A0A3Q0KE07_SCHMA Loading...

BSD domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KE07, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 691 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	46	Very low	48.8	Very low	210 Å²	210	106.1 Å²	106.1	100%	1.034	56%	0.561	S	S	*	*				0	-46	0	-79	175.1	177.7	0	0	112.1	K3 G4 Y5	M1-K3 PolarHBondContact O-N 3.46Å; M1-G4 WeakPolarHBondContact O-CA 3.22Å; M1-G4 PolarHBondContact O-N 3.18Å; M1-Y5 PolarHBondContact O-N 3.35Å
2	L	39.3	Very low	48.2	Very low	86 Å²	86	106.6 Å²	106.6	45%	0.45	56%	0.563	S	S	.	*	H	α-helix	trans	-52	-41.3	-179.6	-155	74.4	0	0	0	116.1	G4 Y5 L6	L2-G4 VanDerWaalsContact C-N 3.26Å; L2-G4 PolarHBondContact O-N 3.2Å; L2-Y5 PolarHBondContact O-N 3.2Å; L2-Y5 VanDerWaalsContact O-N 3.16Å; L2-L6 HydrophobicContact CG-CD1 4.22Å; L2-L6 PolarHBondContact O-N 3.36Å
3	K	37.6	Very low	47.9	Very low	191 Å²	191	103.8 Å²	103.8	83%	0.83	55%	0.553	S	S	*	*	H	α-helix	trans	-61	-31.5	173.8	-90.9	-175.7	176	177.8	0	113.7	M1 K7	M1-K3 PolarHBondContact O-N 3.46Å; K3-K7 WeakPolarHBondContact O-CB 3.29Å; K3-K7 PolarHBondContact O-N 3.47Å
4	G	53.9	Low	47.3	Very low	53 Å²	53	103.4 Å²	103.4	55%	0.546	55%	0.55	S	S	.	*	H	α-helix	trans	-75.5	-36.7	175	0	0	0	0	0	112	M1 L2 G8	M1-G4 WeakPolarHBondContact O-CA 3.22Å; M1-G4 PolarHBondContact O-N 3.18Å; L2-G4 VanDerWaalsContact C-N 3.26Å; L2-G4 PolarHBondContact O-N 3.2Å; G4-G8 PolarHBondContact O-N 3.48Å
5	Y	44.3	Very low	47	Very low	129 Å²	129	104.4 Å²	104.4	51%	0.506	56%	0.556	S	S	.	*	H	α-helix	trans	-68.1	-46.9	176.8	-165.2	-100.9	0	0	0	111.9	M1 L2 K7 G8 V9	M1-Y5 PolarHBondContact O-N 3.35Å; L2-Y5 PolarHBondContact O-N 3.2Å; L2-Y5 VanDerWaalsContact O-N 3.16Å; Y5-K7 VanDerWaalsContact C-N 3.32Å; Y5-K7 PolarHBondContact O-N 2.95Å; Y5-G8 PolarHBondContact O-N 3.36Å; Y5-G8 VanDerWaalsContact O-N 3.09Å; Y5-V9 HydrophobicContact CD1-CG2 4.19Å; Y5-V9 HydrophobicContact CE1-CG2 4.01Å; Y5-V9 WeakPolarHBondContact O-CG2 3.46Å; Y5-V9 PolarHBondContact O-N 3.45Å
6	L	53	Low	46.3	Very low	102 Å²	102	106.2 Å²	106.2	53%	0.534	57%	0.565	S	S	.	*	H	α-helix	trans	-61.9	-38.1	175.4	-77.9	160	0	0	0	112.3	L2 V9 V10	L2-L6 HydrophobicContact CG-CD1 4.22Å; L2-L6 PolarHBondContact O-N 3.36Å; L6-V9 PolarHBondContact O-N 3.46Å; L6-V10 VanDerWaalsContact O-CG2 3.27Å; L6-V10 WeakPolarHBondContact O-CG2 3.37Å; L6-V10 PolarHBondContact O-N 2.77Å
7	K	57.4	Low	45.7	Very low	138 Å²	138	106.4 Å²	106.4	60%	0.6	57%	0.571	S	S	*	*	H	α-helix	trans	-61.1	-45.4	171.6	-175	93.6	-177.3	-177.3	0	111.2	K3 Y5 V10 D11	K3-K7 WeakPolarHBondContact O-CB 3.29Å; K3-K7 PolarHBondContact O-N 3.47Å; Y5-K7 VanDerWaalsContact C-N 3.32Å; Y5-K7 PolarHBondContact O-N 2.95Å; K7-V10 PolarHBondContact O-N 3.29Å; K7-D11 WeakPolarHBondContact O-CB 3.5Å; K7-D11 VanDerWaalsContact O-CG 3.3Å; K7-D11 PolarHBondContact O-N 2.83Å
8	G	45.6	Very low	44.9	Very low	37 Å²	37	109.4 Å²	109.4	38%	0.381	58%	0.581	S	S	.	*	H	α-helix	trans	-64.1	-37.9	178.4	0	0	0	0	0	113.8	G4 Y5 L12	G4-G8 PolarHBondContact O-N 3.48Å; Y5-G8 PolarHBondContact O-N 3.36Å; Y5-G8 VanDerWaalsContact O-N 3.09Å; G8-L12 VanDerWaalsContact O-CB 3.31Å; G8-L12 WeakPolarHBondContact O-CB 3.46Å; G8-L12 PolarHBondContact O-N 3.35Å
9	V	52.8	Low	44.3	Very low	66 Å²	66	109.7 Å²	109.7	40%	0.4	59%	0.59	S	S	.	*	H	α-helix	trans	-70	-40.7	176.2	175.3	0	0	0	0	111.3	Y5 L6 L12 V13	Y5-V9 HydrophobicContact CD1-CG2 4.19Å; Y5-V9 HydrophobicContact CE1-CG2 4.01Å; Y5-V9 WeakPolarHBondContact O-CG2 3.46Å; Y5-V9 PolarHBondContact O-N 3.45Å; L6-V9 PolarHBondContact O-N 3.46Å; V9-L12 PolarHBondContact O-N 3.05Å; V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.29Å; V9-V13 PolarHBondContact O-N 3.49Å
10	V	53.2	Low	43.8	Very low	81 Å²	81	109.2 Å²	109.2	49%	0.491	60%	0.602	S	S	.	*	H	α-helix	trans	-64.8	-42.7	175.2	171.4	0	0	0	0	111.2	L6 K7 L12 V13 N14	L6-V10 VanDerWaalsContact O-CG2 3.27Å; L6-V10 WeakPolarHBondContact O-CG2 3.37Å; L6-V10 PolarHBondContact O-N 2.77Å; K7-V10 PolarHBondContact O-N 3.29Å; V10-L12 VanDerWaalsContact C-N 3.34Å; V10-L12 PolarHBondContact O-N 3.44Å; V10-V13 PolarHBondContact O-N 3.02Å; V10-N14 WeakPolarHBondContact O-CB 2.77Å; V10-N14 PolarHBondContact O-N 3.47Å; V10-N14 PolarHBondContact O-ND2 3.06Å; V10-N14 VanDerWaalsContact O-ND2 3.14Å
11	D	53.7	Low	43.1	Very low	74 Å²	74	111.5 Å²	111.5	40%	0.396	61%	0.613	S	S	.	*	H	α-helix	trans	-67.3	-34	176.8	-69.5	-20.2	0	0	0	111.7	K7 N15	K7-D11 WeakPolarHBondContact O-CB 3.5Å; K7-D11 VanDerWaalsContact O-CG 3.3Å; K7-D11 PolarHBondContact O-N 2.83Å; D11-N15 WeakPolarHBondContact O-CB 3.41Å; D11-N15 PolarHBondContact O-N 3.25Å; D11-N15 PolarHBondContact O-ND2 2.9Å
12	L	42.1	Very low	42.7	Very low	112 Å²	112	107 Å²	107	59%	0.586	60%	0.602	S	S	*	*	H	α-helix	trans	-69	-42.4	175.6	-168.6	73.3	0	0	0	112.2	G8 V9 V10 N15 L16	G8-L12 VanDerWaalsContact O-CB 3.31Å; G8-L12 WeakPolarHBondContact O-CB 3.46Å; G8-L12 PolarHBondContact O-N 3.35Å; V9-L12 PolarHBondContact O-N 3.05Å; V10-L12 VanDerWaalsContact C-N 3.34Å; V10-L12 PolarHBondContact O-N 3.44Å; L12-N15 PolarHBondContact O-N 3.09Å; L12-L16 HydrophobicContact CG-CD1 4.16Å; L12-L16 WeakPolarHBondContact O-CB 3.38Å; L12-L16 WeakPolarHBondContact O-CD1 3.46Å; L12-L16 WeakPolarHBondContact O-CG 3.36Å; L12-L16 PolarHBondContact O-N 2.92Å
13	V	44.4	Very low	42.3	Very low	71 Å²	71	107.3 Å²	107.3	43%	0.43	62%	0.617	S	S	.	*	H	α-helix	trans	-66.6	-38.4	176.3	172.2	0	0	0	0	111	V9 V10 L16 T17	V9-V13 VanDerWaalsContact O-CG2 3.3Å; V9-V13 WeakPolarHBondContact O-CG2 3.29Å; V9-V13 PolarHBondContact O-N 3.49Å; V10-V13 PolarHBondContact O-N 3.02Å; V13-L16 PolarHBondContact O-N 3.39Å; V13-T17 PolarHBondContact O-OG1 3.16Å
14	N	39.3	Very low	42.3	Very low	97 Å²	97	108 Å²	108	52%	0.519	62%	0.623	S	S	.	*	H	α-helix	trans	-68	-36.1	175.8	-70.8	-25.5	0	0	0	112.5	V10 T17	V10-N14 WeakPolarHBondContact O-CB 2.77Å; V10-N14 PolarHBondContact O-N 3.47Å; V10-N14 PolarHBondContact O-ND2 3.06Å; V10-N14 VanDerWaalsContact O-ND2 3.14Å; N14-T17 PolarHBondContact O-N 3.1Å
15	N	42.3	Very low	41.2	Very low	119 Å²	119	112.1 Å²	112.1	64%	0.636	63%	0.633	S	S	*	*	H	α-helix	trans	-78.9	-17.2	177	-70.4	-34.9	0	0	0	113.9	D11 L12 T17	D11-N15 WeakPolarHBondContact O-CB 3.41Å; D11-N15 PolarHBondContact O-N 3.25Å; D11-N15 PolarHBondContact O-ND2 2.9Å; L12-N15 PolarHBondContact O-N 3.09Å; N15-T17 VanDerWaalsContact C-N 3.25Å
16	L	36.8	Very low	40.7	Very low	133 Å²	133	114.6 Å²	114.6	70%	0.696	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-6.7	172.1	-80.4	160.1	0	0	0	113.1	L12 V13	L12-L16 HydrophobicContact CG-CD1 4.16Å; L12-L16 WeakPolarHBondContact O-CB 3.38Å; L12-L16 WeakPolarHBondContact O-CD1 3.46Å; L12-L16 WeakPolarHBondContact O-CG 3.36Å; L12-L16 PolarHBondContact O-N 2.92Å; V13-L16 PolarHBondContact O-N 3.39Å
17	T	36.2	Very low	39.8	Very low	110 Å²	110	117.6 Å²	117.6	68%	0.675	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	5	-176.1	-45.3	0	0	0	0	113	V13 N14 N15	V13-T17 PolarHBondContact O-OG1 3.16Å; N14-T17 PolarHBondContact O-N 3.1Å; N15-T17 VanDerWaalsContact C-N 3.25Å
18	E	31	Very low	38.8	Very low	160 Å²	160	115.9 Å²	115.9	75%	0.748	68%	0.676	S	S	*	*	S	Bend	trans	-101.2	116.8	169.2	-82.2	-170.6	157.3	0	0	111.1	A20	E18-A20 PolarHBondContact O-N 3.21Å
19	P	32.3	Very low	38.3	Very low	116 Å²	116	121 Å²	121	75%	0.753	69%	0.694	S	S	*	*			trans	-73	111.9	171.8	28.2	-30.2	0	0	0	109.7	D21	P19-D21 PolarHBondContact O-N 2.83Å
20	A	34.5	Very low	37.6	Very low	99 Å²	99	125.1 Å²	125.1	82%	0.818	71%	0.714	S	S	*	*			trans	-72	93.5	167.8	0	0	0	0	0	109.8	E18 S22	E18-A20 PolarHBondContact O-N 3.21Å; A20-S22 PolarHBondContact O-N 2.9Å
21	D	30.1	Very low	36.8	Very low	158 Å²	158	128.8 Å²	128.8	85%	0.845	73%	0.731	S	S	*	*			trans	-61.4	108.6	163.6	-82.2	-33.5	0	0	0	110.1	P19	P19-D21 PolarHBondContact O-N 2.83Å
22	S	36.9	Very low	36	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	75%	0.747	S	S	*	*			trans	-160.9	112.2	143.7	40.5	0	0	0	0	110.8	A20	A20-S22 PolarHBondContact O-N 2.9Å
23	A	31.9	Very low	35.7	Very low	92 Å²	92	132.9 Å²	132.9	76%	0.76	76%	0.76	S	S	*	*			trans	-65	147.9	178.2	0	0	0	0	0	112.9
24	E	36.1	Very low	35.3	Very low	205 Å²	205	135.4 Å²	135.4	96%	0.958	78%	0.775	S	S	*	*				-153.8	134.3	129.7	-109.7	175.5	-159.8	0	0	109.9
25	N	31.5	Very low	35	Very low	141 Å²	141	138.9 Å²	138.9	75%	0.754	79%	0.793	S	S	*	*			trans	-128.7	121.7	-151.8	-179.8	15.7	0	0	0	107
26	L	34.7	Very low	34.6	Very low	180 Å²	180	136.5 Å²	136.5	94%	0.942	80%	0.797	S	S	*	*			trans	-154.1	107.5	160.9	-75.1	-176.9	0	0	0	110
27	N	32.3	Very low	34.5	Very low	166 Å²	166	139.9 Å²	139.9	89%	0.888	81%	0.809	S	S	*	*			trans	-133	135.6	164.7	-129.4	9.8	0	0	0	108.5
28	S	37.2	Very low	34.4	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	81%	0.81	S	S	*	*			trans	-157.7	143.2	172.5	55.8	0	0	0	0	105.1
29	D	35.8	Very low	34.7	Very low	144 Å²	144	141.5 Å²	141.5	77%	0.77	82%	0.817	S	S	*	*			cis	-172.2	169.4	-5.3	-108.7	-34.5	0	0	0	104.2
30	D	37.8	Very low	34.9	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	81%	0.814	S	S	*	*			trans	104.4	130.5	149	-65.3	-31.2	0	0	0	123.3
31	N	35.2	Very low	35	Very low	157 Å²	157	145.3 Å²	145.3	84%	0.84	81%	0.809	S	S	*	*			trans	-86.1	168.1	-170.7	-66.7	-66.1	0	0	0	114.2
32	A	37.6	Very low	35.1	Very low	88 Å²	88	146.1 Å²	146.1	73%	0.727	81%	0.808	S	S	*	*				164.4	140.4	116	0	0	0	0	0	116.1
33	E	36.4	Very low	35.1	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	81%	0.808	S	S	*	*			trans	64	128.8	146.7	-68.9	-179.1	153.8	0	0	121.8
34	V	35.2	Very low	35	Very low	125 Å²	125	150.2 Å²	150.2	76%	0.758	81%	0.809	S	S	*	*			cis	101.3	115	23.7	174.5	0	0	0	0	115.1
35	L	32.9	Very low	35.1	Very low	170 Å²	170	146.1 Å²	146.1	89%	0.89	80%	0.797	S	S	*	*			trans	91.5	137.5	145.9	-73.6	166.8	0	0	0	125.3
36	G	34.8	Very low	35	Very low	69 Å²	69	146.1 Å²	146.1	71%	0.711	80%	0.797	S	S	*	*			trans	142.1	79.5	150.1	0	0	0	0	0	114.9
37	E	34	Very low	35	Very low	204 Å²	204	142 Å²	142	95%	0.953	78%	0.783	S	S	*	*				60.4	127.5	92.7	-88.8	-159.3	151.7	0	0	119.8
38	G	33.6	Very low	35.1	Very low	68 Å²	68	141.1 Å²	141.1	70%	0.701	78%	0.779	S	S	*	*			trans	147.1	92.3	155.5	0	0	0	0	0	114.9
39	R	37.1	Very low	34.9	Very low	235 Å²	235	144.8 Å²	144.8	89%	0.887	78%	0.784	S	S	*	*				61	138.9	96.9	-85.6	-174.7	179.4	168	2.9	114.6
40	K	36.4	Very low	34.9	Very low	158 Å²	158	143.2 Å²	143.2	69%	0.687	78%	0.782	S	S	*	*			cis	177	140.3	2.4	-133.9	-178.8	-175.1	-171.2	0	105.6
41	D	36.9	Very low	34.7	Very low	137 Å²	137	139 Å²	139	73%	0.733	78%	0.775	S	S	*	*				141.4	116.6	119	-70.5	-30.6	0	0	0	106.4
42	Q	33.7	Very low	34.3	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	77%	0.774	S	S	*	*				68.9	132.3	66.8	-71.9	-158.5	-12.3	0	0	118.1
43	N	36.4	Very low	34.1	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	78%	0.781	S	S	*	*			trans	104.4	103.9	169.5	-54.3	-24.9	0	0	0	113.6
44	N	30.3	Very low	33.8	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	78%	0.776	S	S	*	*				55.7	113.5	56.7	-159.3	21.5	0	0	0	114.4
45	V	36.4	Very low	33.4	Very low	119 Å²	119	138.2 Å²	138.2	72%	0.721	77%	0.771	S	S	*	*				168.2	125.4	124	160.8	0	0	0	0	110.3
46	N	30.4	Very low	33.2	Very low	140 Å²	140	136.1 Å²	136.1	75%	0.749	77%	0.766	S	S	*	*			trans	-2	172.2	154.7	-64.4	-16.9	0	0	0	123.4
47	S	35.2	Very low	32.8	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	77%	0.77	S	S	*	*			trans	88.8	128.6	157.3	2.3	0	0	0	0	113.2
48	D	33.5	Very low	32.5	Very low	147 Å²	147	134.2 Å²	134.2	79%	0.786	76%	0.758	S	S	*	*			cis	-162.4	134.3	24.9	-77.6	-52.2	0	0	0	111
49	E	32.4	Very low	32.1	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	77%	0.765	S	S	*	*				32	174.3	121.7	-120.5	-156.8	156.7	0	0	123.8
50	P	37.6	Very low	31.9	Very low	111 Å²	111	134 Å²	134	72%	0.721	76%	0.762	S	S	*	*				-128	-172.4	-102.9	44.4	-26.1	0	0	0	114.9
51	G	32	Very low	31.3	Very low	64 Å²	64	131.9 Å²	131.9	66%	0.66	77%	0.767	S	S	*	*			trans	168.8	105.6	162.7	0	0	0	0	0	112.1
52	T	27.8	Very low	31.1	Very low	134 Å²	134	131.6 Å²	131.6	82%	0.822	77%	0.77	S	S	*	*				56.7	118.1	87.4	-43.2	0	0	0	0	113.6
53	L	32.8	Very low	30.9	Very low	166 Å²	166	131.5 Å²	131.5	87%	0.869	77%	0.77	S	S	*	*			trans	172.9	96.5	143.5	-88.3	-178.2	0	0	0	105.9
54	D	31.2	Very low	30.4	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	77%	0.771	S	S	*	*				76.5	133.8	76.3	-141.7	-5.7	0	0	0	114.6
55	S	26.2	Very low	30.4	Very low	94 Å²	94	130.5 Å²	130.5	66%	0.657	77%	0.774	S	S	*	*			trans	-35.9	142.1	-176.5	49	0	0	0	0	120
56	V	28.2	Very low	29.9	Very low	127 Å²	127	135 Å²	135	77%	0.77	79%	0.787	S	S	*	*			trans	-152.7	119.7	137.7	-177.1	0	0	0	0	110.3	I58	V56-I58 HydrophobicContact CG1-CD1 4Å; V56-I58 HydrophobicContact CG1-CG1 3.79Å
57	A	26	Very low	29.9	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	79%	0.787	S	S	*	*			trans	-84.2	130.5	161.1	0	0	0	0	0	109.3
58	I	28.5	Very low	29.6	Very low	135 Å²	135	134.5 Å²	134.5	69%	0.692	79%	0.794	S	S	*	*			trans	-127.4	109.2	165.7	-69.6	163.3	0	0	0	107.8	V56 Q60	V56-I58 HydrophobicContact CG1-CD1 4Å; V56-I58 HydrophobicContact CG1-CG1 3.79Å; I58-Q60 HydrophobicContact CG2-CG 3.99Å
59	S	26.2	Very low	29.4	Very low	122 Å²	122	132.4 Å²	132.4	85%	0.853	79%	0.791	S	S	*	*			trans	-73.7	125.3	159.9	-56	0	0	0	0	108.5
60	Q	31.4	Very low	29.3	Very low	176 Å²	176	129 Å²	129	82%	0.822	78%	0.783	S	S	*	*			trans	-131.8	112.9	160.8	-84.9	-177.2	-21.2	0	0	109.1	I58	I58-Q60 HydrophobicContact CG2-CG 3.99Å
61	S	25	Very low	28.9	Very low	115 Å²	115	129.9 Å²	129.9	80%	0.804	78%	0.781	S	S	*	*			trans	-77.6	127.1	164.5	49	0	0	0	0	110.1
62	V	31.8	Very low	28.9	Very low	130 Å²	130	132.4 Å²	132.4	79%	0.788	79%	0.788	S	S	*	*			trans	-148.8	91.4	158.9	-176.4	0	0	0	0	105.5
63	E	30.8	Very low	29	Very low	174 Å²	174	135.8 Å²	135.8	81%	0.813	79%	0.786	S	S	*	*				65.9	103.5	100.4	-69.6	-163.9	165.5	0	0	115
64	N	25.7	Very low	28.8	Very low	155 Å²	155	133 Å²	133	83%	0.829	77%	0.77	S	S	*	*			trans	37.8	107.7	144.3	-60.5	-11.6	0	0	0	119.8
65	S	30.1	Very low	28.8	Very low	118 Å²	118	131 Å²	131	83%	0.825	77%	0.765	S	S	*	*				-152.2	125.3	124.3	-81.1	0	0	0	0	108.6	S67	S65-S67 PolarHBondContact O-N 3.11Å
66	E	26.1	Very low	28.8	Very low	212 Å²	212	133.8 Å²	133.8	99%	0.991	77%	0.773	S	S	*	*			trans	-62.8	93.5	-178	-67.4	169.9	140.5	0	0	110.5
67	S	30.4	Very low	28.8	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	77%	0.766	S	S	*	*			trans	-108.6	112.7	163.9	60.3	0	0	0	0	108.6	S65 S69	S65-S67 PolarHBondContact O-N 3.11Å; S67-S69 PolarHBondContact O-N 3.31Å
68	S	29.1	Very low	29	Very low	116 Å²	116	137.1 Å²	137.1	81%	0.811	77%	0.771	S	S	*	*			trans	-54	132.8	-177	60.4	0	0	0	0	112.3	V70	S68-V70 PolarHBondContact O-N 3.41Å
69	S	27.7	Very low	29.2	Very low	103 Å²	103	135 Å²	135	72%	0.72	77%	0.774	S	S	*	*			trans	-75.3	115.4	-173.4	57.5	0	0	0	0	112.5	S67	S67-S69 PolarHBondContact O-N 3.31Å
70	V	31.9	Very low	29.5	Very low	108 Å²	108	132.8 Å²	132.8	66%	0.655	76%	0.763	S	S	*	*			trans	-122.3	-2.2	169.5	-176.3	0	0	0	0	112.5	S68 W73	S68-V70 PolarHBondContact O-N 3.41Å; V70-W73 PolarHBondContact O-NE1 3.25Å
71	L	28.9	Very low	29.5	Very low	129 Å²	129	133 Å²	133	68%	0.675	77%	0.77	S	S	*	*			trans	-118.5	12.3	-168.1	-61.5	177.2	0	0	0	115.6	W73 I74	L71-W73 PolarHBondContact O-N 2.87Å; L71-W73 VanDerWaalsContact O-N 3.11Å; L71-I74 HydrophobicContact CD2-CD1 4.17Å
72	S	31	Very low	29.9	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	8.8	-177.6	60.4	0	0	0	0	115.5
73	W	29.8	Very low	30.2	Very low	206 Å²	206	132.7 Å²	132.7	78%	0.78	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	3	-175.7	67.1	-72.6	0	0	0	114.6	V70 L71	V70-W73 PolarHBondContact O-NE1 3.25Å; L71-W73 PolarHBondContact O-N 2.87Å; L71-W73 VanDerWaalsContact O-N 3.11Å
74	I	28.4	Very low	30.6	Very low	106 Å²	106	129.9 Å²	129.9	54%	0.544	75%	0.75	S	S	.	*	S	Bend	trans	-82.4	121.7	176.4	-58.6	174.8	0	0	0	109.2	L71 N76	L71-I74 HydrophobicContact CD2-CD1 4.17Å; I74-N76 PolarHBondContact O-N 2.96Å
75	P	31	Very low	31	Very low	102 Å²	102	124.9 Å²	124.9	66%	0.662	73%	0.727	S	S	*	*			trans	-63.2	136.2	175.1	-15.9	28.7	0	0	0	111.1	L77	P75-L77 PolarHBondContact O-N 3.36Å
76	N	26.9	Very low	31.3	Very low	153 Å²	153	123.9 Å²	123.9	82%	0.818	71%	0.712	S	S	*	*			trans	-48.9	94.9	172.9	-87.9	-37	0	0	0	112.4	I74	I74-N76 PolarHBondContact O-N 2.96Å
77	L	28.1	Very low	31.8	Very low	119 Å²	119	119 Å²	119	62%	0.623	69%	0.692	S	S	*	*			trans	-90.7	3.4	176.7	-83.6	161.6	0	0	0	113.7	P75 A79 Y89	P75-L77 PolarHBondContact O-N 3.36Å; L77-A79 VanDerWaalsContact C-N 3.3Å; L77-A79 PolarHBondContact O-N 2.93Å; L77-Y89 HydrophobicContact CD1-CE2 4.38Å; L77-Y89 HydrophobicContact CD2-CD2 4.39Å; L77-Y89 HydrophobicContact CD2-CE2 4.12Å
78	L	31	Very low	32	Very low	175 Å²	175	121.4 Å²	121.4	92%	0.916	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	3.7	-179.6	-89.6	116.3	0	0	0	115.3
79	A	32.8	Very low	32.3	Very low	92 Å²	92	121.8 Å²	121.8	76%	0.76	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-0.9	-167	0	0	0	0	0	116.8	L77	L77-A79 VanDerWaalsContact C-N 3.3Å; L77-A79 PolarHBondContact O-N 2.93Å
80	A	32.4	Very low	32.6	Very low	74 Å²	74	121.3 Å²	121.3	61%	0.612	66%	0.661	S	S	*	*			trans	-109.3	74.8	-173.7	0	0	0	0	0	113.3	G82	A80-G82 PolarHBondContact O-N 3.47Å
81	N	31	Very low	32.9	Very low	180 Å²	180	121.3 Å²	121.3	96%	0.963	66%	0.657	S	S	*	*			trans	-77.1	101.1	164.8	-98.4	-7.1	0	0	0	109.6
82	G	33.5	Very low	33.2	Very low	45 Å²	45	118 Å²	118	46%	0.464	65%	0.645	S	S	.	*	S	Bend	trans	175.2	140.2	171.2	0	0	0	0	0	112.4	A80 N84 S85	A80-G82 PolarHBondContact O-N 3.47Å; G82-N84 PolarHBondContact O-N 3.42Å; G82-S85 WeakPolarHBondContact O-CB 3.36Å; G82-S85 PolarHBondContact O-N 3.21Å; G82-S85 PolarHBondContact O-OG 2.76Å
83	E	37.1	Very low	33.3	Very low	195 Å²	195	114.8 Å²	114.8	91%	0.911	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	2.5	-174.1	-64.6	172.1	158.7	0	0	115.4
84	N	39.2	Very low	33.6	Very low	114 Å²	114	108.6 Å²	108.6	61%	0.61	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-0	173.7	-105.9	-21.7	0	0	0	114.1	G82 I86 L87 F88	G82-N84 PolarHBondContact O-N 3.42Å; N84-I86 VanDerWaalsContact C-N 3.3Å; N84-I86 PolarHBondContact O-N 3.32Å; N84-L87 PolarHBondContact O-N 2.95Å; N84-F88 PolarHBondContact O-N 3.44Å
85	S	34.9	Very low	34	Very low	51 Å²	51	108.6 Å²	108.6	36%	0.357	62%	0.62	S	S	.	*	H	α-helix	trans	-63	-33.2	-176.5	58.9	0	0	0	0	112.9	G82 Y89	G82-S85 WeakPolarHBondContact O-CB 3.36Å; G82-S85 PolarHBondContact O-N 3.21Å; G82-S85 PolarHBondContact O-OG 2.76Å; S85-Y89 WeakPolarHBondContact O-CB 3.32Å; S85-Y89 PolarHBondContact O-N 2.66Å
86	I	35.7	Very low	34	Very low	97 Å²	97	110.3 Å²	110.3	50%	0.497	62%	0.621	S	S	.	*	H	α-helix	trans	-70.2	-42.1	178.9	-63.2	170.5	0	0	0	111.5	N84 Y89 M90	N84-I86 VanDerWaalsContact C-N 3.3Å; N84-I86 PolarHBondContact O-N 3.32Å; I86-Y89 PolarHBondContact O-N 2.93Å; I86-M90 HydrophobicContact CG2-CG 4.3Å; I86-M90 VanDerWaalsContact O-CB 3.29Å; I86-M90 WeakPolarHBondContact O-CB 3.34Å; I86-M90 WeakPolarHBondContact O-CG 3.36Å; I86-M90 PolarHBondContact O-N 2.84Å
