWaalsContact O-CG2 3.28Å; L598-T602 WeakPolarHBondContact O-CG2 3.49Å; L598-T602 PolarHBondContact O-N 2.85Å; L598-T602 VanDerWaalsContact O-N 3.15Å; L598-T602 PolarHBondContact O-OG1 2.95Å; F599-T602 PolarHBondContact O-N 3.18Å; F599-T602 PolarHBondContact O-OG1 2.92Å; Q600-T602 PolarHBondContact O-N 3.09Å; T602-G604 PolarHBondContact O-N 3.15Å; T602-K605 VanDerWaalsContact O-CB 3.32Å; T602-K605 WeakPolarHBondContact O-CB 3.45Å; T602-K605 WeakPolarHBondContact O-CG 3.35Å; T602-K605 PolarHBondContact O-N 3Å; T602-K605 VanDerWaalsContact O-N 3.1Å; T602-W606 HydrophobicContact CG2-CE3 4.21Å; T602-W606 WeakPolarHBondContact OG1-CA 3.46Å; T602-W606 VanDerWaalsContact OG1-CB 3.31Å; T602-W606 WeakPolarHBondContact OG1-CB 3.18Å; T602-W606 PolarHBondContact OG1-N 3.38Å; T602-Y609 HydrophobicContact CG2-CE2 3.77Å
603	N	75	Confident	79.2	Confident	137 Å²	137	66.3 Å²	66.3	73%	0.733	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	43.8	-176.4	-66.1	-34.7	0	0	0	112	F599 Q600 R601 K605	F599-N603 PolarHBondContact O-N 3.05Å; Q600-N603 PolarHBondContact O-N 3.25Å; Q600-N603 VanDerWaalsContact O-N 3.12Å; R601-N603 VanDerWaalsContact C-N 3.33Å; N603-K605 VanDerWaalsContact C-N 3.31Å; N603-K605 PolarHBondContact O-N 3.35Å
604	G	75.3	Confident	79	Confident	22 Å²	22	67.9 Å²	67.9	23%	0.227	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	0.7	178.8	0	0	0	0	0	115.8	F599 T602 W606	F599-G604 VanDerWaalsContact CE2-CA 3.5Å; F599-G604 VanDerWaalsContact CE2-O 3.29Å; F599-G604 WeakPolarHBondContact CE2-O 3.46Å; F599-G604 VanDerWaalsContact CZ-CA 3.45Å; F599-G604 PolarHBondContact O-N 3.07Å; T602-G604 PolarHBondContact O-N 3.15Å; G604-W606 VanDerWaalsContact C-N 3.31Å; G604-W606 PolarHBondContact O-N 3.24Å
605	K	77.4	Confident	79	Confident	115 Å²	115	71.1 Å²	71.1	50%	0.5	35%	0.351	S	S	.	.			trans	-79.3	-11.8	-179	-62.4	177.7	-178.9	176.9	0	113.9	T602 N603 S607 I608 Y609	T602-K605 VanDerWaalsContact O-CB 3.32Å; T602-K605 WeakPolarHBondContact O-CB 3.45Å; T602-K605 WeakPolarHBondContact O-CG 3.35Å; T602-K605 PolarHBondContact O-N 3Å; T602-K605 VanDerWaalsContact O-N 3.1Å; N603-K605 VanDerWaalsContact C-N 3.31Å; N603-K605 PolarHBondContact O-N 3.35Å; K605-S607 VanDerWaalsContact C-N 3.3Å; K605-S607 PolarHBondContact O-N 2.93Å; K605-I608 WeakPolarHBondContact O-CB 3.27Å; K605-I608 PolarHBondContact O-N 3.5Å; K605-Y609 HydrophobicContact CB-CE1 4.26Å; K605-Y609 HydrophobicContact CB-CE2 3.84Å; K605-Y609 WeakPolarHBondContact O-CD2 3.39Å; K605-Y609 PolarHBondContact O-N 3.45Å
606	W	75.8	Confident	79.1	Confident	12 Å²	12	72.3 Å²	72.3	5%	0.045	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-49.1	-49.7	-176	-176.2	-120.5	0	0	0	112.9	D595 L598 F599 T602 G604 I608 Y609 Q614 V617 H618	D595-W606 PolarHBondContact OD1-NE1 2.87Å; D595-W606 VanDerWaalsContact OD1-NE1 3.07Å; L598-W606 HydrophobicContact CB-CD2 3.65Å; L598-W606 HydrophobicContact CB-CE3 3.94Å; L598-W606 HydrophobicContact CB-CG 4.05Å; L598-W606 HydrophobicContact CB-CH2 4.34Å; L598-W606 HydrophobicContact CB-CZ2 4.08Å; L598-W606 HydrophobicContact CB-CZ3 4.27Å; L598-W606 HydrophobicContact CD1-CH2 3.68Å; L598-W606 HydrophobicContact CD1-CZ2 3.41Å; L598-W606 VanDerWaalsContact CD1-CZ2 3.41Å; L598-W606 HydrophobicContact CD1-CZ3 4.35Å; L598-W606 HydrophobicContact CG-CH2 4.43Å; L598-W606 HydrophobicContact CG-CZ2 4.32Å; F599-W606 HydrophobicContact CB-CB 4.17Å; F599-W606 HydrophobicContact CD2-CB 4.21Å; T602-W606 HydrophobicContact CG2-CE3 4.21Å; T602-W606 WeakPolarHBondContact OG1-CA 3.46Å; T602-W606 VanDerWaalsContact OG1-CB 3.31Å; T602-W606 WeakPolarHBondContact OG1-CB 3.18Å; T602-W606 PolarHBondContact OG1-N 3.38Å; G604-W606 VanDerWaalsContact C-N 3.31Å; G604-W606 PolarHBondContact O-N 3.24Å; W606-I608 PolarHBondContact O-N 2.85Å; W606-Y609 HydrophobicContact CE3-CD2 4.21Å; W606-Y609 PolarHBondContact O-N 3.03Å; W606-Q614 HydrophobicContact CD2-CG 4.4Å; W606-Q614 HydrophobicContact CE3-CG 4.28Å; W606-Q614 HydrophobicContact CH2-CB 3.66Å; W606-Q614 HydrophobicContact CH2-CG 3.98Å; W606-Q614 WeakPolarHBondContact CH2-O 3.39Å; W606-Q614 HydrophobicContact CZ2-CB 3.96Å; W606-Q614 HydrophobicContact CZ2-CG 4.09Å; W606-Q614 HydrophobicContact CZ3-CB 4.13Å; W606-Q614 HydrophobicContact CZ3-CG 4.08Å; W606-Q614 PolarHBondContact O-NE2 3.25Å; W606-V617 HydrophobicContact CH2-CB 4.39Å; W606-V617 HydrophobicContact CH2-CG1 4.44Å; W606-V617 HydrophobicContact CZ3-CB 3.91Å; W606-V617 HydrophobicContact CZ3-CG1 3.8Å; W606-H618 HydrophobicContact CH2-CB 4.34Å
607	S	77.9	Confident	79.1	Confident	90 Å²	90	72 Å²	72	63%	0.629	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-67.3	-17.5	-178	-49.1	0	0	0	0	114.1	K605	K605-S607 VanDerWaalsContact C-N 3.3Å; K605-S607 PolarHBondContact O-N 2.93Å
608	I	80.8	Confident	79.2	Confident	138 Å²	138	72.7 Å²	72.7	71%	0.708	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-91.9	-21.5	-178.2	-51.8	172	0	0	0	110.5	K605 W606	K605-I608 WeakPolarHBondContact O-CB 3.27Å; K605-I608 PolarHBondContact O-N 3.5Å; W606-I608 PolarHBondContact O-N 2.85Å
609	Y	79.4	Confident	79.3	Confident	65 Å²	65	77 Å²	77	26%	0.255	38%	0.383	S	S	.	.	S	Bend	trans	-68.2	138.1	-176.2	-70.4	-45.3	0	0	0	112.5	T602 K605 W606 Y613 Q614	T602-Y609 HydrophobicContact CG2-CE2 3.77Å; K605-Y609 HydrophobicContact CB-CE1 4.26Å; K605-Y609 HydrophobicContact CB-CE2 3.84Å; K605-Y609 WeakPolarHBondContact O-CD2 3.39Å; K605-Y609 PolarHBondContact O-N 3.45Å; W606-Y609 HydrophobicContact CE3-CD2 4.21Å; W606-Y609 PolarHBondContact O-N 3.03Å; Y609-Y613 AromaticContact CD1-CD1 3.71Å; Y609-Y613 HydrophobicContact CD1-CD1 3.71Å; Y609-Y613 AromaticContact CD1-CE1 3.87Å; Y609-Y613 HydrophobicContact CD1-CE1 3.87Å; Y609-Y613 AromaticContact CD2-CD1 3.8Å; Y609-Y613 HydrophobicContact CD2-CD1 3.8Å; Y609-Y613 AromaticContact CD2-CE1 3.82Å; Y609-Y613 HydrophobicContact CD2-CE1 3.82Å; Y609-Y613 HydrophobicContact CE1-CD1 4.24Å; Y609-Y613 AromaticContact CE1-CE1 3.91Å; Y609-Y613 HydrophobicContact CE1-CE1 3.91Å; Y609-Y613 HydrophobicContact CE2-CD1 4.32Å; Y609-Y613 AromaticContact CE2-CE1 3.86Å; Y609-Y613 HydrophobicContact CE2-CE1 3.86Å; Y609-Y613 AromaticContact CG-CD1 3.49Å; Y609-Y613 HydrophobicContact CG-CD1 3.49Å; Y609-Y613 VanDerWaalsContact CG-CD1 3.49Å; Y609-Y613 AromaticContact CG-CE1 3.85Å; Y609-Y613 HydrophobicContact CG-CE1 3.85Å; Y609-Y613 AromaticContact CZ-CE1 3.92Å; Y609-Q614 PolarHBondContact O-NE2 2.98Å
610	P	83.5	Confident	79.6	Confident	66 Å²	66	82 Å²	82	43%	0.429	40%	0.4	S	S	.	.			trans	-56.9	146.3	172	-23.6	32.9	0	0	0	111.7	W612 Y613 Q614	P610-W612 HydrophobicContact CB-CG 4.38Å; P610-W612 PolarHBondContact O-N 2.88Å; P610-W612 VanDerWaalsContact O-N 3.07Å; P610-Y613 WeakPolarHBondContact O-CB 3.4Å; P610-Y613 PolarHBondContact O-N 3.37Å; P610-Q614 PolarHBondContact O-N 3.48Å; P610-Q614 VanDerWaalsContact O-N 3.07Å
611	M	81.5	Confident	79.8	Confident	137 Å²	137	81.5 Å²	81.5	68%	0.675	40%	0.397	S	S	*	.	H	α-helix	trans	-49.8	-39.8	-177.9	-72.1	-58.6	-58.6	0	0	113.7	Y613 Q614 T615	M611-Y613 VanDerWaalsContact C-N 3.33Å; M611-Y613 PolarHBondContact O-N 3.23Å; M611-Q614 PolarHBondContact O-N 2.9Å; M611-Q614 PolarHBondContact SD-OE1 2.87Å; M611-Q614 VanDerWaalsContact SD-OE1 3.41Å; M611-T615 WeakPolarHBondContact O-CB 3.06Å; M611-T615 PolarHBondContact O-N 3.29Å; M611-T615 PolarHBondContact O-OG1 3.49Å
612	W	85.1	Confident	80.2	Confident	169 Å²	169	78.9 Å²	78.9	64%	0.64	39%	0.39	S	S	*	.	H	α-helix	trans	-64.4	-37.5	179	66.3	-98.6	0	0	0	112.1	P610 T615 I616	P610-W612 HydrophobicContact CB-CG 4.38Å; P610-W612 PolarHBondContact O-N 2.88Å; P610-W612 VanDerWaalsContact O-N 3.07Å; W612-T615 PolarHBondContact O-N 3.14Å; W612-I616 HydrophobicContact CE3-CD1 3.67Å; W612-I616 HydrophobicContact CZ3-CD1 3.88Å; W612-I616 WeakPolarHBondContact O-CG1 3.39Å; W612-I616 PolarHBondContact O-N 3.25Å; W612-I616 VanDerWaalsContact O-N 3.16Å
613	Y	81.1	Confident	80.5	Confident	88 Å²	88	81.5 Å²	81.5	35%	0.345	41%	0.41	S	S	.	.	H	α-helix	trans	-73.7	-43.1	178.7	-174	-96.8	0	0	0	111.4	Y609 P610 M611 T615 I616 V617	Y609-Y613 AromaticContact CD1-CD1 3.71Å; Y609-Y613 HydrophobicContact CD1-CD1 3.71Å; Y609-Y613 AromaticContact CD1-CE1 3.87Å; Y609-Y613 HydrophobicContact CD1-CE1 3.87Å; Y609-Y613 AromaticContact CD2-CD1 3.8Å; Y609-Y613 HydrophobicContact CD2-CD1 3.8Å; Y609-Y613 AromaticContact CD2-CE1 3.82Å; Y609-Y613 HydrophobicContact CD2-CE1 3.82Å; Y609-Y613 HydrophobicContact CE1-CD1 4.24Å; Y609-Y613 AromaticContact CE1-CE1 3.91Å; Y609-Y613 HydrophobicContact CE1-CE1 3.91Å; Y609-Y613 HydrophobicContact CE2-CD1 4.32Å; Y609-Y613 AromaticContact CE2-CE1 3.86Å; Y609-Y613 HydrophobicContact CE2-CE1 3.86Å; Y609-Y613 AromaticContact CG-CD1 3.49Å; Y609-Y613 HydrophobicContact CG-CD1 3.49Å; Y609-Y613 VanDerWaalsContact CG-CD1 3.49Å; Y609-Y613 AromaticContact CG-CE1 3.85Å; Y609-Y613 HydrophobicContact CG-CE1 3.85Å; Y609-Y613 AromaticContact CZ-CE1 3.92Å; P610-Y613 WeakPolarHBondContact O-CB 3.4Å; P610-Y613 PolarHBondContact O-N 3.37Å; M611-Y613 VanDerWaalsContact C-N 3.33Å; M611-Y613 PolarHBondContact O-N 3.23Å; Y613-T615 VanDerWaalsContact C-N 3.26Å; Y613-T615 PolarHBondContact O-N 3.46Å; Y613-I616 PolarHBondContact O-N 3.19Å; Y613-I616 VanDerWaalsContact O-N 3.17Å; Y613-V617 HydrophobicContact CD1-CG2 3.97Å; Y613-V617 HydrophobicContact CE1-CG2 3.6Å; Y613-V617 WeakPolarHBondContact O-CG2 3.39Å; Y613-V617 PolarHBondContact O-N 2.85Å
614	Q	80.3	Confident	80.8	Confident	32 Å²	32	79.1 Å²	79.1	15%	0.15	39%	0.394	C	S	.	.	H	α-helix	trans	-54.6	-45.7	171.8	-69.9	179	-12.8	0	0	110.9	W606 Y609 P610 M611 I616 V617 H618	W606-Q614 HydrophobicContact CD2-CG 4.4Å; W606-Q614 HydrophobicContact CE3-CG 4.28Å; W606-Q614 HydrophobicContact CH2-CB 3.66Å; W606-Q614 HydrophobicContact CH2-CG 3.98Å; W606-Q614 WeakPolarHBondContact CH2-O 3.39Å; W606-Q614 HydrophobicContact CZ2-CB 3.96Å; W606-Q614 HydrophobicContact CZ2-CG 4.09Å; W606-Q614 HydrophobicContact CZ3-CB 4.13Å; W606-Q614 HydrophobicContact CZ3-CG 4.08Å; W606-Q614 PolarHBondContact O-NE2 3.25Å; Y609-Q614 PolarHBondContact O-NE2 2.98Å; P610-Q614 PolarHBondContact O-N 3.48Å; P610-Q614 VanDerWaalsContact O-N 3.07Å; M611-Q614 PolarHBondContact O-N 2.9Å; M611-Q614 PolarHBondContact SD-OE1 2.87Å; M611-Q614 VanDerWaalsContact SD-OE1 3.41Å; Q614-I616 VanDerWaalsContact C-N 3.35Å; Q614-I616 PolarHBondContact O-N 3.36Å; Q614-V617 PolarHBondContact O-N 2.87Å; Q614-H618 VanDerWaalsContact O-CB 3.23Å; Q614-H618 WeakPolarHBondContact O-CB 3.33Å; Q614-H618 PolarHBondContact O-N 3.27Å