87	L	36.9	Very low	34.2	Very low	110 Å²	110	105.9 Å²	105.9	58%	0.576	61%	0.611	S	S	*	*	H	α-helix	trans	-68.6	-38.5	175.9	-90.9	162	0	0	0	111.5	N84 N91	N84-L87 PolarHBondContact O-N 2.95Å; L87-N91 WeakPolarHBondContact O-CB 3.37Å; L87-N91 PolarHBondContact O-N 3.5Å
88	F	35.1	Very low	34.4	Very low	158 Å²	158	107.8 Å²	107.8	69%	0.693	62%	0.621	S	S	*	*	H	α-helix	trans	-64.9	-42.3	173.4	-130	-88.7	0	0	0	111.4	N84 N91 S92	N84-F88 PolarHBondContact O-N 3.44Å; F88-N91 PolarHBondContact O-N 2.84Å; F88-S92 WeakPolarHBondContact O-CB 3.33Å; F88-S92 PolarHBondContact O-N 3.38Å; F88-S92 PolarHBondContact O-OG 3.41Å
89	Y	34.2	Very low	34.3	Very low	125 Å²	125	105.9 Å²	105.9	49%	0.49	61%	0.612	S	S	.	*	H	α-helix	trans	-69.1	-39.9	178.3	-163.6	-102.8	0	0	0	112.6	L77 S85 I86 S92 L93	L77-Y89 HydrophobicContact CD1-CE2 4.38Å; L77-Y89 HydrophobicContact CD2-CD2 4.39Å; L77-Y89 HydrophobicContact CD2-CE2 4.12Å; S85-Y89 WeakPolarHBondContact O-CB 3.32Å; S85-Y89 PolarHBondContact O-N 2.66Å; I86-Y89 PolarHBondContact O-N 2.93Å; Y89-S92 PolarHBondContact O-N 3.49Å; Y89-L93 HydrophobicContact CD1-CD1 3.52Å; Y89-L93 HydrophobicContact CD1-CG 4.35Å; Y89-L93 HydrophobicContact CE1-CD1 3.32Å; Y89-L93 HydrophobicContact CE1-CG 4.23Å; Y89-L93 HydrophobicContact CG-CD1 4.4Å; Y89-L93 VanDerWaalsContact O-CB 3.32Å; Y89-L93 WeakPolarHBondContact O-CB 3.43Å; Y89-L93 VanDerWaalsContact O-CG 3.3Å; Y89-L93 WeakPolarHBondContact O-CG 3.41Å; Y89-L93 PolarHBondContact O-N 3.14Å
90	M	35.4	Very low	34.1	Very low	93 Å²	93	107.2 Å²	107.2	46%	0.458	61%	0.612	S	S	.	*	H	α-helix	trans	-63.8	-41.2	173.6	-73.5	-87	-167.9	0	0	111.6	I86 A94	I86-M90 HydrophobicContact CG2-CG 4.3Å; I86-M90 VanDerWaalsContact O-CB 3.29Å; I86-M90 WeakPolarHBondContact O-CB 3.34Å; I86-M90 WeakPolarHBondContact O-CG 3.36Å; I86-M90 PolarHBondContact O-N 2.84Å; M90-A94 WeakPolarHBondContact O-CB 3.32Å; M90-A94 PolarHBondContact O-N 3.35Å
91	N	36.5	Very low	34.2	Very low	108 Å²	108	108.6 Å²	108.6	58%	0.578	62%	0.618	S	S	*	*	H	α-helix	trans	-72.3	-37.8	175.9	-78.5	-18.9	0	0	0	112.8	L87 F88 L93 A94 S95	L87-N91 WeakPolarHBondContact O-CB 3.37Å; L87-N91 PolarHBondContact O-N 3.5Å; F88-N91 PolarHBondContact O-N 2.84Å; N91-L93 VanDerWaalsContact C-N 3.35Å; N91-A94 PolarHBondContact O-N 2.8Å; N91-S95 WeakPolarHBondContact O-CB 3.38Å; N91-S95 PolarHBondContact O-N 3.31Å
92	S	36.1	Very low	34.2	Very low	60 Å²	60	107.2 Å²	107.2	42%	0.42	61%	0.61	S	S	.	*	H	α-helix	trans	-67.2	-35.4	174.4	-66.2	0	0	0	0	112.1	F88 Y89 S95 M96	F88-S92 WeakPolarHBondContact O-CB 3.33Å; F88-S92 PolarHBondContact O-N 3.38Å; F88-S92 PolarHBondContact O-OG 3.41Å; Y89-S92 PolarHBondContact O-N 3.49Å; S92-S95 CarbonylContact O-C 3.59Å; S92-S95 PolarHBondContact O-N 2.86Å; S92-M96 WeakPolarHBondContact O-CB 3.35Å; S92-M96 PolarHBondContact O-N 3.4Å
93	L	33.5	Very low	34.3	Very low	48 Å²	48	112.9 Å²	112.9	25%	0.251	63%	0.63	S	S	.	*	H	α-helix	trans	-74	-35	173.5	-75.1	170.7	0	0	0	112.7	Y89 N91 S95 M96 R189	Y89-L93 HydrophobicContact CD1-CD1 3.52Å; Y89-L93 HydrophobicContact CD1-CG 4.35Å; Y89-L93 HydrophobicContact CE1-CD1 3.32Å; Y89-L93 HydrophobicContact CE1-CG 4.23Å; Y89-L93 HydrophobicContact CG-CD1 4.4Å; Y89-L93 VanDerWaalsContact O-CB 3.32Å; Y89-L93 WeakPolarHBondContact O-CB 3.43Å; Y89-L93 VanDerWaalsContact O-CG 3.3Å; Y89-L93 WeakPolarHBondContact O-CG 3.41Å; Y89-L93 PolarHBondContact O-N 3.14Å; N91-L93 VanDerWaalsContact C-N 3.35Å; L93-S95 PolarHBondContact O-N 3.29Å; L93-M96 HydrophobicContact CD2-CE 4.18Å; L93-M96 PolarHBondContact O-N 2.87Å; L93-R189 VanDerWaalsContact CB-NH2 3.31Å
94	A	35.6	Very low	34.3	Very low	76 Å²	76	112.2 Å²	112.2	63%	0.628	63%	0.626	S	S	*	*	H	α-helix	trans	-64.7	-30	170.3	0	0	0	0	0	111.8	M90 N91 M96	M90-A94 WeakPolarHBondContact O-CB 3.32Å; M90-A94 PolarHBondContact O-N 3.35Å; N91-A94 PolarHBondContact O-N 2.8Å; A94-M96 VanDerWaalsContact C-N 3.32Å
95	S	36.1	Very low	34	Very low	105 Å²	105	114.5 Å²	114.5	73%	0.734	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-3.4	175.4	-160.3	0	0	0	0	114.2	N91 S92 L93	N91-S95 WeakPolarHBondContact O-CB 3.38Å; N91-S95 PolarHBondContact O-N 3.31Å; S92-S95 CarbonylContact O-C 3.59Å; S92-S95 PolarHBondContact O-N 2.86Å; L93-S95 PolarHBondContact O-N 3.29Å
96	M	32.7	Very low	34.3	Very low	138 Å²	138	121.7 Å²	121.7	68%	0.68	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	8	179.5	-152.9	140.4	65.8	0	0	112.8	S92 L93 A94 I98	S92-M96 WeakPolarHBondContact O-CB 3.35Å; S92-M96 PolarHBondContact O-N 3.4Å; L93-M96 HydrophobicContact CD2-CE 4.18Å; L93-M96 PolarHBondContact O-N 2.87Å; A94-M96 VanDerWaalsContact C-N 3.32Å; M96-I98 PolarHBondContact O-N 3.32Å
97	G	30.7	Very low	34.1	Very low	60 Å²	60	125.9 Å²	125.9	62%	0.619	68%	0.681	S	S	*	*	S	Bend	trans	-56.9	121	167	0	0	0	0	0	110	N99	G97-N99 PolarHBondContact O-N 2.83Å
98	I	32.1	Very low	34	Very low	159 Å²	159	126 Å²	126	82%	0.815	69%	0.686	S	S	*	*			trans	-46.2	110.3	-177.8	-64.6	161.1	0	0	0	109.7	M96 P100	M96-I98 PolarHBondContact O-N 3.32Å; I98-P100 WeakPolarHBondContact O-CD 3.38Å
99	N	28.4	Very low	34	Very low	136 Å²	136	124.9 Å²	124.9	73%	0.727	69%	0.687	S	S	*	*			trans	-56.6	123.9	156.5	-115.3	-27.4	0	0	0	106	G97 S101	G97-N99 PolarHBondContact O-N 2.83Å; N99-S101 PolarHBondContact O-N 3.31Å
100	P	30.1	Very low	33.9	Very low	119 Å²	119	127.6 Å²	127.6	77%	0.773	70%	0.704	S	S	*	*			trans	-67.3	86.2	166.3	28.2	-30.6	0	0	0	107.1	I98 D102	I98-P100 WeakPolarHBondContact O-CD 3.38Å; P100-D102 PolarHBondContact O-N 2.92Å; P100-D102 VanDerWaalsContact O-N 3.12Å
101	S	33.9	Very low	33.9	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	73%	0.726	S	S	*	*			trans	-72.9	102.9	173.8	-78	0	0	0	0	109	N99	N99-S101 PolarHBondContact O-N 3.31Å
102	D	31.1	Very low	33.7	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	74%	0.735	S	S	*	*			trans	28.6	97.7	142.8	-77.8	-30.2	0	0	0	117.9	P100	P100-D102 PolarHBondContact O-N 2.92Å; P100-D102 VanDerWaalsContact O-N 3.12Å
103	D	35.1	Very low	33.7	Very low	164 Å²	164	137.3 Å²	137.3	88%	0.877	75%	0.751	S	S	*	*			trans	-121.3	80.9	144	-95.7	-28.7	0	0	0	108.1
104	H	36	Very low	33.7	Very low	181 Å²	181	143.2 Å²	143.2	84%	0.838	77%	0.774	S	S	*	*			trans	-137.8	80.2	166.1	-100.5	-53.6	0	0	0	111.3	K106	H104-K106 PolarHBondContact O-N 2.65Å
105	D	34.9	Very low	33.3	Very low	163 Å²	163	144.9 Å²	144.9	87%	0.872	78%	0.781	S	S	*	*			trans	-77.1	100.9	156.5	-95.9	-27.1	0	0	0	109.6
106	K	40	Very low	33	Very low	201 Å²	201	147 Å²	147	87%	0.874	78%	0.783	S	S	*	*			trans	176.1	91.5	132.4	-93.5	167.2	-169.2	-177	0	111	H104	H104-K106 PolarHBondContact O-N 2.65Å
107	Q	31	Very low	32.7	Very low	186 Å²	186	145.3 Å²	145.3	87%	0.869	78%	0.781	S	S	*	*			trans	-4.1	122.5	140.7	-144.5	173.3	29.1	0	0	115.8
108	V	35.5	Very low	32.7	Very low	111 Å²	111	148.4 Å²	148.4	67%	0.673	78%	0.782	S	S	*	*				163.9	118.6	114	165.6	0	0	0	0	110.1
109	D	36.2	Very low	32.5	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	78%	0.78	S	S	*	*			trans	65.5	96.6	155.2	-55.4	-17.5	0	0	0	119.8
110	Q	31.6	Very low	32.8	Very low	183 Å²	183	148.3 Å²	148.3	86%	0.855	78%	0.782	S	S	*	*				68	98.5	93.9	-78.5	-169.4	11.2	0	0	113.9
111	E	35.6	Very low	32.6	Very low	195 Å²	195	149.7 Å²	149.7	91%	0.911	78%	0.783	S	S	*	*				-165.1	136.6	113.2	-101.9	175.6	-172.1	0	0	110.8
112	S	32.4	Very low	32.5	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	78%	0.784	S	S	*	*			trans	-75.8	146.1	-162.6	53.1	0	0	0	0	115.1
113	E	35.7	Very low	32.4	Very low	161 Å²	161	148.5 Å²	148.5	75%	0.752	77%	0.774	S	S	*	*			trans	-157.3	107	136.4	-111.1	-179.5	167.3	0	0	115.2
114	K	33.9	Very low	32.1	Very low	171 Å²	171	150.4 Å²	150.4	74%	0.743	78%	0.775	S	S	*	*			trans	56.9	95.2	140.9	-64.3	164.5	-169.5	144.9	0	119.7
115	S	27.6	Very low	31.9	Very low	111 Å²	111	148.7 Å²	148.7	78%	0.776	77%	0.77	S	S	*	*			trans	-60.7	127.9	151	169	0	0	0	0	111.3
116	L	28.9	Very low	31.6	Very low	150 Å²	150	149.2 Å²	149.2	79%	0.785	77%	0.767	S	S	*	*			trans	-105.6	101.6	164.3	-170.9	77.8	0	0	0	108.1	I118	L116-I118 HydrophobicContact CD2-CD1 4.06Å; L116-I118 HydrophobicContact CD2-CG1 4.34Å; L116-I118 HydrophobicContact CG-CD1 4.49Å; L116-I118 HydrophobicContact CG-CG1 4.25Å
117	V	27	Very low	31	Very low	103 Å²	103	146.2 Å²	146.2	62%	0.624	77%	0.766	S	S	*	*			trans	-82.2	120.4	164.1	172.1	0	0	0	0	107.4	T119	V117-T119 HydrophobicContact CG1-CG2 4.09Å
118	I	31.1	Very low	30.9	Very low	124 Å²	124	142.3 Å²	142.3	64%	0.636	76%	0.759	S	S	*	*			trans	-118.7	91.2	156.6	-58.9	177	0	0	0	106.3	L116 E120	L116-I118 HydrophobicContact CD2-CD1 4.06Å; L116-I118 HydrophobicContact CD2-CG1 4.34Å; L116-I118 HydrophobicContact CG-CD1 4.49Å; L116-I118 HydrophobicContact CG-CG1 4.25Å; I118-E120 HydrophobicContact CG2-CB 4.21Å
119	T	26.8	Very low	30.8	Very low	126 Å²	126	145.6 Å²	145.6	77%	0.773	77%	0.767	S	S	*	*			trans	-76.4	109.3	152.5	40.9	0	0	0	0	106.8	V117	V117-T119 HydrophobicContact CG1-CG2 4.09Å
120	E	34.3	Very low	30.4	Very low	167 Å²	167	145 Å²	145	78%	0.78	77%	0.768	S	S	*	*			trans	-106.7	109.2	170.8	-135.3	168.7	-162.6	0	0	108.9	I118 I122	I118-E120 HydrophobicContact CG2-CB 4.21Å; E120-I122 PolarHBondContact O-N 3.36Å
121	D	25.8	Very low	30.3	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	77%	0.77	S	S	*	*			trans	-50.8	116.4	168.2	-95.5	-33.4	0	0	0	110.2
122	I	32	Very low	30	Very low	144 Å²	144	142.6 Å²	142.6	74%	0.738	77%	0.767	S	S	*	*			trans	-110.4	56.2	161.8	-41.5	176.4	0	0	0	108.6	E120 I125	E120-I122 PolarHBondContact O-N 3.36Å; I122-I125 HydrophobicContact CG2-CD1 4.05Å; I122-I125 HydrophobicContact CG2-CG1 4.36Å
123	S	28.5	Very low	30.2	Very low	86 Å²	86	142.7 Å²	142.7	60%	0.601	77%	0.768	S	S	*	*			trans	-109.2	82.8	162	58.5	0	0	0	0	108.8
124	K	29.5	Very low	30	Very low	204 Å²	204	142.4 Å²	142.4	89%	0.887	77%	0.766	S	S	*	*			trans	154.6	81	160.1	-89.7	166.9	-177.6	-177.8	0	109.1
125	I	30.8	Very low	29.9	Very low	145 Å²	145	141.5 Å²	141.5	74%	0.744	77%	0.765	S	S	*	*			trans	-115.4	99.5	152.3	-61.3	177.9	0	0	0	105.5	I122 V127	I122-I125 HydrophobicContact CG2-CD1 4.05Å; I122-I125 HydrophobicContact CG2-CG1 4.36Å; I125-V127 PolarHBondContact O-N 2.91Å
126	E	28.6	Very low	30	Very low	173 Å²	173	143.6 Å²	143.6	81%	0.808	77%	0.767	S	S	*	*			trans	-63	115.7	176.3	-149.7	167.9	-157.7	0	0	108	S128	E126-S128 VanDerWaalsContact C-N 3.32Å; E126-S128 PolarHBondContact O-N 3.24Å
127	V	27.4	Very low	30.3	Very low	139 Å²	139	142 Å²	142	84%	0.842	77%	0.769	S	S	*	*			trans	-67.4	93.8	169.4	177.9	0	0	0	0	106.7	I125 E129	I125-V127 PolarHBondContact O-N 2.91Å; V127-E129 PolarHBondContact O-N 3.34Å
128	S	30.3	Very low	30.3	Very low	104 Å²	104	148.7 Å²	148.7	73%	0.727	78%	0.783	S	S	*	*			trans	-81.3	111.3	173.1	-83.4	0	0	0	0	110.2	E126	E126-S128 VanDerWaalsContact C-N 3.32Å; E126-S128 PolarHBondContact O-N 3.24Å
129	E	32.8	Very low	30.2	Very low	180 Å²	180	150.7 Å²	150.7	84%	0.841	79%	0.794	S	S	*	*			trans	-53.3	134.8	168.8	-74.7	174.9	130.2	0	0	112.7	V127	V127-E129 PolarHBondContact O-N 3.34Å
130	V	27.1	Very low	30.2	Very low	122 Å²	122	152.6 Å²	152.6	74%	0.739	80%	0.796	S	S	*	*			trans	-0.9	119.8	146.9	-175.7	0	0	0	0	116	K132	V130-K132 HydrophobicContact CG1-CG 4.5Å
131	C	30.7	Very low	30.1	Very low	135 Å²	135	151 Å²	151	91%	0.912	80%	0.798	S	S	*	*			trans	-133.6	132.7	149.5	-108.8	0	0	0	0	112.2
132	K	28.1	Very low	30.3	Very low	192 Å²	192	153.7 Å²	153.7	84%	0.835	80%	0.797	S	S	*	*			trans	-84.7	135.2	-172.8	-61.6	164.1	175.3	172.3	0	111	V130	V130-K132 HydrophobicContact CG1-CG 4.5Å
133	S	36.8	Very low	30.2	Very low	112 Å²	112	152.1 Å²	152.1	78%	0.783	79%	0.79	S	S	*	*			trans	176.9	100	145.1	52.9	0	0	0	0	107.4
134	Q	31.8	Very low	30.5	Very low	155 Å²	155	155.6 Å²	155.6	72%	0.724	80%	0.8	S	S	*	*				72.5	110.9	83.9	-169.2	169.3	-24	0	0	113.8
135	E	32.5	Very low	30.7	Very low	152 Å²	152	150.9 Å²	150.9	71%	0.71	78%	0.784	S	S	*	*			trans	88.1	111.8	147.3	-80.8	159.2	-173.9	0	0	122.3
136	D	28.3	Very low	30.8	Very low	154 Å²	154	146.9 Å²	146.9	82%	0.824	77%	0.769	S	S	*	*				70.7	88.3	128.8	-81.6	-11.5	0	0	0	120.1
137	S	35.4	Very low	30.9	Very low	117 Å²	117	143.5 Å²	143.5	82%	0.818	76%	0.756	S	S	*	*				-159.4	108.8	128.3	53.1	0	0	0	0	111.5	L139	S137-L139 PolarHBondContact O-N 3.08Å
138	R	27.1	Very low	31.2	Very low	244 Å²	244	144 Å²	144	92%	0.921	74%	0.743	S	S	*	*			trans	-13.4	116.1	156.3	-62.7	168.7	177.1	178	-2.8	114.9
139	L	30.6	Very low	31.5	Very low	166 Å²	166	142.6 Å²	142.6	87%	0.869	73%	0.73	S	S	*	*			trans	-169.4	133.2	133	-100.2	163.3	0	0	0	108.6	S137 T141	S137-L139 PolarHBondContact O-N 3.08Å; L139-T141 PolarHBondContact O-N 3.36Å; L139-T141 VanDerWaalsContact O-N 3.07Å
140	M	25.6	Very low	31.4	Very low	165 Å²	165	140.4 Å²	140.4	81%	0.813	72%	0.724	S	S	*	*			trans	-61.2	104.4	174.7	-91.7	-147.6	174.3	0	0	110.6
141	T	31.6	Very low	31.6	Very low	134 Å²	134	144.2 Å²	144.2	82%	0.822	73%	0.725	S	S	*	*			trans	-117.1	77.4	152.4	24.5	0	0	0	0	106.7	L139 N143	L139-T141 PolarHBondContact O-N 3.36Å; L139-T141 VanDerWaalsContact O-N 3.07Å; T141-N143 PolarHBondContact O-N 3.26Å
142	R	31	Very low	31.4	Very low	205 Å²	205	145 Å²	145	77%	0.774	71%	0.713	S	S	*	*			trans	-61.3	113.9	165.4	-124.2	177.5	-176.8	146.9	-0	105.5	I144	R142-I144 VanDerWaalsContact C-N 3.3Å; R142-I144 WeakPolarHBondContact O-CG1 3.11Å; R142-I144 PolarHBondContact O-N 2.9Å
143	N	30.3	Very low	31.6	Very low	111 Å²	111	138.7 Å²	138.7	59%	0.594	69%	0.694	S	S	*	*			trans	-75.8	83	-176.6	-150.4	-4.6	0	0	0	107.8	T141 N145	T141-N143 PolarHBondContact O-N 3.26Å; N143-N145 PolarHBondContact O-N 2.97Å; N143-N145 VanDerWaalsContact O-N 3.15Å
144	I	34.5	Very low	31.3	Very low	159 Å²	159	138.4 Å²	138.4	82%	0.815	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-6.1	-174.6	-53	170.2	0	0	0	111.4	R142	R142-I144 VanDerWaalsContact C-N 3.3Å; R142-I144 WeakPolarHBondContact O-CG1 3.11Å; R142-I144 PolarHBondContact O-N 2.9Å
145	N	33.9	Very low	31.3	Very low	104 Å²	104	139 Å²	139	56%	0.556	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	4.3	-168.2	-146.5	16.6	0	0	0	116.1	N143	N143-N145 PolarHBondContact O-N 2.97Å; N143-N145 VanDerWaalsContact O-N 3.15Å
146	C	32.3	Very low	31.3	Very low	61 Å²	61	134.3 Å²	134.3	41%	0.412	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.9	-10.8	-177.1	-59.5	0	0	0	0	116.1	W148	C146-W148 PolarHBondContact O-N 3.36Å
147	D	30.1	Very low	31.7	Very low	103 Å²	103	129.6 Å²	129.6	55%	0.551	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-7.2	-173	-78.4	-1.4	0	0	0	115.5
148	W	35.3	Very low	31.8	Very low	149 Å²	149	131 Å²	131	56%	0.564	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-29.3	-172.9	75	-74.7	0	0	0	113.8	C146	C146-W148 PolarHBondContact O-N 3.36Å
149	T	35.2	Very low	32.4	Very low	75 Å²	75	123.4 Å²	123.4	46%	0.46	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.1	-30.5	172.8	48.2	0	0	0	0	111.8	R151 F152	T149-R151 PolarHBondContact O-N 2.79Å; T149-F152 PolarHBondContact O-N 3.35Å
150	D	31.5	Very low	33.1	Very low	133 Å²	133	122.2 Å²	122.2	71%	0.711	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-11.9	178.7	-72	-4.3	0	0	0	113.5
151	R	30.5	Very low	34	Very low	202 Å²	202	118.9 Å²	118.9	76%	0.762	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	1	173	-69.7	-170	-163	-144.7	3.5	114.3	T149 S153	T149-R151 PolarHBondContact O-N 2.79Å; R151-S153 PolarHBondContact O-N 3.3Å
152	F	27.8	Very low	34.7	Very low	151 Å²	151	117 Å²	117	66%	0.662	57%	0.57	S	S	*	*			trans	-70.9	73.7	161	-88.4	-88.8	0	0	0	109.1	T149 T156	T149-F152 PolarHBondContact O-N 3.35Å; F152-T156 WeakPolarHBondContact CA-OG1 3.15Å; F152-T156 HydrophobicContact CD1-CG2 4.24Å
153	S	32.2	Very low	35.3	Very low	60 Å²	60	109.8 Å²	109.8	42%	0.42	55%	0.547	S	S	.	.			trans	-60.1	157.9	178.3	175	0	0	0	0	112	R151 K155 T156 S157	R151-S153 PolarHBondContact O-N 3.3Å; S153-K155 CarbonylContact O-C 3.58Å; S153-K155 PolarHBondContact O-N 2.94Å; S153-K155 PolarHBondContact OG-N 3.13Å; S153-T156 PolarHBondContact N-OG1 2.86Å; S153-T156 WeakPolarHBondContact O-CA 3.29Å; S153-T156 PolarHBondContact O-N 3.5Å; S153-T156 PolarHBondContact O-OG1 3.38Å; S153-S157 PolarHBondContact O-N 3.42Å
154	V	30.9	Very low	36	Very low	106 Å²	106	108.3 Å²	108.3	64%	0.642	54%	0.535	S	S	*	.	H	α-helix	trans	-43.8	-30	165.8	177.2	0	0	0	0	112.7	S157 H158	V154-S157 PolarHBondContact O-N 2.96Å; V154-H158 PolarHBondContact O-N 2.81Å
155	K	30.2	Very low	36.8	Very low	169 Å²	169	107.2 Å²	107.2	74%	0.735	52%	0.524	S	S	*	.	H	α-helix	trans	-63.5	-41.8	171.8	-69.2	-174.8	177	-176	0	113.5	S153 S157 H158 V159	S153-K155 CarbonylContact O-C 3.58Å; S153-K155 PolarHBondContact O-N 2.94Å; S153-K155 PolarHBondContact OG-N 3.13Å; K155-S157 VanDerWaalsContact C-N 3.32Å; K155-H158 PolarHBondContact O-N 3.45Å; K155-V159 VanDerWaalsContact O-CG2 3.25Å; K155-V159 WeakPolarHBondContact O-CG2 3.35Å; K155-V159 PolarHBondContact O-N 2.89Å
156	T	33.3	Very low	37	Very low	53 Å²	53	105 Å²	105	33%	0.325	51%	0.512	S	S	.	.	H	α-helix	trans	-68.8	-28.7	172.8	40.3	0	0	0	0	112.7	F152 S153 W160	F152-T156 WeakPolarHBondContact CA-OG1 3.15Å; F152-T156 HydrophobicContact CD1-CG2 4.24Å; S153-T156 PolarHBondContact N-OG1 2.86Å; S153-T156 WeakPolarHBondContact O-CA 3.29Å; S153-T156 PolarHBondContact O-N 3.5Å; S153-T156 PolarHBondContact O-OG1 3.38Å; T156-W160 WeakPolarHBondContact O-CB 3.33Å; T156-W160 PolarHBondContact O-N 2.91Å
157	S	36.6	Very low	37.5	Very low	55 Å²	55	103.6 Å²	103.6	39%	0.385	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-42.9	171	173.3	0	0	0	0	111.5	S153 V154 K155 W160 E161	S153-S157 PolarHBondContact O-N 3.42Å; V154-S157 PolarHBondContact O-N 2.96Å; K155-S157 VanDerWaalsContact C-N 3.32Å; S157-W160 CarbonylContact O-C 3.59Å; S157-W160 PolarHBondContact O-N 2.92Å; S157-E161 WeakPolarHBondContact O-CG 3.18Å; S157-E161 PolarHBondContact O-N 2.79Å
158	H	38.4	Very low	38.2	Very low	145 Å²	145	102.5 Å²	102.5	67%	0.671	49%	0.494	S	S	*	.	H	α-helix	trans	-64	-42	174.7	-123.6	74.9	0	0	0	112.3	V154 K155 W160 E161 Q162	V154-H158 PolarHBondContact O-N 2.81Å; K155-H158 PolarHBondContact O-N 3.45Å; H158-W160 VanDerWaalsContact C-N 3.3Å; H158-W160 PolarHBondContact O-N 3.3Å; H158-E161 PolarHBondContact O-N 2.77Å; H158-Q162 WeakPolarHBondContact O-CB 3.44Å; H158-Q162 PolarHBondContact O-N 3.45Å
159	V	39	Very low	38.6	Very low	85 Å²	85	99.7 Å²	99.7	52%	0.515	49%	0.486	S	S	.	.	H	α-helix	trans	-62.8	-38.8	172.9	171.7	0	0	0	0	110.7	K155 Q162 I163	K155-V159 VanDerWaalsContact O-CG2 3.25Å; K155-V159 WeakPolarHBondContact O-CG2 3.35Å; K155-V159 PolarHBondContact O-N 2.89Å; V159-Q162 PolarHBondContact O-N 3.4Å; V159-I163 HydrophobicContact CG1-CD1 3.79Å; V159-I163 HydrophobicContact CG1-CG1 4.38Å; V159-I163 WeakPolarHBondContact O-CB 3.34Å; V159-I163 WeakPolarHBondContact O-CG1 3.27Å; V159-I163 PolarHBondContact O-N 2.81Å