615	T	82.3	Confident	81.2	Confident	69 Å²	69	78.3 Å²	78.3	42%	0.423	39%	0.385	S	S	.	.	H	α-helix	trans	-60.2	-42.4	178.3	-51.4	0	0	0	0	112	M611 W612 Y613 N619	M611-T615 WeakPolarHBondContact O-CB 3.06Å; M611-T615 PolarHBondContact O-N 3.29Å; M611-T615 PolarHBondContact O-OG1 3.49Å; W612-T615 PolarHBondContact O-N 3.14Å; Y613-T615 VanDerWaalsContact C-N 3.26Å; Y613-T615 PolarHBondContact O-N 3.46Å; T615-N619 VanDerWaalsContact O-CB 3.26Å; T615-N619 WeakPolarHBondContact O-CB 3.4Å; T615-N619 PolarHBondContact O-N 3.03Å; T615-N619 PolarHBondContact O-ND2 3.41Å
616	I	82	Confident	81.4	Confident	99 Å²	99	77.3 Å²	77.3	51%	0.508	39%	0.385	S	S	.	.	H	α-helix	trans	-63.1	-48.8	177.3	-68.8	167.3	0	0	0	111.3	W612 Y613 Q614 N619 R620	W612-I616 HydrophobicContact CE3-CD1 3.67Å; W612-I616 HydrophobicContact CZ3-CD1 3.88Å; W612-I616 WeakPolarHBondContact O-CG1 3.39Å; W612-I616 PolarHBondContact O-N 3.25Å; W612-I616 VanDerWaalsContact O-N 3.16Å; Y613-I616 PolarHBondContact O-N 3.19Å; Y613-I616 VanDerWaalsContact O-N 3.17Å; Q614-I616 VanDerWaalsContact C-N 3.35Å; Q614-I616 PolarHBondContact O-N 3.36Å; I616-N619 PolarHBondContact O-N 3.4Å; I616-R620 PolarHBondContact O-N 3.26Å
617	V	79.6	Confident	81.6	Confident	22 Å²	22	84.3 Å²	84.3	13%	0.133	42%	0.418	C	S	.	.	H	α-helix	trans	-63.3	-45.1	-180	174.3	0	0	0	0	110.6	W606 Y613 Q614 R620 F621	W606-V617 HydrophobicContact CH2-CB 4.39Å; W606-V617 HydrophobicContact CH2-CG1 4.44Å; W606-V617 HydrophobicContact CZ3-CB 3.91Å; W606-V617 HydrophobicContact CZ3-CG1 3.8Å; Y613-V617 HydrophobicContact CD1-CG2 3.97Å; Y613-V617 HydrophobicContact CE1-CG2 3.6Å; Y613-V617 WeakPolarHBondContact O-CG2 3.39Å; Y613-V617 PolarHBondContact O-N 2.85Å; Q614-V617 PolarHBondContact O-N 2.87Å; V617-R620 WeakPolarHBondContact O-CB 3.44Å; V617-R620 PolarHBondContact O-N 3.17Å; V617-F621 HydrophobicContact CG1-CD2 3.79Å; V617-F621 HydrophobicContact CG1-CE2 3.5Å; V617-F621 WeakPolarHBondContact O-CD2 3.18Å; V617-F621 PolarHBondContact O-N 3.12Å; V617-F621 VanDerWaalsContact O-N 3.14Å
618	H	81.3	Confident	81.7	Confident	18 Å²	18	84.7 Å²	84.7	8%	0.083	41%	0.41	C	S	.	.	H	α-helix	trans	-61.7	-45.8	178.1	-156.6	108.1	0	0	0	111.1	L593 L598 W606 Q614 R620 F621 L622 V644	L593-H618 PolarHBondContact O-CE1 2.67Å; L598-H618 VanDerWaalsContact CD1-ND1 3.33Å; L598-H618 WeakPolarHBondContact CD1-ND1 3.49Å; W606-H618 HydrophobicContact CH2-CB 4.34Å; Q614-H618 VanDerWaalsContact O-CB 3.23Å; Q614-H618 WeakPolarHBondContact O-CB 3.33Å; Q614-H618 PolarHBondContact O-N 3.27Å; H618-R620 VanDerWaalsContact C-N 3.29Å; H618-R620 PolarHBondContact O-N 3.16Å; H618-F621 PolarHBondContact O-N 3.03Å; H618-L622 WeakPolarHBondContact O-CB 3.35Å; H618-L622 PolarHBondContact O-N 3.21Å; H618-V644 WeakPolarHBondContact NE2-CG1 3.24Å; H618-V644 WeakPolarHBondContact NE2-CG2 3.28Å
619	N	83.2	Confident	81.7	Confident	91 Å²	91	78.1 Å²	78.1	49%	0.487	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-36.2	177.5	-77.1	-18.1	0	0	0	112.5	T615 I616 S623	T615-N619 VanDerWaalsContact O-CB 3.26Å; T615-N619 WeakPolarHBondContact O-CB 3.4Å; T615-N619 PolarHBondContact O-N 3.03Å; T615-N619 PolarHBondContact O-ND2 3.41Å; I616-N619 PolarHBondContact O-N 3.4Å; N619-S623 WeakPolarHBondContact O-CB 3.25Å; N619-S623 PolarHBondContact O-N 2.95Å
620	R	83.3	Confident	81.5	Confident	176 Å²	176	76 Å²	76	66%	0.664	37%	0.373	S	S	*	.	H	α-helix	trans	-62.8	-48.6	175.2	-175.9	179.2	178.4	169.9	-0.1	111.5	I616 V617 H618 S623 Q624	I616-R620 PolarHBondContact O-N 3.26Å; V617-R620 WeakPolarHBondContact O-CB 3.44Å; V617-R620 PolarHBondContact O-N 3.17Å; H618-R620 VanDerWaalsContact C-N 3.29Å; H618-R620 PolarHBondContact O-N 3.16Å; R620-S623 PolarHBondContact O-N 3.22Å; R620-Q624 WeakPolarHBondContact O-CG 3.41Å; R620-Q624 PolarHBondContact O-N 2.81Å
621	F	81	Confident	81.2	Confident	42 Å²	42	76.5 Å²	76.5	18%	0.184	38%	0.377	C	S	.	.	H	α-helix	trans	-69.5	-38	178	-71.5	-61	0	0	0	112.4	L593 L598 R601 V617 H618 S623 Q624 V625	L593-F621 HydrophobicContact CD2-CB 3.93Å; L598-F621 HydrophobicContact CD2-CD2 3.5Å; L598-F621 HydrophobicContact CD2-CE2 3.78Å; L598-F621 HydrophobicContact CD2-CG 4.39Å; R601-F621 VanDerWaalsContact NH1-CD1 3.29Å; V617-F621 HydrophobicContact CG1-CD2 3.79Å; V617-F621 HydrophobicContact CG1-CE2 3.5Å; V617-F621 WeakPolarHBondContact O-CD2 3.18Å; V617-F621 PolarHBondContact O-N 3.12Å; V617-F621 VanDerWaalsContact O-N 3.14Å; H618-F621 PolarHBondContact O-N 3.03Å; F621-S623 VanDerWaalsContact C-N 3.29Å; F621-S623 PolarHBondContact O-N 3.23Å; F621-Q624 PolarHBondContact O-N 3.03Å; F621-V625 WeakPolarHBondContact O-CB 3.39Å; F621-V625 WeakPolarHBondContact O-CG2 3.39Å; F621-V625 PolarHBondContact O-N 3.33Å
622	L	84	Confident	81	Confident	47 Å²	47	70.2 Å²	70.2	25%	0.246	35%	0.346	C	S	.	.	H	α-helix	trans	-58.3	-43.8	174.5	-176.4	68.8	0	0	0	110.8	L593 H618 V625 N626 L643 V644	L593-L622 HydrophobicContact CD1-CD1 3.81Å; L593-L622 HydrophobicContact CD2-CB 4.28Å; H618-L622 WeakPolarHBondContact O-CB 3.35Å; H618-L622 PolarHBondContact O-N 3.21Å; L622-V625 PolarHBondContact O-N 3.34Å; L622-N626 WeakPolarHBondContact O-CB 3.44Å; L622-N626 PolarHBondContact O-N 3.39Å; L622-L643 HydrophobicContact CD1-CB 3.82Å; L622-L643 HydrophobicContact CD1-CD1 3.86Å; L622-L643 HydrophobicContact CD1-CG 4.41Å; L622-V644 HydrophobicContact CD1-CG2 4.24Å; L622-V644 HydrophobicContact CD2-CG2 4.46Å
623	S	82	Confident	80.7	Confident	77 Å²	77	63.1 Å²	63.1	54%	0.538	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-46.5	175.5	-171.4	0	0	0	0	111.9	N619 R620 F621 N626 E627	N619-S623 WeakPolarHBondContact O-CB 3.25Å; N619-S623 PolarHBondContact O-N 2.95Å; R620-S623 PolarHBondContact O-N 3.22Å; F621-S623 VanDerWaalsContact C-N 3.29Å; F621-S623 PolarHBondContact O-N 3.23Å; S623-N626 PolarHBondContact O-N 3.1Å; S623-E627 WeakPolarHBondContact O-CB 3.44Å; S623-E627 PolarHBondContact O-N 3.44Å
624	Q	81	Confident	80.4	Confident	87 Å²	87	65.4 Å²	65.4	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-43.3	178.9	-70.3	177.5	-20.8	0	0	112.3	R620 F621 E627 Q628	R620-Q624 WeakPolarHBondContact O-CG 3.41Å; R620-Q624 PolarHBondContact O-N 2.81Å; F621-Q624 PolarHBondContact O-N 3.03Å; Q624-E627 PolarHBondContact O-N 3.08Å; Q624-Q628 WeakPolarHBondContact O-CG 3.42Å; Q624-Q628 PolarHBondContact O-N 3.39Å
625	V	82.3	Confident	80.1	Confident	5 Å²	5	71 Å²	71	3%	0.03	35%	0.354	C	S	.	.	H	α-helix	trans	-64.4	-43.4	177.3	164.2	0	0	0	0	110.7	F588 N592 L593 F621 L622 E627 Q628 I629 L643	F588-V625 HydrophobicContact CE1-CB 4.39Å; F588-V625 HydrophobicContact CE1-CG1 3.98Å; F588-V625 HydrophobicContact CE1-CG2 4.01Å; N592-V625 HydrophobicContact CB-CG2 3.64Å; L593-V625 HydrophobicContact CD1-CB 4.23Å; L593-V625 HydrophobicContact CD1-CG1 3.86Å; L593-V625 HydrophobicContact CD1-CG2 4.35Å; L593-V625 HydrophobicContact CD2-CG2 4.21Å; L593-V625 HydrophobicContact CG-CG1 4.48Å; L593-V625 HydrophobicContact CG-CG2 4.1Å; F621-V625 WeakPolarHBondContact O-CB 3.39Å; F621-V625 WeakPolarHBondContact O-CG2 3.39Å; F621-V625 PolarHBondContact O-N 3.33Å; L622-V625 PolarHBondContact O-N 3.34Å; V625-E627 VanDerWaalsContact C-N 3.32Å; V625-E627 PolarHBondContact O-N 3.14Å; V625-Q628 PolarHBondContact O-N 3.32Å; V625-I629 HydrophobicContact CG1-CD1 3.87Å; V625-I629 HydrophobicContact CG1-CG1 4.34Å; V625-I629 WeakPolarHBondContact O-CG1 3.34Å; V625-I629 PolarHBondContact O-N 2.68Å; V625-L643 HydrophobicContact CG1-CD1 4.37Å
626	N	81.3	Confident	79.8	Confident	94 Å²	94	69.5 Å²	69.5	50%	0.503	34%	0.343	S	S	.	.	H	α-helix	trans	-67.7	-32.9	179.6	-162.7	37.9	0	0	0	112.1	L622 S623 G630	L622-N626 WeakPolarHBondContact O-CB 3.44Å; L622-N626 PolarHBondContact O-N 3.39Å; S623-N626 PolarHBondContact O-N 3.1Å; N626-G630 WeakPolarHBondContact O-CA 3.47Å; N626-G630 PolarHBondContact O-N 2.88Å
627	E	81.5	Confident	79.5	Confident	159 Å²	159	66.5 Å²	66.5	74%	0.743	33%	0.329	S	S	*	.	H	α-helix	trans	-64	-40.9	172.7	-170.8	179.2	178.6	0	0	111.9	S623 Q624 V625	S623-E627 WeakPolarHBondContact O-CB 3.44Å; S623-E627 PolarHBondContact O-N 3.44Å; Q624-E627 PolarHBondContact O-N 3.08Å; V625-E627 VanDerWaalsContact C-N 3.32Å; V625-E627 PolarHBondContact O-N 3.14Å
628	Q	79.2	Confident	78.7	Confident	98 Å²	98	70.7 Å²	70.7	46%	0.458	36%	0.357	S	S	.	.	H	α-helix	trans	-75.5	-46.8	-179.8	-67.2	-175.3	15.8	0	0	113	M566 F588 Q624 V625	M566-Q628 HydrophobicContact CE-CB 4.41Å; M566-Q628 WeakPolarHBondContact CE-O 3.23Å; F588-Q628 VanDerWaalsContact CZ-OE1 3.29Å; Q624-Q628 WeakPolarHBondContact O-CG 3.42Å; Q624-Q628 PolarHBondContact O-N 3.39Å; V625-Q628 PolarHBondContact O-N 3.32Å
629	I	80.4	Confident	78.4	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-99.1	-19.2	-172.6	-34.7	175	0	0	0	113.6	M566 I585 F588 I589 V625 P631 L632 I633	M566-I629 HydrophobicContact CE-CB 4.47Å; M566-I629 HydrophobicContact CE-CG1 4.33Å; M566-I629 HydrophobicContact SD-CG1 4.01Å; M566-I629 HydrophobicContact SD-CG2 4.44Å; I585-I629 HydrophobicContact CD1-CG2 4.31Å; I585-I629 HydrophobicContact CG1-CG2 4.15Å; I585-I629 HydrophobicContact CG2-CD1 4.23Å; I585-I629 HydrophobicContact CG2-CG2 4.04Å; F588-I629 HydrophobicContact CD1-CD1 3.13Å; F588-I629 HydrophobicContact CD1-CG1 3.79Å; F588-I629 HydrophobicContact CE1-CD1 3.35Å; F588-I629 HydrophobicContact CE1-CG1 3.55Å; F588-I629 HydrophobicContact CG-CD1 4.22Å; F588-I629 HydrophobicContact CZ-CG1 4.42Å; I589-I629 HydrophobicContact CG1-CD1 3.9Å; V625-I629 HydrophobicContact CG1-CD1 3.87Å; V625-I629 HydrophobicContact CG1-CG1 4.34Å; V625-I629 WeakPolarHBondContact O-CG1 3.34Å; V625-I629 PolarHBondContact O-N 2.68Å; I629-P631 VanDerWaalsContact C-CD 3.45Å; I629-P631 VanDerWaalsContact C-N 3.3Å; I629-P631 VanDerWaalsContact O-N 3.08Å; I629-L632 HydrophobicContact CG2-CB 4.19Å; I629-L632 HydrophobicContact CG2-CD2 4.48Å; I629-L632 WeakPolarHBondContact O-CA 3.4Å; I629-L632 PolarHBondContact O-N 3.42Å; I629-I633 HydrophobicContact CB-CD1 3.77Å; I629-I633 HydrophobicContact CB-CG1 4.33Å; I629-I633 HydrophobicContact CD1-CD1 4.24Å; I629-I633 HydrophobicContact CG2-CB 4.48Å; I629-I633 HydrophobicContact CG2-CD1 3.45Å; I629-I633 VanDerWaalsContact CG2-CD1 3.45Å; I629-I633 HydrophobicContact CG2-CG1 3.54Å; I629-I633 PolarHBondContact O-N 3.08Å
630	G	75.8	Confident	77.9	Confident	19 Å²	19	84 Å²	84	20%	0.196	41%	0.406	C	S	.	.	H	α-helix	trans	-45	-47.5	-174.1	0	0	0	0	0	114.4	N626 L632 H634	N626-G630 WeakPolarHBondContact O-CA 3.47Å; N626-G630 PolarHBondContact O-N 2.88Å; G630-L632 PolarHBondContact O-N 2.81Å; G630-H634 WeakPolarHBondContact O-CB 3.21Å; G630-H634 PolarHBondContact O-N 3.11Å; G630-H634 VanDerWaalsContact O-N 3.14Å