160	W	44	Very low	38.6	Very low	142 Å²	142	97.1 Å²	97.1	54%	0.538	47%	0.471	S	S	.	.	H	α-helix	trans	-70.6	-37.5	177.3	-172.8	-111.8	0	0	0	113.1	T156 S157 H158 Q162 I163 K164	T156-W160 WeakPolarHBondContact O-CB 3.33Å; T156-W160 PolarHBondContact O-N 2.91Å; S157-W160 CarbonylContact O-C 3.59Å; S157-W160 PolarHBondContact O-N 2.92Å; H158-W160 VanDerWaalsContact C-N 3.3Å; H158-W160 PolarHBondContact O-N 3.3Å; W160-Q162 VanDerWaalsContact C-N 3.33Å; W160-I163 HydrophobicContact CE3-CD1 4.34Å; W160-I163 HydrophobicContact CE3-CG2 4.47Å; W160-I163 HydrophobicContact CZ3-CG2 4.47Å; W160-I163 PolarHBondContact O-N 3.44Å; W160-K164 WeakPolarHBondContact O-CB 3.5Å; W160-K164 WeakPolarHBondContact O-CG 3.25Å; W160-K164 PolarHBondContact O-N 3.37Å
161	E	46.2	Very low	39	Very low	94 Å²	94	90.9 Å²	90.9	44%	0.439	44%	0.438	S	S	.	.	H	α-helix	trans	-64.1	-40.3	170.2	-69.8	-49.9	141.1	0	0	111.3	S157 H158 K164 K165	S157-E161 WeakPolarHBondContact O-CG 3.18Å; S157-E161 PolarHBondContact O-N 2.79Å; H158-E161 PolarHBondContact O-N 2.77Å; E161-K164 PolarHBondContact O-N 3.26Å; E161-K164 WeakPolarHBondContact OE1-CE 3.36Å; E161-K164 IonicContact OE1-NZ 3.62Å; E161-K164 PolarHBondContact OE1-NZ 2.99Å; E161-K164 VanDerWaalsContact OE2-CE 3.25Å; E161-K164 WeakPolarHBondContact OE2-CE 2.93Å; E161-K164 IonicContact OE2-NZ 3.4Å; E161-K164 PolarHBondContact OE2-NZ 2.95Å; E161-K165 WeakPolarHBondContact O-CB 3.42Å; E161-K165 PolarHBondContact O-N 3.19Å
162	Q	45.2	Very low	39.6	Very low	94 Å²	94	87.9 Å²	87.9	44%	0.439	43%	0.432	S	S	.	.	H	α-helix	trans	-63.7	-46.9	174.6	-168.6	63	50.4	0	0	110.9	H158 V159 W160 K164 K165 D166	H158-Q162 WeakPolarHBondContact O-CB 3.44Å; H158-Q162 PolarHBondContact O-N 3.45Å; V159-Q162 PolarHBondContact O-N 3.4Å; W160-Q162 VanDerWaalsContact C-N 3.33Å; Q162-K164 VanDerWaalsContact C-N 3.3Å; Q162-K164 PolarHBondContact O-N 2.91Å; Q162-K165 PolarHBondContact O-N 2.84Å; Q162-K165 VanDerWaalsContact O-N 3.14Å; Q162-D166 PolarHBondContact NE2-OD1 3.37Å; Q162-D166 WeakPolarHBondContact O-CB 3.21Å; Q162-D166 PolarHBondContact O-N 3.48Å
163	I	43.8	Very low	40.2	Very low	55 Å²	55	83.1 Å²	83.1	28%	0.282	42%	0.417	S	S	.	.	H	α-helix	trans	-58.8	-41.6	174.6	-70.9	164.9	0	0	0	110.8	V159 W160 F167	V159-I163 HydrophobicContact CG1-CD1 3.79Å; V159-I163 HydrophobicContact CG1-CG1 4.38Å; V159-I163 WeakPolarHBondContact O-CB 3.34Å; V159-I163 WeakPolarHBondContact O-CG1 3.27Å; V159-I163 PolarHBondContact O-N 2.81Å; W160-I163 HydrophobicContact CE3-CD1 4.34Å; W160-I163 HydrophobicContact CE3-CG2 4.47Å; W160-I163 HydrophobicContact CZ3-CG2 4.47Å; W160-I163 PolarHBondContact O-N 3.44Å; I163-F167 WeakPolarHBondContact O-CA 3.45Å; I163-F167 WeakPolarHBondContact O-CB 3.41Å; I163-F167 PolarHBondContact O-N 3.35Å
164	K	45.9	Very low	40.2	Very low	79 Å²	79	82.7 Å²	82.7	34%	0.343	41%	0.412	S	S	.	.	H	α-helix	trans	-66	-39.7	176.6	-80.7	-173.4	-73	164.6	0	112.3	W160 E161 Q162 N168	W160-K164 WeakPolarHBondContact O-CB 3.5Å; W160-K164 WeakPolarHBondContact O-CG 3.25Å; W160-K164 PolarHBondContact O-N 3.37Å; E161-K164 PolarHBondContact O-N 3.26Å; E161-K164 WeakPolarHBondContact OE1-CE 3.36Å; E161-K164 IonicContact OE1-NZ 3.62Å; E161-K164 PolarHBondContact OE1-NZ 2.99Å; E161-K164 VanDerWaalsContact OE2-CE 3.25Å; E161-K164 WeakPolarHBondContact OE2-CE 2.93Å; E161-K164 IonicContact OE2-NZ 3.4Å; E161-K164 PolarHBondContact OE2-NZ 2.95Å; Q162-K164 VanDerWaalsContact C-N 3.3Å; Q162-K164 PolarHBondContact O-N 2.91Å; K164-N168 WeakPolarHBondContact O-CB 3.43Å; K164-N168 PolarHBondContact O-N 2.84Å
165	K	50.1	Low	40.6	Very low	136 Å²	136	83.9 Å²	83.9	59%	0.591	43%	0.425	S	S	*	.	H	α-helix	trans	-65.1	-50	176.5	-171.7	179.5	177.3	-176.6	0	110.4	E161 Q162 F167 N168 E169	E161-K165 WeakPolarHBondContact O-CB 3.42Å; E161-K165 PolarHBondContact O-N 3.19Å; Q162-K165 PolarHBondContact O-N 2.84Å; Q162-K165 VanDerWaalsContact O-N 3.14Å; K165-F167 VanDerWaalsContact C-N 3.3Å; K165-F167 PolarHBondContact O-N 2.67Å; K165-N168 PolarHBondContact O-N 3.48Å; K165-E169 VanDerWaalsContact O-CB 3.32Å; K165-E169 WeakPolarHBondContact O-CB 3.45Å; K165-E169 PolarHBondContact O-N 2.95Å
166	D	39.3	Very low	41	Very low	57 Å²	57	81.5 Å²	81.5	31%	0.305	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-39.9	177	-60.7	-11.4	0	0	0	110.5	Q162 E169 V170	Q162-D166 PolarHBondContact NE2-OD1 3.37Å; Q162-D166 WeakPolarHBondContact O-CB 3.21Å; Q162-D166 PolarHBondContact O-N 3.48Å; D166-E169 PolarHBondContact O-N 2.89Å; D166-V170 VanDerWaalsContact O-CB 3.29Å; D166-V170 WeakPolarHBondContact O-CB 3.32Å; D166-V170 WeakPolarHBondContact O-CG2 3.35Å; D166-V170 PolarHBondContact O-N 2.89Å
167	F	42.2	Very low	41.4	Very low	32 Å²	32	83 Å²	83	14%	0.14	43%	0.427	C	S	.	.	H	α-helix	trans	-67.3	-44.2	176.9	-171.9	-99	0	0	0	112.4	I163 K165 E169 V170 V171 V181 A185 F255	I163-F167 WeakPolarHBondContact O-CA 3.45Å; I163-F167 WeakPolarHBondContact O-CB 3.41Å; I163-F167 PolarHBondContact O-N 3.35Å; K165-F167 VanDerWaalsContact C-N 3.3Å; K165-F167 PolarHBondContact O-N 2.67Å; F167-E169 VanDerWaalsContact C-N 3.32Å; F167-V170 PolarHBondContact O-N 3.35Å; F167-V171 HydrophobicContact CD1-CG2 3.92Å; F167-V171 HydrophobicContact CE1-CG2 3.75Å; F167-V171 HydrophobicContact CG-CG2 4.47Å; F167-V171 HydrophobicContact CZ-CG2 4.17Å; F167-V171 WeakPolarHBondContact O-CB 3.46Å; F167-V171 WeakPolarHBondContact O-CG2 3.41Å; F167-V171 PolarHBondContact O-N 3.47Å; F167-V181 HydrophobicContact CD2-CG1 4.29Å; F167-V181 HydrophobicContact CE1-CG1 4.02Å; F167-V181 HydrophobicContact CE2-CG1 3.34Å; F167-V181 HydrophobicContact CZ-CG1 3.19Å; F167-A185 HydrophobicContact CE1-CB 4.47Å; F167-A185 HydrophobicContact CZ-CB 3.85Å; F167-F255 HydrophobicContact CD2-CE2 4.43Å; F167-F255 AromaticContact CD2-CZ 3.63Å; F167-F255 HydrophobicContact CD2-CZ 3.63Å; F167-F255 HydrophobicContact CE2-CE2 4.04Å; F167-F255 AromaticContact CE2-CZ 3.63Å; F167-F255 HydrophobicContact CE2-CZ 3.63Å
168	N	44.9	Very low	41.6	Very low	81 Å²	81	86 Å²	86	43%	0.433	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-40.6	174.3	-92.3	-14.1	0	0	0	111.2	K164 K165 V170 V171 H172	K164-N168 WeakPolarHBondContact O-CB 3.43Å; K164-N168 PolarHBondContact O-N 2.84Å; K165-N168 PolarHBondContact O-N 3.48Å; N168-V170 VanDerWaalsContact C-N 3.34Å; N168-V171 PolarHBondContact O-N 2.92Å; N168-H172 WeakPolarHBondContact O-CB 3.37Å; N168-H172 PolarHBondContact O-CD2 3Å; N168-H172 VanDerWaalsContact O-CG 3.27Å; N168-H172 PolarHBondContact O-N 3.36Å
169	E	43	Very low	41.9	Very low	89 Å²	89	83.1 Å²	83.1	42%	0.416	42%	0.423	S	S	.	.	H	α-helix	trans	-63.9	-40.2	176.3	-169	168.8	178.5	0	0	111.5	K165 D166 F167 H172 S173 F266	K165-E169 VanDerWaalsContact O-CB 3.32Å; K165-E169 WeakPolarHBondContact O-CB 3.45Å; K165-E169 PolarHBondContact O-N 2.95Å; D166-E169 PolarHBondContact O-N 2.89Å; F167-E169 VanDerWaalsContact C-N 3.32Å; E169-H172 PolarHBondContact O-N 2.77Å; E169-S173 WeakPolarHBondContact O-CB 3.06Å; E169-S173 PolarHBondContact O-N 3.01Å; E169-S173 PolarHBondContact O-OG 3.14Å; E169-F266 HydrophobicContact CG-CZ 4.46Å
170	V	36.5	Very low	41.8	Very low	22 Å²	22	83.1 Å²	83.1	13%	0.133	42%	0.423	C	S	.	.	H	α-helix	trans	-68.1	-41.7	174.3	170	0	0	0	0	111.8	D166 F167 N168 H172 S173 V174 L259	D166-V170 VanDerWaalsContact O-CB 3.29Å; D166-V170 WeakPolarHBondContact O-CB 3.32Å; D166-V170 WeakPolarHBondContact O-CG2 3.35Å; D166-V170 PolarHBondContact O-N 2.89Å; F167-V170 PolarHBondContact O-N 3.35Å; N168-V170 VanDerWaalsContact C-N 3.34Å; V170-H172 PolarHBondContact O-N 3.49Å; V170-S173 WeakPolarHBondContact CA-OG 3.35Å; V170-S173 PolarHBondContact O-N 2.96Å; V170-S173 PolarHBondContact O-OG 3.03Å; V170-V174 HydrophobicContact CG1-CG2 3.84Å; V170-V174 VanDerWaalsContact O-CB 3.27Å; V170-V174 WeakPolarHBondContact O-CB 3.25Å; V170-V174 WeakPolarHBondContact O-CG2 3.5Å; V170-V174 PolarHBondContact O-N 3.32Å; V170-L259 HydrophobicContact CB-CD2 4.09Å; V170-L259 HydrophobicContact CG1-CD2 3.93Å; V170-L259 HydrophobicContact CG2-CD2 3.65Å
171	V	40	Very low	41.6	Very low	2 Å²	2	78.1 Å²	78.1	1%	0.012	41%	0.408	C	S	.	.	H	α-helix	trans	-65.2	-27.9	174.4	169.9	0	0	0	0	111.9	F167 N168 K178 V181 Y182	F167-V171 HydrophobicContact CD1-CG2 3.92Å; F167-V171 HydrophobicContact CE1-CG2 3.75Å; F167-V171 HydrophobicContact CG-CG2 4.47Å; F167-V171 HydrophobicContact CZ-CG2 4.17Å; F167-V171 WeakPolarHBondContact O-CB 3.46Å; F167-V171 WeakPolarHBondContact O-CG2 3.41Å; F167-V171 PolarHBondContact O-N 3.47Å; N168-V171 PolarHBondContact O-N 2.92Å; V171-K178 HydrophobicContact CG1-CG 4.19Å; V171-V181 HydrophobicContact CG2-CB 4.24Å; V171-V181 HydrophobicContact CG2-CG1 3.48Å; V171-V181 VanDerWaalsContact CG2-CG1 3.48Å; V171-Y182 HydrophobicContact CG1-CE2 3.76Å
172	H	43	Very low	41.5	Very low	139 Å²	139	79.5 Å²	79.5	64%	0.644	41%	0.41	S	S	*	.	H	α-helix	trans	-85.1	-23.6	175.4	-73.1	-49.5	0	0	0	113.8	N168 E169 V170	N168-H172 WeakPolarHBondContact O-CB 3.37Å; N168-H172 PolarHBondContact O-CD2 3Å; N168-H172 VanDerWaalsContact O-CG 3.27Å; N168-H172 PolarHBondContact O-N 3.36Å; E169-H172 PolarHBondContact O-N 2.77Å; V170-H172 PolarHBondContact O-N 3.49Å
173	S	39.5	Very low	41.6	Very low	51 Å²	51	81 Å²	81	36%	0.357	41%	0.411	S	S	.	.	H	α-helix	trans	-100.8	-15.3	-177.9	51.4	0	0	0	0	114.4	E169 V170	E169-S173 WeakPolarHBondContact O-CB 3.06Å; E169-S173 PolarHBondContact O-N 3.01Å; E169-S173 PolarHBondContact O-OG 3.14Å; V170-S173 WeakPolarHBondContact CA-OG 3.35Å; V170-S173 PolarHBondContact O-N 2.96Å; V170-S173 PolarHBondContact O-OG 3.03Å
174	V	32.7	Very low	41.7	Very low	50 Å²	50	79.2 Å²	79.2	30%	0.303	40%	0.403	S	S	.	.			trans	-87.1	114.2	176.9	173.5	0	0	0	0	110.1	V170 E176	V170-V174 HydrophobicContact CG1-CG2 3.84Å; V170-V174 VanDerWaalsContact O-CB 3.27Å; V170-V174 WeakPolarHBondContact O-CB 3.25Å; V170-V174 WeakPolarHBondContact O-CG2 3.5Å; V170-V174 PolarHBondContact O-N 3.32Å; V174-E176 HydrophobicContact CG1-CB 3.61Å; V174-E176 HydrophobicContact CG1-CG 4.31Å; V174-E176 PolarHBondContact O-N 3.2Å
175	S	38.7	Very low	41.6	Very low	131 Å²	131	77.3 Å²	77.3	92%	0.916	40%	0.402	S	S	*	.			trans	-77.3	11	171.2	58.5	0	0	0	0	113.8
176	E	37.8	Very low	41.4	Very low	120 Å²	120	73.4 Å²	73.4	56%	0.561	39%	0.392	S	S	*	.	S	Bend	trans	-91.3	153.3	165.7	-67.5	-176.2	169.4	0	0	109.3	V174 K178 R284	V174-E176 HydrophobicContact CG1-CB 3.61Å; V174-E176 HydrophobicContact CG1-CG 4.31Å; V174-E176 PolarHBondContact O-N 3.2Å; E176-K178 PolarHBondContact O-N 2.72Å; E176-R284 IonicContact OE1-NH2 3.81Å
177	P	42.5	Very low	41.8	Very low	85 Å²	85	71.6 Å²	71.6	55%	0.552	38%	0.384	S	S	*	.			trans	-59	118.9	-162.6	-15.5	26.3	0	0	0	110.2	D179 V180	P177-D179 HydrophobicContact CB-CB 4.18Å; P177-D179 PolarHBondContact O-N 2.8Å; P177-V180 PolarHBondContact O-N 2.91Å
178	K	41.5	Very low	41.9	Very low	117 Å²	117	71.7 Å²	71.7	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-39.3	-33.8	170.2	-68.5	174.6	178.4	170.1	0	111.6	V171 E176 V180 V181 Y182	V171-K178 HydrophobicContact CG1-CG 4.19Å; E176-K178 PolarHBondContact O-N 2.72Å; K178-V180 PolarHBondContact O-N 2.62Å; K178-V181 PolarHBondContact O-N 3.02Å; K178-Y182 HydrophobicContact CB-CD2 4.07Å; K178-Y182 HydrophobicContact CB-CE2 4.21Å; K178-Y182 WeakPolarHBondContact O-CB 3.46Å; K178-Y182 WeakPolarHBondContact O-CD2 3.46Å; K178-Y182 PolarHBondContact O-N 2.9Å
179	D	43.5	Very low	42	Very low	85 Å²	85	71.9 Å²	71.9	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-52.6	-41.4	175.7	-146.5	2.7	0	0	0	114.5	P177 R183	P177-D179 HydrophobicContact CB-CB 4.18Å; P177-D179 PolarHBondContact O-N 2.8Å; D179-R183 VanDerWaalsContact CG-NE 3.25Å; D179-R183 WeakPolarHBondContact O-CB 3.16Å; D179-R183 WeakPolarHBondContact O-CD 3.18Å; D179-R183 WeakPolarHBondContact O-CG 3.39Å; D179-R183 PolarHBondContact O-N 2.99Å; D179-R183 IonicContact OD1-CZ 2.72Å; D179-R183 IonicContact OD1-NE 2.85Å; D179-R183 PolarHBondContact OD1-NE 2.85Å; D179-R183 IonicContact OD1-NH2 3.78Å; D179-R183 PolarHBondContact OD1-NH2 2.78Å; D179-R183 IonicContact OD2-CZ 3.82Å; D179-R183 IonicContact OD2-NE 2.77Å; D179-R183 PolarHBondContact OD2-NE 3.49Å; D179-R183 IonicContact OD2-NH2 2.77Å; D179-R183 PolarHBondContact OD2-NH2 2.78Å
180	V	38.1	Very low	42.3	Very low	84 Å²	84	72.1 Å²	72.1	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-67.2	-46.5	179.7	179.4	0	0	0	0	110.6	P177 K178 R183 T184	P177-V180 PolarHBondContact O-N 2.91Å; K178-V180 PolarHBondContact O-N 2.62Å; V180-R183 PolarHBondContact O-N 3.09Å; V180-T184 PolarHBondContact O-N 3.38Å; V180-T184 PolarHBondContact O-OG1 2.85Å
181	V	39.5	Very low	42.8	Very low	37 Å²	37	74.3 Å²	74.3	22%	0.224	39%	0.392	C	S	.	.	H	α-helix	trans	-68.9	-41.6	-177.6	179.2	0	0	0	0	111	F167 V171 K178 A185	F167-V181 HydrophobicContact CD2-CG1 4.29Å; F167-V181 HydrophobicContact CE1-CG1 4.02Å; F167-V181 HydrophobicContact CE2-CG1 3.34Å; F167-V181 HydrophobicContact CZ-CG1 3.19Å; V171-V181 HydrophobicContact CG2-CB 4.24Å; V171-V181 HydrophobicContact CG2-CG1 3.48Å; V171-V181 VanDerWaalsContact CG2-CG1 3.48Å; K178-V181 PolarHBondContact O-N 3.02Å; V181-A185 WeakPolarHBondContact O-CB 3.14Å; V181-A185 PolarHBondContact O-N 3.08Å; V181-A185 VanDerWaalsContact O-N 3.11Å
182	Y	44.6	Very low	42.9	Very low	124 Å²	124	78.5 Å²	78.5	49%	0.486	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-40.7	172.3	-85.6	-71.3	0	0	0	112.4	V171 K178 A185 S186	V171-Y182 HydrophobicContact CG1-CE2 3.76Å; K178-Y182 HydrophobicContact CB-CD2 4.07Å; K178-Y182 HydrophobicContact CB-CE2 4.21Å; K178-Y182 WeakPolarHBondContact O-CB 3.46Å; K178-Y182 WeakPolarHBondContact O-CD2 3.46Å; K178-Y182 PolarHBondContact O-N 2.9Å; Y182-A185 PolarHBondContact O-N 2.92Å; Y182-S186 WeakPolarHBondContact O-CB 3.16Å; Y182-S186 PolarHBondContact O-N 3.33Å
183	R	46.7	Very low	43.1	Very low	124 Å²	124	74.4 Å²	74.4	47%	0.468	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-44.3	179.1	-77.1	171.6	-168.7	-143.3	10.6	112.5	D179 V180 A185 S186 S187	D179-R183 VanDerWaalsContact CG-NE 3.25Å; D179-R183 WeakPolarHBondContact O-CB 3.16Å; D179-R183 WeakPolarHBondContact O-CD 3.18Å; D179-R183 WeakPolarHBondContact O-CG 3.39Å; D179-R183 PolarHBondContact O-N 2.99Å; D179-R183 IonicContact OD1-CZ 2.72Å; D179-R183 IonicContact OD1-NE 2.85Å; D179-R183 PolarHBondContact OD1-NE 2.85Å; D179-R183 IonicContact OD1-NH2 3.78Å; D179-R183 PolarHBondContact OD1-NH2 2.78Å; D179-R183 IonicContact OD2-CZ 3.82Å; D179-R183 IonicContact OD2-NE 2.77Å; D179-R183 PolarHBondContact OD2-NE 3.49Å; D179-R183 IonicContact OD2-NH2 2.77Å; D179-R183 PolarHBondContact OD2-NH2 2.78Å; V180-R183 PolarHBondContact O-N 3.09Å; R183-A185 VanDerWaalsContact C-N 3.33Å; R183-A185 PolarHBondContact O-N 3.21Å; R183-S186 PolarHBondContact O-N 3.03Å; R183-S187 WeakPolarHBondContact O-CB 3.31Å; R183-S187 PolarHBondContact O-N 2.84Å
184	T	45.3	Very low	43.3	Very low	18 Å²	18	74.5 Å²	74.5	11%	0.11	40%	0.402	C	S	.	.	H	α-helix	trans	-61.8	-44.4	175.8	-53.1	0	0	0	0	110.2	V180 S186 S187 V188 D291	V180-T184 PolarHBondContact O-N 3.38Å; V180-T184 PolarHBondContact O-OG1 2.85Å; T184-S186 VanDerWaalsContact C-N 3.34Å; T184-S186 PolarHBondContact O-N 2.99Å; T184-S187 PolarHBondContact O-N 3.37Å; T184-V188 HydrophobicContact CG2-CG2 4.43Å; T184-V188 WeakPolarHBondContact O-CB 3.24Å; T184-V188 VanDerWaalsContact O-CG2 3.23Å; T184-V188 WeakPolarHBondContact O-CG2 3.36Å; T184-V188 PolarHBondContact O-N 2.84Å; T184-D291 PolarHBondContact OG1-OD2 3.38Å
185	A	43.7	Very low	43.6	Very low	39 Å²	39	73.2 Å²	73.2	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-39.9	175.7	0	0	0	0	0	112.8	F167 V181 Y182 R183 R189	F167-A185 HydrophobicContact CE1-CB 4.47Å; F167-A185 HydrophobicContact CZ-CB 3.85Å; V181-A185 WeakPolarHBondContact O-CB 3.14Å; V181-A185 PolarHBondContact O-N 3.08Å; V181-A185 VanDerWaalsContact O-N 3.11Å; Y182-A185 PolarHBondContact O-N 2.92Å; R183-A185 VanDerWaalsContact C-N 3.33Å; R183-A185 PolarHBondContact O-N 3.21Å; A185-R189 WeakPolarHBondContact O-CB 3.38Å; A185-R189 PolarHBondContact O-N 2.96Å
186	S	46.8	Very low	43.5	Very low	55 Å²	55	69.5 Å²	69.5	39%	0.385	37%	0.374	S	S	.	.	H	α-helix	trans	-66.1	-44.8	175.8	-163.4	0	0	0	0	112	Y182 R183 T184 V188 R189 D190	Y182-S186 WeakPolarHBondContact O-CB 3.16Å; Y182-S186 PolarHBondContact O-N 3.33Å; R183-S186 PolarHBondContact O-N 3.03Å; T184-S186 VanDerWaalsContact C-N 3.34Å; T184-S186 PolarHBondContact O-N 2.99Å; S186-V188 PolarHBondContact O-N 3.18Å; S186-R189 CarbonylContact O-C 3.54Å; S186-R189 WeakPolarHBondContact O-CB 3.43Å; S186-R189 PolarHBondContact O-N 3.44Å; S186-R189 VanDerWaalsContact O-N 3.16Å; S186-D190 VanDerWaalsContact O-CG 3.26Å; S186-D190 PolarHBondContact O-N 3.36Å
187	S	46.8	Very low	43.7	Very low	19 Å²	19	67.3 Å²	67.3	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-64.1	-41.8	179.3	-171.7	0	0	0	0	112	R183 T184 R189 D190 R191 P292	R183-S187 WeakPolarHBondContact O-CB 3.31Å; R183-S187 PolarHBondContact O-N 2.84Å; T184-S187 PolarHBondContact O-N 3.37Å; S187-R189 VanDerWaalsContact C-N 3.32Å; S187-R189 PolarHBondContact O-N 3.31Å; S187-D190 PolarHBondContact O-N 3.01Å; S187-R191 WeakPolarHBondContact O-CG 3.32Å; S187-R191 PolarHBondContact O-N 3.35Å; S187-P292 VanDerWaalsContact OG-CG 3.23Å; S187-P292 WeakPolarHBondContact OG-CG 3.29Å
188	V	45	Very low	43.6	Very low	33 Å²	33	66.3 Å²	66.3	20%	0.2	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-43.7	172.7	169.8	0	0	0	0	110.8	T184 S186 R191 I192 L251	T184-V188 HydrophobicContact CG2-CG2 4.43Å; T184-V188 WeakPolarHBondContact O-CB 3.24Å; T184-V188 VanDerWaalsContact O-CG2 3.23Å; T184-V188 WeakPolarHBondContact O-CG2 3.36Å; T184-V188 PolarHBondContact O-N 2.84Å; S186-V188 PolarHBondContact O-N 3.18Å; V188-R191 PolarHBondContact O-N 3.41Å; V188-I192 HydrophobicContact CG1-CD1 3.76Å; V188-I192 HydrophobicContact CG1-CG1 4.45Å; V188-I192 VanDerWaalsContact O-CG1 3.28Å; V188-I192 WeakPolarHBondContact O-CG1 3.49Å; V188-I192 PolarHBondContact O-N 3.39Å; V188-L251 HydrophobicContact CB-CD2 4.23Å; V188-L251 HydrophobicContact CG1-CD2 3.73Å; V188-L251 HydrophobicContact CG2-CD1 4.04Å; V188-L251 HydrophobicContact CG2-CD2 3.62Å; V188-L251 HydrophobicContact CG2-CG 4.24Å
189	R	46.4	Very low	43.5	Very low	85 Å²	85	62.9 Å²	62.9	32%	0.321	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-45.5	175.8	-178.6	-172.9	-179.8	-159.1	-1.9	111.8	L93 A185 S186 S187 R191 I192 T193	L93-R189 VanDerWaalsContact CB-NH2 3.31Å; A185-R189 WeakPolarHBondContact O-CB 3.38Å; A185-R189 PolarHBondContact O-N 2.96Å; S186-R189 CarbonylContact O-C 3.54Å; S186-R189 WeakPolarHBondContact O-CB 3.43Å; S186-R189 PolarHBondContact O-N 3.44Å; S186-R189 VanDerWaalsContact O-N 3.16Å; S187-R189 VanDerWaalsContact C-N 3.32Å; S187-R189 PolarHBondContact O-N 3.31Å; R189-R191 VanDerWaalsContact C-N 3.27Å; R189-R191 PolarHBondContact O-N 3.37Å; R189-I192 PolarHBondContact O-N 2.87Å; R189-T193 VanDerWaalsContact O-CB 3.27Å; R189-T193 WeakPolarHBondContact O-CB 3.41Å; R189-T193 PolarHBondContact O-N 3.49Å; R189-T193 PolarHBondContact O-OG1 3.39Å