631	P	77.2	Confident	77.3	Confident	78 Å²	78	77.6 Å²	77.6	51%	0.506	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-33.9	176.4	-23	34.1	0	0	0	114.6	I629 R635	I629-P631 VanDerWaalsContact C-CD 3.45Å; I629-P631 VanDerWaalsContact C-N 3.3Å; I629-P631 VanDerWaalsContact O-N 3.08Å; P631-R635 WeakPolarHBondContact O-CD 3.44Å; P631-R635 VanDerWaalsContact O-CG 3.27Å; P631-R635 WeakPolarHBondContact O-CG 3.45Å
632	L	78	Confident	77.1	Confident	5 Å²	5	78.1 Å²	78.1	3%	0.026	39%	0.389	C	S	.	.	H	α-helix	trans	-80.5	-42.8	-177.7	-173.6	65.2	0	0	0	111.5	A569 L570 Y573 I585 I629 G630 R635 L636	A569-L632 HydrophobicContact CB-CD2 4.19Å; L570-L632 HydrophobicContact CD2-CD1 4.22Å; L570-L632 HydrophobicContact CD2-CD2 3.92Å; L570-L632 HydrophobicContact CD2-CG 4.47Å; L570-L632 HydrophobicContact CG-CD2 4.39Å; Y573-L632 HydrophobicContact CD1-CD1 4.01Å; Y573-L632 HydrophobicContact CD2-CD1 3.68Å; Y573-L632 HydrophobicContact CE2-CD1 4.3Å; Y573-L632 HydrophobicContact CG-CD1 3.52Å; I585-L632 HydrophobicContact CD1-CD2 3.61Å; I585-L632 HydrophobicContact CD1-CG 3.93Å; I585-L632 HydrophobicContact CG1-CD2 4.05Å; I629-L632 HydrophobicContact CG2-CB 4.19Å; I629-L632 HydrophobicContact CG2-CD2 4.48Å; I629-L632 WeakPolarHBondContact O-CA 3.4Å; I629-L632 PolarHBondContact O-N 3.42Å; G630-L632 PolarHBondContact O-N 2.81Å; L632-R635 PolarHBondContact O-N 3.3Å; L632-L636 HydrophobicContact CD1-CD1 4.43Å; L632-L636 HydrophobicContact CG-CD1 4.1Å; L632-L636 PolarHBondContact O-N 3.12Å; L632-L636 VanDerWaalsContact O-N 3.09Å
633	I	77.7	Confident	76.8	Confident	20 Å²	20	76.6 Å²	76.6	10%	0.103	38%	0.381	C	S	.	.	H	α-helix	trans	-62.1	-44.8	176.2	-79.9	161.9	0	0	0	110.7	I585 I589 I629 R635 L636 T637 L643	I585-I633 HydrophobicContact CG2-CD1 4.17Å; I585-I633 HydrophobicContact CG2-CG1 4.11Å; I589-I633 HydrophobicContact CD1-CD1 4.42Å; I629-I633 HydrophobicContact CB-CD1 3.77Å; I629-I633 HydrophobicContact CB-CG1 4.33Å; I629-I633 HydrophobicContact CD1-CD1 4.24Å; I629-I633 HydrophobicContact CG2-CB 4.48Å; I629-I633 HydrophobicContact CG2-CD1 3.45Å; I629-I633 VanDerWaalsContact CG2-CD1 3.45Å; I629-I633 HydrophobicContact CG2-CG1 3.54Å; I629-I633 PolarHBondContact O-N 3.08Å; I633-R635 PolarHBondContact O-N 2.66Å; I633-L636 PolarHBondContact O-N 3.46Å; I633-L636 VanDerWaalsContact O-N 3.11Å; I633-T637 CarbonylContact O-C 3.45Å; I633-T637 PolarHBondContact O-N 3.33Å; I633-T637 VanDerWaalsContact O-O 3.13Å; I633-T637 PolarHBondContact O-OG1 2.95Å; I633-L643 HydrophobicContact CD1-CD2 3.87Å
634	H	74.5	Confident	76.4	Confident	135 Å²	135	75 Å²	75	63%	0.625	37%	0.368	S	S	*	.	H	α-helix	trans	-60	-30.3	178.6	-172.4	-72.5	0	0	0	112.4	G630	G630-H634 WeakPolarHBondContact O-CB 3.21Å; G630-H634 PolarHBondContact O-N 3.11Å; G630-H634 VanDerWaalsContact O-N 3.14Å
635	R	75.6	Confident	76.3	Confident	150 Å²	150	78.1 Å²	78.1	57%	0.566	38%	0.38	S	S	*	.	H	α-helix	trans	-77.7	-34.1	176.6	-70	171.5	-172.2	-178.6	2	113.1	Y573 P631 L632 I633	Y573-R635 HydrophobicContact CE2-CB 4.07Å; Y573-R635 WeakPolarHBondContact OH-CD 3.31Å; P631-R635 WeakPolarHBondContact O-CD 3.44Å; P631-R635 VanDerWaalsContact O-CG 3.27Å; P631-R635 WeakPolarHBondContact O-CG 3.45Å; L632-R635 PolarHBondContact O-N 3.3Å; I633-R635 PolarHBondContact O-N 2.66Å
636	L	74.6	Confident	76.1	Confident	38 Å²	38	79.4 Å²	79.4	20%	0.199	39%	0.388	C	S	.	.	H	α-helix	trans	-83.9	-37.7	-179.2	-71.3	169.7	0	0	0	112.5	Y573 T578 W582 I585 L632 I633	Y573-L636 HydrophobicContact CD2-CD2 3.88Å; Y573-L636 HydrophobicContact CD2-CG 4.22Å; Y573-L636 HydrophobicContact CE2-CD2 4.1Å; Y573-L636 HydrophobicContact CE2-CG 4.37Å; T578-L636 HydrophobicContact CG2-CD2 4.15Å; W582-L636 HydrophobicContact CE3-CB 4.14Å; W582-L636 HydrophobicContact CE3-CD1 4.1Å; W582-L636 HydrophobicContact CZ3-CB 4.3Å; I585-L636 HydrophobicContact CD1-CD1 3.29Å; L632-L636 HydrophobicContact CD1-CD1 4.43Å; L632-L636 HydrophobicContact CG-CD1 4.1Å; L632-L636 PolarHBondContact O-N 3.12Å; L632-L636 VanDerWaalsContact O-N 3.09Å; I633-L636 PolarHBondContact O-N 3.46Å; I633-L636 VanDerWaalsContact O-N 3.11Å
637	T	75.9	Confident	76	Confident	36 Å²	36	74.9 Å²	74.9	22%	0.221	36%	0.364	C	S	.	.			trans	-140.9	105.7	-178.1	53.6	0	0	0	0	110	W582 I633 K639 I641	W582-T637 HydrophobicContact CE3-CG2 4.4Å; W582-T637 HydrophobicContact CH2-CG2 3.72Å; W582-T637 HydrophobicContact CZ2-CG2 4.36Å; W582-T637 HydrophobicContact CZ3-CG2 3.74Å; I633-T637 CarbonylContact O-C 3.45Å; I633-T637 PolarHBondContact O-N 3.33Å; I633-T637 VanDerWaalsContact O-O 3.13Å; I633-T637 PolarHBondContact O-OG1 2.95Å; T637-K639 PolarHBondContact O-N 2.91Å; T637-K639 VanDerWaalsContact O-N 3.12Å; T637-I641 HydrophobicContact CG2-CD1 4.25Å; T637-I641 VanDerWaalsContact OG1-CD1 3.27Å; T637-I641 WeakPolarHBondContact OG1-CD1 3.46Å
638	P	63.7	Low	75.8	Confident	110 Å²	110	71 Å²	71	71%	0.714	35%	0.348	S	S	*	.			trans	-74.2	1.3	-178.7	27.9	-33.9	0	0	0	114.1
639	K	74.3	Confident	75.8	Confident	175 Å²	175	67.9 Å²	67.9	76%	0.761	34%	0.338	S	S	*	.	S	Bend	trans	-91.6	145.3	177.9	-66.8	-176.3	178.9	-179.7	0	110	T637 I641	T637-K639 PolarHBondContact O-N 2.91Å; T637-K639 VanDerWaalsContact O-N 3.12Å; K639-I641 PolarHBondContact O-N 3.37Å
640	Y	72	Confident	75.6	Confident	212 Å²	212	75.3 Å²	75.3	83%	0.831	37%	0.37	S	S	*	.			trans	-59.8	130.4	170.5	178.2	-97	0	0	0	110.1	D642	Y640-D642 HydrophobicContact CE1-CB 4.44Å
641	I	71.1	Confident	75.7	Confident	43 Å²	43	79.7 Å²	79.7	22%	0.221	39%	0.385	C	S	.	.			trans	-122.3	125.1	178.2	-65.7	175	0	0	0	107.6	W582 T637 K639 L643 V646	W582-I641 HydrophobicContact CH2-CD1 3.69Å; W582-I641 HydrophobicContact CZ2-CD1 4.4Å; T637-I641 HydrophobicContact CG2-CD1 4.25Å; T637-I641 VanDerWaalsContact OG1-CD1 3.27Å; T637-I641 WeakPolarHBondContact OG1-CD1 3.46Å; K639-I641 PolarHBondContact O-N 3.37Å; I641-L643 HydrophobicContact CG2-CD2 4.5Å; I641-L643 PolarHBondContact O-N 2.6Å; I641-V646 HydrophobicContact CG2-CB 4.34Å; I641-V646 HydrophobicContact CG2-CG2 3.38Å
642	D	76.2	Confident	75.7	Confident	53 Å²	53	76 Å²	76	28%	0.283	36%	0.361	S	S	.	.			trans	-73.5	95.6	169.9	-175.4	-15.8	0	0	0	108.7	Y640 V644 K645 V646	Y640-D642 HydrophobicContact CE1-CB 4.44Å; D642-V644 PolarHBondContact O-N 2.96Å; D642-V644 PolarHBondContact OD1-N 3.36Å; D642-K645 HydrophobicContact CB-CB 4.21Å; D642-K645 HydrophobicContact CB-CD 4.14Å; D642-K645 HydrophobicContact CB-CG 4.31Å; D642-K645 PolarHBondContact O-N 3.12Å; D642-K645 PolarHBondContact OD1-N 3.33Å; D642-K645 WeakPolarHBondContact OD2-CD 3.15Å; D642-K645 WeakPolarHBondContact OD2-CE 3.21Å; D642-K645 WeakPolarHBondContact OD2-CG 3.4Å; D642-K645 IonicContact OD2-NZ 3.41Å; D642-K645 PolarHBondContact OD2-NZ 2.98Å; D642-V646 PolarHBondContact O-N 3.04Å
643	L	78.2	Confident	75.6	Confident	15 Å²	15	78.4 Å²	78.4	8%	0.079	37%	0.372	C	S	.	.	H	α-helix	trans	-57.4	-31.1	-175.5	-64.7	176.2	0	0	0	112.4	I589 L593 L622 V625 I633 I641 V646 A647	I589-L643 HydrophobicContact CD1-CD2 3.84Å; I589-L643 HydrophobicContact CG1-CD2 4.5Å; L593-L643 HydrophobicContact CD1-CB 3.97Å; L622-L643 HydrophobicContact CD1-CB 3.82Å; L622-L643 HydrophobicContact CD1-CD1 3.86Å; L622-L643 HydrophobicContact CD1-CG 4.41Å; V625-L643 HydrophobicContact CG1-CD1 4.37Å; I633-L643 HydrophobicContact CD1-CD2 3.87Å; I641-L643 HydrophobicContact CG2-CD2 4.5Å; I641-L643 PolarHBondContact O-N 2.6Å; L643-V646 PolarHBondContact O-N 3.37Å; L643-A647 VanDerWaalsContact O-CB 3.3Å; L643-A647 WeakPolarHBondContact O-CB 3.47Å; L643-A647 PolarHBondContact O-N 3.06Å
644	V	74.4	Confident	75.6	Confident	42 Å²	42	80.7 Å²	80.7	26%	0.255	38%	0.384	S	S	.	.	H	α-helix	trans	-69.1	-46.2	-179.7	-175.4	0	0	0	0	110.3	H618 L622 D642 V646 A647 N648	H618-V644 WeakPolarHBondContact NE2-CG1 3.24Å; H618-V644 WeakPolarHBondContact NE2-CG2 3.28Å; L622-V644 HydrophobicContact CD1-CG2 4.24Å; L622-V644 HydrophobicContact CD2-CG2 4.46Å; D642-V644 PolarHBondContact O-N 2.96Å; D642-V644 PolarHBondContact OD1-N 3.36Å; V644-V646 VanDerWaalsContact C-N 3.3Å; V644-V646 PolarHBondContact O-N 3.25Å; V644-A647 PolarHBondContact O-N 3.02Å; V644-N648 PolarHBondContact O-N 3.42Å
645	K	77.4	Confident	75.7	Confident	153 Å²	153	74.7 Å²	74.7	67%	0.665	36%	0.357	S	S	*	.	H	α-helix	trans	-63.6	-37.9	175.2	-72.5	180	-172.7	161.9	0	112.1	D642 S649	D642-K645 HydrophobicContact CB-CB 4.21Å; D642-K645 HydrophobicContact CB-CD 4.14Å; D642-K645 HydrophobicContact CB-CG 4.31Å; D642-K645 PolarHBondContact O-N 3.12Å; D642-K645 PolarHBondContact OD1-N 3.33Å; D642-K645 WeakPolarHBondContact OD2-CD 3.15Å; D642-K645 WeakPolarHBondContact OD2-CE 3.21Å; D642-K645 WeakPolarHBondContact OD2-CG 3.4Å; D642-K645 IonicContact OD2-NZ 3.41Å; D642-K645 PolarHBondContact OD2-NZ 2.98Å; K645-S649 PolarHBondContact O-N 2.88Å
646	V	79.6	Confident	75.8	Confident	32 Å²	32	67.5 Å²	67.5	19%	0.194	33%	0.33	C	S	.	.	H	α-helix	trans	-68.3	-41.5	176.3	174.5	0	0	0	0	111.1	L586 I641 D642 L643 V644 N648 S649 C652	L586-V646 HydrophobicContact CD2-CG1 3.73Å; I641-V646 HydrophobicContact CG2-CB 4.34Å; I641-V646 HydrophobicContact CG2-CG2 3.38Å; D642-V646 PolarHBondContact O-N 3.04Å; L643-V646 PolarHBondContact O-N 3.37Å; V644-V646 VanDerWaalsContact C-N 3.3Å; V644-V646 PolarHBondContact O-N 3.25Å; V646-N648 VanDerWaalsContact C-N 3.28Å; V646-N648 PolarHBondContact O-N 3.35Å; V646-S649 WeakPolarHBondContact O-CB 3.48Å; V646-S649 PolarHBondContact O-N 2.8Å; V646-S649 PolarHBondContact O-OG 3.16Å; V646-C652 PolarHBondContact O-SG 3.34Å
647	A	78.2	Confident	75.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57.1	-41.5	178.1	0	0	0	0	0	112.7	I589 Y590 L593 L643 V644 S649	I589-A647 HydrophobicContact CG2-CB 3.56Å; Y590-A647 WeakPolarHBondContact CD2-O 3.36Å; L593-A647 HydrophobicContact CB-CB 3.67Å; L643-A647 VanDerWaalsContact O-CB 3.3Å; L643-A647 WeakPolarHBondContact O-CB 3.47Å; L643-A647 PolarHBondContact O-N 3.06Å; V644-A647 PolarHBondContact O-N 3.02Å; A647-S649 VanDerWaalsContact C-N 3.29Å; A647-S649 PolarHBondContact O-N 3.03Å
648	N	76.8	Confident	75.8	Confident	76 Å²	76	73.2 Å²	73.2	41%	0.406	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	8.2	177.6	-72.1	-18.1	0	0	0	113.4	S594 D595 V644 V646	S594-N648 WeakPolarHBondContact CA-OD1 3.29Å; D595-N648 PolarHBondContact N-OD1 3.17Å; D595-N648 VanDerWaalsContact N-OD1 3.1Å; D595-N648 PolarHBondContact OD2-ND2 3.02Å; V644-N648 PolarHBondContact O-N 3.42Å; V646-N648 VanDerWaalsContact C-N 3.28Å; V646-N648 PolarHBondContact O-N 3.35Å
649	S	79.3	Confident	76.3	Confident	34 Å²	34	68.7 Å²	68.7	24%	0.238	32%	0.317	C	S	.	.	S	Bend	trans	-77.3	147.7	176	78.1	0	0	0	0	111.4	K645 V646 A647 E651 C652 E653	K645-S649 PolarHBondContact O-N 2.88Å; V646-S649 WeakPolarHBondContact O-CB 3.48Å; V646-S649 PolarHBondContact O-N 2.8Å; V646-S649 PolarHBondContact O-OG 3.16Å; A647-S649 VanDerWaalsContact C-N 3.29Å; A647-S649 PolarHBondContact O-N 3.03Å; S649-E651 PolarHBondContact O-N 3.47Å; S649-E651 VanDerWaalsContact O-N 3.13Å; S649-C652 PolarHBondContact O-N 3.12Å; S649-E653 PolarHBondContact O-N 3.37Å
650	K	77.4	Confident	76.3	Confident	155 Å²	155	60.7 Å²	60.7	67%	0.674	28%	0.282	S	S	*	.	H	α-helix	trans	-60.5	-23.3	175.4	-165	167.5	-173.3	170	0	112.8	L654	K650-L654 HydrophobicContact CG-CD1 4.04Å; K650-L654 HydrophobicContact CG-CG 4.21Å; K650-L654 VanDerWaalsContact O-CB 3.28Å; K650-L654 WeakPolarHBondContact O-CB 3.47Å; K650-L654 WeakPolarHBondContact O-CD1 3.26Å; K650-L654 WeakPolarHBondContact O-CG 3.32Å; K650-L654 PolarHBondContact O-N 2.76Å
651	E	77.6	Confident	76.2	Confident	111 Å²	111	57.7 Å²	57.7	52%	0.519	27%	0.27	S	S	.	.	H	α-helix	trans	-68.4	-42	179.9	-168	178	178.6	0	0	112.3	L586 S649 S655	L586-E651 HydrophobicContact CD1-CG 4.05Å; S649-E651 PolarHBondContact O-N 3.47Å; S649-E651 VanDerWaalsContact O-N 3.13Å; E651-S655 WeakPolarHBondContact O-CB 3.28Å; E651-S655 PolarHBondContact O-N 3.08Å; E651-S655 PolarHBondContact O-OG 2.8Å
652	C	77.6	Confident	76.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-48.6	175	-79.3	0	0	0	0	111.7	L586 Y590 V646 S649 L654 S655 L656	L586-C652 PolarHBondContact O-SG 2.92Å; L586-C652 VanDerWaalsContact O-SG 3.4Å; Y590-C652 HydrophobicContact CD2-CB 3.79Å; Y590-C652 HydrophobicContact CG-CB 4.31Å; V646-C652 PolarHBondContact O-SG 3.34Å; S649-C652 PolarHBondContact O-N 3.12Å; C652-L654 PolarHBondContact O-N 3.39Å; C652-S655 PolarHBondContact O-N 2.7Å; C652-L656 PolarHBondContact O-N 3.2Å; C652-L656 VanDerWaalsContact O-N 3.15Å
653	E	75.5	Confident	75.6	Confident	57 Å²	57	58.4 Å²	58.4	27%	0.266	27%	0.266	S	S	.	.	H	α-helix	trans	-58.9	-47.3	177.1	-166.8	-165.4	162.5	0	0	111.5	Y590 S649 S655 L656 L657 I698	Y590-E653 HydrophobicContact CD2-CB 4.48Å; Y590-E653 HydrophobicContact CE2-CB 3.89Å; Y590-E653 HydrophobicContact CE2-CG 4.2Å; S649-E653 PolarHBondContact O-N 3.37Å; E653-S655 VanDerWaalsContact C-N 3.28Å; E653-S655 PolarHBondContact O-N 2.96Å; E653-L656 PolarHBondContact O-N 2.9Å; E653-L657 HydrophobicContact CG-CD1 4.08Å; E653-L657 WeakPolarHBondContact O-CB 3.33Å; E653-L657 VanDerWaalsContact O-CG 3.31Å; E653-L657 WeakPolarHBondContact O-CG 3.41Å; E653-L657 PolarHBondContact O-N 2.95Å; E653-I698 HydrophobicContact CG-CD1 3.6Å
654	L	77	Confident	74.9	Confident	68 Å²	68	59.6 Å²	59.6	36%	0.356	27%	0.272	S	S	.	.	H	α-helix	trans	-62.4	-34.6	178	-75.5	172.3	0	0	0	112.6	K650 C652 R658	K650-L654 HydrophobicContact CG-CD1 4.04Å; K650-L654 HydrophobicContact CG-CG 4.21Å; K650-L654 VanDerWaalsContact O-CB 3.28Å; K650-L654 WeakPolarHBondContact O-CB 3.47Å; K650-L654 WeakPolarHBondContact O-CD1 3.26Å; K650-L654 WeakPolarHBondContact O-CG 3.32Å; K650-L654 PolarHBondContact O-N 2.76Å; C652-L654 PolarHBondContact O-N 3.39Å; L654-R658 WeakPolarHBondContact O-CB 3.27Å; L654-R658 VanDerWaalsContact O-CG 3.22Å; L654-R658 WeakPolarHBondContact O-CG 3.32Å; L654-R658 PolarHBondContact O-N 3.22Å
655	S	76.7	Confident	74.1	Confident	8 Å²	8	61.6 Å²	61.6	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-44.1	178.6	-62.4	0	0	0	0	111.5	E651 C652 E653 N659	E651-S655 WeakPolarHBondContact O-CB 3.28Å; E651-S655 PolarHBondContact O-N 3.08Å; E651-S655 PolarHBondContact O-OG 2.8Å; C652-S655 PolarHBondContact O-N 2.7Å; E653-S655 VanDerWaalsContact C-N 3.28Å; E653-S655 PolarHBondContact O-N 2.96Å; S655-N659 PolarHBondContact O-N 3.29Å
656	L	77.7	Confident	73.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-47.3	172.8	178.4	62.9	0	0	0	111.2	F560 I587 Y590 L591 C652 E653 R658 N659 L660 I698	F560-L656 HydrophobicContact CE1-CD2 4.43Å; I587-L656 HydrophobicContact CG1-CB 4.45Å; I587-L656 HydrophobicContact CG2-CD1 3.98Å; Y590-L656 HydrophobicContact CD1-CD2 3.62Å; Y590-L656 HydrophobicContact CE1-CD2 3.65Å; L591-L656 HydrophobicContact CD2-CD1 4.46Å; L591-L656 HydrophobicContact CD2-CD2 3.95Å; C652-L656 PolarHBondContact O-N 3.2Å; C652-L656 VanDerWaalsContact O-N 3.15Å; E653-L656 PolarHBondContact O-N 2.9Å; L656-R658 VanDerWaalsContact C-N 3.32Å; L656-R658 PolarHBondContact O-N 2.88Å; L656-N659 WeakPolarHBondContact O-CB 3.5Å; L656-N659 PolarHBondContact O-N 3.09Å; L656-N659 VanDerWaalsContact O-N 3.08Å; L656-L660 HydrophobicContact CD1-CD1 4.12Å; L656-L660 HydrophobicContact CD1-CG 4.12Å; L656-L660 HydrophobicContact CD2-CD1 4.38Å; L656-L660 HydrophobicContact CG-CD1 3.84Å; L656-L660 HydrophobicContact CG-CG 4.27Å; L656-L660 WeakPolarHBondContact O-CG 3.4Å; L656-L660 PolarHBondContact O-N 3.17Å; L656-I698 HydrophobicContact CD2-CD1 4.13Å; L656-I698 HydrophobicContact CD2-CG2 4.25Å
657	L	75.3	Confident	71.7	Confident	31 Å²	31	60.6 Å²	60.6	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-37.7	179.7	-75.7	172.7	0	0	0	113	E653 N659 R661 P697 I698 L701	E653-L657 HydrophobicContact CG-CD1 4.08Å; E653-L657 WeakPolarHBondContact O-CB 3.33Å; E653-L657 VanDerWaalsContact O-CG 3.31Å; E653-L657 WeakPolarHBondContact O-CG 3.41Å; E653-L657 PolarHBondContact O-N 2.95Å; L657-N659 VanDerWaalsContact C-N 3.34Å; L657-R661 WeakPolarHBondContact O-CB 3.33Å; L657-R661 PolarHBondContact O-N 3.4Å; L657-P697 HydrophobicContact CD2-CB 4.05Å; L657-I698 HydrophobicContact CD2-CD1 4.45Å; L657-I698 HydrophobicContact CD2-CG1 3.76Å; L657-I698 HydrophobicContact CG-CD1 4.4Å; L657-I698 HydrophobicContact CG-CG1 4.24Å; L657-L701 HydrophobicContact CD2-CD1 4.44Å
658	R	76.5	Confident	70.3	Confident	163 Å²	163	65.3 Å²	65.3	62%	0.615	30%	0.299	S	S	*	.	H	α-helix	trans	-62.2	-43.2	174.1	-77.2	171.9	-168.8	150.9	2.4	111.3	L654 L656 R661 R662	L654-R658 WeakPolarHBondContact O-CB 3.27Å; L654-R658 VanDerWaalsContact O-CG 3.22Å; L654-R658 WeakPolarHBondContact O-CG 3.32Å; L654-R658 PolarHBondContact O-N 3.22Å; L656-R658 VanDerWaalsContact C-N 3.32Å; L656-R658 PolarHBondContact O-N 2.88Å; R658-R661 PolarHBondContact O-N 3.23Å; R658-R662 PolarHBondContact O-N 2.84Å; R658-R662 VanDerWaalsContact O-N 3.15Å
659	N	74	Confident	68.9	Low	15 Å²	15	63.6 Å²	63.6	8%	0.08	29%	0.292	C	S	.	.	H	α-helix	trans	-67.5	-46.7	178.9	-168.4	23.9	0	0	0	111.7	I555 Y565 I587 S655 L656 L657 R661 R662 I663	I555-N659 WeakPolarHBondContact CG2-ND2 3.37Å; Y565-N659 VanDerWaalsContact CE1-ND2 3.27Å; Y565-N659 WeakPolarHBondContact CE1-ND2 3.46Å; Y565-N659 PolarHBondContact OH-ND2 3.49Å; I587-N659 HydrophobicContact CD1-CB 4.46Å; S655-N659 PolarHBondContact O-N 3.29Å; L656-N659 WeakPolarHBondContact O-CB 3.5Å; L656-N659 PolarHBondContact O-N 3.09Å; L656-N659 VanDerWaalsContact O-N 3.08Å; L657-N659 VanDerWaalsContact C-N 3.34Å; N659-R661 VanDerWaalsContact C-N 3.3Å; N659-R661 PolarHBondContact O-N 3Å; N659-R662 VanDerWaalsContact O-CB 3.28Å; N659-R662 WeakPolarHBondContact O-CB 3.42Å; N659-R662 PolarHBondContact O-N 3Å; N659-R662 VanDerWaalsContact O-N 3.09Å; N659-I663 WeakPolarHBondContact O-CG1 3.49Å; N659-I663 PolarHBondContact O-N 3.26Å
660	L	73.8	Confident	67.3	Low	6 Å²	6	65 Å²	65	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-59.8	-40.9	175.2	-68.5	173.7	0	0	0	111.7	P559 F560 L656 R662 I663 I664 L701	P559-L660 HydrophobicContact CB-CD2 3.58Å; P559-L660 HydrophobicContact CG-CD2 3.8Å; F560-L660 HydrophobicContact CE1-CD1 4.29Å; F560-L660 HydrophobicContact CE2-CD2 4.47Å; F560-L660 HydrophobicContact CZ-CD1 4.07Å; F560-L660 HydrophobicContact CZ-CD2 4.27Å; L656-L660 HydrophobicContact CD1-CD1 4.12Å; L656-L660 HydrophobicContact CD1-CG 4.12Å; L656-L660 HydrophobicContact CD2-CD1 4.38Å; L656-L660 HydrophobicContact CG-CD1 3.84Å; L656-L660 HydrophobicContact CG-CG 4.27Å; L656-L660 WeakPolarHBondContact O-CG 3.4Å; L656-L660 PolarHBondContact O-N 3.17Å; L660-R662 VanDerWaalsContact C-N 3.28Å; L660-R662 PolarHBondContact O-N 3.1Å; L660-I663 PolarHBondContact O-N 3.41Å; L660-I663 VanDerWaalsContact O-N 3.16Å; L660-I664 WeakPolarHBondContact O-CD1 3.48Å; L660-I664 WeakPolarHBondContact O-CG1 3.46Å; L660-I664 PolarHBondContact O-N 3.48Å; L660-L701 HydrophobicContact CB-CD1 3.95Å; L660-L701 HydrophobicContact CD1-CB 4.48Å; L660-L701 HydrophobicContact CD1-CD1 3.71Å; L660-L701 HydrophobicContact CG-CD1 4.4Å
661	R	70	Confident	65.6	Low	149 Å²	149	62 Å²	62	56%	0.562	30%	0.301	S	S	*	.	H	α-helix	trans	-61	-36.1	175.9	-170.5	-179	-68.7	-172.1	-1.8	112.5	L657 R658 N659 N665	L657-R661 WeakPolarHBondContact O-CB 3.33Å; L657-R661 PolarHBondContact O-N 3.4Å; R658-R661 PolarHBondContact O-N 3.23Å; N659-R661 VanDerWaalsContact C-N 3.3Å; N659-R661 PolarHBondContact O-N 3Å; R661-N665 WeakPolarHBondContact O-CB 3.48Å; R661-N665 VanDerWaalsContact O-CG 3.29Å; R661-N665 PolarHBondContact O-N 2.99Å; R661-N665 VanDerWaalsContact O-N 3.14Å; R661-N665 PolarHBondContact O-ND2 3.45Å
662	R	70	Confident	64	Low	108 Å²	108	58.5 Å²	58.5	41%	0.408	29%	0.288	S	S	.	.	H	α-helix	trans	-59.6	-51.2	173.1	-168.6	178.2	84.5	170.1	6.7	110.3	D552 R658 N659 L660 I664 N665 E666	D552-R662 IonicContact OD2-CZ 3.82Å; D552-R662 IonicContact OD2-NH1 3.71Å; D552-R662 IonicContact OD2-NH2 2.96Å; D552-R662 PolarHBondContact OD2-NH2 2.77Å; R658-R662 PolarHBondContact O-N 2.84Å; R658-R662 VanDerWaalsContact O-N 3.15Å; N659-R662 VanDerWaalsContact O-CB 3.28Å; N659-R662 WeakPolarHBondContact O-CB 3.42Å; N659-R662 PolarHBondContact O-N 3Å; N659-R662 VanDerWaalsContact O-N 3.09Å; L660-R662 VanDerWaalsContact C-N 3.28Å; L660-R662 PolarHBondContact O-N 3.1Å; R662-I664 PolarHBondContact O-N 3.39Å; R662-N665 PolarHBondContact O-N 3.48Å; R662-E666 PolarHBondContact O-N 3.1Å
663	I	65.7	Low	62.3	Low	4 Å²	4	63 Å²	63	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-41.8	-178.4	-61.1	167.1	0	0	0	112	I555 Y556 P559 N659 L660 N665 E666 N667	I555-I663 HydrophobicContact CG2-CD1 4.39Å; Y556-I663 HydrophobicContact CD2-CG1 4.35Å; Y556-I663 HydrophobicContact CD2-CG2 3.99Å; Y556-I663 HydrophobicContact CE2-CG2 4.15Å; P559-I663 HydrophobicContact CB-CD1 3.82Å; P559-I663 HydrophobicContact CG-CD1 4.46Å; N659-I663 WeakPolarHBondContact O-CG1 3.49Å; N659-I663 PolarHBondContact O-N 3.26Å; L660-I663 PolarHBondContact O-N 3.41Å; L660-I663 VanDerWaalsContact O-N 3.16Å; I663-N665 PolarHBondContact O-N 3.16Å; I663-E666 PolarHBondContact O-N 3.1Å; I663-N667 PolarHBondContact O-N 2.95Å; I663-N667 PolarHBondContact O-ND2 3.48Å