190	D	50.5	Low	43.3	Very low	95 Å²	95	68.7 Å²	68.7	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-63.5	-37.1	-179.6	-69.7	-24.2	0	0	0	110.9	S186 S187 T193 A194	S186-D190 VanDerWaalsContact O-CG 3.26Å; S186-D190 PolarHBondContact O-N 3.36Å; S187-D190 PolarHBondContact O-N 3.01Å; D190-T193 CarbonylContact O-C 3.59Å; D190-T193 PolarHBondContact O-N 3.44Å; D190-A194 VanDerWaalsContact O-CB 3.25Å; D190-A194 WeakPolarHBondContact O-CB 3.45Å; D190-A194 PolarHBondContact O-N 2.73Å
191	R	45.6	Very low	43.4	Very low	67 Å²	67	70.9 Å²	70.9	25%	0.253	37%	0.372	S	S	.	.	H	α-helix	trans	-70.7	-42.3	174.4	-73.1	-171.6	133.5	-133	-16.5	113.6	S187 V188 R189 T193 A194 A195 Y369	S187-R191 WeakPolarHBondContact O-CG 3.32Å; S187-R191 PolarHBondContact O-N 3.35Å; V188-R191 PolarHBondContact O-N 3.41Å; R189-R191 VanDerWaalsContact C-N 3.27Å; R189-R191 PolarHBondContact O-N 3.37Å; R191-T193 PolarHBondContact O-N 2.75Å; R191-A194 PolarHBondContact O-N 3.16Å; R191-A195 WeakPolarHBondContact O-CB 3.34Å; R191-A195 PolarHBondContact O-N 3.05Å; R191-Y369 VanDerWaalsContact CZ-CZ 3.43Å; R191-Y369 PolarHBondContact NH1-OH 3.39Å; R191-Y369 VanDerWaalsContact NH2-CD1 3.26Å
192	I	43.3	Very low	43.3	Very low	90 Å²	90	71.5 Å²	71.5	46%	0.462	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-38.9	172.2	-68.8	167.3	0	0	0	109.6	V188 R189 A196	V188-I192 HydrophobicContact CG1-CD1 3.76Å; V188-I192 HydrophobicContact CG1-CG1 4.45Å; V188-I192 VanDerWaalsContact O-CG1 3.28Å; V188-I192 WeakPolarHBondContact O-CG1 3.49Å; V188-I192 PolarHBondContact O-N 3.39Å; R189-I192 PolarHBondContact O-N 2.87Å; I192-A196 WeakPolarHBondContact O-CB 3.46Å; I192-A196 PolarHBondContact O-N 2.85Å
193	T	46.6	Very low	42.8	Very low	53 Å²	53	69.1 Å²	69.1	33%	0.325	37%	0.369	S	S	.	.	H	α-helix	trans	-70.1	-42.3	178.6	-55.6	0	0	0	0	111.4	R189 D190 R191 A196 N197	R189-T193 VanDerWaalsContact O-CB 3.27Å; R189-T193 WeakPolarHBondContact O-CB 3.41Å; R189-T193 PolarHBondContact O-N 3.49Å; R189-T193 PolarHBondContact O-OG1 3.39Å; D190-T193 CarbonylContact O-C 3.59Å; D190-T193 PolarHBondContact O-N 3.44Å; R191-T193 PolarHBondContact O-N 2.75Å; T193-A196 PolarHBondContact O-N 2.98Å; T193-N197 VanDerWaalsContact O-CB 3.24Å; T193-N197 WeakPolarHBondContact O-CB 3.42Å; T193-N197 PolarHBondContact O-N 3Å; T193-N197 PolarHBondContact O-ND2 3.2Å
194	A	43.6	Very low	42.2	Very low	54 Å²	54	67.6 Å²	67.6	45%	0.446	38%	0.375	S	S	.	.	H	α-helix	trans	-65.6	-40.7	174.8	0	0	0	0	0	111.6	D190 R191 N197 T198	D190-A194 VanDerWaalsContact O-CB 3.25Å; D190-A194 WeakPolarHBondContact O-CB 3.45Å; D190-A194 PolarHBondContact O-N 2.73Å; R191-A194 PolarHBondContact O-N 3.16Å; A194-N197 PolarHBondContact O-N 3.18Å; A194-T198 WeakPolarHBondContact O-CB 3.2Å; A194-T198 WeakPolarHBondContact O-CG2 3.17Å; A194-T198 PolarHBondContact O-N 3.44Å; A194-T198 PolarHBondContact O-OG1 2.78Å
195	A	39	Very low	41.7	Very low	22 Å²	22	71.6 Å²	71.6	18%	0.182	40%	0.396	C	S	.	.	H	α-helix	trans	-64.1	-43.5	172.5	0	0	0	0	0	111.3	R191 T198 V199 I244	R191-A195 WeakPolarHBondContact O-CB 3.34Å; R191-A195 PolarHBondContact O-N 3.05Å; A195-T198 VanDerWaalsContact CA-OG1 3.26Å; A195-T198 WeakPolarHBondContact CA-OG1 3.24Å; A195-T198 PolarHBondContact O-N 2.98Å; A195-T198 PolarHBondContact O-OG1 2.9Å; A195-V199 WeakPolarHBondContact O-CB 3.49Å; A195-V199 WeakPolarHBondContact O-CG2 3.44Å; A195-V199 PolarHBondContact O-N 3.23Å; A195-I244 HydrophobicContact CB-CG2 4.18Å
196	A	37.8	Very low	41.5	Very low	53 Å²	53	76.7 Å²	76.7	44%	0.438	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-39.9	176.4	0	0	0	0	0	111.7	I192 T193 V199 R200	I192-A196 WeakPolarHBondContact O-CB 3.46Å; I192-A196 PolarHBondContact O-N 2.85Å; T193-A196 PolarHBondContact O-N 2.98Å; A196-V199 PolarHBondContact O-N 3.32Å; A196-R200 VanDerWaalsContact O-CB 3.24Å; A196-R200 WeakPolarHBondContact O-CB 3.45Å; A196-R200 PolarHBondContact O-N 3.33Å
197	N	41.3	Very low	40.8	Very low	74 Å²	74	81.5 Å²	81.5	40%	0.396	43%	0.427	S	S	.	.	H	α-helix	trans	-69.6	-38.1	177.3	-75.9	-23.7	0	0	0	112	T193 A194 R200 N201	T193-N197 VanDerWaalsContact O-CB 3.24Å; T193-N197 WeakPolarHBondContact O-CB 3.42Å; T193-N197 PolarHBondContact O-N 3Å; T193-N197 PolarHBondContact O-ND2 3.2Å; A194-N197 PolarHBondContact O-N 3.18Å; N197-R200 PolarHBondContact O-N 2.61Å; N197-N201 WeakPolarHBondContact O-CB 3.5Å; N197-N201 PolarHBondContact O-N 3.06Å; N197-N201 PolarHBondContact O-ND2 3.25Å
198	T	41.1	Very low	39.8	Very low	64 Å²	64	86 Å²	86	39%	0.393	45%	0.449	S	S	.	.	H	α-helix	trans	-65.9	-40.4	172.6	41.5	0	0	0	0	111.2	A194 A195 R200 N201 L202	A194-T198 WeakPolarHBondContact O-CB 3.2Å; A194-T198 WeakPolarHBondContact O-CG2 3.17Å; A194-T198 PolarHBondContact O-N 3.44Å; A194-T198 PolarHBondContact O-OG1 2.78Å; A195-T198 VanDerWaalsContact CA-OG1 3.26Å; A195-T198 WeakPolarHBondContact CA-OG1 3.24Å; A195-T198 PolarHBondContact O-N 2.98Å; A195-T198 PolarHBondContact O-OG1 2.9Å; T198-R200 VanDerWaalsContact C-N 3.34Å; T198-R200 PolarHBondContact O-N 2.74Å; T198-N201 PolarHBondContact O-N 2.8Å; T198-L202 WeakPolarHBondContact O-CB 3.48Å; T198-L202 WeakPolarHBondContact O-CD1 3.35Å; T198-L202 WeakPolarHBondContact O-CG 3.34Å; T198-L202 PolarHBondContact O-N 3.45Å
199	V	37.8	Very low	39.1	Very low	45 Å²	45	91.2 Å²	91.2	27%	0.273	48%	0.475	S	S	.	.	H	α-helix	trans	-64.8	-35.3	172	174	0	0	0	0	112.6	A195 A196 L241	A195-V199 WeakPolarHBondContact O-CB 3.49Å; A195-V199 WeakPolarHBondContact O-CG2 3.44Å; A195-V199 PolarHBondContact O-N 3.23Å; A196-V199 PolarHBondContact O-N 3.32Å; V199-L241 HydrophobicContact CG2-CD1 4.27Å
200	R	39.3	Very low	38.2	Very low	208 Å²	208	92.1 Å²	92.1	79%	0.785	49%	0.492	S	S	*	.	H	α-helix	trans	-76.6	-30.5	178.5	-168.3	177.7	-176.6	179.1	1.1	113.3	A196 N197 T198	A196-R200 VanDerWaalsContact O-CB 3.24Å; A196-R200 WeakPolarHBondContact O-CB 3.45Å; A196-R200 PolarHBondContact O-N 3.33Å; N197-R200 PolarHBondContact O-N 2.61Å; T198-R200 VanDerWaalsContact C-N 3.34Å; T198-R200 PolarHBondContact O-N 2.74Å
201	N	41.8	Very low	37.2	Very low	130 Å²	130	94.3 Å²	94.3	70%	0.695	50%	0.504	S	S	*	.	H	α-helix	trans	-92	-7.2	178.7	-66.1	-19	0	0	0	113	N197 T198 N203	N197-N201 WeakPolarHBondContact O-CB 3.5Å; N197-N201 PolarHBondContact O-N 3.06Å; N197-N201 PolarHBondContact O-ND2 3.25Å; T198-N201 PolarHBondContact O-N 2.8Å; N201-N203 PolarHBondContact O-N 2.98Å; N201-N203 VanDerWaalsContact O-N 3.15Å
202	L	36.6	Very low	36.3	Very low	50 Å²	50	98.6 Å²	98.6	26%	0.262	53%	0.532	S	S	.	.	S	Bend	trans	-64.5	111.6	169.3	-90.9	160.4	0	0	0	108.4	T198 P204 F207	T198-L202 WeakPolarHBondContact O-CB 3.48Å; T198-L202 WeakPolarHBondContact O-CD1 3.35Å; T198-L202 WeakPolarHBondContact O-CG 3.34Å; T198-L202 PolarHBondContact O-N 3.45Å; L202-P204 VanDerWaalsContact O-CD 3.3Å; L202-P204 WeakPolarHBondContact O-CD 3.13Å; L202-F207 HydrophobicContact CD2-CE2 4.18Å
203	N	33.2	Very low	35.7	Very low	73 Å²	73	102.6 Å²	102.6	39%	0.39	55%	0.549	S	S	.	.			trans	-63.6	119.7	173.9	-172.8	-9.5	0	0	0	107.4	N201 N205 E206	N201-N203 PolarHBondContact O-N 2.98Å; N201-N203 VanDerWaalsContact O-N 3.15Å; N203-N205 PolarHBondContact O-N 3.38Å; N203-N205 WeakPolarHBondContact OD1-CB 3.44Å; N203-N205 PolarHBondContact OD1-N 3.5Å; N203-N205 VanDerWaalsContact OD1-N 3.11Å; N203-N205 PolarHBondContact OD1-ND2 2.88Å; N203-E206 HydrophobicContact CB-CB 4.27Å; N203-E206 HydrophobicContact CB-CG 4.04Å; N203-E206 PolarHBondContact O-N 2.89Å
204	P	35.6	Very low	35.1	Very low	93 Å²	93	105.4 Å²	105.4	60%	0.604	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-16.6	176.9	21.8	-31	0	0	0	112.3	L202	L202-P204 VanDerWaalsContact O-CD 3.3Å; L202-P204 WeakPolarHBondContact O-CD 3.13Å
205	N	34.3	Very low	34.3	Very low	102 Å²	102	112.1 Å²	112.1	55%	0.545	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-11.4	175.2	-54.1	-57.4	0	0	0	114.7	N203 F207 L208	N203-N205 PolarHBondContact O-N 3.38Å; N203-N205 WeakPolarHBondContact OD1-CB 3.44Å; N203-N205 PolarHBondContact OD1-N 3.5Å; N203-N205 VanDerWaalsContact OD1-N 3.11Å; N203-N205 PolarHBondContact OD1-ND2 2.88Å; N205-F207 PolarHBondContact O-N 3.34Å; N205-L208 HydrophobicContact CB-CD1 4.35Å; N205-L208 PolarHBondContact O-N 3.06Å
206	E	38.7	Very low	34	Very low	145 Å²	145	117.4 Å²	117.4	68%	0.678	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-9.5	169.4	-85.9	178.9	161.2	0	0	112.1	N203	N203-E206 HydrophobicContact CB-CB 4.27Å; N203-E206 HydrophobicContact CB-CG 4.04Å; N203-E206 PolarHBondContact O-N 2.89Å
207	F	32.3	Very low	33.5	Very low	156 Å²	156	122.3 Å²	122.3	68%	0.684	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	16.2	171.6	-92.4	-83.4	0	0	0	114	L202 N205 L209	L202-F207 HydrophobicContact CD2-CE2 4.18Å; N205-F207 PolarHBondContact O-N 3.34Å; F207-L209 PolarHBondContact O-N 2.93Å
208	L	26.9	Very low	33.1	Very low	114 Å²	114	127.2 Å²	127.2	60%	0.597	66%	0.662	S	S	*	*			trans	-70.7	84.9	163.5	-66.7	177.5	0	0	0	108.5	N205	N205-L208 HydrophobicContact CB-CD1 4.35Å; N205-L208 PolarHBondContact O-N 3.06Å
209	L	30.4	Very low	32.4	Very low	143 Å²	143	132.3 Å²	132.3	75%	0.749	68%	0.681	S	S	*	*			trans	-41.7	134.7	152.3	-73.2	160	0	0	0	107.4	F207 D211	F207-L209 PolarHBondContact O-N 2.93Å; L209-D211 PolarHBondContact O-N 2.97Å
210	P	27.1	Very low	32.1	Very low	104 Å²	104	140 Å²	140	68%	0.675	71%	0.711	S	S	*	*			trans	-54.7	117	-176.1	21.3	-30.9	0	0	0	108.9	N212	P210-N212 VanDerWaalsContact C-N 3.33Å; P210-N212 PolarHBondContact O-N 2.95Å
211	D	29.7	Very low	31.6	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	71%	0.707	S	S	*	*			trans	-57.1	101.2	170.8	-76.3	-34.3	0	0	0	107.1	L209 E213	L209-D211 PolarHBondContact O-N 2.97Å; D211-E213 PolarHBondContact O-N 2.77Å
212	N	26.2	Very low	31	Very low	158 Å²	158	138.9 Å²	138.9	85%	0.845	72%	0.716	S	S	*	*			trans	-72.5	70.9	172.4	-84.1	-37.9	0	0	0	108.7	P210	P210-N212 VanDerWaalsContact C-N 3.33Å; P210-N212 PolarHBondContact O-N 2.95Å
213	E	30.3	Very low	30.6	Very low	173 Å²	173	143.3 Å²	143.3	81%	0.808	75%	0.745	S	S	*	*			trans	-136.3	120.9	170.6	-67.3	-162.9	179.6	0	0	111.9	D211	D211-E213 PolarHBondContact O-N 2.77Å
214	S	33.8	Very low	30.4	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	76%	0.763	S	S	*	*			trans	84.8	100.3	162.5	73.8	0	0	0	0	118.6	T216	S214-T216 PolarHBondContact O-N 3.31Å
215	Q	28.1	Very low	30.2	Very low	195 Å²	195	147.1 Å²	147.1	91%	0.911	78%	0.778	S	S	*	*			trans	-31.7	119.8	143.8	-73.8	170.8	-25.3	0	0	111.5
216	T	32.1	Very low	29.9	Very low	133 Å²	133	149.5 Å²	149.5	82%	0.816	79%	0.789	S	S	*	*			trans	-157.1	120.4	133.3	24.3	0	0	0	0	110.7	S214 Q218	S214-T216 PolarHBondContact O-N 3.31Å; T216-Q218 PolarHBondContact O-N 3.03Å
217	N	26.1	Very low	29.7	Very low	156 Å²	156	149 Å²	149	83%	0.834	80%	0.795	S	S	*	*			trans	-47.6	126	167.9	-62.5	-61	0	0	0	111.6
218	Q	34.1	Very low	29.5	Very low	178 Å²	178	147.6 Å²	147.6	83%	0.832	80%	0.795	S	S	*	*			trans	-167.3	90.5	143.1	-106.5	170.9	104.6	0	0	112.1	T216	T216-Q218 PolarHBondContact O-N 3.03Å
219	Q	26.5	Very low	29.5	Very low	170 Å²	170	149.4 Å²	149.4	79%	0.794	81%	0.805	S	S	*	*			trans	8.8	109.3	134	-166.2	174.5	20.5	0	0	117	T221	Q219-T221 HydrophobicContact CG-CG2 4.47Å
220	F	30.5	Very low	29.3	Very low	206 Å²	206	150.1 Å²	150.1	90%	0.904	81%	0.81	S	S	*	*			trans	-132.1	120.1	150.1	-95.6	-82.6	0	0	0	110.9
221	T	29.8	Very low	29.4	Very low	112 Å²	112	153.2 Å²	153.2	69%	0.687	82%	0.82	S	S	*	*			trans	-89.6	132.6	-174	43.8	0	0	0	0	112.4	Q219	Q219-T221 HydrophobicContact CG-CG2 4.47Å
222	K	28	Very low	29.3	Very low	203 Å²	203	153.3 Å²	153.3	88%	0.883	83%	0.826	S	S	*	*			trans	-12.6	123.3	151.8	-171.6	175.5	-171.9	172.3	0	117.4
223	T	28.5	Very low	29.3	Very low	144 Å²	144	150.4 Å²	150.4	88%	0.883	82%	0.824	S	S	*	*			trans	176.8	129.6	132.2	30.1	0	0	0	0	111.8
224	G	29.3	Very low	29.1	Very low	74 Å²	74	150 Å²	150	76%	0.763	83%	0.826	S	S	*	*			trans	144	79.3	153.3	0	0	0	0	0	119.1
225	N	30.6	Very low	29	Very low	171 Å²	171	149.6 Å²	149.6	91%	0.914	82%	0.821	S	S	*	*			trans	58.2	128.6	145.8	-66.2	-4.8	0	0	0	124.2
226	I	29.3	Very low	29.2	Very low	152 Å²	152	146 Å²	146	78%	0.779	81%	0.814	S	S	*	*			trans	-74.5	136.6	174	-64	153.4	0	0	0	111.6
227	V	33.6	Very low	29.4	Very low	134 Å²	134	147 Å²	147	81%	0.812	82%	0.815	S	S	*	*			trans	-153.6	105.8	139.3	-179	0	0	0	0	109.5
228	D	27.8	Very low	29.7	Very low	128 Å²	128	145.5 Å²	145.5	68%	0.684	81%	0.806	S	S	*	*			trans	40.9	134	138	-58.5	-30.6	0	0	0	125.5
229	D	27.2	Very low	29.7	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	78%	0.784	S	S	*	*			trans	90.3	102.8	142.7	-69	-14.7	0	0	0	122.6
230	D	27.3	Very low	30.1	Very low	158 Å²	158	134.3 Å²	134.3	85%	0.845	77%	0.765	S	S	*	*			trans	87.2	43.2	131.1	-133.4	18.5	0	0	0	120.6
231	L	29.3	Very low	30.4	Very low	169 Å²	169	129 Å²	129	89%	0.885	75%	0.746	S	S	*	*			trans	-130.4	67.2	169.6	-78.9	165.7	0	0	0	112.1
232	T	26.5	Very low	30.7	Very low	142 Å²	142	127.1 Å²	127.1	87%	0.871	74%	0.737	S	S	*	*			trans	-140.4	60.4	166.3	51.6	0	0	0	0	111.6
233	A	26.2	Very low	31.3	Very low	97 Å²	97	120.8 Å²	120.8	80%	0.802	71%	0.713	S	S	*	*			trans	-98	98.5	155.5	0	0	0	0	0	107.3
234	L	26.8	Very low	31.9	Very low	164 Å²	164	116 Å²	116	86%	0.859	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-54.2	129.8	164.5	-89.4	138.6	0	0	0	107.8
235	P	30.9	Very low	32.5	Very low	105 Å²	105	118.6 Å²	118.6	68%	0.682	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.1	142.3	174.9	24.1	-31.9	0	0	0	109.3	N237	P235-N237 PolarHBondContact O-N 3.34Å
236	P	33	Very low	33.4	Very low	118 Å²	118	115.2 Å²	115.2	77%	0.766	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-56.2	130.6	177.9	23.7	-31.5	0	0	0	108.7	L238	P236-L238 PolarHBondContact O-N 3.34Å
237	N	36.3	Very low	33.9	Very low	156 Å²	156	109.5 Å²	109.5	83%	0.834	62%	0.622	S	S	*	*			trans	-44.3	111.7	175.6	-92.2	-38.4	0	0	0	109.4	P235	P235-N237 PolarHBondContact O-N 3.34Å
238	L	32.1	Very low	34.5	Very low	124 Å²	124	105.8 Å²	105.8	65%	0.649	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-53.1	134.5	176.2	-78.1	154.1	0	0	0	108.6	P236 S240	P236-L238 PolarHBondContact O-N 3.34Å; L238-S240 PolarHBondContact O-N 2.93Å; L238-S240 VanDerWaalsContact O-N 3.12Å
239	P	34.2	Very low	35.5	Very low	56 Å²	56	102.8 Å²	102.8	36%	0.364	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-56.1	124.5	171.6	21.9	-29.5	0	0	0	107.7	L241 I244	P239-L241 PolarHBondContact O-N 3.31Å; P239-I244 HydrophobicContact CB-CG1 4.22Å; P239-I244 HydrophobicContact CG-CD1 4.17Å; P239-I244 HydrophobicContact CG-CG1 4.22Å
240	S	35.5	Very low	36.6	Very low	56 Å²	56	98.6 Å²	98.6	39%	0.392	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-54.5	141.5	177.2	53.6	0	0	0	0	109.1	L238 S242 N243 I244	L238-S240 PolarHBondContact O-N 2.93Å; L238-S240 VanDerWaalsContact O-N 3.12Å; S240-S242 PolarHBondContact O-N 3.04Å; S240-S242 PolarHBondContact OG-OG 3.3Å; S240-N243 WeakPolarHBondContact O-CA 3.27Å; S240-N243 WeakPolarHBondContact O-CB 3.13Å; S240-N243 PolarHBondContact O-N 3.07Å; S240-N243 PolarHBondContact OG-ND2 3.11Å; S240-N243 VanDerWaalsContact OG-ND2 3.15Å; S240-N243 PolarHBondContact OG-OD1 3.05Å; S240-I244 PolarHBondContact O-N 3.35Å
241	L	35.8	Very low	37.7	Very low	95 Å²	95	92.5 Å²	92.5	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-56	-23	-176.9	-151.4	126.2	0	0	0	112.5	V199 P239 K245	V199-L241 HydrophobicContact CG2-CD1 4.27Å; P239-L241 PolarHBondContact O-N 3.31Å; L241-K245 WeakPolarHBondContact O-CG 3.3Å; L241-K245 PolarHBondContact O-N 2.84Å; L241-K245 VanDerWaalsContact O-N 3.14Å
242	S	36.3	Very low	38.7	Very low	72 Å²	72	88.5 Å²	88.5	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-41.1	170.3	55.4	0	0	0	0	113.3	S240 K245 Q246	S240-S242 PolarHBondContact O-N 3.04Å; S240-S242 PolarHBondContact OG-OG 3.3Å; S242-K245 PolarHBondContact O-N 2.92Å; S242-Q246 WeakPolarHBondContact O-CB 3.12Å; S242-Q246 PolarHBondContact O-N 2.9Å
243	N	40.5	Very low	39.7	Very low	70 Å²	70	86 Å²	86	37%	0.374	50%	0.495	S	S	.	.	H	α-helix	trans	-69.1	-41.1	179.9	-64.9	-3.9	0	0	0	110.2	S240 K245 Q246 D247	S240-N243 WeakPolarHBondContact O-CA 3.27Å; S240-N243 WeakPolarHBondContact O-CB 3.13Å; S240-N243 PolarHBondContact O-N 3.07Å; S240-N243 PolarHBondContact OG-ND2 3.11Å; S240-N243 VanDerWaalsContact OG-ND2 3.15Å; S240-N243 PolarHBondContact OG-OD1 3.05Å; N243-K245 VanDerWaalsContact C-N 3.35Å; N243-K245 PolarHBondContact O-N 2.83Å; N243-Q246 PolarHBondContact O-N 3.41Å; N243-D247 WeakPolarHBondContact O-CB 3.32Å; N243-D247 PolarHBondContact O-N 3.47Å
244	I	42	Very low	40.6	Very low	43 Å²	43	82.4 Å²	82.4	22%	0.221	46%	0.463	C	S	.	.	H	α-helix	trans	-61.9	-43.1	174.4	-59.8	172.9	0	0	0	110.8	A195 P239 S240 Q246 D247 V248	A195-I244 HydrophobicContact CB-CG2 4.18Å; P239-I244 HydrophobicContact CB-CG1 4.22Å; P239-I244 HydrophobicContact CG-CD1 4.17Å; P239-I244 HydrophobicContact CG-CG1 4.22Å; S240-I244 PolarHBondContact O-N 3.35Å; I244-Q246 VanDerWaalsContact C-N 3.33Å; I244-Q246 PolarHBondContact O-N 2.88Å; I244-D247 PolarHBondContact O-N 3.31Å; I244-V248 HydrophobicContact CG2-CG2 4.33Å; I244-V248 WeakPolarHBondContact O-CB 3.35Å; I244-V248 VanDerWaalsContact O-CG2 3.27Å; I244-V248 WeakPolarHBondContact O-CG2 3.03Å; I244-V248 PolarHBondContact O-N 2.67Å
245	K	40.6	Very low	41.5	Very low	129 Å²	129	77.8 Å²	77.8	56%	0.561	44%	0.436	S	S	*	.	H	α-helix	trans	-61.6	-41.5	175.5	-80.4	-176.4	177.1	-176.1	0	112.3	L241 S242 N243 S249	L241-K245 WeakPolarHBondContact O-CG 3.3Å; L241-K245 PolarHBondContact O-N 2.84Å; L241-K245 VanDerWaalsContact O-N 3.14Å; S242-K245 PolarHBondContact O-N 2.92Å; N243-K245 VanDerWaalsContact C-N 3.35Å; N243-K245 PolarHBondContact O-N 2.83Å; K245-S249 VanDerWaalsContact O-CB 3.28Å; K245-S249 WeakPolarHBondContact O-CB 3.14Å; K245-S249 PolarHBondContact O-N 3.46Å; K245-S249 PolarHBondContact O-OG 2.81Å
246	Q	49	Very low	42.2	Very low	100 Å²	100	79.1 Å²	79.1	47%	0.467	43%	0.429	S	S	.	.	H	α-helix	trans	-67.8	-43	178.4	-172.6	171.1	-8.7	0	0	111.3	S242 N243 I244 S249 Q250	S242-Q246 WeakPolarHBondContact O-CB 3.12Å; S242-Q246 PolarHBondContact O-N 2.9Å; N243-Q246 PolarHBondContact O-N 3.41Å; I244-Q246 VanDerWaalsContact C-N 3.33Å; I244-Q246 PolarHBondContact O-N 2.88Å; Q246-S249 PolarHBondContact O-N 2.84Å; Q246-Q250 HydrophobicContact CG-CG 4.45Å; Q246-Q250 WeakPolarHBondContact O-CB 3.29Å; Q246-Q250 VanDerWaalsContact O-CG 3.29Å; Q246-Q250 WeakPolarHBondContact O-CG 3.47Å; Q246-Q250 PolarHBondContact O-N 3.45Å
247	D	41.6	Very low	42.9	Very low	33 Å²	33	77.1 Å²	77.1	18%	0.176	41%	0.411	C	S	.	.	H	α-helix	trans	-63	-46	177.9	-70.5	2.3	0	0	0	111.3	N243 I244 Q250 L251 F365	N243-D247 WeakPolarHBondContact O-CB 3.32Å; N243-D247 PolarHBondContact O-N 3.47Å; I244-D247 PolarHBondContact O-N 3.31Å; D247-Q250 PolarHBondContact O-N 3.41Å; D247-L251 WeakPolarHBondContact O-CB 3.33Å; D247-L251 PolarHBondContact O-N 3.48Å; D247-F365 VanDerWaalsContact OD1-CB 3.23Å; D247-F365 WeakPolarHBondContact OD1-CB 3.26Å
248	V	46.4	Very low	42.9	Very low	56 Å²	56	70.2 Å²	70.2	34%	0.339	38%	0.378	S	S	.	.	H	α-helix	trans	-65.7	-41.4	176.4	173.6	0	0	0	0	110.9	I244 L251 V252	I244-V248 HydrophobicContact CG2-CG2 4.33Å; I244-V248 WeakPolarHBondContact O-CB 3.35Å; I244-V248 VanDerWaalsContact O-CG2 3.27Å; I244-V248 WeakPolarHBondContact O-CG2 3.03Å; I244-V248 PolarHBondContact O-N 2.67Å; V248-L251 PolarHBondContact O-N 3.08Å; V248-V252 HydrophobicContact CG1-CG2 4.37Å; V248-V252 WeakPolarHBondContact O-CB 3.28Å; V248-V252 VanDerWaalsContact O-CG2 3.23Å; V248-V252 WeakPolarHBondContact O-CG2 3.18Å; V248-V252 PolarHBondContact O-N 2.76Å
249	S	48.6	Very low	43.4	Very low	64 Å²	64	66.4 Å²	66.4	45%	0.448	36%	0.357	S	S	.	.	H	α-helix	trans	-65.1	-44.7	177.6	-57	0	0	0	0	111.2	K245 Q246 L251 V252 D253	K245-S249 VanDerWaalsContact O-CB 3.28Å; K245-S249 WeakPolarHBondContact O-CB 3.14Å; K245-S249 PolarHBondContact O-N 3.46Å; K245-S249 PolarHBondContact O-OG 2.81Å; Q246-S249 PolarHBondContact O-N 2.84Å; S249-L251 VanDerWaalsContact C-N 3.34Å; S249-L251 PolarHBondContact O-N 3Å; S249-V252 PolarHBondContact O-N 3.35Å; S249-D253 VanDerWaalsContact O-CB 3.28Å; S249-D253 WeakPolarHBondContact O-CB 3.46Å; S249-D253 PolarHBondContact O-N 3.2Å
250	Q	50.5	Low	43.5	Very low	63 Å²	63	69.6 Å²	69.6	29%	0.294	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-37	177.6	-75.6	-177.5	1.9	0	0	112.5	Q246 D247 S254	Q246-Q250 HydrophobicContact CG-CG 4.45Å; Q246-Q250 WeakPolarHBondContact O-CB 3.29Å; Q246-Q250 VanDerWaalsContact O-CG 3.29Å; Q246-Q250 WeakPolarHBondContact O-CG 3.47Å; Q246-Q250 PolarHBondContact O-N 3.45Å; D247-Q250 PolarHBondContact O-N 3.41Å; Q250-S254 WeakPolarHBondContact O-CB 3.48Å; Q250-S254 PolarHBondContact O-N 2.81Å; Q250-S254 PolarHBondContact O-OG 2.75Å
251	L	49.1	Very low	43.5	Very low	31 Å²	31	68.8 Å²	68.8	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-64.7	-47.9	173.9	176.5	75.5	0	0	0	111	V188 D247 V248 S249 S254 F255 A290	V188-L251 HydrophobicContact CB-CD2 4.23Å; V188-L251 HydrophobicContact CG1-CD2 3.73Å; V188-L251 HydrophobicContact CG2-CD1 4.04Å; V188-L251 HydrophobicContact CG2-CD2 3.62Å; V188-L251 HydrophobicContact CG2-CG 4.24Å; D247-L251 WeakPolarHBondContact O-CB 3.33Å; D247-L251 PolarHBondContact O-N 3.48Å; V248-L251 PolarHBondContact O-N 3.08Å; S249-L251 VanDerWaalsContact C-N 3.34Å; S249-L251 PolarHBondContact O-N 3Å; L251-S254 PolarHBondContact O-N 3.31Å; L251-F255 VanDerWaalsContact O-CB 3.24Å; L251-F255 WeakPolarHBondContact O-CB 3.46Å; L251-F255 PolarHBondContact O-N 2.79Å; L251-A290 HydrophobicContact CD1-CB 3.91Å
252	V	49.9	Very low	43.5	Very low	84 Å²	84	67.7 Å²	67.7	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-43.7	177.1	170.4	0	0	0	0	110.7	V248 S249 S254 F255 Y256	V248-V252 HydrophobicContact CG1-CG2 4.37Å; V248-V252 WeakPolarHBondContact O-CB 3.28Å; V248-V252 VanDerWaalsContact O-CG2 3.23Å; V248-V252 WeakPolarHBondContact O-CG2 3.18Å; V248-V252 PolarHBondContact O-N 2.76Å; S249-V252 PolarHBondContact O-N 3.35Å; V252-S254 VanDerWaalsContact C-N 3.35Å; V252-S254 PolarHBondContact O-N 3.46Å; V252-F255 PolarHBondContact O-N 2.81Å; V252-Y256 VanDerWaalsContact O-CB 3.24Å; V252-Y256 WeakPolarHBondContact O-CB 3.41Å; V252-Y256 PolarHBondContact O-N 3.49Å
253	D	48.5	Very low	43.2	Very low	91 Å²	91	67.1 Å²	67.1	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-63.8	-40.8	176	-71.4	-18.5	0	0	0	111.1	S249 N257	S249-D253 VanDerWaalsContact O-CB 3.28Å; S249-D253 WeakPolarHBondContact O-CB 3.46Å; S249-D253 PolarHBondContact O-N 3.2Å; D253-N257 WeakPolarHBondContact O-CB 3.49Å; D253-N257 PolarHBondContact O-N 2.86Å; D253-N257 PolarHBondContact O-ND2 3.33Å
254	S	44.4	Very low	43	Very low	20 Å²	20	68.7 Å²	68.7	14%	0.14	38%	0.378	C	S	.	.	H	α-helix	trans	-70.3	-35	178.2	-60.2	0	0	0	0	111.9	Q250 L251 V252 G258	Q250-S254 WeakPolarHBondContact O-CB 3.48Å; Q250-S254 PolarHBondContact O-N 2.81Å; Q250-S254 PolarHBondContact O-OG 2.75Å; L251-S254 PolarHBondContact O-N 3.31Å; V252-S254 VanDerWaalsContact C-N 3.35Å; V252-S254 PolarHBondContact O-N 3.46Å; S254-G258 WeakPolarHBondContact O-CA 3.38Å; S254-G258 PolarHBondContact O-N 2.88Å
255	F	47.2	Very low	42.3	Very low	68 Å²	68	75.6 Å²	75.6	30%	0.298	40%	0.403	S	S	.	.	H	α-helix	trans	-71.4	-45.2	175.4	-175.9	-103.3	0	0	0	111.6	F167 L251 V252 G258 L259	F167-F255 HydrophobicContact CD2-CE2 4.43Å; F167-F255 AromaticContact CD2-CZ 3.63Å; F167-F255 HydrophobicContact CD2-CZ 3.63Å; F167-F255 HydrophobicContact CE2-CE2 4.04Å; F167-F255 AromaticContact CE2-CZ 3.63Å; F167-F255 HydrophobicContact CE2-CZ 3.63Å; L251-F255 VanDerWaalsContact O-CB 3.24Å; L251-F255 WeakPolarHBondContact O-CB 3.46Å; L251-F255 PolarHBondContact O-N 2.79Å; V252-F255 PolarHBondContact O-N 2.81Å; F255-G258 PolarHBondContact O-N 3.46Å; F255-L259 HydrophobicContact CD1-CD1 3.67Å; F255-L259 HydrophobicContact CE1-CD1 3.2Å; F255-L259 HydrophobicContact CE1-CG 4.47Å; F255-L259 HydrophobicContact CE2-CD1 4.17Å; F255-L259 HydrophobicContact CG-CD1 4.33Å; F255-L259 HydrophobicContact CZ-CD1 3.5Å; F255-L259 HydrophobicContact CZ-CG 4.48Å; F255-L259 WeakPolarHBondContact O-CB 3.44Å; F255-L259 PolarHBondContact O-N 2.85Å
256	Y	44.9	Very low	41.8	Very low	132 Å²	132	74.7 Å²	74.7	52%	0.518	40%	0.399	S	S	.	.	H	α-helix	trans	-61.9	-48.2	175.2	-173.4	-96.6	0	0	0	110.9	V252 G258 L259 M260	V252-Y256 VanDerWaalsContact O-CB 3.24Å; V252-Y256 WeakPolarHBondContact O-CB 3.41Å; V252-Y256 PolarHBondContact O-N 3.49Å; Y256-G258 VanDerWaalsContact C-N 3.3Å; Y256-G258 PolarHBondContact O-N 3.28Å; Y256-L259 PolarHBondContact O-N 2.67Å; Y256-M260 HydrophobicContact CD1-CG 4.3Å; Y256-M260 HydrophobicContact CE1-CG 4.05Å; Y256-M260 WeakPolarHBondContact O-CB 3.23Å; Y256-M260 WeakPolarHBondContact O-CG 3.42Å; Y256-M260 PolarHBondContact O-N 3.26Å
257	N	46.8	Very low	40.7	Very low	76 Å²	76	73.7 Å²	73.7	41%	0.406	42%	0.415	S	S	.	.	H	α-helix	trans	-66	-33.6	174.4	-68.9	-37.3	0	0	0	111.8	D253 S261 T283	D253-N257 WeakPolarHBondContact O-CB 3.49Å; D253-N257 PolarHBondContact O-N 2.86Å; D253-N257 PolarHBondContact O-ND2 3.33Å; N257-S261 WeakPolarHBondContact O-CA 3.38Å; N257-S261 WeakPolarHBondContact O-CB 3.29Å; N257-S261 PolarHBondContact O-N 2.7Å; N257-T283 HydrophobicContact CB-CG2 4.42Å
258	G	37.7	Very low	39.9	Very low	12 Å²	12	79.6 Å²	79.6	12%	0.124	45%	0.446	C	S	.	.	H	α-helix	trans	-62.8	-51.8	175.5	0	0	0	0	0	112.1	S254 F255 Y256 S261 T262	S254-G258 WeakPolarHBondContact O-CA 3.38Å; S254-G258 PolarHBondContact O-N 2.88Å; F255-G258 PolarHBondContact O-N 3.46Å; Y256-G258 VanDerWaalsContact C-N 3.3Å; Y256-G258 PolarHBondContact O-N 3.28Å; G258-S261 PolarHBondContact O-N 3Å; G258-T262 WeakPolarHBondContact O-CG2 3.44Å; G258-T262 PolarHBondContact O-N 3.02Å; G258-T262 PolarHBondContact O-OG1 2.91Å
259	L	41.4	Very low	39.2	Very low	43 Å²	43	84.2 Å²	84.2	23%	0.225	47%	0.467	C	S	.	.	H	α-helix	trans	-60	-46.2	175	-88.6	158.1	0	0	0	111.9	V170 F255 Y256 S261 T262	V170-L259 HydrophobicContact CB-CD2 4.09Å; V170-L259 HydrophobicContact CG1-CD2 3.93Å; V170-L259 HydrophobicContact CG2-CD2 3.65Å; F255-L259 HydrophobicContact CD1-CD1 3.67Å; F255-L259 HydrophobicContact CE1-CD1 3.2Å; F255-L259 HydrophobicContact CE1-CG 4.47Å; F255-L259 HydrophobicContact CE2-CD1 4.17Å; F255-L259 HydrophobicContact CG-CD1 4.33Å; F255-L259 HydrophobicContact CZ-CD1 3.5Å; F255-L259 HydrophobicContact CZ-CG 4.48Å; F255-L259 WeakPolarHBondContact O-CB 3.44Å; F255-L259 PolarHBondContact O-N 2.85Å; Y256-L259 PolarHBondContact O-N 2.67Å; L259-S261 VanDerWaalsContact C-N 3.34Å; L259-S261 PolarHBondContact O-N 3.37Å; L259-T262 PolarHBondContact O-N 3.18Å; L259-T262 PolarHBondContact O-OG1 3.35Å
260	M	37.6	Very low	38.1	Very low	124 Å²	124	87.8 Å²	87.8	61%	0.611	49%	0.487	S	S	*	.	H	α-helix	trans	-71.5	-28.1	179.3	-63.4	-66.1	-100.2	0	0	112.5	Y256	Y256-M260 HydrophobicContact CD1-CG 4.3Å; Y256-M260 HydrophobicContact CE1-CG 4.05Å; Y256-M260 WeakPolarHBondContact O-CB 3.23Å; Y256-M260 WeakPolarHBondContact O-CG 3.42Å; Y256-M260 PolarHBondContact O-N 3.26Å
261	S	35	Very low	37	Very low	38 Å²	38	87.8 Å²	87.8	27%	0.266	50%	0.503	S	S	.	.	H	α-helix	trans	-85.8	-10.8	177.1	-163.4	0	0	0	0	113.1	N257 G258 L259 G263	N257-S261 WeakPolarHBondContact O-CA 3.38Å; N257-S261 WeakPolarHBondContact O-CB 3.29Å; N257-S261 PolarHBondContact O-N 2.7Å; G258-S261 PolarHBondContact O-N 3Å; L259-S261 VanDerWaalsContact C-N 3.34Å; L259-S261 PolarHBondContact O-N 3.37Å; S261-G263 PolarHBondContact O-N 2.81Å
262	T	36.1	Very low	35.9	Very low	73 Å²	73	95.3 Å²	95.3	45%	0.448	54%	0.538	S	S	.	.			trans	-72.6	29.3	163.2	53	0	0	0	0	113.3	G258 L259 T264	G258-T262 WeakPolarHBondContact O-CG2 3.44Å; G258-T262 PolarHBondContact O-N 3.02Å; G258-T262 PolarHBondContact O-OG1 2.91Å; L259-T262 PolarHBondContact O-N 3.18Å; L259-T262 PolarHBondContact O-OG1 3.35Å; T262-T264 PolarHBondContact O-N 3.26Å
263	G	30.4	Very low	35	Very low	59 Å²	59	97.7 Å²	97.7	61%	0.608	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	47.6	178.8	0	0	0	0	0	116.3	S261	S261-G263 PolarHBondContact O-N 2.81Å
264	T	34.9	Very low	34.1	Very low	104 Å²	104	102.5 Å²	102.5	64%	0.638	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	4.7	168	-11.2	0	0	0	0	111.5	T262 K280	T262-T264 PolarHBondContact O-N 3.26Å; T264-K280 PolarHBondContact OG1-NZ 3.47Å
265	Y	28.6	Very low	33.7	Very low	188 Å²	188	111.3 Å²	111.3	74%	0.737	60%	0.599	S	S	*	*	S	Bend	trans	-139.4	7.3	173.1	-104.2	-83.3	0	0	0	117
266	F	30.3	Very low	33.3	Very low	110 Å²	110	117.8 Å²	117.8	48%	0.482	63%	0.627	S	S	.	*			trans	-126	74.8	172	-91.9	-85.6	0	0	0	110.9	E169 L268	E169-F266 HydrophobicContact CG-CZ 4.46Å; F266-L268 PolarHBondContact O-N 3.45Å
267	G	24.3	Very low	33	Very low	78 Å²	78	119.5 Å²	119.5	80%	0.804	65%	0.645	S	S	*	*			trans	-77.8	20.5	173.7	0	0	0	0	0	114.8
268	L	25.8	Very low	33.2	Very low	157 Å²	157	121.1 Å²	121.1	82%	0.822	65%	0.648	S	S	*	*			trans	-145.7	37.5	-169.6	-74.4	178.9	0	0	0	115.9	F266	F266-L268 PolarHBondContact O-N 3.45Å
269	I	31	Very low	34.7	Very low	153 Å²	153	123.9 Å²	123.9	79%	0.785	67%	0.666	S	S	*	*			trans	-142.8	101.7	151.2	-42.7	175	0	0	0	110.2
270	T	26.7	Very low	36	Very low	140 Å²	140	124.7 Å²	124.7	86%	0.859	67%	0.668	S	S	*	*			trans	-54.1	140.8	170.1	47.8	0	0	0	0	113.3
271	G	27.2	Very low	37.7	Very low	62 Å²	62	121.3 Å²	121.3	64%	0.639	65%	0.65	S	S	*	*			trans	163.2	103.4	160.4	0	0	0	0	0	112.4	N273	G271-N273 PolarHBondContact O-N 2.96Å
272	E	26.2	Very low	39.8	Very low	189 Å²	189	122.1 Å²	122.1	88%	0.883	65%	0.65	S	S	*	*			trans	-45.3	96.5	172.5	-67.6	173	130	0	0	112.1
273	N	30.3	Very low	41.5	Very low	135 Å²	135	119.2 Å²	119.2	72%	0.722	63%	0.632	S	S	*	*			trans	-105.8	99.5	163.5	-82.3	-32.5	0	0	0	108	G271 Y275	G271-N273 PolarHBondContact O-N 2.96Å; N273-Y275 PolarHBondContact O-N 2.96Å
274	Q	29.2	Very low	43.6	Very low	191 Å²	191	119.6 Å²	119.6	89%	0.893	62%	0.615	S	S	*	*			trans	-67.6	56.9	171.8	-67.2	-164.2	7.2	0	0	112.5
275	Y	36.9	Very low	45.9	Very low	206 Å²	206	115 Å²	115	81%	0.808	59%	0.586	S	S	*	*	S	Bend	trans	-94.9	117.2	161.2	-86.5	-89.9	0	0	0	107.5	N273 D277	N273-Y275 PolarHBondContact O-N 2.96Å; Y275-D277 PolarHBondContact O-N 3.31Å
276	K	38.5	Very low	48.2	Very low	203 Å²	203	106.5 Å²	106.5	88%	0.883	55%	0.554	S	S	*	*			trans	-27.8	109.2	179.9	-74.2	178.2	175.1	179.7	0	111.3	K278	K276-K278 VanDerWaalsContact C-N 3.29Å; K276-K278 PolarHBondContact O-N 3.38Å
277	D	37.6	Very low	50.4	Low	169 Å²	169	104.2 Å²	104.2	90%	0.904	55%	0.546	S	S	*	.			trans	-51.7	91	179.2	-118.3	-17.7	0	0	0	109.5	Y275 S279	Y275-D277 PolarHBondContact O-N 3.31Å; D277-S279 PolarHBondContact O-N 2.99Å
278	K	51.8	Low	53.2	Low	109 Å²	109	102.2 Å²	102.2	47%	0.474	52%	0.517	S	S	.	.			trans	-65.8	126.1	163.2	-75.2	-176.4	175.5	-173.6	0	104.5	K276 K280 Q282 D286	K276-K278 VanDerWaalsContact C-N 3.29Å; K276-K278 PolarHBondContact O-N 3.38Å; K278-K280 PolarHBondContact O-N 3.27Å; K278-Q282 HydrophobicContact CB-CB 4.35Å; K278-Q282 HydrophobicContact CB-CG 4.43Å; K278-Q282 HydrophobicContact CD-CG 4.37Å; K278-Q282 HydrophobicContact CG-CG 4.49Å; K278-D286 IonicContact NZ-OD2 2.89Å; K278-D286 PolarHBondContact NZ-OD2 2.97Å
279	S	68.4	Low	56.1	Low	71 Å²	71	95.1 Å²	95.1	50%	0.497	48%	0.479	S	S	.	.			trans	-52.9	142.6	175.5	65.2	0	0	0	0	109	D277 H281 Q282 T283	D277-S279 PolarHBondContact O-N 2.99Å; S279-H281 CarbonylContact O-C 3.59Å; S279-H281 PolarHBondContact O-N 3.5Å; S279-Q282 WeakPolarHBondContact O-CA 3.47Å; S279-Q282 WeakPolarHBondContact O-CB 3.42Å; S279-Q282 PolarHBondContact O-N 2.82Å; S279-Q282 PolarHBondContact OG-N 3.02Å; S279-T283 PolarHBondContact O-N 3.48Å; S279-T283 VanDerWaalsContact O-N 3.16Å
280	K	70.1	Confident	58.2	Low	59 Å²	59	88.1 Å²	88.1	26%	0.257	44%	0.444	S	S	.	.	H	α-helix	trans	-46.1	-37.3	177.8	-178.2	176.6	-179.1	174.1	0	112.4	T264 K278 T283 R284	T264-K280 PolarHBondContact OG1-NZ 3.47Å; K278-K280 PolarHBondContact O-N 3.27Å; K280-T283 PolarHBondContact O-N 3.42Å; K280-R284 WeakPolarHBondContact O-CG 3.41Å; K280-R284 PolarHBondContact O-N 3.12Å
281	H	73.3	Confident	60.6	Low	54 Å²	54	82.4 Å²	82.4	25%	0.25	41%	0.408	C	S	.	.	H	α-helix	trans	-60.5	-46.3	174.1	174.8	-109.1	0	0	0	113.1	S279 T283 R284 L285 D402	S279-H281 CarbonylContact O-C 3.59Å; S279-H281 PolarHBondContact O-N 3.5Å; H281-T283 VanDerWaalsContact C-N 3.33Å; H281-T283 PolarHBondContact O-N 2.95Å; H281-R284 PolarHBondContact O-N 3.46Å; H281-L285 VanDerWaalsContact CE1-CD1 3.41Å; H281-L285 WeakPolarHBondContact CE1-CD1 3.46Å; H281-L285 WeakPolarHBondContact O-CG 3.34Å; H281-L285 PolarHBondContact O-N 3.16Å; H281-D402 IonicContact CD2-OD1 3.27Å; H281-D402 IonicContact CE1-OD1 3.96Å; H281-D402 IonicContact NE2-OD1 2.89Å; H281-D402 PolarHBondContact NE2-OD1 2.8Å
282	Q	78.5	Confident	62.9	Low	55 Å²	55	79.5 Å²	79.5	26%	0.257	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-39.6	176.4	-175	63.5	48.3	0	0	111.9	K278 S279 R284 L285 D286 Y363	K278-Q282 HydrophobicContact CB-CB 4.35Å; K278-Q282 HydrophobicContact CB-CG 4.43Å; K278-Q282 HydrophobicContact CD-CG 4.37Å; K278-Q282 HydrophobicContact CG-CG 4.49Å; S279-Q282 WeakPolarHBondContact O-CA 3.47Å; S279-Q282 WeakPolarHBondContact O-CB 3.42Å; S279-Q282 PolarHBondContact O-N 2.82Å; S279-Q282 PolarHBondContact OG-N 3.02Å; Q282-R284 VanDerWaalsContact C-N 3.35Å; Q282-L285 WeakPolarHBondContact O-CB 3.45Å; Q282-L285 PolarHBondContact O-N 2.99Å; Q282-D286 PolarHBondContact NE2-OD1 2.99Å; Q282-D286 VanDerWaalsContact O-CG 3.23Å; Q282-D286 PolarHBondContact O-N 2.99Å; Q282-Y363 PolarHBondContact NE2-OH 3.34Å
283	T	72.6	Confident	65.4	Low	11 Å²	11	71.2 Å²	71.2	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-63.5	-41.6	175.8	-52.8	0	0	0	0	111.5	N257 S279 K280 H281 L285 D286 L287	N257-T283 HydrophobicContact CB-CG2 4.42Å; S279-T283 PolarHBondContact O-N 3.48Å; S279-T283 VanDerWaalsContact O-N 3.16Å; K280-T283 PolarHBondContact O-N 3.42Å; H281-T283 VanDerWaalsContact C-N 3.33Å; H281-T283 PolarHBondContact O-N 2.95Å; T283-L285 VanDerWaalsContact C-N 3.33Å; T283-L285 PolarHBondContact O-N 3.22Å; T283-D286 PolarHBondContact O-N 2.94Å; T283-L287 PolarHBondContact O-N 3.47Å
284	R	73.5	Confident	67.8	Low	68 Å²	68	64.8 Å²	64.8	26%	0.257	31%	0.308	S	S	.	.	H	α-helix	trans	-65.1	-37.2	175.1	-68	176.2	101.4	-178.3	6.4	111.7	E176 K280 H281 Q282 L287 L288 L401 E405	E176-R284 IonicContact OE1-NH2 3.81Å; K280-R284 WeakPolarHBondContact O-CG 3.41Å; K280-R284 PolarHBondContact O-N 3.12Å; H281-R284 PolarHBondContact O-N 3.46Å; Q282-R284 VanDerWaalsContact C-N 3.35Å; R284-L287 PolarHBondContact O-N 2.93Å; R284-L288 WeakPolarHBondContact O-CG 3.45Å; R284-L288 PolarHBondContact O-N 3.4Å; R284-L401 HydrophobicContact CB-CD1 3.94Å; R284-L401 HydrophobicContact CB-CD2 3.79Å; R284-E405 IonicContact CZ-OE1 3.12Å; R284-E405 IonicContact NH1-OE1 3.43Å; R284-E405 PolarHBondContact NH1-OE1 3.04Å
285	L	83.4	Confident	70.4	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.031	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-42.6	171.9	-74.2	175	0	0	0	112.4	H281 Q282 T283 L287 L288 R289 V398 L401	H281-L285 VanDerWaalsContact CE1-CD1 3.41Å; H281-L285 WeakPolarHBondContact CE1-CD1 3.46Å; H281-L285 WeakPolarHBondContact O-CG 3.34Å; H281-L285 PolarHBondContact O-N 3.16Å; Q282-L285 WeakPolarHBondContact O-CB 3.45Å; Q282-L285 PolarHBondContact O-N 2.99Å; T283-L285 VanDerWaalsContact C-N 3.33Å; T283-L285 PolarHBondContact O-N 3.22Å; L285-L287 VanDerWaalsContact C-N 3.3Å; L285-L287 PolarHBondContact O-N 3.31Å; L285-L288 PolarHBondContact O-N 3.23Å; L285-R289 VanDerWaalsContact O-CG 3.29Å; L285-R289 WeakPolarHBondContact O-CG 3.23Å; L285-R289 PolarHBondContact O-N 2.81Å; L285-V398 HydrophobicContact CD2-CB 4.37Å; L285-V398 HydrophobicContact CD2-CG1 3.9Å; L285-V398 HydrophobicContact CD2-CG2 3.83Å; L285-L401 HydrophobicContact CD2-CD2 3.75Å; L285-L401 HydrophobicContact CG-CD2 3.9Å
286	D	77.7	Confident	72.5	Confident	10 Å²	10	50 Å²	50	5%	0.053	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-39.6	177.7	-69.3	-6.6	0	0	0	110.6	K278 Q282 T283 R289 A290 Y363	K278-D286 IonicContact NZ-OD2 2.89Å; K278-D286 PolarHBondContact NZ-OD2 2.97Å; Q282-D286 PolarHBondContact NE2-OD1 2.99Å; Q282-D286 VanDerWaalsContact O-CG 3.23Å; Q282-D286 PolarHBondContact O-N 2.99Å; T283-D286 PolarHBondContact O-N 2.94Å; D286-R289 PolarHBondContact O-N 3.41Å; D286-R289 IonicContact OD1-NH1 3.23Å; D286-R289 PolarHBondContact OD1-NH1 3.46Å; D286-A290 WeakPolarHBondContact O-CB 3.48Å; D286-A290 PolarHBondContact O-N 3.16Å; D286-Y363 PolarHBondContact OD1-OH 2.81Å
287	L	76.3	Confident	74.5	Confident	62 Å²	62	44 Å²	44	33%	0.325	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-47.6	173.3	-173.4	69.5	0	0	0	112.1	T283 R284 L285 R289 A290 D291	T283-L287 PolarHBondContact O-N 3.47Å; R284-L287 PolarHBondContact O-N 2.93Å; L285-L287 VanDerWaalsContact C-N 3.3Å; L285-L287 PolarHBondContact O-N 3.31Å; L287-R289 VanDerWaalsContact C-N 3.26Å; L287-R289 PolarHBondContact O-N 2.91Å; L287-A290 PolarHBondContact O-N 2.96Å; L287-D291 WeakPolarHBondContact O-CB 3.43Å; L287-D291 PolarHBondContact O-N 2.86Å
288	L	82.7	Confident	76.6	Confident	37 Å²	37	40.1 Å²	40.1	19%	0.194	20%	0.2	C	C	.	.	H	α-helix	trans	-59.1	-37.8	176.9	-77.7	176.5	0	0	0	112.2	R284 L285 T294 R397 L401	R284-L288 WeakPolarHBondContact O-CG 3.45Å; R284-L288 PolarHBondContact O-N 3.4Å; L285-L288 PolarHBondContact O-N 3.23Å; L288-T294 VanDerWaalsContact O-CB 3.3Å; L288-T294 WeakPolarHBondContact O-CB 3.34Å; L288-T294 WeakPolarHBondContact O-CG2 3.34Å; L288-T294 PolarHBondContact O-OG1 2.78Å; L288-R397 HydrophobicContact CD1-CB 4.4Å; L288-R397 HydrophobicContact CD2-CB 4.3Å; L288-L401 HydrophobicContact CD1-CB 4.28Å; L288-L401 HydrophobicContact CD1-CD2 3.86Å