664	I	61.9	Low	60.6	Low	39 Å²	39	70 Å²	70	20%	0.2	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-41.5	178.3	-64.1	157.2	0	0	0	111	L660 R662 E666 N667 I683 L701	L660-I664 WeakPolarHBondContact O-CD1 3.48Å; L660-I664 WeakPolarHBondContact O-CG1 3.46Å; L660-I664 PolarHBondContact O-N 3.48Å; R662-I664 PolarHBondContact O-N 3.39Å; I664-E666 VanDerWaalsContact C-N 3.31Å; I664-E666 PolarHBondContact O-N 2.94Å; I664-N667 PolarHBondContact O-N 3.44Å; I664-I683 HydrophobicContact CG2-CD1 4.03Å; I664-L701 HydrophobicContact CD1-CD1 4.03Å; I664-L701 HydrophobicContact CD1-CD2 3.28Å; I664-L701 HydrophobicContact CD1-CG 4.3Å; I664-L701 HydrophobicContact CG1-CD2 3.98Å
665	N	59.2	Low	58.8	Low	84 Å²	84	69 Å²	69	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-34.3	-179	-77	-27	0	0	0	112.2	R661 R662 I663 K668	R661-N665 WeakPolarHBondContact O-CB 3.48Å; R661-N665 VanDerWaalsContact O-CG 3.29Å; R661-N665 PolarHBondContact O-N 2.99Å; R661-N665 VanDerWaalsContact O-N 3.14Å; R661-N665 PolarHBondContact O-ND2 3.45Å; R662-N665 PolarHBondContact O-N 3.48Å; I663-N665 PolarHBondContact O-N 3.16Å; N665-K668 PolarHBondContact OD1-NZ 3.06Å
666	E	54.9	Low	56.7	Low	108 Å²	108	70.8 Å²	70.8	51%	0.505	35%	0.347	S	S	.	.	H	α-helix	trans	-69	-32.8	175.7	-72	168.9	-173.7	0	0	112.6	Y556 R662 I663 I664 K668	Y556-E666 WeakPolarHBondContact CD2-OE2 3.3Å; Y556-E666 HydrophobicContact CE2-CB 4.12Å; Y556-E666 WeakPolarHBondContact CE2-OE2 3.37Å; R662-E666 PolarHBondContact O-N 3.1Å; I663-E666 PolarHBondContact O-N 3.1Å; I664-E666 VanDerWaalsContact C-N 3.31Å; I664-E666 PolarHBondContact O-N 2.94Å; E666-K668 PolarHBondContact O-N 3.18Å
667	N	51.3	Low	54.7	Low	57 Å²	57	78.6 Å²	78.6	31%	0.305	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	0.3	-178.2	-81.1	-64.1	0	0	0	115.3	Y556 I663 I664 C669	Y556-N667 VanDerWaalsContact OH-CG 3.23Å; Y556-N667 PolarHBondContact OH-ND2 3.26Å; Y556-N667 PolarHBondContact OH-OD1 3.22Å; I663-N667 PolarHBondContact O-N 2.95Å; I663-N667 PolarHBondContact O-ND2 3.48Å; I664-N667 PolarHBondContact O-N 3.44Å; N667-C669 PolarHBondContact O-N 3.42Å; N667-C669 VanDerWaalsContact O-N 3.09Å
668	K	47.9	Very low	52.7	Low	99 Å²	99	82 Å²	82	43%	0.43	41%	0.41	S	S	.	.			trans	-66.4	114.7	-178.9	-73.7	-178.4	-179.4	169.8	0	110.7	N665 E666 A670	N665-K668 PolarHBondContact OD1-NZ 3.06Å; E666-K668 PolarHBondContact O-N 3.18Å; K668-A670 PolarHBondContact O-N 2.83Å
669	C	48.4	Very low	50.5	Low	39 Å²	39	77.7 Å²	77.7	26%	0.264	41%	0.405	S	S	.	.			trans	-53.2	129.8	175.6	171.6	0	0	0	0	111.9	C509 N667 T671 C672 Q673	C509-C669 PolarHBondContact SG-SG 3.35Å; N667-C669 PolarHBondContact O-N 3.42Å; N667-C669 VanDerWaalsContact O-N 3.09Å; C669-T671 VanDerWaalsContact C-N 3.31Å; C669-T671 PolarHBondContact O-N 2.81Å; C669-T671 PolarHBondContact SG-N 3.19Å; C669-T671 PolarHBondContact SG-OG1 2.99Å; C669-C672 HydrophobicContact CB-CB 3.91Å; C669-C672 CarbonylContact O-C 3.59Å; C669-C672 WeakPolarHBondContact O-CA 3.31Å; C669-C672 WeakPolarHBondContact O-CB 3.26Å; C669-C672 PolarHBondContact O-N 3.34Å; C669-Q673 PolarHBondContact O-N 3.34Å
670	A	44.3	Very low	48.3	Very low	64 Å²	64	83 Å²	83	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-63	-32	-179.9	0	0	0	0	0	113.4	K668 Q673 R674	K668-A670 PolarHBondContact O-N 2.83Å; A670-Q673 WeakPolarHBondContact O-CB 3.42Å; A670-Q673 PolarHBondContact O-N 3.2Å; A670-R674 PolarHBondContact O-N 3.41Å
671	T	42.1	Very low	46	Very low	93 Å²	93	88 Å²	88	57%	0.571	47%	0.469	S	S	*	.	H	α-helix	trans	-71.1	-33.3	171.8	15.9	0	0	0	0	111.9	C669 R674 A675	C669-T671 VanDerWaalsContact C-N 3.31Å; C669-T671 PolarHBondContact O-N 2.81Å; C669-T671 PolarHBondContact SG-N 3.19Å; C669-T671 PolarHBondContact SG-OG1 2.99Å; T671-R674 PolarHBondContact O-N 3.39Å; T671-A675 PolarHBondContact O-N 2.84Å
672	C	44.9	Very low	43.9	Very low	36 Å²	36	88.6 Å²	88.6	24%	0.243	48%	0.476	C	S	.	.	H	α-helix	trans	-71.7	-30.4	169.7	-68.3	0	0	0	0	112.9	C509 C669 R674 A675 S676	C509-C672 WeakPolarHBondContact CB-SG 3.3Å; C509-C672 PolarHBondContact SG-SG 3.45Å; C669-C672 HydrophobicContact CB-CB 3.91Å; C669-C672 CarbonylContact O-C 3.59Å; C669-C672 WeakPolarHBondContact O-CA 3.31Å; C669-C672 WeakPolarHBondContact O-CB 3.26Å; C669-C672 PolarHBondContact O-N 3.34Å; C672-R674 VanDerWaalsContact C-N 3.26Å; C672-R674 PolarHBondContact O-N 3Å; C672-A675 PolarHBondContact O-N 3.2Å; C672-S676 WeakPolarHBondContact O-CB 3.45Å; C672-S676 PolarHBondContact O-N 3.19Å; C672-S676 PolarHBondContact O-OG 2.92Å; C672-S676 VanDerWaalsContact O-OG 3.08Å
673	Q	41.3	Very low	42	Very low	95 Å²	95	87.6 Å²	87.6	44%	0.444	48%	0.477	S	S	.	.	H	α-helix	trans	-57.6	-45.5	169.4	-74.4	-179.9	-16.8	0	0	109.6	C669 A670 S676 H677	C669-Q673 PolarHBondContact O-N 3.34Å; A670-Q673 WeakPolarHBondContact O-CB 3.42Å; A670-Q673 PolarHBondContact O-N 3.2Å; Q673-S676 WeakPolarHBondContact CA-OG 3.38Å; Q673-S676 PolarHBondContact O-N 3.4Å; Q673-S676 PolarHBondContact O-OG 3.12Å; Q673-H677 PolarHBondContact O-CD2 2.95Å; Q673-H677 PolarHBondContact O-N 2.94Å
674	R	39	Very low	40.2	Very low	203 Å²	203	92 Å²	92	77%	0.766	51%	0.505	S	S	*	.	H	α-helix	trans	-64.6	-41	176.5	-66.7	-176	-172.5	173	2.7	113.4	A670 T671 C672 H677	A670-R674 PolarHBondContact O-N 3.41Å; T671-R674 PolarHBondContact O-N 3.39Å; C672-R674 VanDerWaalsContact C-N 3.26Å; C672-R674 PolarHBondContact O-N 3Å; R674-H677 PolarHBondContact O-N 2.77Å
675	A	39.5	Very low	38.7	Very low	49 Å²	49	94.1 Å²	94.1	41%	0.405	51%	0.513	S	S	.	.	H	α-helix	trans	-70.9	-32.2	174.9	0	0	0	0	0	113.2	T671 C672 H677 S678 S679	T671-A675 PolarHBondContact O-N 2.84Å; C672-A675 PolarHBondContact O-N 3.2Å; A675-H677 VanDerWaalsContact C-N 3.25Å; A675-H677 PolarHBondContact O-N 3.45Å; A675-S678 PolarHBondContact O-N 3.16Å; A675-S678 PolarHBondContact O-OG 3.15Å; A675-S679 PolarHBondContact O-N 3.33Å; A675-S679 VanDerWaalsContact O-N 3.16Å
676	S	33.2	Very low	37.1	Very low	44 Å²	44	95.1 Å²	95.1	31%	0.308	52%	0.524	S	S	.	.	H	α-helix	trans	-73.5	-18.4	176.2	72.4	0	0	0	0	113	C672 Q673 S678 S679	C672-S676 WeakPolarHBondContact O-CB 3.45Å; C672-S676 PolarHBondContact O-N 3.19Å; C672-S676 PolarHBondContact O-OG 2.92Å; C672-S676 VanDerWaalsContact O-OG 3.08Å; Q673-S676 WeakPolarHBondContact CA-OG 3.38Å; Q673-S676 PolarHBondContact O-N 3.4Å; Q673-S676 PolarHBondContact O-OG 3.12Å; S676-S678 VanDerWaalsContact C-N 3.3Å; S676-S679 WeakPolarHBondContact CA-O 3.47Å; S676-S679 CarbonylContact O-C 3.52Å; S676-S679 VanDerWaalsContact O-O 3.13Å
677	H	35.7	Very low	35.9	Very low	165 Å²	165	94.9 Å²	94.9	76%	0.764	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-18	167.4	-70.4	-52.9	0	0	0	112.7	Q673 R674 A675	Q673-H677 PolarHBondContact O-CD2 2.95Å; Q673-H677 PolarHBondContact O-N 2.94Å; R674-H677 PolarHBondContact O-N 2.77Å; A675-H677 VanDerWaalsContact C-N 3.25Å; A675-H677 PolarHBondContact O-N 3.45Å
678	S	34	Very low	34.7	Very low	103 Å²	103	100.2 Å²	100.2	72%	0.72	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-17.2	171.7	58.6	0	0	0	0	114.2	A675 S676	A675-S678 PolarHBondContact O-N 3.16Å; A675-S678 PolarHBondContact O-OG 3.15Å; S676-S678 VanDerWaalsContact C-N 3.3Å
679	S	30.2	Very low	34.1	Very low	72 Å²	72	98.8 Å²	98.8	50%	0.503	57%	0.572	S	S	.	*	S	Bend	trans	-151.1	119.6	164.7	57.3	0	0	0	0	110.1	A675 S676 T681	A675-S679 PolarHBondContact O-N 3.33Å; A675-S679 VanDerWaalsContact O-N 3.16Å; S676-S679 WeakPolarHBondContact CA-O 3.47Å; S676-S679 CarbonylContact O-C 3.52Å; S676-S679 VanDerWaalsContact O-O 3.13Å; S679-T681 PolarHBondContact O-N 3.13Å
680	T	26.9	Very low	33.1	Very low	127 Å²	127	104.2 Å²	104.2	78%	0.779	60%	0.598	S	S	*	*			trans	-61.8	67.9	178	37.1	0	0	0	0	112.8	K682	T680-K682 PolarHBondContact O-N 3.05Å
681	T	26.1	Very low	32.3	Very low	109 Å²	109	110.8 Å²	110.8	67%	0.669	62%	0.618	S	S	*	*			trans	-77	73.2	153.3	43.1	0	0	0	0	107.5	S679 I683	S679-T681 PolarHBondContact O-N 3.13Å; T681-I683 PolarHBondContact O-N 3.28Å
682	K	26.6	Very low	31.8	Very low	162 Å²	162	114.5 Å²	114.5	70%	0.704	63%	0.629	S	S	*	*			trans	-44.4	135.6	144.8	-79.3	176.6	177.9	174.8	0	105	T680 T684	T680-K682 PolarHBondContact O-N 3.05Å; K682-T684 HydrophobicContact CB-CG2 4.02Å; K682-T684 PolarHBondContact O-N 3.37Å; K682-T684 PolarHBondContact O-OG1 3.41Å
683	I	28.9	Very low	31.2	Very low	87 Å²	87	118.7 Å²	118.7	45%	0.446	65%	0.654	S	S	.	*			trans	-63.9	78	159.5	-58.8	168.6	0	0	0	104.5	I664 T681 F685	I664-I683 HydrophobicContact CG2-CD1 4.03Å; T681-I683 PolarHBondContact O-N 3.28Å; I683-F685 VanDerWaalsContact C-N 3.28Å; I683-F685 PolarHBondContact O-N 3.33Å; I683-F685 VanDerWaalsContact O-N 3.13Å
684	T	27.6	Very low	30.8	Very low	98 Å²	98	121.2 Å²	121.2	60%	0.601	67%	0.669	S	S	*	*			trans	-69.7	99.9	162.2	41.3	0	0	0	0	102.3	K682 P686	K682-T684 HydrophobicContact CB-CG2 4.02Å; K682-T684 PolarHBondContact O-N 3.37Å; K682-T684 PolarHBondContact O-OG1 3.41Å; T684-P686 VanDerWaalsContact O-N 3.1Å
685	F	30.2	Very low	31.1	Very low	83 Å²	83	116.1 Å²	116.1	36%	0.364	65%	0.654	S	S	.	*			trans	-38.9	122.3	149.5	-66.3	-77.9	0	0	0	105.6	I683 T687 P697	I683-F685 VanDerWaalsContact C-N 3.28Å; I683-F685 PolarHBondContact O-N 3.33Å; I683-F685 VanDerWaalsContact O-N 3.13Å; F685-T687 PolarHBondContact O-N 3.4Å; F685-T687 PolarHBondContact O-OG1 3.42Å; F685-P697 HydrophobicContact CD1-CB 4.13Å; F685-P697 HydrophobicContact CD1-CG 4.13Å; F685-P697 HydrophobicContact CE1-CB 3.74Å; F685-P697 HydrophobicContact CE1-CG 4.21Å
686	P	26.6	Very low	32	Very low	104 Å²	104	116 Å²	116	68%	0.675	65%	0.646	S	S	*	*			trans	-60.6	95.8	-170.3	22	-30.7	0	0	0	108.2	T684	T684-P686 VanDerWaalsContact O-N 3.1Å
687	T	29.6	Very low	33.3	Very low	104 Å²	104	115.9 Å²	115.9	64%	0.638	65%	0.645	S	S	*	*			trans	-104.1	109.8	173.5	44.8	0	0	0	0	104.8	F685	F685-T687 PolarHBondContact O-N 3.4Å; F685-T687 PolarHBondContact O-OG1 3.42Å
688	N	27	Very low	34.7	Very low	169 Å²	169	108 Å²	108	90%	0.904	61%	0.609	S	S	*	*	S	Bend	trans	82.6	125.1	173.6	-54	-24.4	0	0	0	116.8
689	G	33.3	Very low	36.1	Very low	69 Å²	69	104.8 Å²	104.8	71%	0.711	58%	0.583	S	S	*	*	S	Bend	trans	146.4	-62.8	151.9	0	0	0	0	0	114.5
690	N	28.6	Very low	37.5	Very low	152 Å²	152	105.8 Å²	105.8	81%	0.813	58%	0.576	S	S	*	*			trans	-121.8	124.3	-171.7	-67.5	-19	0	0	0	109.2	Q692	N690-Q692 PolarHBondContact O-N 3.41Å
691	Q	28.2	Very low	39	Very low	202 Å²	202	100 Å²	100	94%	0.944	54%	0.54	S	S	*	.			trans	-66.8	47.5	-178.6	-67.2	176	-27.9	0	0	113.4	T693	Q691-T693 PolarHBondContact O-N 3.22Å
692	Q	30.3	Very low	40.6	Very low	172 Å²	172	95.9 Å²	95.9	80%	0.804	51%	0.513	S	S	*	.	S	Bend	trans	-84.3	95.4	158.9	-70.9	-176.4	-7.2	0	0	105.4	N690 L694	N690-Q692 PolarHBondContact O-N 3.41Å; Q692-L694 PolarHBondContact O-N 3.44Å
693	T	33.3	Very low	42.1	Very low	124 Å²	124	91.5 Å²	91.5	76%	0.761	50%	0.498	S	S	*	.			trans	-0.5	103.6	166.6	49.6	0	0	0	0	113	Q691 E695	Q691-T693 PolarHBondContact O-N 3.22Å; T693-E695 VanDerWaalsContact C-N 3.34Å; T693-E695 PolarHBondContact O-N 3.48Å