289	R	85.7	Confident	78.2	Confident	8 Å²	8	35.4 Å²	35.4	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-68.7	-44.1	176.4	-69	170.9	-167.2	128.6	4	111.5	L285 D286 L287 D291 Y295 Y363 F365 M366 Y394	L285-R289 VanDerWaalsContact O-CG 3.29Å; L285-R289 WeakPolarHBondContact O-CG 3.23Å; L285-R289 PolarHBondContact O-N 2.81Å; D286-R289 PolarHBondContact O-N 3.41Å; D286-R289 IonicContact OD1-NH1 3.23Å; D286-R289 PolarHBondContact OD1-NH1 3.46Å; L287-R289 VanDerWaalsContact C-N 3.26Å; L287-R289 PolarHBondContact O-N 2.91Å; R289-D291 VanDerWaalsContact C-N 3.28Å; R289-D291 PolarHBondContact O-N 2.76Å; R289-Y295 WeakPolarHBondContact CA-OH 3.48Å; R289-Y295 WeakPolarHBondContact O-CE2 3.38Å; R289-Y295 PolarHBondContact O-OH 3.48Å; R289-Y363 VanDerWaalsContact NH1-CZ 3.34Å; R289-Y363 PolarHBondContact NH1-OH 3.05Å; R289-F365 HydrophobicContact CB-CE2 4.28Å; R289-F365 HydrophobicContact CB-CZ 3.98Å; R289-F365 VanDerWaalsContact O-CE2 3.29Å; R289-F365 WeakPolarHBondContact O-CE2 3.38Å; R289-M366 HydrophobicContact CB-SD 4.07Å; R289-M366 HydrophobicContact CG-SD 3.93Å; R289-Y394 HydrophobicContact CG-CE2 3.58Å; R289-Y394 PolarHBondContact NE-OH 3.46Å; R289-Y394 PolarHBondContact NH2-OH 3.45Å
290	A	76.3	Confident	78.7	Confident	6 Å²	6	37.4 Å²	37.4	5%	0.05	19%	0.191	C	C	.	.	H	α-helix	trans	-69.6	-26.3	-177.6	0	0	0	0	0	112.9	L251 D286 L287 P292 Y369	L251-A290 HydrophobicContact CD1-CB 3.91Å; D286-A290 WeakPolarHBondContact O-CB 3.48Å; D286-A290 PolarHBondContact O-N 3.16Å; L287-A290 PolarHBondContact O-N 2.96Å; A290-P292 WeakPolarHBondContact O-CD 3.34Å; A290-Y369 PolarHBondContact O-OH 3.44Å
291	D	77.4	Confident	79	Confident	19 Å²	19	40 Å²	40	10%	0.102	21%	0.212	C	C	.	.			trans	-75.1	114.6	-178.9	-172.3	1.1	0	0	0	112.6	T184 L287 R289 A293 T294	T184-D291 PolarHBondContact OG1-OD2 3.38Å; L287-D291 WeakPolarHBondContact O-CB 3.43Å; L287-D291 PolarHBondContact O-N 2.86Å; R289-D291 VanDerWaalsContact C-N 3.28Å; R289-D291 PolarHBondContact O-N 2.76Å; D291-A293 PolarHBondContact O-N 3.35Å; D291-A293 VanDerWaalsContact OD1-CB 3.29Å; D291-A293 WeakPolarHBondContact OD1-CB 3.34Å; D291-A293 PolarHBondContact OD1-N 2.92Å; D291-T294 VanDerWaalsContact O-CB 3.25Å; D291-T294 WeakPolarHBondContact O-CB 3.35Å; D291-T294 PolarHBondContact O-N 2.99Å; D291-T294 PolarHBondContact O-OG1 3.4Å
292	P	73.9	Confident	79.2	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.013	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.4	175.1	-17.7	28.3	0	0	0	113.2	S187 A290 T294 Y295 E296 Y369	S187-P292 VanDerWaalsContact OG-CG 3.23Å; S187-P292 WeakPolarHBondContact OG-CG 3.29Å; A290-P292 WeakPolarHBondContact O-CD 3.34Å; P292-T294 PolarHBondContact O-N 2.93Å; P292-T294 VanDerWaalsContact O-N 3.13Å; P292-Y295 PolarHBondContact O-N 3.21Å; P292-E296 WeakPolarHBondContact O-CG 3.43Å; P292-E296 PolarHBondContact O-N 3.44Å; P292-E296 VanDerWaalsContact O-N 3.09Å; P292-Y369 HydrophobicContact CB-CD1 4.37Å; P292-Y369 HydrophobicContact CB-CE1 3.61Å; P292-Y369 HydrophobicContact CG-CE1 3.62Å; P292-Y369 WeakPolarHBondContact CG-OH 3.16Å
293	A	78.6	Confident	78.9	Confident	14 Å²	14	40.2 Å²	40.2	12%	0.116	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-22.2	-177.4	0	0	0	0	0	112.3	D291 Y295 L297 R397	D291-A293 PolarHBondContact O-N 3.35Å; D291-A293 VanDerWaalsContact OD1-CB 3.29Å; D291-A293 WeakPolarHBondContact OD1-CB 3.34Å; D291-A293 PolarHBondContact OD1-N 2.92Å; A293-Y295 PolarHBondContact O-N 2.69Å; A293-L297 HydrophobicContact CB-CD1 4.11Å; A293-L297 HydrophobicContact CB-CG 4.47Å; A293-L297 WeakPolarHBondContact O-CB 3.46Å; A293-L297 PolarHBondContact O-N 3.24Å; A293-L297 VanDerWaalsContact O-N 3.13Å; A293-R397 PolarHBondContact O-NH2 2.86Å; A293-R397 VanDerWaalsContact O-NH2 3.08Å
294	T	81.7	Confident	78.6	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-33.4	171.6	-66.8	0	0	0	0	112.1	L288 D291 P292 Y394 R397	L288-T294 VanDerWaalsContact O-CB 3.3Å; L288-T294 WeakPolarHBondContact O-CB 3.34Å; L288-T294 WeakPolarHBondContact O-CG2 3.34Å; L288-T294 PolarHBondContact O-OG1 2.78Å; D291-T294 VanDerWaalsContact O-CB 3.25Å; D291-T294 WeakPolarHBondContact O-CB 3.35Å; D291-T294 PolarHBondContact O-N 2.99Å; D291-T294 PolarHBondContact O-OG1 3.4Å; P292-T294 PolarHBondContact O-N 2.93Å; P292-T294 VanDerWaalsContact O-N 3.13Å; T294-Y394 HydrophobicContact CG2-CD2 4.03Å; T294-R397 PolarHBondContact O-NH1 3.05Å
295	Y	84	Confident	77.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-98.5	-40.7	-176.9	-50.1	-74.9	0	0	0	110.9	R289 P292 A293 M366 Y369 M385 F390 R393 Y394	R289-Y295 WeakPolarHBondContact CA-OH 3.48Å; R289-Y295 WeakPolarHBondContact O-CE2 3.38Å; R289-Y295 PolarHBondContact O-OH 3.48Å; P292-Y295 PolarHBondContact O-N 3.21Å; A293-Y295 PolarHBondContact O-N 2.69Å; Y295-M366 HydrophobicContact CE1-CE 3.97Å; Y295-M366 WeakPolarHBondContact OH-CE 3.42Å; Y295-Y369 HydrophobicContact CD2-CD2 4.14Å; Y295-Y369 HydrophobicContact CD2-CG 4.17Å; Y295-Y369 AromaticContact CE2-CD2 3.78Å; Y295-Y369 HydrophobicContact CE2-CD2 3.78Å; Y295-Y369 HydrophobicContact CE2-CE2 4.19Å; Y295-Y369 HydrophobicContact CE2-CG 4.28Å; Y295-M385 VanDerWaalsContact O-CE 3.26Å; Y295-M385 WeakPolarHBondContact O-CE 3.28Å; Y295-F390 HydrophobicContact CD1-CD1 4.03Å; Y295-F390 AromaticContact CD1-CD2 3.81Å; Y295-F390 HydrophobicContact CD1-CD2 3.81Å; Y295-F390 AromaticContact CD1-CE1 3.57Å; Y295-F390 HydrophobicContact CD1-CE1 3.57Å; Y295-F390 AromaticContact CD1-CE2 3.32Å; Y295-F390 HydrophobicContact CD1-CE2 3.32Å; Y295-F390 HydrophobicContact CD1-CG 4.15Å; Y295-F390 AromaticContact CD1-CZ 3.18Å; Y295-F390 HydrophobicContact CD1-CZ 3.18Å; Y295-F390 HydrophobicContact CD2-CE2 4.22Å; Y295-F390 HydrophobicContact CD2-CZ 4.31Å; Y295-F390 HydrophobicContact CE1-CD1 4.43Å; Y295-F390 AromaticContact CE1-CE1 3.65Å; Y295-F390 HydrophobicContact CE1-CE1 3.65Å; Y295-F390 HydrophobicContact CE1-CE2 4.07Å; Y295-F390 AromaticContact CE1-CZ 3.44Å; Y295-F390 HydrophobicContact CE1-CZ 3.44Å; Y295-F390 VanDerWaalsContact CE1-CZ 3.44Å; Y295-F390 HydrophobicContact CG-CD2 4.02Å; Y295-F390 HydrophobicContact CG-CE1 4.46Å; Y295-F390 AromaticContact CG-CE2 3.4Å; Y295-F390 HydrophobicContact CG-CE2 3.4Å; Y295-F390 AromaticContact CG-CZ 3.66Å; Y295-F390 HydrophobicContact CG-CZ 3.66Å; Y295-R393 WeakPolarHBondContact O-CD 3.29Å; Y295-R393 PolarHBondContact O-NH1 3.32Å; Y295-Y394 HydrophobicContact CE1-CD2 4.08Å; Y295-Y394 HydrophobicContact CE1-CG 4.18Å
296	E	80.6	Confident	76.8	Confident	87 Å²	87	48.2 Å²	48.2	41%	0.407	30%	0.297	S	S	.	.	H	α-helix	trans	-72.8	-38.3	-173.7	-67.6	177.4	-166.8	0	0	114	P292 L373 R393	P292-E296 WeakPolarHBondContact O-CG 3.43Å; P292-E296 PolarHBondContact O-N 3.44Å; P292-E296 VanDerWaalsContact O-N 3.09Å; E296-L373 HydrophobicContact CG-CD1 3.66Å; E296-L373 HydrophobicContact CG-CD2 3.75Å; E296-L373 HydrophobicContact CG-CG 4.36Å; E296-R393 PolarHBondContact O-NH1 2.87Å
297	L	80.7	Confident	76.3	Confident	76 Å²	76	50 Å²	50	40%	0.398	32%	0.318	S	S	.	.	S	Bend	trans	-97.5	135.6	-175.7	-60.7	179.5	0	0	0	111.4	A293 R397	A293-L297 HydrophobicContact CB-CD1 4.11Å; A293-L297 HydrophobicContact CB-CG 4.47Å; A293-L297 WeakPolarHBondContact O-CB 3.46Å; A293-L297 PolarHBondContact O-N 3.24Å; A293-L297 VanDerWaalsContact O-N 3.13Å; L297-R397 PolarHBondContact O-NH2 3.47Å
298	E	82.1	Confident	76.3	Confident	88 Å²	88	49.7 Å²	49.7	41%	0.411	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-68.5	134	165.9	-173.2	154.3	-144.3	0	0	109.9	Y311 H312	E298-Y311 HydrophobicContact CG-CD1 3.93Å; E298-Y311 HydrophobicContact CG-CE1 4.11Å; E298-Y311 VanDerWaalsContact OE1-CD1 3.23Å; E298-Y311 WeakPolarHBondContact OE1-CD1 3.39Å; E298-Y311 WeakPolarHBondContact OE1-CE1 3.34Å; E298-H312 IonicContact OE1-CE1 3.8Å; E298-H312 PolarHBondContact OE1-CE1 2.82Å; E298-H312 IonicContact OE1-ND1 3.61Å; E298-H312 IonicContact OE1-NE2 2.81Å; E298-H312 PolarHBondContact OE1-NE2 2.94Å
299	P	83.9	Confident	76	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.058	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-59.2	137.1	176.7	-22.6	32	0	0	0	111.3	Y311 Y396	P299-Y311 HydrophobicContact CG-CD2 3.88Å; P299-Y311 HydrophobicContact CG-CE2 4.46Å; P299-Y311 HydrophobicContact CG-CG 4.07Å; P299-Y396 HydrophobicContact CB-CD1 3.61Å; P299-Y396 HydrophobicContact CB-CE1 3.52Å; P299-Y396 HydrophobicContact CG-CD1 3.48Å; P299-Y396 VanDerWaalsContact CG-CD1 3.48Å; P299-Y396 HydrophobicContact CG-CE1 3.95Å; P299-Y396 HydrophobicContact CG-CG 4.42Å
300	P	79.4	Confident	76	Confident	114 Å²	114	51.9 Å²	51.9	74%	0.74	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-63.3	144.4	176.8	27.1	-33.8	0	0	0	110.6
301	T	77.3	Confident	76.5	Confident	112 Å²	112	51.9 Å²	51.9	69%	0.687	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-63.2	124	175.1	-53.4	0	0	0	0	109.5
302	P	76.2	Confident	77	Confident	25 Å²	25	56 Å²	56	16%	0.162	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-67.1	151.9	178.3	28.7	-34	0	0	0	110.7	A304 I308	P302-A304 PolarHBondContact O-N 3.47Å; P302-I308 HydrophobicContact CB-CB 4.19Å; P302-I308 HydrophobicContact CB-CG2 4.46Å; P302-I308 HydrophobicContact CG-CB 4.24Å; P302-I308 HydrophobicContact CG-CG2 4.29Å; P302-I308 WeakPolarHBondContact CG-O 3.43Å
303	P	71.7	Confident	77.6	Confident	89 Å²	89	60.2 Å²	60.2	58%	0.578	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-55.7	140	172.4	-22.7	32.4	0	0	0	110.8	S305 S306	P303-S305 PolarHBondContact O-N 2.98Å; P303-S305 VanDerWaalsContact O-N 3.08Å; P303-S306 VanDerWaalsContact O-CB 3.31Å; P303-S306 WeakPolarHBondContact O-CB 3.27Å; P303-S306 PolarHBondContact O-N 3.13Å; P303-S306 PolarHBondContact O-OG 2.93Å
304	A	66.8	Low	78.1	Confident	110 Å²	110	59.5 Å²	59.5	91%	0.909	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-57.8	-27	-178.7	0	0	0	0	0	113.2	P302 S306	P302-A304 PolarHBondContact O-N 3.47Å; A304-S306 VanDerWaalsContact C-N 3.29Å; A304-S306 PolarHBondContact O-N 3.39Å
305	S	57.7	Low	78.6	Confident	115 Å²	115	60.7 Å²	60.7	80%	0.804	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-71.4	-17.5	177.1	54	0	0	0	0	114.4	P303 G307	P303-S305 PolarHBondContact O-N 2.98Å; P303-S305 VanDerWaalsContact O-N 3.08Å; S305-G307 VanDerWaalsContact C-N 3.28Å; S305-G307 PolarHBondContact O-N 3.5Å
306	S	62.4	Low	78.7	Confident	29 Å²	29	65.7 Å²	65.7	20%	0.203	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-72.9	-18.1	-171.8	65.4	0	0	0	0	114.2	P303 A304 I308 N334	P303-S306 VanDerWaalsContact O-CB 3.31Å; P303-S306 WeakPolarHBondContact O-CB 3.27Å; P303-S306 PolarHBondContact O-N 3.13Å; P303-S306 PolarHBondContact O-OG 2.93Å; A304-S306 VanDerWaalsContact C-N 3.29Å; A304-S306 PolarHBondContact O-N 3.39Å; S306-I308 PolarHBondContact O-N 3.35Å; S306-I308 PolarHBondContact OG-N 2.9Å; S306-N334 PolarHBondContact O-ND2 2.8Å; S306-N334 PolarHBondContact O-OD1 3.42Å
307	G	66.7	Low	79	Confident	48 Å²	48	64.1 Å²	64.1	50%	0.495	40%	0.403	S	S	.	.			trans	66.9	5.8	-171.4	0	0	0	0	0	114.1	S305 N334	S305-G307 VanDerWaalsContact C-N 3.28Å; S305-G307 PolarHBondContact O-N 3.5Å; G307-N334 VanDerWaalsContact CA-OD1 3.27Å; G307-N334 WeakPolarHBondContact CA-OD1 3.41Å; G307-N334 PolarHBondContact O-OD1 3.33Å; G307-N334 VanDerWaalsContact O-OD1 3.07Å
308	I	75.8	Confident	79.3	Confident	55 Å²	55	62.7 Å²	62.7	28%	0.282	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-87.5	131.4	178.5	-54.5	175.8	0	0	0	108.7	P302 S306 S310 A333 W399 L400	P302-I308 HydrophobicContact CB-CB 4.19Å; P302-I308 HydrophobicContact CB-CG2 4.46Å; P302-I308 HydrophobicContact CG-CB 4.24Å; P302-I308 HydrophobicContact CG-CG2 4.29Å; P302-I308 WeakPolarHBondContact CG-O 3.43Å; S306-I308 PolarHBondContact O-N 3.35Å; S306-I308 PolarHBondContact OG-N 2.9Å; I308-S310 PolarHBondContact O-N 3.2Å; I308-A333 HydrophobicContact CG1-CB 4.12Å; I308-A333 HydrophobicContact CG2-CB 4.35Å; I308-W399 HydrophobicContact CG2-CH2 3.99Å; I308-W399 HydrophobicContact CG2-CZ3 3.81Å; I308-L400 HydrophobicContact CG2-CD2 3.63Å
309	H	77.8	Confident	79.7	Confident	72 Å²	72	59.2 Å²	59.2	33%	0.333	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-60.7	136	173	-73.9	-65.7	0	0	0	111	D313 W314 Y318 Y396 W399	H309-D313 HydrophobicContact CB-CB 4.39Å; H309-W314 HydrophobicContact CB-CB 4.03Å; H309-Y318 AromaticContact CD2-CE2 3.89Å; H309-Y396 PolarHBondContact O-OH 2.97Å; H309-W399 HydrophobicContact CB-CH2 4.16Å
310	S	84.6	Confident	79.9	Confident	18 Å²	18	61.1 Å²	61.1	13%	0.126	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-59.1	156.8	168.5	78.5	0	0	0	0	110.3	I308 H312 D313 W314	I308-S310 PolarHBondContact O-N 3.2Å; S310-H312 VanDerWaalsContact C-N 3.26Å; S310-H312 PolarHBondContact O-N 2.98Å; S310-D313 WeakPolarHBondContact CB-OD2 3.2Å; S310-D313 PolarHBondContact O-N 3.33Å; S310-D313 VanDerWaalsContact O-N 3.15Å; S310-D313 WeakPolarHBondContact OG-CB 3.24Å; S310-D313 PolarHBondContact OG-N 2.79Å; S310-D313 PolarHBondContact OG-OD2 3.14Å; S310-W314 WeakPolarHBondContact O-CB 3.2Å; S310-W314 PolarHBondContact O-N 3.31Å
311	Y	87.1	Confident	80.3	Confident	6 Å²	6	60 Å²	60	2%	0.024	37%	0.37	C	S	.	.	H	α-helix	trans	-53.2	-45.4	178.4	164.4	-108.4	0	0	0	112.3	E298 P299 R315 S392 R393 Y396	E298-Y311 HydrophobicContact CG-CD1 3.93Å; E298-Y311 HydrophobicContact CG-CE1 4.11Å; E298-Y311 VanDerWaalsContact OE1-CD1 3.23Å; E298-Y311 WeakPolarHBondContact OE1-CD1 3.39Å; E298-Y311 WeakPolarHBondContact OE1-CE1 3.34Å; P299-Y311 HydrophobicContact CG-CD2 3.88Å; P299-Y311 HydrophobicContact CG-CE2 4.46Å; P299-Y311 HydrophobicContact CG-CG 4.07Å; Y311-R315 VanDerWaalsContact O-CB 3.28Å; Y311-R315 WeakPolarHBondContact O-CB 3.28Å; Y311-R315 PolarHBondContact O-N 3.27Å; Y311-R315 PolarHBondContact OH-NH1 3.43Å; Y311-S392 PolarHBondContact OH-OG 3.43Å; Y311-R393 HydrophobicContact CE2-CG 4.1Å; Y311-Y396 HydrophobicContact CD2-CD1 4.03Å; Y311-Y396 HydrophobicContact CD2-CD2 4.22Å; Y311-Y396 AromaticContact CD2-CG 3.78Å; Y311-Y396 HydrophobicContact CD2-CG 3.78Å
312	H	87.9	Confident	80.6	Confident	105 Å²	105	61.8 Å²	61.8	49%	0.486	38%	0.376	S	S	.	.	H	α-helix	trans	-67	-39	178.7	-65.3	-57.1	0	0	0	113.1	E298 S310 S316	E298-H312 IonicContact OE1-CE1 3.8Å; E298-H312 PolarHBondContact OE1-CE1 2.82Å; E298-H312 IonicContact OE1-ND1 3.61Å; E298-H312 IonicContact OE1-NE2 2.81Å; E298-H312 PolarHBondContact OE1-NE2 2.94Å; S310-H312 VanDerWaalsContact C-N 3.26Å; S310-H312 PolarHBondContact O-N 2.98Å; H312-S316 VanDerWaalsContact O-CB 3.31Å; H312-S316 WeakPolarHBondContact O-CB 3.4Å; H312-S316 PolarHBondContact O-N 3.4Å; H312-S316 PolarHBondContact O-OG 3.33Å
313	D	86.8	Confident	80.9	Confident	91 Å²	91	65.4 Å²	65.4	49%	0.487	39%	0.394	S	S	.	.	H	α-helix	trans	-68.2	-44.1	177.8	-64.4	-38.6	0	0	0	111	H309 S310 S316 A317	H309-D313 HydrophobicContact CB-CB 4.39Å; S310-D313 WeakPolarHBondContact CB-OD2 3.2Å; S310-D313 PolarHBondContact O-N 3.33Å; S310-D313 VanDerWaalsContact O-N 3.15Å; S310-D313 WeakPolarHBondContact OG-CB 3.24Å; S310-D313 PolarHBondContact OG-N 2.79Å; S310-D313 PolarHBondContact OG-OD2 3.14Å; D313-S316 PolarHBondContact O-N 2.88Å; D313-A317 VanDerWaalsContact O-CB 3.24Å; D313-A317 WeakPolarHBondContact O-CB 3.38Å; D313-A317 PolarHBondContact O-N 3.2Å
314	W	89.3	Confident	81.7	Confident	0 Å²	0	62 Å²	62	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-61.1	-47.4	176.7	177.9	92.3	0	0	0	110.8	H309 S310 S316 A317 Y318 F319 P326 Y396 W399	H309-W314 HydrophobicContact CB-CB 4.03Å; S310-W314 WeakPolarHBondContact O-CB 3.2Å; S310-W314 PolarHBondContact O-N 3.31Å; W314-S316 PolarHBondContact O-N 3.4Å; W314-A317 PolarHBondContact O-N 2.79Å; W314-Y318 AromaticContact CD1-CD2 3.7Å; W314-Y318 HydrophobicContact CG-CD2 4.19Å; W314-Y318 WeakPolarHBondContact O-CB 3.35Å; W314-Y318 PolarHBondContact O-N 2.74Å; W314-F319 HydrophobicContact CE3-CB 4.49Å; W314-F319 HydrophobicContact CH2-CB 4.41Å; W314-F319 HydrophobicContact CH2-CD2 4.01Å; W314-F319 HydrophobicContact CZ3-CB 3.97Å; W314-F319 AromaticContact CZ3-CD2 3.98Å; W314-F319 HydrophobicContact CZ3-CD2 3.98Å; W314-F319 HydrophobicContact CZ3-CG 4.27Å; W314-P326 HydrophobicContact CH2-CB 4.18Å; W314-P326 HydrophobicContact CZ2-CB 4.03Å; W314-Y396 HydrophobicContact CB-CD2 3.82Å; W314-Y396 HydrophobicContact CB-CE2 3.74Å; W314-Y396 AromaticContact CD2-CD2 3.69Å; W314-Y396 HydrophobicContact CD2-CD2 3.69Å; W314-Y396 HydrophobicContact CD2-CE2 4.47Å; W314-Y396 AromaticContact CE3-CD2 3.78Å; W314-Y396 HydrophobicContact CE3-CD2 3.78Å; W314-Y396 HydrophobicContact CE3-CG 4.4Å; W314-Y396 AromaticContact CG-CD2 3.69Å; W314-Y396 HydrophobicContact CG-CD2 3.69Å; W314-Y396 AromaticContact CG-CE2 4Å; W314-Y396 HydrophobicContact CG-CE2 4Å; W314-W399 AromaticContact CD1-CD2 3.57Å; W314-W399 AromaticContact CD1-CE2 3.7Å; W314-W399 AromaticContact CD1-CE3 3.63Å; W314-W399 AromaticContact CD1-CH2 3.96Å; W314-W399 AromaticContact CD1-CZ2 3.91Å; W314-W399 AromaticContact CD1-CZ3 3.82Å; W314-W399 HydrophobicContact CG-CE3 4.29Å; W314-W399 HydrophobicContact CG-CZ3 4.44Å; W314-W399 HydrophobicContact CZ2-CB 4.19Å; W314-W399 HydrophobicContact CZ2-CG 4.45Å; W314-W399 AromaticContact NE1-CD1 3.74Å; W314-W399 AromaticContact NE1-CD2 3.33Å; W314-W399 VanDerWaalsContact NE1-CD2 3.33Å; W314-W399 AromaticContact NE1-CE2 3.62Å; W314-W399 AromaticContact NE1-CE3 3.79Å; W314-W399 AromaticContact NE1-CG 3.44Å; W314-W399 AromaticContact NE1-NE1 3.82Å
315	R	90.8	Very high	82.7	Confident	25 Å²	25	59.6 Å²	59.6	9%	0.094	34%	0.342	C	S	.	.	H	α-helix	trans	-60.9	-47	178.9	-174.7	177.3	178	168	-13.2	111.2	Y311 A317 F319 E321 A388 D389 S392	Y311-R315 VanDerWaalsContact O-CB 3.28Å; Y311-R315 WeakPolarHBondContact O-CB 3.28Å; Y311-R315 PolarHBondContact O-N 3.27Å; Y311-R315 PolarHBondContact OH-NH1 3.43Å; R315-A317 VanDerWaalsContact C-N 3.27Å; R315-A317 PolarHBondContact O-N 3.2Å; R315-F319 HydrophobicContact CB-CB 4.35Å; R315-F319 HydrophobicContact CG-CB 3.85Å; R315-F319 HydrophobicContact CG-CD1 3.97Å; R315-F319 HydrophobicContact CG-CG 4.18Å; R315-F319 VanDerWaalsContact O-CB 3.28Å; R315-F319 WeakPolarHBondContact O-CB 3.43Å; R315-F319 PolarHBondContact O-N 3.37Å; R315-E321 IonicContact CZ-OE1 3.59Å; R315-E321 IonicContact CZ-OE2 3.14Å; R315-E321 IonicContact NE-OE1 2.62Å; R315-E321 PolarHBondContact NE-OE1 3.41Å; R315-E321 IonicContact NE-OE2 2.91Å; R315-E321 IonicContact NH2-OE1 3.45Å; R315-E321 PolarHBondContact NH2-OE1 2.82Å; R315-E321 IonicContact NH2-OE2 3.33Å; R315-E321 PolarHBondContact NH2-OE2 2.8Å; R315-A388 VanDerWaalsContact NH2-CB 3.34Å; R315-D389 IonicContact CZ-OD1 3.73Å; R315-D389 IonicContact NH1-OD1 3.59Å; R315-D389 PolarHBondContact NH1-OD1 3.14Å; R315-D389 IonicContact NH2-OD1 2.84Å; R315-D389 PolarHBondContact NH2-OD1 3.13Å; R315-D389 VanDerWaalsContact NH2-OD1 3.14Å; R315-S392 PolarHBondContact NH1-OG 2.98Å
316	S	87.7	Confident	84.1	Confident	106 Å²	106	55 Å²	55	74%	0.741	31%	0.309	S	S	*	.	H	α-helix	trans	-64.8	-29.8	-180	-57.9	0	0	0	0	113.4	H312 D313 W314	H312-S316 VanDerWaalsContact O-CB 3.31Å; H312-S316 WeakPolarHBondContact O-CB 3.4Å; H312-S316 PolarHBondContact O-N 3.4Å; H312-S316 PolarHBondContact O-OG 3.33Å; D313-S316 PolarHBondContact O-N 2.88Å; W314-S316 PolarHBondContact O-N 3.4Å