694	L	32.9	Very low	42.9	Very low	148 Å²	148	90.1 Å²	90.1	78%	0.775	49%	0.489	S	S	*	.			trans	-48	97.3	173.9	-84.1	139.9	0	0	0	109.2	Q692 N696	Q692-L694 PolarHBondContact O-N 3.44Å; L694-N696 PolarHBondContact O-N 3.42Å
695	E	45.6	Very low	43.9	Very low	95 Å²	95	86.5 Å²	86.5	44%	0.444	47%	0.467	S	S	.	.			trans	-59.3	128.4	166.1	-71.3	-174.1	161.6	0	0	106.3	T693 W700 H704	T693-E695 VanDerWaalsContact C-N 3.34Å; T693-E695 PolarHBondContact O-N 3.48Å; E695-W700 HydrophobicContact CB-CB 4.38Å; E695-H704 IonicContact OE2-CE1 3.76Å
696	N	58.7	Low	44.4	Very low	46 Å²	46	84.9 Å²	84.9	25%	0.246	47%	0.466	C	S	.	.			trans	-47.4	133.5	171	177.8	-23.3	0	0	0	107.6	L694 I698 D699 W700	L694-N696 PolarHBondContact O-N 3.42Å; N696-I698 CarbonylContact O-C 3.49Å; N696-I698 PolarHBondContact O-N 3.23Å; N696-I698 WeakPolarHBondContact OD1-CB 3.37Å; N696-I698 PolarHBondContact OD1-N 3.32Å; N696-D699 HydrophobicContact CB-CB 4.02Å; N696-D699 WeakPolarHBondContact CB-OD2 3.35Å; N696-D699 CarbonylContact O-C 3.34Å; N696-D699 WeakPolarHBondContact O-CA 3.36Å; N696-D699 WeakPolarHBondContact O-CB 3.38Å; N696-D699 PolarHBondContact O-N 3.25Å; N696-W700 PolarHBondContact O-N 2.94Å
697	P	60.5	Low	45.3	Very low	43 Å²	43	80.8 Å²	80.8	28%	0.279	44%	0.437	S	S	.	.	H	α-helix	trans	-45.9	-34.2	175.4	-32.4	37.1	0	0	0	113.3	L657 F685 L701	L657-P697 HydrophobicContact CD2-CB 4.05Å; F685-P697 HydrophobicContact CD1-CB 4.13Å; F685-P697 HydrophobicContact CD1-CG 4.13Å; F685-P697 HydrophobicContact CE1-CB 3.74Å; F685-P697 HydrophobicContact CE1-CG 4.21Å; P697-L701 WeakPolarHBondContact O-CB 3.32Å; P697-L701 WeakPolarHBondContact O-CD1 3.42Å; P697-L701 WeakPolarHBondContact O-CG 3.32Å; P697-L701 PolarHBondContact O-N 3.2Å
698	I	64.5	Low	45.6	Very low	0 Å²	0	80 Å²	80	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-73.7	-38.2	176.2	-58.3	172.1	0	0	0	111.8	F560 Y590 W596 E653 L656 L657 N696 L701 H702	F560-I698 HydrophobicContact CE1-CG2 3.84Å; F560-I698 HydrophobicContact CZ-CG2 4.38Å; Y590-I698 HydrophobicContact CE1-CD1 3.82Å; Y590-I698 WeakPolarHBondContact OH-CD1 3.47Å; W596-I698 HydrophobicContact CD2-CG2 4.02Å; W596-I698 HydrophobicContact CE3-CG2 4.43Å; W596-I698 HydrophobicContact CH2-CG2 4.01Å; W596-I698 HydrophobicContact CZ2-CG2 3.53Å; W596-I698 HydrophobicContact CZ3-CG2 4.43Å; E653-I698 HydrophobicContact CG-CD1 3.6Å; L656-I698 HydrophobicContact CD2-CD1 4.13Å; L656-I698 HydrophobicContact CD2-CG2 4.25Å; L657-I698 HydrophobicContact CD2-CD1 4.45Å; L657-I698 HydrophobicContact CD2-CG1 3.76Å; L657-I698 HydrophobicContact CG-CD1 4.4Å; L657-I698 HydrophobicContact CG-CG1 4.24Å; N696-I698 CarbonylContact O-C 3.49Å; N696-I698 PolarHBondContact O-N 3.23Å; N696-I698 WeakPolarHBondContact OD1-CB 3.37Å; N696-I698 PolarHBondContact OD1-N 3.32Å; I698-L701 PolarHBondContact O-N 2.9Å; I698-H702 WeakPolarHBondContact O-CB 3.34Å; I698-H702 PolarHBondContact O-N 3.08Å
699	D	63.3	Low	46.1	Very low	35 Å²	35	73.4 Å²	73.4	19%	0.187	39%	0.394	C	S	.	.	H	α-helix	trans	-65.4	-44.1	172.4	-76.3	-31.7	0	0	0	111.4	W596 Q600 N696 L701 H702 N703	W596-D699 PolarHBondContact NE1-OD1 3.45Å; Q600-D699 PolarHBondContact NE2-OD1 3.04Å; N696-D699 HydrophobicContact CB-CB 4.02Å; N696-D699 WeakPolarHBondContact CB-OD2 3.35Å; N696-D699 CarbonylContact O-C 3.34Å; N696-D699 WeakPolarHBondContact O-CA 3.36Å; N696-D699 WeakPolarHBondContact O-CB 3.38Å; N696-D699 PolarHBondContact O-N 3.25Å; D699-L701 VanDerWaalsContact C-N 3.3Å; D699-L701 PolarHBondContact O-N 3.3Å; D699-H702 PolarHBondContact O-N 3.41Å; D699-N703 VanDerWaalsContact O-CB 3.25Å; D699-N703 WeakPolarHBondContact O-CB 3.24Å; D699-N703 PolarHBondContact O-N 3.31Å; D699-N703 PolarHBondContact O-ND2 2.85Å
700	W	58.3	Low	46	Very low	92 Å²	92	74.3 Å²	74.3	35%	0.348	38%	0.378	S	S	.	.	H	α-helix	trans	-58.2	-47.2	174.9	-174.5	84.3	0	0	0	110.1	E695 N696 N703 H704	E695-W700 HydrophobicContact CB-CB 4.38Å; N696-W700 PolarHBondContact O-N 2.94Å; W700-N703 PolarHBondContact O-N 2.86Å; W700-H704 AromaticContact CD1-CE1 3.39Å; W700-H704 AromaticContact CD1-ND1 3.56Å; W700-H704 AromaticContact CD1-NE2 3.81Å; W700-H704 HydrophobicContact CD2-CB 4.37Å; W700-H704 AromaticContact CE2-CD2 3.78Å; W700-H704 AromaticContact CE2-CG 3.75Å; W700-H704 AromaticContact CG-ND1 3.91Å; W700-H704 HydrophobicContact CH2-CB 4.45Å; W700-H704 HydrophobicContact CZ2-CB 4.22Å; W700-H704 AromaticContact CZ2-CD2 3.99Å; W700-H704 AromaticContact NE1-CD2 3.51Å; W700-H704 AromaticContact NE1-CE1 3.41Å; W700-H704 PolarHBondContact NE1-CE1 3.33Å; W700-H704 AromaticContact NE1-CG 3.69Å; W700-H704 AromaticContact NE1-ND1 3.62Å; W700-H704 AromaticContact NE1-NE2 3.33Å; W700-H704 PolarHBondContact NE1-NE2 3.34Å; W700-H704 WeakPolarHBondContact O-CB 3.5Å; W700-H704 PolarHBondContact O-N 2.65Å; W700-H704 PolarHBondContact O-ND1 2.81Å
701	L	58.8	Low	46	Very low	5 Å²	5	71.5 Å²	71.5	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-65.7	-42.2	177	-72	170.5	0	0	0	112.8	F560 L657 L660 I664 P697 I698 D699 N703 V705	F560-L701 HydrophobicContact CZ-CB 4.49Å; L657-L701 HydrophobicContact CD2-CD1 4.44Å; L660-L701 HydrophobicContact CB-CD1 3.95Å; L660-L701 HydrophobicContact CD1-CB 4.48Å; L660-L701 HydrophobicContact CD1-CD1 3.71Å; L660-L701 HydrophobicContact CG-CD1 4.4Å; I664-L701 HydrophobicContact CD1-CD1 4.03Å; I664-L701 HydrophobicContact CD1-CD2 3.28Å; I664-L701 HydrophobicContact CD1-CG 4.3Å; I664-L701 HydrophobicContact CG1-CD2 3.98Å; P697-L701 WeakPolarHBondContact O-CB 3.32Å; P697-L701 WeakPolarHBondContact O-CD1 3.42Å; P697-L701 WeakPolarHBondContact O-CG 3.32Å; P697-L701 PolarHBondContact O-N 3.2Å; I698-L701 PolarHBondContact O-N 2.9Å; D699-L701 VanDerWaalsContact C-N 3.3Å; D699-L701 PolarHBondContact O-N 3.3Å; L701-N703 VanDerWaalsContact C-N 3.34Å; L701-N703 PolarHBondContact O-N 3.42Å; L701-V705 HydrophobicContact CD2-CG2 3.65Å; L701-V705 CarbonylContact O-C 3.48Å; L701-V705 WeakPolarHBondContact O-CA 3.43Å; L701-V705 WeakPolarHBondContact O-CB 3.46Å; L701-V705 PolarHBondContact O-N 2.98Å
702	H	60.4	Low	45.8	Very low	23 Å²	23	69.5 Å²	69.5	11%	0.106	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-46.3	175.7	-179.4	-95.4	0	0	0	110	F560 W596 I698 D699 S706	F560-H702 HydrophobicContact CE1-CB 4.47Å; F560-H702 HydrophobicContact CE2-CB 4.19Å; F560-H702 HydrophobicContact CZ-CB 3.96Å; W596-H702 HydrophobicContact CZ2-CB 4.03Å; I698-H702 WeakPolarHBondContact O-CB 3.34Å; I698-H702 PolarHBondContact O-N 3.08Å; D699-H702 PolarHBondContact O-N 3.41Å; H702-S706 WeakPolarHBondContact O-CA 3.26Å; H702-S706 WeakPolarHBondContact O-CB 3.4Å; H702-S706 PolarHBondContact O-N 2.97Å
703	N	57.6	Low	45.7	Very low	71 Å²	71	64.8 Å²	64.8	38%	0.38	35%	0.346	S	S	.	.	H	α-helix	trans	-76.5	-31.3	-176.2	-65.4	-17.9	0	0	0	114	D699 W700 L701 S706	D699-N703 VanDerWaalsContact O-CB 3.25Å; D699-N703 WeakPolarHBondContact O-CB 3.24Å; D699-N703 PolarHBondContact O-N 3.31Å; D699-N703 PolarHBondContact O-ND2 2.85Å; W700-N703 PolarHBondContact O-N 2.86Å; L701-N703 VanDerWaalsContact C-N 3.34Å; L701-N703 PolarHBondContact O-N 3.42Å; N703-S706 PolarHBondContact O-OG 2.99Å
704	H	46.6	Very low	45.3	Very low	58 Å²	58	70.3 Å²	70.3	27%	0.269	35%	0.353	S	S	.	.	H	α-helix	trans	-102.6	-25.8	-174.1	-64.8	64.8	0	0	0	113	E695 W700	E695-H704 IonicContact OE2-CE1 3.76Å; W700-H704 AromaticContact CD1-CE1 3.39Å; W700-H704 AromaticContact CD1-ND1 3.56Å; W700-H704 AromaticContact CD1-NE2 3.81Å; W700-H704 HydrophobicContact CD2-CB 4.37Å; W700-H704 AromaticContact CE2-CD2 3.78Å; W700-H704 AromaticContact CE2-CG 3.75Å; W700-H704 AromaticContact CG-ND1 3.91Å; W700-H704 HydrophobicContact CH2-CB 4.45Å; W700-H704 HydrophobicContact CZ2-CB 4.22Å; W700-H704 AromaticContact CZ2-CD2 3.99Å; W700-H704 AromaticContact NE1-CD2 3.51Å; W700-H704 AromaticContact NE1-CE1 3.41Å; W700-H704 PolarHBondContact NE1-CE1 3.33Å; W700-H704 AromaticContact NE1-CG 3.69Å; W700-H704 AromaticContact NE1-ND1 3.62Å; W700-H704 AromaticContact NE1-NE2 3.33Å; W700-H704 PolarHBondContact NE1-NE2 3.34Å; W700-H704 WeakPolarHBondContact O-CB 3.5Å; W700-H704 PolarHBondContact O-N 2.65Å; W700-H704 PolarHBondContact O-ND1 2.81Å
705	V	48.3	Very low	45	Very low	22 Å²	22	71.6 Å²	71.6	13%	0.133	36%	0.36	C	S	.	.	S	Bend	trans	-106.3	11.6	174.3	-164.7	0	0	0	0	109.7	L701 F707	L701-V705 HydrophobicContact CD2-CG2 3.65Å; L701-V705 CarbonylContact O-C 3.48Å; L701-V705 WeakPolarHBondContact O-CA 3.43Å; L701-V705 WeakPolarHBondContact O-CB 3.46Å; L701-V705 PolarHBondContact O-N 2.98Å; V705-F707 VanDerWaalsContact C-N 3.29Å; V705-F707 HydrophobicContact CG1-CD2 4Å; V705-F707 HydrophobicContact CG1-CE2 3.54Å; V705-F707 WeakPolarHBondContact O-CD2 3.27Å; V705-F707 PolarHBondContact O-N 2.81Å
706	S	39.7	Very low	44.2	Very low	48 Å²	48	70.3 Å²	70.3	34%	0.336	37%	0.372	S	S	.	.			trans	-55	92.6	179.6	48.3	0	0	0	0	110.8	H702 N703 N708	H702-S706 WeakPolarHBondContact O-CA 3.26Å; H702-S706 WeakPolarHBondContact O-CB 3.4Å; H702-S706 PolarHBondContact O-N 2.97Å; N703-S706 PolarHBondContact O-OG 2.99Å; S706-N708 PolarHBondContact O-N 2.77Å; S706-N708 VanDerWaalsContact O-N 3.08Å
707	F	45.7	Very low	42.6	Very low	19 Å²	19	71 Å²	71	8%	0.083	38%	0.38	C	S	.	.			trans	-75.6	60.5	148.6	-57.5	-84.4	0	0	0	106.6	M514 I516 L557 V705 L709	M514-F707 HydrophobicContact CE-CZ 4.37Å; I516-F707 HydrophobicContact CD1-CD1 3.77Å; I516-F707 HydrophobicContact CD1-CE1 3.18Å; I516-F707 HydrophobicContact CD1-CZ 3.85Å; L557-F707 WeakPolarHBondContact O-CB 3.46Å; L557-F707 VanDerWaalsContact O-CG 3.22Å; L557-F707 WeakPolarHBondContact O-CG 3.44Å; V705-F707 VanDerWaalsContact C-N 3.29Å; V705-F707 HydrophobicContact CG1-CD2 4Å; V705-F707 HydrophobicContact CG1-CE2 3.54Å; V705-F707 WeakPolarHBondContact O-CD2 3.27Å; V705-F707 PolarHBondContact O-N 2.81Å; F707-L709 HydrophobicContact CB-CD1 4.32Å; F707-L709 HydrophobicContact CB-CG 4.22Å; F707-L709 PolarHBondContact O-N 3.21Å
708	N	36.1	Very low	40.9	Very low	88 Å²	88	75.7 Å²	75.7	47%	0.471	41%	0.407	S	S	.	.			trans	-72.1	73	169.3	-99	-12.3	0	0	0	107.4	S706 F710	S706-N708 PolarHBondContact O-N 2.77Å; S706-N708 VanDerWaalsContact O-N 3.08Å; N708-F710 PolarHBondContact O-N 2.66Å
709	L	38.6	Very low	39.1	Very low	29 Å²	29	79.8 Å²	79.8	15%	0.152	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.1	179.6	-72.4	167.4	0	0	0	111.8	N521 N524 G525 A558 F707	N521-L709 HydrophobicContact CB-CD2 4.46Å; N521-L709 WeakPolarHBondContact O-CD2 3.41Å; N524-L709 HydrophobicContact CB-CD2 4.2Å; G525-L709 VanDerWaalsContact CA-CD2 3.49Å; G525-L709 VanDerWaalsContact N-CD2 3.26Å; A558-L709 HydrophobicContact CB-CD1 3.95Å; F707-L709 HydrophobicContact CB-CD1 4.32Å; F707-L709 HydrophobicContact CB-CG 4.22Å; F707-L709 PolarHBondContact O-N 3.21Å