317	A	86.1	Confident	85.1	Confident	53 Å²	53	59 Å²	59	44%	0.438	33%	0.326	S	S	.	.	H	α-helix	trans	-93.5	-32.9	-175.7	0	0	0	0	0	114	D313 W314 R315	D313-A317 VanDerWaalsContact O-CB 3.24Å; D313-A317 WeakPolarHBondContact O-CB 3.38Å; D313-A317 PolarHBondContact O-N 3.2Å; W314-A317 PolarHBondContact O-N 2.79Å; R315-A317 VanDerWaalsContact C-N 3.27Å; R315-A317 PolarHBondContact O-N 3.2Å
318	Y	87.9	Confident	85.7	Confident	47 Å²	47	63.9 Å²	63.9	18%	0.184	34%	0.341	C	S	.	.	H	α-helix	trans	-131.7	-6.7	-164.4	-56.9	-64.6	0	0	0	114.6	H309 W314 P326 M327 V330	H309-Y318 AromaticContact CD2-CE2 3.89Å; W314-Y318 AromaticContact CD1-CD2 3.7Å; W314-Y318 HydrophobicContact CG-CD2 4.19Å; W314-Y318 WeakPolarHBondContact O-CB 3.35Å; W314-Y318 PolarHBondContact O-N 2.74Å; Y318-P326 CarbonylContact O-C 3.52Å; Y318-P326 WeakPolarHBondContact O-CA 3.18Å; Y318-M327 WeakPolarHBondContact O-CG 3.25Å; Y318-M327 PolarHBondContact O-N 2.98Å; Y318-V330 HydrophobicContact CD1-CG1 3.88Å; Y318-V330 HydrophobicContact CD1-CG2 4.41Å; Y318-V330 HydrophobicContact CD2-CG1 4.05Å; Y318-V330 HydrophobicContact CE1-CG1 4.41Å; Y318-V330 HydrophobicContact CG-CG1 3.68Å; Y318-V330 HydrophobicContact CG-CG2 4.39Å
319	F	89.6	Confident	85.6	Confident	14 Å²	14	63.6 Å²	63.6	6%	0.061	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129	-179.5	-171.8	-102.7	0	0	0	111.1	W314 R315 C324 A388 W391 Y395	W314-F319 HydrophobicContact CE3-CB 4.49Å; W314-F319 HydrophobicContact CH2-CB 4.41Å; W314-F319 HydrophobicContact CH2-CD2 4.01Å; W314-F319 HydrophobicContact CZ3-CB 3.97Å; W314-F319 AromaticContact CZ3-CD2 3.98Å; W314-F319 HydrophobicContact CZ3-CD2 3.98Å; W314-F319 HydrophobicContact CZ3-CG 4.27Å; R315-F319 HydrophobicContact CB-CB 4.35Å; R315-F319 HydrophobicContact CG-CB 3.85Å; R315-F319 HydrophobicContact CG-CD1 3.97Å; R315-F319 HydrophobicContact CG-CG 4.18Å; R315-F319 VanDerWaalsContact O-CB 3.28Å; R315-F319 WeakPolarHBondContact O-CB 3.43Å; R315-F319 PolarHBondContact O-N 3.37Å; F319-C324 VanDerWaalsContact CE2-C 3.49Å; F319-C324 VanDerWaalsContact CZ-CA 3.49Å; F319-C324 HydrophobicContact CZ-CB 4.26Å; F319-A388 HydrophobicContact CE1-CB 4.23Å; F319-W391 HydrophobicContact CZ-CB 4.03Å; F319-Y395 AromaticContact CE2-CD2 3.96Å; F319-Y395 HydrophobicContact CE2-CD2 3.96Å
320	D	88	Confident	85.7	Confident	50 Å²	50	60.3 Å²	60.3	27%	0.267	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	106.1	173.3	-174.4	-8.7	0	0	0	109.4	D322 N323 C324 Q325	D320-D322 PolarHBondContact O-N 2.91Å; D320-D322 WeakPolarHBondContact OD1-CB 3.48Å; D320-D322 PolarHBondContact OD1-N 3.41Å; D320-N323 HydrophobicContact CB-CB 4.39Å; D320-N323 PolarHBondContact O-N 2.69Å; D320-N323 PolarHBondContact OD1-N 3.36Å; D320-N323 PolarHBondContact OD2-ND2 3.3Å; D320-C324 WeakPolarHBondContact O-CA 3.3Å; D320-C324 PolarHBondContact O-N 2.91Å; D320-Q325 WeakPolarHBondContact CB-O 3.42Å; D320-Q325 PolarHBondContact N-O 3.38Å; D320-Q325 PolarHBondContact O-N 3.4Å
321	E	87.5	Confident	85.5	Confident	89 Å²	89	62 Å²	62	42%	0.416	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.1	178.3	-61	-73.6	164.1	0	0	112.4	R315 A388	R315-E321 IonicContact CZ-OE1 3.59Å; R315-E321 IonicContact CZ-OE2 3.14Å; R315-E321 IonicContact NE-OE1 2.62Å; R315-E321 PolarHBondContact NE-OE1 3.41Å; R315-E321 IonicContact NE-OE2 2.91Å; R315-E321 IonicContact NH2-OE1 3.45Å; R315-E321 PolarHBondContact NH2-OE1 2.82Å; R315-E321 IonicContact NH2-OE2 3.33Å; R315-E321 PolarHBondContact NH2-OE2 2.8Å; E321-A388 WeakPolarHBondContact OE2-CB 3.41Å
322	D	83.5	Confident	85.2	Confident	151 Å²	151	62.1 Å²	62.1	81%	0.807	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-38.9	-176	-71.4	-32.3	0	0	0	111.4	D320	D320-D322 PolarHBondContact O-N 2.91Å; D320-D322 WeakPolarHBondContact OD1-CB 3.48Å; D320-D322 PolarHBondContact OD1-N 3.41Å
323	N	83.6	Confident	84.2	Confident	100 Å²	100	57.4 Å²	57.4	54%	0.535	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-5.6	-178.9	-66.9	-37.2	0	0	0	113.4	D320 Q325	D320-N323 HydrophobicContact CB-CB 4.39Å; D320-N323 PolarHBondContact O-N 2.69Å; D320-N323 PolarHBondContact OD1-N 3.36Å; D320-N323 PolarHBondContact OD2-ND2 3.3Å; N323-Q325 WeakPolarHBondContact O-CG 3.27Å; N323-Q325 PolarHBondContact O-N 2.78Å
324	C	87.3	Confident	83.3	Confident	19 Å²	19	56 Å²	56	13%	0.128	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	40.7	-175.3	-68.3	0	0	0	0	112.7	F319 D320 P356 W391 Y395	F319-C324 VanDerWaalsContact CE2-C 3.49Å; F319-C324 VanDerWaalsContact CZ-CA 3.49Å; F319-C324 HydrophobicContact CZ-CB 4.26Å; D320-C324 WeakPolarHBondContact O-CA 3.3Å; D320-C324 PolarHBondContact O-N 2.91Å; C324-P356 HydrophobicContact CB-CG 4.1Å; C324-P356 WeakPolarHBondContact O-CG 3.23Å; C324-W391 HydrophobicContact CB-CB 3.94Å; C324-W391 HydrophobicContact CB-CG 3.95Å; C324-Y395 VanDerWaalsContact O-CE2 3.25Å; C324-Y395 WeakPolarHBondContact O-CE2 3.46Å
325	Q	88.3	Confident	82	Confident	59 Å²	59	56.5 Å²	56.5	28%	0.276	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	150.4	-174.3	-77.3	173.6	34	0	0	111.4	D320 N323 P356	D320-Q325 WeakPolarHBondContact CB-O 3.42Å; D320-Q325 PolarHBondContact N-O 3.38Å; D320-Q325 PolarHBondContact O-N 3.4Å; N323-Q325 WeakPolarHBondContact O-CG 3.27Å; N323-Q325 PolarHBondContact O-N 2.78Å; Q325-P356 VanDerWaalsContact CG-CD 3.43Å; Q325-P356 HydrophobicContact CG-CG 4.14Å
326	P	86.8	Confident	80.8	Confident	17 Å²	17	63.2 Å²	63.2	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.8	166.7	28.5	-32.4	0	0	0	110.6	W314 Y318 V330 Y395	W314-P326 HydrophobicContact CH2-CB 4.18Å; W314-P326 HydrophobicContact CZ2-CB 4.03Å; Y318-P326 CarbonylContact O-C 3.52Å; Y318-P326 WeakPolarHBondContact O-CA 3.18Å; P326-V330 HydrophobicContact CB-CG2 4.06Å; P326-Y395 HydrophobicContact CG-CD1 3.99Å; P326-Y395 HydrophobicContact CG-CE1 4.47Å; P326-Y395 HydrophobicContact CG-CG 4.21Å
327	M	83.7	Confident	79.8	Confident	114 Å²	114	59.7 Å²	59.7	56%	0.562	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-61.2	143.1	173.4	-64	-176.6	97.4	0	0	110.1	Y318 G329 V330	Y318-M327 WeakPolarHBondContact O-CG 3.25Å; Y318-M327 PolarHBondContact O-N 2.98Å; M327-G329 PolarHBondContact O-N 2.74Å; M327-V330 WeakPolarHBondContact O-CG2 3.25Å
328	N	79.7	Confident	79	Confident	151 Å²	151	62.4 Å²	62.4	81%	0.807	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	136.5	178.3	-70.5	-25.9	0	0	0	111.6
329	G	73.7	Confident	78.1	Confident	48 Å²	48	66.4 Å²	66.4	50%	0.495	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	26.4	177.7	0	0	0	0	0	114.8	M327 L331	M327-G329 PolarHBondContact O-N 2.74Å; G329-L331 PolarHBondContact O-N 3.29Å
330	V	80.7	Confident	77.3	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.018	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-56.4	128.6	169.7	-170.5	0	0	0	0	109.4	Y318 P326 M327 T349 Q350	Y318-V330 HydrophobicContact CD1-CG1 3.88Å; Y318-V330 HydrophobicContact CD1-CG2 4.41Å; Y318-V330 HydrophobicContact CD2-CG1 4.05Å; Y318-V330 HydrophobicContact CE1-CG1 4.41Å; Y318-V330 HydrophobicContact CG-CG1 3.68Å; Y318-V330 HydrophobicContact CG-CG2 4.39Å; P326-V330 HydrophobicContact CB-CG2 4.06Å; M327-V330 WeakPolarHBondContact O-CG2 3.25Å; V330-T349 CarbonylContact O-C 3.59Å; V330-T349 WeakPolarHBondContact O-CA 3.32Å; V330-Q350 HydrophobicContact CB-CB 4.33Å; V330-Q350 PolarHBondContact O-N 3.15Å
331	L	79.4	Confident	76.5	Confident	53 Å²	53	68.2 Å²	68.2	28%	0.277	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-69.2	139.7	173.7	-69.4	174.4	0	0	0	110.4	G329 A335 K336 L348 T349 W399	G329-L331 PolarHBondContact O-N 3.29Å; L331-A335 HydrophobicContact CB-CB 4.04Å; L331-A335 HydrophobicContact CD2-CB 4.3Å; L331-K336 HydrophobicContact CD1-CG 4.37Å; L331-L348 CarbonylContact C-O 3.44Å; L331-L348 WeakPolarHBondContact CA-O 3.47Å; L331-L348 HydrophobicContact CD2-CB 4.48Å; L331-T349 HydrophobicContact CD2-CG2 4.1Å; L331-W399 PolarHBondContact O-NE1 3.31Å
332	L	79.9	Confident	75.9	Confident	9 Å²	9	71.2 Å²	71.2	5%	0.047	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-63.1	154.7	170.9	-64.1	177.7	0	0	0	110.6	N334 A335 L348 Q350 D402 F406	L332-N334 PolarHBondContact O-N 2.94Å; L332-A335 WeakPolarHBondContact O-CB 3.49Å; L332-A335 PolarHBondContact O-N 2.64Å; L332-L348 WeakPolarHBondContact CG-O 3.23Å; L332-L348 PolarHBondContact N-O 3.18Å; L332-Q350 HydrophobicContact CD2-CB 4.16Å; L332-D402 HydrophobicContact CD2-CB 3.92Å; L332-F406 HydrophobicContact CD1-CB 3.57Å; L332-F406 HydrophobicContact CD1-CD1 4.24Å; L332-F406 HydrophobicContact CD1-CD2 3.92Å; L332-F406 HydrophobicContact CD1-CG 3.64Å
333	A	68.1	Low	75.6	Confident	7 Å²	7	65.2 Å²	65.2	6%	0.058	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	133.9	178.2	0	0	0	0	0	110.6	I308 A335 W399 S403 H407	I308-A333 HydrophobicContact CG1-CB 4.12Å; I308-A333 HydrophobicContact CG2-CB 4.35Å; A333-A335 PolarHBondContact O-N 3.09Å; A333-W399 HydrophobicContact CB-CH2 3.76Å; A333-W399 HydrophobicContact CB-CZ2 3.81Å; A333-S403 PolarHBondContact N-OG 3.27Å; A333-H407 PolarHBondContact O-NE2 2.74Å; A333-H407 VanDerWaalsContact O-NE2 3.09Å
334	N	66.9	Low	75.4	Confident	60 Å²	60	63.6 Å²	63.6	32%	0.321	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	13.3	-175.2	-59.9	-24.1	0	0	0	116.1	S306 G307 L332 K336 S337 Y340	S306-N334 PolarHBondContact O-ND2 2.8Å; S306-N334 PolarHBondContact O-OD1 3.42Å; G307-N334 VanDerWaalsContact CA-OD1 3.27Å; G307-N334 WeakPolarHBondContact CA-OD1 3.41Å; G307-N334 PolarHBondContact O-OD1 3.33Å; G307-N334 VanDerWaalsContact O-OD1 3.07Å; L332-N334 PolarHBondContact O-N 2.94Å; N334-K336 PolarHBondContact O-N 3.13Å; N334-K336 VanDerWaalsContact O-N 3.08Å; N334-S337 WeakPolarHBondContact O-CB 3.45Å; N334-S337 PolarHBondContact O-N 3.08Å; N334-Y340 WeakPolarHBondContact O-CD2 3.15Å
335	A	63.7	Low	74.8	Confident	11 Å²	11	68.2 Å²	68.2	9%	0.091	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.8	175	0	0	0	0	0	114.2	L331 L332 A333 S337 L348	L331-A335 HydrophobicContact CB-CB 4.04Å; L331-A335 HydrophobicContact CD2-CB 4.3Å; L332-A335 WeakPolarHBondContact O-CB 3.49Å; L332-A335 PolarHBondContact O-N 2.64Å; A333-A335 PolarHBondContact O-N 3.09Å; A335-S337 VanDerWaalsContact C-N 3.27Å; A335-S337 PolarHBondContact O-N 3.13Å; A335-L348 HydrophobicContact CB-CB 3.99Å; A335-L348 HydrophobicContact CB-CD1 4.49Å; A335-L348 HydrophobicContact CB-CD2 4.21Å; A335-L348 HydrophobicContact CB-CG 4.47Å
336	K	65.2	Low	74.2	Confident	167 Å²	167	72.4 Å²	72.4	73%	0.726	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-0.4	175.4	-65.4	-179.7	-178.5	171.9	0	113.8	L331 N334	L331-K336 HydrophobicContact CD1-CG 4.37Å; N334-K336 PolarHBondContact O-N 3.13Å; N334-K336 VanDerWaalsContact O-N 3.08Å
337	S	67.1	Low	73.6	Confident	32 Å²	32	75.7 Å²	75.7	22%	0.224	41%	0.414	C	S	.	.	S	Bend	trans	-60.8	138	176	177.6	0	0	0	0	110.1	N334 A335 E339 Y340	N334-S337 WeakPolarHBondContact O-CB 3.45Å; N334-S337 PolarHBondContact O-N 3.08Å; A335-S337 VanDerWaalsContact C-N 3.27Å; A335-S337 PolarHBondContact O-N 3.13Å; S337-E339 PolarHBondContact O-N 2.92Å; S337-E339 VanDerWaalsContact O-N 3.08Å; S337-E339 PolarHBondContact OG-N 3.47Å; S337-Y340 PolarHBondContact O-N 2.84Å
338	P	68.3	Low	73.3	Confident	109 Å²	109	70.8 Å²	70.8	71%	0.708	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-56.7	-24.8	175	23.4	-33.6	0	0	0	112.6	Y340 S341	P338-Y340 PolarHBondContact O-N 3.07Å; P338-S341 VanDerWaalsContact O-CB 3.32Å; P338-S341 WeakPolarHBondContact O-CB 3.4Å; P338-S341 PolarHBondContact O-N 3.26Å; P338-S341 PolarHBondContact O-OG 2.96Å
339	E	68.8	Low	73.3	Confident	132 Å²	132	65.3 Å²	65.3	62%	0.617	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-57.8	-31.9	174.8	-64.3	-176.5	175	0	0	113	S337	S337-E339 PolarHBondContact O-N 2.92Å; S337-E339 VanDerWaalsContact O-N 3.08Å; S337-E339 PolarHBondContact OG-N 3.47Å
340	Y	73.9	Confident	73.4	Confident	12 Å²	12	63.7 Å²	63.7	5%	0.047	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-102.4	8.4	-177.6	-57.7	-54	0	0	0	113.7	N334 S337 P338 N342 V343 L348 F406 H407 K410	N334-Y340 WeakPolarHBondContact O-CD2 3.15Å; S337-Y340 PolarHBondContact O-N 2.84Å; P338-Y340 PolarHBondContact O-N 3.07Å; Y340-N342 PolarHBondContact O-N 3.29Å; Y340-V343 HydrophobicContact CD1-CG2 4.03Å; Y340-V343 WeakPolarHBondContact O-CB 3.24Å; Y340-V343 PolarHBondContact O-N 2.84Å; Y340-L348 HydrophobicContact CG-CD2 4.2Å; Y340-F406 HydrophobicContact CD1-CE1 4.05Å; Y340-F406 HydrophobicContact CD1-CZ 4.29Å; Y340-F406 AromaticContact CE1-CE1 3.86Å; Y340-F406 HydrophobicContact CE1-CE1 3.86Å; Y340-F406 HydrophobicContact CE1-CZ 4.4Å; Y340-F406 HydrophobicContact CE2-CE1 4.37Å; Y340-F406 HydrophobicContact CG-CE1 4.39Å; Y340-H407 AromaticContact CE2-CE1 3.67Å; Y340-H407 AromaticContact CZ-CE1 3.9Å; Y340-H407 AromaticContact CZ-ND1 3.76Å; Y340-H407 PolarHBondContact OH-CE1 3.12Å; Y340-H407 PolarHBondContact OH-ND1 3.15Å; Y340-K410 HydrophobicContact CE1-CB 4.19Å; Y340-K410 HydrophobicContact CE1-CG 4Å
341	S	71	Confident	73.1	Confident	89 Å²	89	66.2 Å²	66.2	62%	0.622	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.5	177.6	57.4	0	0	0	0	114.1	P338	P338-S341 VanDerWaalsContact O-CB 3.32Å; P338-S341 WeakPolarHBondContact O-CB 3.4Å; P338-S341 PolarHBondContact O-N 3.26Å; P338-S341 PolarHBondContact O-OG 2.96Å
342	N	75.1	Confident	73	Confident	153 Å²	153	69.4 Å²	69.4	82%	0.818	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-4.3	178.6	-57.5	-56.9	0	0	0	113.7	Y340	Y340-N342 PolarHBondContact O-N 3.29Å
343	V	76.4	Confident	73	Confident	24 Å²	24	70.7 Å²	70.7	15%	0.145	39%	0.393	C	S	.	.	S	Bend	trans	-89.9	135.7	-177.1	-177.5	0	0	0	0	109.6	Y340 E347 L348 F406	Y340-V343 HydrophobicContact CD1-CG2 4.03Å; Y340-V343 WeakPolarHBondContact O-CB 3.24Å; Y340-V343 PolarHBondContact O-N 2.84Å; V343-E347 HydrophobicContact CG1-CB 3.61Å; V343-E347 WeakPolarHBondContact CG1-OE2 3.49Å; V343-L348 HydrophobicContact CB-CD1 4.16Å; V343-L348 HydrophobicContact CB-CD2 4.14Å; V343-L348 HydrophobicContact CB-CG 4.1Å; V343-L348 HydrophobicContact CG1-CD1 4.46Å; V343-L348 HydrophobicContact CG1-CD2 3.94Å; V343-L348 HydrophobicContact CG1-CG 3.87Å; V343-F406 HydrophobicContact CG1-CE2 4.43Å; V343-F406 HydrophobicContact CG1-CZ 4.19Å
344	P	79	Confident	73.7	Confident	66 Å²	66	72.5 Å²	72.5	43%	0.429	40%	0.404	S	S	.	.			trans	-54.9	141.9	175	-24	33.8	0	0	0	111.8	E346 E347 L348	P344-E346 WeakPolarHBondContact CB-OE2 3.23Å; P344-E346 PolarHBondContact O-N 2.62Å; P344-E347 WeakPolarHBondContact O-CB 3.44Å; P344-E347 PolarHBondContact O-N 3.15Å; P344-L348 PolarHBondContact O-N 3.12Å
345	I	75.7	Confident	74.6	Confident	117 Å²	117	70.7 Å²	70.7	60%	0.6	40%	0.396	S	S	*	.	H	α-helix	trans	-59.2	-34.3	-178.4	-64.5	171.1	0	0	0	110.2	E347 L348 T349	I345-E347 VanDerWaalsContact C-N 3.27Å; I345-E347 PolarHBondContact O-N 3.3Å; I345-L348 CarbonylContact O-C 3.59Å; I345-L348 WeakPolarHBondContact O-CA 3.43Å; I345-L348 PolarHBondContact O-N 3.39Å; I345-T349 HydrophobicContact CG2-CG2 4.13Å; I345-T349 WeakPolarHBondContact O-CG2 3.43Å; I345-T349 PolarHBondContact O-N 3.18Å; I345-T349 PolarHBondContact O-OG1 3.32Å
346	E	75.9	Confident	75.7	Confident	146 Å²	146	70.8 Å²	70.8	68%	0.682	40%	0.396	S	S	*	.	H	α-helix	trans	-62.3	-32.2	178.4	-59.6	76.5	-166.7	0	0	112.7	P344 L348 T349	P344-E346 WeakPolarHBondContact CB-OE2 3.23Å; P344-E346 PolarHBondContact O-N 2.62Å; E346-L348 VanDerWaalsContact C-N 3.34Å; E346-T349 WeakPolarHBondContact CA-OG1 3.34Å; E346-T349 PolarHBondContact O-OG1 2.78Å
347	E	74.4	Confident	76.5	Confident	86 Å²	86	68 Å²	68	40%	0.402	39%	0.385	S	S	.	.	H	α-helix	trans	-77.3	-22.9	173.6	-86.2	-174.5	-154.8	0	0	112.6	V343 P344 I345 F406 K410	V343-E347 HydrophobicContact CG1-CB 3.61Å; V343-E347 WeakPolarHBondContact CG1-OE2 3.49Å; P344-E347 WeakPolarHBondContact O-CB 3.44Å; P344-E347 PolarHBondContact O-N 3.15Å; I345-E347 VanDerWaalsContact C-N 3.27Å; I345-E347 PolarHBondContact O-N 3.3Å; E347-F406 HydrophobicContact CB-CE2 4.36Å; E347-F406 WeakPolarHBondContact O-CD2 3.45Å; E347-F406 VanDerWaalsContact O-CE2 3.32Å; E347-F406 WeakPolarHBondContact O-CE2 3.43Å; E347-K410 IonicContact OE2-NZ 3.51Å; E347-K410 PolarHBondContact OE2-NZ 3.34Å
348	L	76.3	Confident	77.5	Confident	11 Å²	11	71.5 Å²	71.5	6%	0.058	40%	0.398	C	S	.	.	H	α-helix	trans	-92.7	-2.5	179.5	-64.2	176.8	0	0	0	113.3	L331 L332 A335 Y340 V343 P344 I345 E346 F406	L331-L348 CarbonylContact C-O 3.44Å; L331-L348 WeakPolarHBondContact CA-O 3.47Å; L331-L348 HydrophobicContact CD2-CB 4.48Å; L332-L348 WeakPolarHBondContact CG-O 3.23Å; L332-L348 PolarHBondContact N-O 3.18Å; A335-L348 HydrophobicContact CB-CB 3.99Å; A335-L348 HydrophobicContact CB-CD1 4.49Å; A335-L348 HydrophobicContact CB-CD2 4.21Å; A335-L348 HydrophobicContact CB-CG 4.47Å; Y340-L348 HydrophobicContact CG-CD2 4.2Å; V343-L348 HydrophobicContact CB-CD1 4.16Å; V343-L348 HydrophobicContact CB-CD2 4.14Å; V343-L348 HydrophobicContact CB-CG 4.1Å; V343-L348 HydrophobicContact CG1-CD1 4.46Å; V343-L348 HydrophobicContact CG1-CD2 3.94Å; V343-L348 HydrophobicContact CG1-CG 3.87Å; P344-L348 PolarHBondContact O-N 3.12Å; I345-L348 CarbonylContact O-C 3.59Å; I345-L348 WeakPolarHBondContact O-CA 3.43Å; I345-L348 PolarHBondContact O-N 3.39Å; E346-L348 VanDerWaalsContact C-N 3.34Å; L348-F406 HydrophobicContact CD2-CE1 3.82Å; L348-F406 HydrophobicContact CD2-CE2 4.19Å; L348-F406 HydrophobicContact CD2-CZ 3.44Å; L348-F406 VanDerWaalsContact CD2-CZ 3.44Å
349	T	79.4	Confident	78.4	Confident	37 Å²	37	66.4 Å²	66.4	23%	0.227	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-99.1	142.1	175	49.8	0	0	0	0	111.3	V330 L331 I345 E346	V330-T349 CarbonylContact O-C 3.59Å; V330-T349 WeakPolarHBondContact O-CA 3.32Å; L331-T349 HydrophobicContact CD2-CG2 4.1Å; I345-T349 HydrophobicContact CG2-CG2 4.13Å; I345-T349 WeakPolarHBondContact O-CG2 3.43Å; I345-T349 PolarHBondContact O-N 3.18Å; I345-T349 PolarHBondContact O-OG1 3.32Å; E346-T349 WeakPolarHBondContact CA-OG1 3.34Å; E346-T349 PolarHBondContact O-OG1 2.78Å
350	Q	75.7	Confident	79.2	Confident	13 Å²	13	61.2 Å²	61.2	6%	0.061	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-57.5	139.5	172.6	-169.8	174.9	11.6	0	0	110.3	V330 L332 H353 W399 D402	V330-Q350 HydrophobicContact CB-CB 4.33Å; V330-Q350 PolarHBondContact O-N 3.15Å; L332-Q350 HydrophobicContact CD2-CB 4.16Å; Q350-H353 WeakPolarHBondContact CG-NE2 3.38Å; Q350-H353 PolarHBondContact NE2-CD2 3.21Å; Q350-H353 PolarHBondContact NE2-NE2 3.37Å; Q350-W399 VanDerWaalsContact NE2-CA 3.3Å; Q350-W399 VanDerWaalsContact OE1-CD1 3.26Å; Q350-D402 WeakPolarHBondContact CG-OD2 3.39Å
351	A	74.3	Confident	79.6	Confident	57 Å²	57	65.3 Å²	65.3	47%	0.471	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-64	147	175.6	0	0	0	0	0	110	H353	A351-H353 PolarHBondContact O-CD2 2.96Å; A351-H353 PolarHBondContact O-N 3.47Å; A351-H353 VanDerWaalsContact O-N 3.13Å