710	F	30.8	Very low	37.3	Very low	89 Å²	89	87 Å²	87	39%	0.39	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	65.2	175.9	-53.8	-77.3	0	0	0	108.4	L529 N708 E712	L529-F710 HydrophobicContact CD1-CE1 4.26Å; L529-F710 HydrophobicContact CD1-CZ 3.98Å; L529-F710 HydrophobicContact CD2-CZ 3.94Å; L529-F710 HydrophobicContact CG-CZ 4Å; N708-F710 PolarHBondContact O-N 2.66Å; F710-E712 VanDerWaalsContact C-N 3.34Å; F710-E712 PolarHBondContact O-N 3.38Å
711	S	29	Very low	35.6	Very low	92 Å²	92	90.3 Å²	90.3	64%	0.643	49%	0.492	S	S	*	.			trans	-56.2	109.6	157.2	53.9	0	0	0	0	106.4
712	E	23.8	Very low	33.9	Very low	160 Å²	160	93.9 Å²	93.9	75%	0.748	52%	0.516	S	S	*	.			trans	-44.1	123.7	178.3	-68.4	178.5	156.5	0	0	108.7	F710 R714	F710-E712 VanDerWaalsContact C-N 3.34Å; F710-E712 PolarHBondContact O-N 3.38Å; E712-R714 PolarHBondContact O-N 3.46Å
713	P	26.6	Very low	32.3	Very low	74 Å²	74	96.8 Å²	96.8	48%	0.481	53%	0.528	S	S	.	.			trans	-62	119.1	172.1	25.7	-29.4	0	0	0	106	D715 C717	P713-D715 PolarHBondContact O-N 3.43Å; P713-D715 VanDerWaalsContact O-N 3.09Å; P713-C717 HydrophobicContact CB-CB 3.93Å; P713-C717 HydrophobicContact CG-CB 3.96Å
714	R	26.2	Very low	30.8	Very low	240 Å²	240	99.3 Å²	99.3	91%	0.906	55%	0.546	S	S	*	.	S	Bend	trans	-36.2	120	177.7	-68.3	179.3	-168.3	172.7	4.2	109.1	E712 G716	E712-R714 PolarHBondContact O-N 3.46Å; R714-G716 PolarHBondContact O-N 3.36Å; R714-G716 VanDerWaalsContact O-N 3.15Å
715	D	25.5	Very low	29.8	Very low	174 Å²	174	100.4 Å²	100.4	93%	0.93	55%	0.554	S	S	*	*	S	Bend	trans	-1.9	96.2	176.3	-68.6	-41.2	0	0	0	114.5	P713	P713-D715 PolarHBondContact O-N 3.43Å; P713-D715 VanDerWaalsContact O-N 3.09Å
716	G	28.6	Very low	28.9	Very low	68 Å²	68	103 Å²	103	70%	0.701	57%	0.573	S	S	*	*	S	Bend	trans	158.4	-20.3	173.5	0	0	0	0	0	117.3	R714	R714-G716 PolarHBondContact O-N 3.36Å; R714-G716 VanDerWaalsContact O-N 3.15Å
717	C	25.7	Very low	28.5	Very low	60 Å²	60	104.8 Å²	104.8	41%	0.405	58%	0.579	S	S	.	*			trans	-113.9	23.8	-170.1	-63.6	0	0	0	0	116.4	P713 A719 P722	P713-C717 HydrophobicContact CB-CB 3.93Å; P713-C717 HydrophobicContact CG-CB 3.96Å; C717-A719 PolarHBondContact O-N 2.87Å; C717-P722 HydrophobicContact CB-CG 4.23Å
718	V	24.8	Very low	27.8	Very low	142 Å²	142	108.5 Å²	108.5	86%	0.861	60%	0.6	S	S	*	*			trans	-80.4	-2.8	173.1	-175.2	0	0	0	0	112.5	K720	V718-K720 PolarHBondContact O-N 3Å
719	A	26	Very low	27.5	Very low	86 Å²	86	111.2 Å²	111.2	71%	0.711	61%	0.612	S	S	*	*	S	Bend	trans	-89.2	95	168.8	0	0	0	0	0	110.6	C717	C717-A719 PolarHBondContact O-N 2.87Å
720	K	25.7	Very low	27.2	Very low	187 Å²	187	113.6 Å²	113.6	81%	0.813	63%	0.628	S	S	*	*	S	Bend	trans	64.8	116.4	-178.4	-55.7	179.6	177.5	-175.8	0	111.9	V718 P722	V718-K720 PolarHBondContact O-N 3Å; K720-P722 VanDerWaalsContact C-N 3.35Å; K720-P722 WeakPolarHBondContact O-CD 3.36Å; K720-P722 WeakPolarHBondContact O-CG 3.47Å
721	M	22.7	Very low	27	Very low	161 Å²	161	115.6 Å²	115.6	79%	0.793	64%	0.639	S	S	*	*			trans	-41.2	98.4	167.6	-85.6	172.9	131	0	0	108.6	F723	M721-F723 PolarHBondContact O-N 2.91Å
722	P	24.8	Very low	27.1	Very low	80 Å²	80	119.3 Å²	119.3	52%	0.519	64%	0.643	S	S	.	*			trans	-72.8	126.6	174.9	-0.2	18.7	0	0	0	102.1	C717 K720 V724	C717-P722 HydrophobicContact CB-CG 4.23Å; K720-P722 VanDerWaalsContact C-N 3.35Å; K720-P722 WeakPolarHBondContact O-CD 3.36Å; K720-P722 WeakPolarHBondContact O-CG 3.47Å; P722-V724 PolarHBondContact O-N 3.49Å
723	F	25.9	Very low	27.3	Very low	85 Å²	85	117.5 Å²	117.5	37%	0.373	64%	0.643	S	S	.	*			trans	-37.6	117.5	161.7	-79.4	-86	0	0	0	106.7	L444 K445 F479 M721 N725	L444-F723 HydrophobicContact CD2-CD1 4.46Å; L444-F723 HydrophobicContact CD2-CE1 3.25Å; L444-F723 HydrophobicContact CD2-CE2 4.24Å; L444-F723 HydrophobicContact CD2-CZ 3.11Å; K445-F723 HydrophobicContact CG-CD2 3.95Å; K445-F723 HydrophobicContact CG-CE2 4.15Å; K445-F723 HydrophobicContact CG-CG 4.3Å; F479-F723 HydrophobicContact CE2-CZ 4.5Å; M721-F723 PolarHBondContact O-N 2.91Å; F723-N725 WeakPolarHBondContact O-CA 3.38Å; F723-N725 PolarHBondContact O-N 2.78Å
724	V	26.1	Very low	27.6	Very low	124 Å²	124	121.5 Å²	121.5	75%	0.752	65%	0.653	S	S	*	*			trans	-45.4	105.1	165.9	172.5	0	0	0	0	102.8	P722 S726	P722-V724 PolarHBondContact O-N 3.49Å; V724-S726 PolarHBondContact O-N 2.76Å
725	N	25.8	Very low	28	Very low	81 Å²	81	115.7 Å²	115.7	43%	0.433	65%	0.645	S	S	.	*			trans	-57	121.8	-176.5	-98.2	-31.8	0	0	0	101.8	F723 N727 D728	F723-N725 WeakPolarHBondContact O-CA 3.38Å; F723-N725 PolarHBondContact O-N 2.78Å; N725-N727 HydrophobicContact CB-CB 4.13Å; N725-N727 PolarHBondContact O-N 3.22Å; N725-D728 PolarHBondContact O-N 3.47Å
726	S	28.9	Very low	28.6	Very low	75 Å²	75	115 Å²	115	52%	0.524	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.8	-6.7	171.7	44	0	0	0	0	111.6	V724	V724-S726 PolarHBondContact O-N 2.76Å
727	N	32.1	Very low	29.2	Very low	86 Å²	86	115 Å²	115	46%	0.46	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	-20.4	167.1	-59.4	-9.6	0	0	0	115.2	N725 I729 T730 Q731	N725-N727 HydrophobicContact CB-CB 4.13Å; N725-N727 PolarHBondContact O-N 3.22Å; N727-I729 VanDerWaalsContact C-N 3.27Å; N727-I729 PolarHBondContact O-N 2.99Å; N727-T730 VanDerWaalsContact CA-OG1 3.23Å; N727-T730 WeakPolarHBondContact CA-OG1 3.47Å; N727-T730 CarbonylContact O-C 3.56Å; N727-T730 VanDerWaalsContact O-CA 3.29Å; N727-T730 WeakPolarHBondContact O-CA 3.38Å; N727-T730 PolarHBondContact O-N 3.5Å; N727-T730 PolarHBondContact O-OG1 2.96Å; N727-Q731 WeakPolarHBondContact O-CG 3.45Å; N727-Q731 PolarHBondContact O-N 3.48Å
728	D	29.2	Very low	30.1	Very low	98 Å²	98	116 Å²	116	52%	0.524	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.1	-22.7	179.5	-77.2	-6.7	0	0	0	112.5	N725 T730 Q731	N725-D728 PolarHBondContact O-N 3.47Å; D728-T730 VanDerWaalsContact C-N 3.3Å; D728-Q731 PolarHBondContact O-N 3.02Å
729	I	30.6	Very low	31.8	Very low	144 Å²	144	115.7 Å²	115.7	74%	0.738	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-16.3	166.9	-59.2	177.1	0	0	0	111.1	N727	N727-I729 VanDerWaalsContact C-N 3.27Å; N727-I729 PolarHBondContact O-N 2.99Å
730	T	32.7	Very low	33.5	Very low	80 Å²	80	119 Å²	119	49%	0.491	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.3	-1	169.1	65.8	0	0	0	0	114	N727 D728	N727-T730 VanDerWaalsContact CA-OG1 3.23Å; N727-T730 WeakPolarHBondContact CA-OG1 3.47Å; N727-T730 CarbonylContact O-C 3.56Å; N727-T730 VanDerWaalsContact O-CA 3.29Å; N727-T730 WeakPolarHBondContact O-CA 3.38Å; N727-T730 PolarHBondContact O-N 3.5Å; N727-T730 PolarHBondContact O-OG1 2.96Å; D728-T730 VanDerWaalsContact C-N 3.3Å
731	Q	25.9	Very low	35.1	Very low	131 Å²	131	113.8 Å²	113.8	61%	0.612	60%	0.6	S	S	*	*			trans	-104.5	36.6	170.8	-71.3	-169.9	7.9	0	0	111.1	N727 D728 T733	N727-Q731 WeakPolarHBondContact O-CG 3.45Å; N727-Q731 PolarHBondContact O-N 3.48Å; D728-Q731 PolarHBondContact O-N 3.02Å; Q731-T733 PolarHBondContact O-N 2.85Å
732	K	31.5	Very low	36.6	Very low	169 Å²	169	108 Å²	108	74%	0.735	57%	0.569	S	S	*	*	S	Bend		-51.7	102.9	124.2	-83	-172	178.2	-178	0	103	F734	K732-F734 WeakPolarHBondContact O-CD2 3.34Å; K732-F734 PolarHBondContact O-N 3.22Å
733	T	28.9	Very low	38.7	Very low	122 Å²	122	109.8 Å²	109.8	75%	0.748	57%	0.569	S	S	*	*			trans	-44.4	98	163.9	37.8	0	0	0	0	103.5	Q731 T735	Q731-T733 PolarHBondContact O-N 2.85Å; T733-T735 PolarHBondContact O-N 3.28Å
734	F	32.3	Very low	40.7	Very low	158 Å²	158	109.6 Å²	109.6	69%	0.693	57%	0.569	S	S	*	*			trans	-64.9	93	169.6	-87.7	-88.4	0	0	0	99.9	K732 D736	K732-F734 WeakPolarHBondContact O-CD2 3.34Å; K732-F734 PolarHBondContact O-N 3.22Å; F734-D736 PolarHBondContact O-N 2.9Å
735	T	33.8	Very low	42.3	Very low	118 Å²	118	107.8 Å²	107.8	72%	0.724	55%	0.554	S	S	*	*			trans	-36.2	117.3	164.4	44	0	0	0	0	104.4	T733 V737	T733-T735 PolarHBondContact O-N 3.28Å; T735-V737 WeakPolarHBondContact O-CA 3.47Å; T735-V737 PolarHBondContact O-N 2.97Å
736	D	39.6	Very low	44.2	Very low	161 Å²	161	106 Å²	106	86%	0.861	55%	0.545	S	S	*	.			trans	-34.3	108.7	-177.8	-79.5	-39.9	0	0	0	106.9	F734 C738	F734-D736 PolarHBondContact O-N 2.9Å; D736-C738 WeakPolarHBondContact O-CA 3.21Å; D736-C738 PolarHBondContact O-N 3.06Å
737	V	40.9	Very low	46.4	Very low	68 Å²	68	106 Å²	106	41%	0.412	54%	0.542	S	S	.	.			trans	-52.3	112.1	-167.8	173.8	0	0	0	0	104.5	T735 E739 D741 I745	T735-V737 WeakPolarHBondContact O-CA 3.47Å; T735-V737 PolarHBondContact O-N 2.97Å; V737-E739 PolarHBondContact O-N 2.87Å; V737-D741 HydrophobicContact CG1-CB 3.58Å; V737-I745 HydrophobicContact CG1-CD1 4.49Å
738	C	44	Very low	48	Very low	81 Å²	81	107.8 Å²	107.8	55%	0.547	55%	0.546	S	S	.	.			trans	-54.4	139	-170.4	-148.4	0	0	0	0	105.8	D736 Y740 D741 Y742	D736-C738 WeakPolarHBondContact O-CA 3.21Å; D736-C738 PolarHBondContact O-N 3.06Å; C738-Y740 CarbonylContact O-C 3.58Å; C738-Y740 PolarHBondContact O-N 3.14Å; C738-D741 WeakPolarHBondContact O-CA 3.23Å; C738-D741 PolarHBondContact O-N 3.18Å; C738-Y742 PolarHBondContact O-N 3.43Å; C738-Y742 VanDerWaalsContact O-N 3.08Å
739	E	59.7	Low	49.3	Very low	134 Å²	134	105.7 Å²	105.7	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-52	-26.7	-172.1	-156	-164.3	140.7	0	0	111.8	V737 K743	V737-E739 PolarHBondContact O-N 2.87Å; E739-K743 WeakPolarHBondContact O-CB 3.41Å; E739-K743 VanDerWaalsContact O-CG 3.3Å; E739-K743 WeakPolarHBondContact O-CG 3.21Å; E739-K743 PolarHBondContact O-N 3.2Å; E739-K743 WeakPolarHBondContact OE1-CE 3.48Å; E739-K743 IonicContact OE1-NZ 2.73Å; E739-K743 PolarHBondContact OE1-NZ 3.44Å
740	Y	62.9	Low	50.9	Low	155 Å²	155	103.2 Å²	103.2	61%	0.608	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-50.9	168.8	-171	-97.4	0	0	0	115	C738 Y742 K743 Q744	C738-Y740 CarbonylContact O-C 3.58Å; C738-Y740 PolarHBondContact O-N 3.14Å; Y740-Y742 VanDerWaalsContact C-N 3.32Å; Y740-Y742 PolarHBondContact O-N 2.79Å; Y740-K743 PolarHBondContact O-N 2.86Å; Y740-Q744 HydrophobicContact CE1-CG 4.11Å; Y740-Q744 VanDerWaalsContact CE1-NE2 3.26Å; Y740-Q744 PolarHBondContact O-N 3.49Å; Y740-Q744 PolarHBondContact OH-NE2 3.18Å
741	D	58.6	Low	52.5	Low	78 Å²	78	103.8 Å²	103.8	42%	0.417	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-38.1	178.4	-69	-27.2	0	0	0	111	V737 C738 Q744 I745	V737-D741 HydrophobicContact CG1-CB 3.58Å; C738-D741 WeakPolarHBondContact O-CA 3.23Å; C738-D741 PolarHBondContact O-N 3.18Å; D741-Q744 PolarHBondContact O-N 3.32Å; D741-I745 WeakPolarHBondContact O-CB 3.24Å; D741-I745 VanDerWaalsContact O-CG1 3.26Å; D741-I745 WeakPolarHBondContact O-CG1 3.45Å; D741-I745 PolarHBondContact O-N 2.95Å
742	Y	54.4	Low	53.7	Low	41 Å²	41	102 Å²	102	16%	0.161	51%	0.509	C	S	.	.	H	α-helix	trans	-62.7	-45.4	174.1	177.9	-96.4	0	0	0	110.8	E355 L358 C738 Y740 Q744 I745 N746	E355-Y742 WeakPolarHBondContact CB-OH 3.43Å; E355-Y742 VanDerWaalsContact CD-OH 3.31Å; E355-Y742 WeakPolarHBondContact CG-OH 3.3Å; L358-Y742 HydrophobicContact CB-CE2 4.38Å; L358-Y742 HydrophobicContact CD1-CE2 4.03Å; C738-Y742 PolarHBondContact O-N 3.43Å; C738-Y742 VanDerWaalsContact O-N 3.08Å; Y740-Y742 VanDerWaalsContact C-N 3.32Å; Y740-Y742 PolarHBondContact O-N 2.79Å; Y742-Q744 VanDerWaalsContact C-N 3.33Å; Y742-Q744 PolarHBondContact O-N 3.03Å; Y742-I745 PolarHBondContact O-N 2.96Å; Y742-N746 HydrophobicContact CE1-CB 4.34Å; Y742-N746 VanDerWaalsContact O-CB 3.23Å; Y742-N746 WeakPolarHBondContact O-CB 3.46Å; Y742-N746 PolarHBondContact O-N 3.01Å; Y742-N746 PolarHBondContact OH-ND2 2.98Å
743	K	67.7	Low	54.3	Low	116 Å²	116	98.5 Å²	98.5	50%	0.504	49%	0.49	S	S	.	.	H	α-helix	trans	-59	-43.3	174.8	-79.2	171.8	-173	162.6	0	111.4	E739 Y740 N746 T747	E739-K743 WeakPolarHBondContact O-CB 3.41Å; E739-K743 VanDerWaalsContact O-CG 3.3Å; E739-K743 WeakPolarHBondContact O-CG 3.21Å; E739-K743 PolarHBondContact O-N 3.2Å; E739-K743 WeakPolarHBondContact OE1-CE 3.48Å; E739-K743 IonicContact OE1-NZ 2.73Å; E739-K743 PolarHBondContact OE1-NZ 3.44Å; Y740-K743 PolarHBondContact O-N 2.86Å; K743-N746 PolarHBondContact O-N 2.83Å; K743-T747 WeakPolarHBondContact O-CB 3.27Å; K743-T747 WeakPolarHBondContact O-CG2 3.3Å; K743-T747 PolarHBondContact O-N 3.45Å; K743-T747 PolarHBondContact O-OG1 3.25Å
744	Q	69.7	Low	55.4	Low	81 Å²	81	99.8 Å²	99.8	38%	0.379	49%	0.488	S	S	.	.	H	α-helix	trans	-66.4	-40.2	177.2	-75.5	-147.2	8.4	0	0	113.9	Y740 D741 Y742 T747 K748	Y740-Q744 HydrophobicContact CE1-CG 4.11Å; Y740-Q744 VanDerWaalsContact CE1-NE2 3.26Å; Y740-Q744 PolarHBondContact O-N 3.49Å; Y740-Q744 PolarHBondContact OH-NE2 3.18Å; D741-Q744 PolarHBondContact O-N 3.32Å; Y742-Q744 VanDerWaalsContact C-N 3.33Å; Y742-Q744 PolarHBondContact O-N 3.03Å; Q744-T747 WeakPolarHBondContact CA-OG1 3.44Å; Q744-T747 PolarHBondContact O-OG1 3.47Å; Q744-K748 WeakPolarHBondContact O-CB 3.44Å; Q744-K748 PolarHBondContact O-N 3.09Å
745	I	59.8	Low	56.2	Low	86 Å²	86	101.7 Å²	101.7	44%	0.441	49%	0.491	S	S	.	.	H	α-helix	trans	-67.1	-44.4	176.8	-68.8	166.1	0	0	0	109.4	V737 D741 Y742 K748 I749	V737-I745 HydrophobicContact CG1-CD1 4.49Å; D741-I745 WeakPolarHBondContact O-CB 3.24Å; D741-I745 VanDerWaalsContact O-CG1 3.26Å; D741-I745 WeakPolarHBondContact O-CG1 3.45Å; D741-I745 PolarHBondContact O-N 2.95Å; Y742-I745 PolarHBondContact O-N 2.96Å; I745-K748 PolarHBondContact O-N 2.87Å; I745-I749 HydrophobicContact CG2-CD1 3.75Å; I745-I749 HydrophobicContact CG2-CG1 4.37Å; I745-I749 VanDerWaalsContact O-CG1 3.28Å; I745-I749 WeakPolarHBondContact O-CG1 3.18Å; I745-I749 PolarHBondContact O-N 3.3Å
746	N	63.8	Low	56.4	Low	43 Å²	43	101.2 Å²	101.2	23%	0.23	48%	0.484	C	S	.	.	H	α-helix	trans	-67.6	-38.6	-179.8	-159.6	7.3	0	0	0	111.7	Y742 K743 I749 K750	Y742-N746 HydrophobicContact CE1-CB 4.34Å; Y742-N746 VanDerWaalsContact O-CB 3.23Å; Y742-N746 WeakPolarHBondContact O-CB 3.46Å; Y742-N746 PolarHBondContact O-N 3.01Å; Y742-N746 PolarHBondContact OH-ND2 2.98Å; K743-N746 PolarHBondContact O-N 2.83Å; N746-I749 PolarHBondContact O-N 3.12Å; N746-K750 WeakPolarHBondContact O-CB 3.38Å; N746-K750 WeakPolarHBondContact O-CG 3.32Å; N746-K750 PolarHBondContact O-N 3.39Å
747	T	75.3	Confident	56.3	Low	76 Å²	76	100 Å²	100	47%	0.466	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-42.8	171.6	51.6	0	0	0	0	111.6	K743 Q744 I749 K750 E751	K743-T747 WeakPolarHBondContact O-CB 3.27Å; K743-T747 WeakPolarHBondContact O-CG2 3.3Å; K743-T747 PolarHBondContact O-N 3.45Å; K743-T747 PolarHBondContact O-OG1 3.25Å; Q744-T747 WeakPolarHBondContact CA-OG1 3.44Å; Q744-T747 PolarHBondContact O-OG1 3.47Å; T747-I749 PolarHBondContact O-N 2.93Å; T747-K750 PolarHBondContact O-N 3.4Å; T747-E751 WeakPolarHBondContact O-CB 3.38Å; T747-E751 WeakPolarHBondContact O-CG 3.05Å; T747-E751 PolarHBondContact O-N 3.39Å
748	K	66.6	Low	56	Low	124 Å²	124	101.1 Å²	101.1	54%	0.539	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-40.3	174	-82.9	-178.6	177.8	173.9	0	112.7	Q744 I745 E751 I752	Q744-K748 WeakPolarHBondContact O-CB 3.44Å; Q744-K748 PolarHBondContact O-N 3.09Å; I745-K748 PolarHBondContact O-N 2.87Å; K748-E751 PolarHBondContact O-N 3.14Å; K748-I752 WeakPolarHBondContact O-CB 3.35Å; K748-I752 WeakPolarHBondContact O-CD1 3.45Å; K748-I752 WeakPolarHBondContact O-CG1 3.34Å; K748-I752 PolarHBondContact O-N 3.02Å
749	I	55.5	Low	55.7	Low	53 Å²	53	109 Å²	109	27%	0.272	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-44.3	175.5	-70.2	168	0	0	0	110.1	I745 N746 T747 I752 R753	I745-I749 HydrophobicContact CG2-CD1 3.75Å; I745-I749 HydrophobicContact CG2-CG1 4.37Å; I745-I749 VanDerWaalsContact O-CG1 3.28Å; I745-I749 WeakPolarHBondContact O-CG1 3.18Å; I745-I749 PolarHBondContact O-N 3.3Å; N746-I749 PolarHBondContact O-N 3.12Å; T747-I749 PolarHBondContact O-N 2.93Å; I749-I752 PolarHBondContact O-N 3.32Å; I749-R753 WeakPolarHBondContact O-CB 3.27Å; I749-R753 WeakPolarHBondContact O-CG 3.4Å; I749-R753 PolarHBondContact O-N 3.29Å
750	K	66.2	Low	54.5	Low	92 Å²	92	109.7 Å²	109.7	40%	0.4	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-42.4	174.2	-74.3	-175.5	178.3	-169.9	0	112	N746 T747 R753 Q754	N746-K750 WeakPolarHBondContact O-CB 3.38Å; N746-K750 WeakPolarHBondContact O-CG 3.32Å; N746-K750 PolarHBondContact O-N 3.39Å; T747-K750 PolarHBondContact O-N 3.4Å; K750-R753 PolarHBondContact O-N 3.22Å; K750-Q754 WeakPolarHBondContact O-CB 3.38Å; K750-Q754 VanDerWaalsContact O-CG 3.26Å; K750-Q754 WeakPolarHBondContact O-CG 3.42Å; K750-Q754 PolarHBondContact O-N 3.19Å
751	E	64.7	Low	53.1	Low	92 Å²	92	111.4 Å²	111.4	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-41	174.4	-78.2	178.8	-178.1	0	0	112.1	T747 K748 Q754 R755	T747-E751 WeakPolarHBondContact O-CB 3.38Å; T747-E751 WeakPolarHBondContact O-CG 3.05Å; T747-E751 PolarHBondContact O-N 3.39Å; K748-E751 PolarHBondContact O-N 3.14Å; E751-Q754 PolarHBondContact O-N 3.3Å; E751-R755 WeakPolarHBondContact O-CB 3.42Å; E751-R755 VanDerWaalsContact O-CG 3.25Å; E751-R755 WeakPolarHBondContact O-CG 3.38Å; E751-R755 PolarHBondContact O-N 3.44Å
752	I	51.4	Low	51.9	Low	95 Å²	95	115.2 Å²	115.2	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-44	175.7	-70	162.6	0	0	0	110	K748 I749 Q754 R755 N756	K748-I752 WeakPolarHBondContact O-CB 3.35Å; K748-I752 WeakPolarHBondContact O-CD1 3.45Å; K748-I752 WeakPolarHBondContact O-CG1 3.34Å; K748-I752 PolarHBondContact O-N 3.02Å; I749-I752 PolarHBondContact O-N 3.32Å; I752-Q754 VanDerWaalsContact C-N 3.35Å; I752-Q754 PolarHBondContact O-N 3.34Å; I752-R755 PolarHBondContact O-N 2.87Å; I752-N756 VanDerWaalsContact O-CB 3.26Å; I752-N756 WeakPolarHBondContact O-CB 3.42Å; I752-N756 PolarHBondContact O-N 3.42Å
753	R	44.1	Very low	50.9	Low	94 Å²	94	122.1 Å²	122.1	36%	0.355	56%	0.563	S	S	.	*	H	α-helix	trans	-63.5	-39.9	176.3	-74.4	177.2	174.5	-165.8	-6	112.2	E351 I749 K750	E351-R753 IonicContact OE1-NH1 3.43Å; E351-R753 PolarHBondContact OE1-NH1 3.47Å; E351-R753 VanDerWaalsContact OE1-NH1 3.12Å; I749-R753 WeakPolarHBondContact O-CB 3.27Å; I749-R753 WeakPolarHBondContact O-CG 3.4Å; I749-R753 PolarHBondContact O-N 3.29Å; K750-R753 PolarHBondContact O-N 3.22Å
754	Q	51.2	Low	49.4	Very low	149 Å²	149	122.7 Å²	122.7	70%	0.696	58%	0.576	S	S	*	*	H	α-helix	trans	-72.5	-36.6	175.9	-73.8	178.2	-1.1	0	0	112.5	K750 E751 I752	K750-Q754 WeakPolarHBondContact O-CB 3.38Å; K750-Q754 VanDerWaalsContact O-CG 3.26Å; K750-Q754 WeakPolarHBondContact O-CG 3.42Å; K750-Q754 PolarHBondContact O-N 3.19Å; E751-Q754 PolarHBondContact O-N 3.3Å; I752-Q754 VanDerWaalsContact C-N 3.35Å; I752-Q754 PolarHBondContact O-N 3.34Å
755	R	49.4	Very low	47.5	Very low	198 Å²	198	132.4 Å²	132.4	75%	0.747	62%	0.617	S	S	*	*	H	α-helix	trans	-71.7	-30.6	175.6	-78.8	-179.3	-179.2	177.9	4.1	112.5	E751 I752 F757	E751-R755 WeakPolarHBondContact O-CB 3.42Å; E751-R755 VanDerWaalsContact O-CG 3.25Å; E751-R755 WeakPolarHBondContact O-CG 3.38Å; E751-R755 PolarHBondContact O-N 3.44Å; I752-R755 PolarHBondContact O-N 2.87Å; R755-F757 PolarHBondContact O-N 3.26Å
756	N	39	Very low	46.9	Very low	109 Å²	109	134.8 Å²	134.8	58%	0.583	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	0.8	-179.8	-81.3	-1.8	0	0	0	114.6	I752	I752-N756 VanDerWaalsContact O-CB 3.26Å; I752-N756 WeakPolarHBondContact O-CB 3.42Å; I752-N756 PolarHBondContact O-N 3.42Å
757	F	38	Very low	46	Very low	134 Å²	134	139.6 Å²	139.6	59%	0.588	65%	0.647	S	S	*	*			trans	-143.1	91.1	170.7	-75.1	-81.2	0	0	0	112.1	N420 R755 R759	N420-F757 WeakPolarHBondContact ND2-CE1 3.2Å; R755-F757 PolarHBondContact O-N 3.26Å; F757-R759 PolarHBondContact O-N 3.45Å; F757-R759 VanDerWaalsContact O-N 3.14Å
758	P	34.6	Very low	44.4	Very low	93 Å²	93	143.1 Å²	143.1	60%	0.604	66%	0.657	S	S	*	*			trans	-63.4	117.3	158.4	27.4	-29.2	0	0	0	107.6	Q760	P758-Q760 HydrophobicContact CB-CB 4.1Å; P758-Q760 HydrophobicContact CB-CG 4.05Å; P758-Q760 PolarHBondContact O-N 3.39Å
759	R	36.8	Very low	43.1	Very low	246 Å²	246	144.2 Å²	144.2	93%	0.928	66%	0.664	S	S	*	*			trans	-60.5	48.9	162.5	-72.3	-179.6	168	179.5	-4.6	111.6	F757	F757-R759 PolarHBondContact O-N 3.45Å; F757-R759 VanDerWaalsContact O-N 3.14Å
760	Q	34.7	Very low	42.3	Very low	148 Å²	148	149.9 Å²	149.9	69%	0.692	69%	0.689	S	S	*	*			trans	-102.3	10.2	-170.8	-88.5	-170.4	-11.9	0	0	115.2	P758	P758-Q760 HydrophobicContact CB-CB 4.1Å; P758-Q760 HydrophobicContact CB-CG 4.05Å; P758-Q760 PolarHBondContact O-N 3.39Å
761	F	33.2	Very low	40.7	Very low	191 Å²	191	153.8 Å²	153.8	84%	0.838	71%	0.708	S	S	*	*			trans	-131.4	46.4	166.4	-68.7	-77.8	0	0	0	112
762	M	34	Very low	39	Very low	159 Å²	159	158.2 Å²	158.2	78%	0.783	73%	0.728	S	S	*	*	S	Bend	trans	-96.9	93.5	141.2	-79.6	-155.1	177.7	0	0	106.1
763	H	33.5	Very low	38	Very low	186 Å²	186	163.1 Å²	163.1	86%	0.861	75%	0.746	S	S	*	*			trans	155.7	72.6	157.4	-77.8	-44.9	0	0	0	110.4
764	T	35.6	Very low	37.5	Very low	128 Å²	128	168.8 Å²	168.8	79%	0.785	78%	0.779	S	S	*	*			trans	-128.4	119.8	146.2	45.6	0	0	0	0	106.4
765	K	30.2	Very low	36.3	Very low	285 Å²	285	170.6 Å²	170.6	100%	1.239	79%	0.786	S	S	*	*			trans	-40.5	0	-169.4	-77.2	174.3	170.9	177.9	0	116.1

Retrieved 765 of 765 residues in 269.1 ms (Link to these results)

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