352	P	77.2	Confident	80.1	Confident	119 Å²	119	64.8 Å²	64.8	77%	0.773	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-57.5	121.2	172.1	-22.2	32.8	0	0	0	109.9
353	H	80	Confident	80.5	Confident	36 Å²	36	59.9 Å²	59.9	17%	0.167	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-92.2	149.4	175.3	-69.5	-59.5	0	0	0	111.1	Q350 A351 Y395 V398 D402	Q350-H353 WeakPolarHBondContact CG-NE2 3.38Å; Q350-H353 PolarHBondContact NE2-CD2 3.21Å; Q350-H353 PolarHBondContact NE2-NE2 3.37Å; A351-H353 PolarHBondContact O-CD2 2.96Å; A351-H353 PolarHBondContact O-N 3.47Å; A351-H353 VanDerWaalsContact O-N 3.13Å; H353-Y395 HydrophobicContact CB-CD1 4.29Å; H353-Y395 HydrophobicContact CB-CE1 3.79Å; H353-V398 WeakPolarHBondContact CE1-CG1 3.48Å; H353-V398 WeakPolarHBondContact NE2-CG1 3.39Å; H353-D402 IonicContact CE1-OD2 2.65Å; H353-D402 PolarHBondContact CE1-OD2 3.31Å; H353-D402 IonicContact NE2-OD2 2.66Å; H353-D402 PolarHBondContact NE2-OD2 3.02Å
354	P	84	Confident	80.5	Confident	45 Å²	45	61.8 Å²	61.8	29%	0.292	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-58.6	146.6	175.1	26.1	-36	0	0	0	110.5	E358 L359 Y395	P354-E358 WeakPolarHBondContact CA-OE2 3.36Å; P354-E358 HydrophobicContact CB-CB 4.04Å; P354-L359 HydrophobicContact CB-CD2 4.33Å; P354-L359 HydrophobicContact CB-CG 4.09Å; P354-L359 HydrophobicContact CG-CD1 4.22Å; P354-L359 HydrophobicContact CG-CD2 3.53Å; P354-L359 HydrophobicContact CG-CG 3.68Å; P354-Y395 PolarHBondContact O-OH 2.78Å
355	S	85.7	Confident	80.4	Confident	22 Å²	22	59.5 Å²	59.5	15%	0.154	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-63.2	159.4	176.8	61.9	0	0	0	0	112.1	E357 E358 L359	S355-E357 PolarHBondContact O-N 3.28Å; S355-E358 PolarHBondContact N-OE2 2.9Å; S355-E358 PolarHBondContact O-N 2.96Å; S355-E358 WeakPolarHBondContact OG-CB 3.29Å; S355-E358 VanDerWaalsContact OG-CG 3.25Å; S355-E358 WeakPolarHBondContact OG-CG 3.18Å; S355-E358 PolarHBondContact OG-N 3.47Å; S355-E358 PolarHBondContact OG-OE2 3.38Å; S355-L359 PolarHBondContact O-N 3.4Å
356	P	85.6	Confident	80.7	Confident	14 Å²	14	54 Å²	54	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-47	-43.4	169.1	-34.8	41.4	0	0	0	113.5	C324 Q325 L359 L360 W391 Y395	C324-P356 HydrophobicContact CB-CG 4.1Å; C324-P356 WeakPolarHBondContact O-CG 3.23Å; Q325-P356 VanDerWaalsContact CG-CD 3.43Å; Q325-P356 HydrophobicContact CG-CG 4.14Å; P356-L359 PolarHBondContact O-N 2.89Å; P356-L360 WeakPolarHBondContact O-CB 3.15Å; P356-L360 WeakPolarHBondContact O-CG 3.43Å; P356-L360 PolarHBondContact O-N 3.4Å; P356-W391 HydrophobicContact CB-CD2 3.96Å; P356-W391 HydrophobicContact CB-CE3 4.36Å; P356-W391 HydrophobicContact CB-CH2 3.98Å; P356-W391 HydrophobicContact CB-CZ2 3.55Å; P356-W391 HydrophobicContact CB-CZ3 4.38Å; P356-W391 HydrophobicContact CG-CD2 3.89Å; P356-W391 HydrophobicContact CG-CE3 4.24Å; P356-W391 HydrophobicContact CG-CG 4.19Å; P356-W391 HydrophobicContact CG-CZ2 4.39Å; P356-Y395 WeakPolarHBondContact CD-OH 3.45Å; P356-Y395 HydrophobicContact CG-CE2 4.4Å
357	E	83.6	Confident	80.8	Confident	108 Å²	108	51.4 Å²	51.4	51%	0.505	28%	0.283	S	S	.	.	H	α-helix	trans	-64	-48.4	-179.9	-63.5	-175.1	171.2	0	0	111.4	S355 L359 L360 D361	S355-E357 PolarHBondContact O-N 3.28Å; E357-L359 VanDerWaalsContact C-N 3.32Å; E357-L359 PolarHBondContact O-N 3.19Å; E357-L360 PolarHBondContact O-N 2.82Å; E357-D361 PolarHBondContact O-N 3.14Å
358	E	86.4	Confident	80.9	Confident	106 Å²	106	48.7 Å²	48.7	50%	0.495	27%	0.272	S	S	.	.	H	α-helix	trans	-63.2	-36.3	176.8	-71.4	168.6	157.8	0	0	112.7	P354 S355 D361 S362	P354-E358 WeakPolarHBondContact CA-OE2 3.36Å; P354-E358 HydrophobicContact CB-CB 4.04Å; S355-E358 PolarHBondContact N-OE2 2.9Å; S355-E358 PolarHBondContact O-N 2.96Å; S355-E358 WeakPolarHBondContact OG-CB 3.29Å; S355-E358 VanDerWaalsContact OG-CG 3.25Å; S355-E358 WeakPolarHBondContact OG-CG 3.18Å; S355-E358 PolarHBondContact OG-N 3.47Å; S355-E358 PolarHBondContact OG-OE2 3.38Å; E358-D361 PolarHBondContact O-N 3.49Å; E358-S362 WeakPolarHBondContact O-CB 3.25Å; E358-S362 PolarHBondContact O-N 2.99Å; E358-S362 PolarHBondContact O-OG 3.35Å
359	L	87	Confident	81	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-43	175.5	-79.2	172	0	0	0	111.7	P354 S355 P356 E357 D361 S362 Y363 W391 Y394 Y395	P354-L359 HydrophobicContact CB-CD2 4.33Å; P354-L359 HydrophobicContact CB-CG 4.09Å; P354-L359 HydrophobicContact CG-CD1 4.22Å; P354-L359 HydrophobicContact CG-CD2 3.53Å; P354-L359 HydrophobicContact CG-CG 3.68Å; S355-L359 PolarHBondContact O-N 3.4Å; P356-L359 PolarHBondContact O-N 2.89Å; E357-L359 VanDerWaalsContact C-N 3.32Å; E357-L359 PolarHBondContact O-N 3.19Å; L359-D361 VanDerWaalsContact C-N 3.3Å; L359-D361 PolarHBondContact O-N 2.8Å; L359-S362 PolarHBondContact O-N 3.22Å; L359-Y363 HydrophobicContact CD2-CD2 4.06Å; L359-Y363 HydrophobicContact CD2-CE2 4.11Å; L359-Y363 WeakPolarHBondContact O-CA 2.99Å; L359-Y363 WeakPolarHBondContact O-CB 3.44Å; L359-Y363 WeakPolarHBondContact O-CD2 3.2Å; L359-Y363 PolarHBondContact O-N 3.29Å; L359-W391 HydrophobicContact CB-CH2 4.08Å; L359-W391 HydrophobicContact CB-CZ3 4.27Å; L359-W391 HydrophobicContact CD1-CH2 4.33Å; L359-W391 HydrophobicContact CD1-CZ3 3.68Å; L359-Y394 HydrophobicContact CD1-CD1 4.37Å; L359-Y394 HydrophobicContact CD1-CE1 3.5Å; L359-Y394 VanDerWaalsContact CD1-CE1 3.5Å; L359-Y395 HydrophobicContact CD1-CE1 4.43Å
360	L	86.3	Confident	81.2	Confident	23 Å²	23	48 Å²	48	12%	0.12	27%	0.266	C	S	.	.	H	α-helix	trans	-69.6	-28.7	177.9	-67.3	178.6	0	0	0	112.6	P356 E357 M366 R367 L370 W391	P356-L360 WeakPolarHBondContact O-CB 3.15Å; P356-L360 WeakPolarHBondContact O-CG 3.43Å; P356-L360 PolarHBondContact O-N 3.4Å; E357-L360 PolarHBondContact O-N 2.82Å; L360-M366 HydrophobicContact CD2-CB 3.77Å; L360-R367 HydrophobicContact CB-CG 3.94Å; L360-R367 HydrophobicContact CD1-CG 4.32Å; L360-R367 HydrophobicContact CD2-CB 4.47Å; L360-R367 HydrophobicContact CD2-CG 3.72Å; L360-R367 HydrophobicContact CG-CG 4.19Å; L360-R367 PolarHBondContact O-NE 3.44Å; L360-L370 HydrophobicContact CD1-CD2 3.96Å; L360-W391 HydrophobicContact CD1-CZ2 4.12Å; L360-W391 HydrophobicContact CD2-CH2 4.06Å; L360-W391 HydrophobicContact CD2-CZ2 3.98Å; L360-W391 HydrophobicContact CG-CH2 4.09Å; L360-W391 HydrophobicContact CG-CZ2 3.9Å
361	D	83.1	Confident	81.2	Confident	98 Å²	98	52.1 Å²	52.1	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-71.9	-39	171.4	-76.7	-18.6	0	0	0	111.8	E357 E358 L359 R367	E357-D361 PolarHBondContact O-N 3.14Å; E358-D361 PolarHBondContact O-N 3.49Å; L359-D361 VanDerWaalsContact C-N 3.3Å; L359-D361 PolarHBondContact O-N 2.8Å; D361-R367 IonicContact OD1-CZ 3.42Å; D361-R367 IonicContact OD1-NH2 3.32Å; D361-R367 PolarHBondContact OD1-NH2 3.32Å
362	S	81.2	Confident	81.3	Confident	78 Å²	78	54.3 Å²	54.3	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-77.3	-32.8	179.8	-57.7	0	0	0	0	113.2	E358 L359	E358-S362 WeakPolarHBondContact O-CB 3.25Å; E358-S362 PolarHBondContact O-N 2.99Å; E358-S362 PolarHBondContact O-OG 3.35Å; L359-S362 PolarHBondContact O-N 3.22Å
363	Y	83.1	Confident	81.2	Confident	50 Å²	50	49.8 Å²	49.8	20%	0.196	26%	0.262	C	S	.	.			trans	-129.6	81.3	-175.3	-57.8	-80.3	0	0	0	110.3	Q282 D286 R289 L359 F365 M366	Q282-Y363 PolarHBondContact NE2-OH 3.34Å; D286-Y363 PolarHBondContact OD1-OH 2.81Å; R289-Y363 VanDerWaalsContact NH1-CZ 3.34Å; R289-Y363 PolarHBondContact NH1-OH 3.05Å; L359-Y363 HydrophobicContact CD2-CD2 4.06Å; L359-Y363 HydrophobicContact CD2-CE2 4.11Å; L359-Y363 WeakPolarHBondContact O-CA 2.99Å; L359-Y363 WeakPolarHBondContact O-CB 3.44Å; L359-Y363 WeakPolarHBondContact O-CD2 3.2Å; L359-Y363 PolarHBondContact O-N 3.29Å; Y363-F365 AromaticContact CD1-CE1 3.72Å; Y363-F365 HydrophobicContact CD1-CE1 3.72Å; Y363-F365 AromaticContact CD1-CZ 3.98Å; Y363-F365 HydrophobicContact CD1-CZ 3.98Å; Y363-F365 HydrophobicContact CG-CE1 4.24Å; Y363-F365 HydrophobicContact CG-CZ 4.32Å; Y363-F365 PolarHBondContact O-N 3.46Å; Y363-F365 VanDerWaalsContact O-N 3.14Å; Y363-M366 HydrophobicContact CD2-SD 4.47Å; Y363-M366 HydrophobicContact CG-SD 4.39Å; Y363-M366 WeakPolarHBondContact O-CB 3.22Å; Y363-M366 PolarHBondContact O-N 3.34Å
364	P	77.1	Confident	81	Confident	65 Å²	65	48.8 Å²	48.8	42%	0.422	26%	0.258	S	S	.	.	H	α-helix	trans	-58.3	-31	-175.8	-26.8	35.6	0	0	0	114.1	M366 R367	P364-M366 PolarHBondContact O-N 3.02Å; P364-R367 VanDerWaalsContact O-CB 3.23Å; P364-R367 WeakPolarHBondContact O-CB 3.24Å; P364-R367 PolarHBondContact O-N 3.5Å
365	F	77.2	Confident	80	Confident	18 Å²	18	50.4 Å²	50.4	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-25.5	177.5	68.8	-104.5	0	0	0	112.8	D247 R289 Y363 R367 T368 Y369	D247-F365 VanDerWaalsContact OD1-CB 3.23Å; D247-F365 WeakPolarHBondContact OD1-CB 3.26Å; R289-F365 HydrophobicContact CB-CE2 4.28Å; R289-F365 HydrophobicContact CB-CZ 3.98Å; R289-F365 VanDerWaalsContact O-CE2 3.29Å; R289-F365 WeakPolarHBondContact O-CE2 3.38Å; Y363-F365 AromaticContact CD1-CE1 3.72Å; Y363-F365 HydrophobicContact CD1-CE1 3.72Å; Y363-F365 AromaticContact CD1-CZ 3.98Å; Y363-F365 HydrophobicContact CD1-CZ 3.98Å; Y363-F365 HydrophobicContact CG-CE1 4.24Å; Y363-F365 HydrophobicContact CG-CZ 4.32Å; Y363-F365 PolarHBondContact O-N 3.46Å; Y363-F365 VanDerWaalsContact O-N 3.14Å; F365-R367 PolarHBondContact O-N 3.14Å; F365-T368 WeakPolarHBondContact O-CB 3.15Å; F365-T368 PolarHBondContact O-N 2.89Å; F365-T368 PolarHBondContact O-OG1 3.45Å; F365-Y369 AromaticContact CD2-CD2 4Å; F365-Y369 HydrophobicContact CD2-CD2 4Å; F365-Y369 AromaticContact CD2-CE2 3.59Å; F365-Y369 HydrophobicContact CD2-CE2 3.59Å; F365-Y369 HydrophobicContact CE2-CD2 4.44Å; F365-Y369 AromaticContact CE2-CE2 3.97Å; F365-Y369 HydrophobicContact CE2-CE2 3.97Å; F365-Y369 PolarHBondContact O-N 2.94Å
366	M	81.3	Confident	78.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-27.1	174.7	-69.5	-175.8	56.7	0	0	111.8	R289 Y295 L360 Y363 P364 T368 Y369 L370 W391	R289-M366 HydrophobicContact CB-SD 4.07Å; R289-M366 HydrophobicContact CG-SD 3.93Å; Y295-M366 HydrophobicContact CE1-CE 3.97Å; Y295-M366 WeakPolarHBondContact OH-CE 3.42Å; L360-M366 HydrophobicContact CD2-CB 3.77Å; Y363-M366 HydrophobicContact CD2-SD 4.47Å; Y363-M366 HydrophobicContact CG-SD 4.39Å; Y363-M366 WeakPolarHBondContact O-CB 3.22Å; Y363-M366 PolarHBondContact O-N 3.34Å; P364-M366 PolarHBondContact O-N 3.02Å; M366-T368 VanDerWaalsContact C-N 3.26Å; M366-T368 PolarHBondContact O-N 2.76Å; M366-Y369 PolarHBondContact O-N 2.82Å; M366-L370 WeakPolarHBondContact O-CB 3.42Å; M366-L370 PolarHBondContact O-N 2.77Å; M366-W391 HydrophobicContact CE-CH2 3.65Å; M366-W391 HydrophobicContact CE-CZ3 3.6Å
367	R	78.7	Confident	77.1	Confident	93 Å²	93	60.8 Å²	60.8	35%	0.351	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-38.8	171.5	-64.7	-179.1	169.9	155.5	6.3	110.6	L360 D361 P364 F365 L370 T371	L360-R367 HydrophobicContact CB-CG 3.94Å; L360-R367 HydrophobicContact CD1-CG 4.32Å; L360-R367 HydrophobicContact CD2-CB 4.47Å; L360-R367 HydrophobicContact CD2-CG 3.72Å; L360-R367 HydrophobicContact CG-CG 4.19Å; L360-R367 PolarHBondContact O-NE 3.44Å; D361-R367 IonicContact OD1-CZ 3.42Å; D361-R367 IonicContact OD1-NH2 3.32Å; D361-R367 PolarHBondContact OD1-NH2 3.32Å; P364-R367 VanDerWaalsContact O-CB 3.23Å; P364-R367 WeakPolarHBondContact O-CB 3.24Å; P364-R367 PolarHBondContact O-N 3.5Å; F365-R367 PolarHBondContact O-N 3.14Å; R367-L370 PolarHBondContact O-N 3.34Å; R367-T371 WeakPolarHBondContact O-CB 3.44Å; R367-T371 VanDerWaalsContact O-CG2 3.31Å; R367-T371 WeakPolarHBondContact O-CG2 3.44Å; R367-T371 PolarHBondContact O-N 2.86Å; R367-T371 PolarHBondContact O-OG1 3.49Å
368	T	75.4	Confident	75.6	Confident	29 Å²	29	58.5 Å²	58.5	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-59.6	-50	176.1	-48.7	0	0	0	0	110.4	F365 M366 L370 T371 Q372	F365-T368 WeakPolarHBondContact O-CB 3.15Å; F365-T368 PolarHBondContact O-N 2.89Å; F365-T368 PolarHBondContact O-OG1 3.45Å; M366-T368 VanDerWaalsContact C-N 3.26Å; M366-T368 PolarHBondContact O-N 2.76Å; T368-L370 PolarHBondContact O-N 2.8Å; T368-T371 PolarHBondContact O-N 3.36Å; T368-T371 PolarHBondContact O-OG1 2.82Å; T368-Q372 WeakPolarHBondContact O-CB 3.24Å; T368-Q372 WeakPolarHBondContact O-CG 3.26Å; T368-Q372 PolarHBondContact O-N 3.07Å
369	Y	78.7	Confident	74	Confident	7 Å²	7	61.3 Å²	61.3	3%	0.027	34%	0.338	C	S	.	.	H	α-helix	trans	-59.2	-46.6	175.7	-66.9	-56.7	0	0	0	112.7	R191 A290 P292 Y295 F365 M366 T371 Q372 L373	R191-Y369 VanDerWaalsContact CZ-CZ 3.43Å; R191-Y369 PolarHBondContact NH1-OH 3.39Å; R191-Y369 VanDerWaalsContact NH2-CD1 3.26Å; A290-Y369 PolarHBondContact O-OH 3.44Å; P292-Y369 HydrophobicContact CB-CD1 4.37Å; P292-Y369 HydrophobicContact CB-CE1 3.61Å; P292-Y369 HydrophobicContact CG-CE1 3.62Å; P292-Y369 WeakPolarHBondContact CG-OH 3.16Å; Y295-Y369 HydrophobicContact CD2-CD2 4.14Å; Y295-Y369 HydrophobicContact CD2-CG 4.17Å; Y295-Y369 AromaticContact CE2-CD2 3.78Å; Y295-Y369 HydrophobicContact CE2-CD2 3.78Å; Y295-Y369 HydrophobicContact CE2-CE2 4.19Å; Y295-Y369 HydrophobicContact CE2-CG 4.28Å; F365-Y369 AromaticContact CD2-CD2 4Å; F365-Y369 HydrophobicContact CD2-CD2 4Å; F365-Y369 AromaticContact CD2-CE2 3.59Å; F365-Y369 HydrophobicContact CD2-CE2 3.59Å; F365-Y369 HydrophobicContact CE2-CD2 4.44Å; F365-Y369 AromaticContact CE2-CE2 3.97Å; F365-Y369 HydrophobicContact CE2-CE2 3.97Å; F365-Y369 PolarHBondContact O-N 2.94Å; M366-Y369 PolarHBondContact O-N 2.82Å; Y369-T371 PolarHBondContact O-N 3.3Å; Y369-Q372 PolarHBondContact O-N 2.87Å; Y369-L373 WeakPolarHBondContact O-CB 3.37Å; Y369-L373 WeakPolarHBondContact O-CG 3.2Å; Y369-L373 PolarHBondContact O-N 2.84Å
370	L	82.6	Confident	72.6	Confident	25 Å²	25	67.4 Å²	67.4	13%	0.131	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-48.1	179.2	-172.8	71.9	0	0	0	111.1	L360 M366 R367 T368 Q372 L373 V374 F390	L360-L370 HydrophobicContact CD1-CD2 3.96Å; M366-L370 WeakPolarHBondContact O-CB 3.42Å; M366-L370 PolarHBondContact O-N 2.77Å; R367-L370 PolarHBondContact O-N 3.34Å; T368-L370 PolarHBondContact O-N 2.8Å; L370-Q372 VanDerWaalsContact C-N 3.32Å; L370-Q372 PolarHBondContact O-N 3.15Å; L370-L373 PolarHBondContact O-N 3.24Å; L370-V374 HydrophobicContact CD1-CB 4.31Å; L370-V374 HydrophobicContact CD1-CG2 3.71Å; L370-V374 HydrophobicContact CG-CG2 4.45Å; L370-V374 WeakPolarHBondContact O-CA 3.35Å; L370-V374 VanDerWaalsContact O-CB 3.23Å; L370-V374 WeakPolarHBondContact O-CB 3.11Å; L370-V374 PolarHBondContact O-N 2.75Å; L370-F390 HydrophobicContact CB-CE1 4.33Å; L370-F390 HydrophobicContact CB-CE2 4.32Å; L370-F390 HydrophobicContact CB-CZ 4.08Å; L370-F390 HydrophobicContact CD1-CB 4.11Å; L370-F390 HydrophobicContact CD1-CD1 3.46Å; L370-F390 VanDerWaalsContact CD1-CD1 3.46Å; L370-F390 HydrophobicContact CD1-CD2 4.04Å; L370-F390 HydrophobicContact CD1-CE1 3.79Å; L370-F390 HydrophobicContact CD1-CE2 4.32Å; L370-F390 HydrophobicContact CD1-CG 3.6Å; L370-F390 HydrophobicContact CD1-CZ 4.2Å
371	T	77.4	Confident	71.1	Confident	100 Å²	100	69.8 Å²	69.8	61%	0.613	38%	0.382	S	S	*	.	H	α-helix	trans	-69.5	-26.5	179.2	57	0	0	0	0	113.9	R367 T368 Y369	R367-T371 WeakPolarHBondContact O-CB 3.44Å; R367-T371 VanDerWaalsContact O-CG2 3.31Å; R367-T371 WeakPolarHBondContact O-CG2 3.44Å; R367-T371 PolarHBondContact O-N 2.86Å; R367-T371 PolarHBondContact O-OG1 3.49Å; T368-T371 PolarHBondContact O-N 3.36Å; T368-T371 PolarHBondContact O-OG1 2.82Å; Y369-T371 PolarHBondContact O-N 3.3Å
372	Q	75.2	Confident	69.8	Low	103 Å²	103	73.7 Å²	73.7	48%	0.481	40%	0.403	S	S	.	.	H	α-helix	trans	-75.9	-38.9	176.4	-77.1	175.5	-5.3	0	0	112.1	T368 Y369 L370	T368-Q372 WeakPolarHBondContact O-CB 3.24Å; T368-Q372 WeakPolarHBondContact O-CG 3.26Å; T368-Q372 PolarHBondContact O-N 3.07Å; Y369-Q372 PolarHBondContact O-N 2.87Å; L370-Q372 VanDerWaalsContact C-N 3.32Å; L370-Q372 PolarHBondContact O-N 3.15Å
373	L	76.1	Confident	68.7	Low	24 Å²	24	79.2 Å²	79.2	13%	0.126	42%	0.417	C	S	.	.	H	α-helix	trans	-98.7	-29.8	-171.7	-62.8	174.4	0	0	0	113.5	E296 Y369 L370 M385 F390	E296-L373 HydrophobicContact CG-CD1 3.66Å; E296-L373 HydrophobicContact CG-CD2 3.75Å; E296-L373 HydrophobicContact CG-CG 4.36Å; Y369-L373 WeakPolarHBondContact O-CB 3.37Å; Y369-L373 WeakPolarHBondContact O-CG 3.2Å; Y369-L373 PolarHBondContact O-N 2.84Å; L370-L373 PolarHBondContact O-N 3.24Å; L373-M385 HydrophobicContact CB-CE 3.9Å; L373-M385 HydrophobicContact CB-CG 4.11Å; L373-M385 HydrophobicContact CB-SD 3.94Å; L373-M385 HydrophobicContact CD1-CE 3.96Å; L373-M385 HydrophobicContact CD1-SD 4.3Å; L373-M385 HydrophobicContact CD2-CE 4.23Å; L373-M385 HydrophobicContact CG-CE 4.25Å; L373-M385 PolarHBondContact O-N 3.47Å; L373-M385 VanDerWaalsContact O-N 3.12Å; L373-F390 HydrophobicContact CD1-CD2 4.29Å; L373-F390 HydrophobicContact CD1-CE2 4.21Å
374	V	74.6	Confident	67.7	Low	15 Å²	15	77.4 Å²	77.4	9%	0.091	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-105.8	116.7	-179.6	-173.3	0	0	0	0	110	L370 M385 D387 F390	L370-V374 HydrophobicContact CD1-CB 4.31Å; L370-V374 HydrophobicContact CD1-CG2 3.71Å; L370-V374 HydrophobicContact CG-CG2 4.45Å; L370-V374 WeakPolarHBondContact O-CA 3.35Å; L370-V374 VanDerWaalsContact O-CB 3.23Å; L370-V374 WeakPolarHBondContact O-CB 3.11Å; L370-V374 PolarHBondContact O-N 2.75Å; V374-M385 HydrophobicContact CG2-CG 3.93Å; V374-D387 VanDerWaalsContact CG1-OD1 3.3Å; V374-D387 WeakPolarHBondContact CG1-OD1 3.25Å; V374-F390 HydrophobicContact CG2-CB 3.88Å; V374-F390 HydrophobicContact CG2-CD2 4.38Å; V374-F390 HydrophobicContact CG2-CG 4.34Å
375	H	64.2	Low	67.7	Low	79 Å²	79	75.2 Å²	75.2	37%	0.366	40%	0.397	S	S	.	.			trans	-81.8	133.3	175.4	-71.7	-47.3	0	0	0	111.5	D377 G378 N381 S384	H375-D377 PolarHBondContact O-N 2.96Å; H375-D377 VanDerWaalsContact O-N 3.12Å; H375-G378 PolarHBondContact O-N 2.87Å; H375-N381 PolarHBondContact CD2-ND2 2.81Å; H375-N381 PolarHBondContact NE2-ND2 2.67Å; H375-S384 WeakPolarHBondContact CD2-CB 3.28Å
376	P	56.9	Low	68	Low	125 Å²	125	76.2 Å²	76.2	81%	0.812	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-20	-179.1	26.9	-35.1	0	0	0	113.3	G378	P376-G378 VanDerWaalsContact C-N 3.31Å; P376-G378 PolarHBondContact O-N 2.72Å
377	D	53.3	Low	68.1	Low	129 Å²	129	79 Å²	79	69%	0.69	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.5	-175.3	-68.3	-10.4	0	0	0	113.4	H375 K379	H375-D377 PolarHBondContact O-N 2.96Å; H375-D377 VanDerWaalsContact O-N 3.12Å; D377-K379 PolarHBondContact O-N 3.31Å
378	G	52.7	Low	68.5	Low	61 Å²	61	75.1 Å²	75.1	63%	0.629	41%	0.408	S	S	*	.			trans	60.9	7.8	-178.6	0	0	0	0	0	114.3	H375 P376 I380	H375-G378 PolarHBondContact O-N 2.87Å; P376-G378 VanDerWaalsContact C-N 3.31Å; P376-G378 PolarHBondContact O-N 2.72Å; G378-I380 PolarHBondContact O-N 3.42Å; G378-I380 VanDerWaalsContact O-N 3.12Å
379	K	52.7	Low	69.1	Low	164 Å²	164	75.8 Å²	75.8	71%	0.713	41%	0.411	S	S	*	.			trans	-77.4	96.4	172.6	-72.8	-174.9	-179.6	176	0	107.8	D377 N381 S384	D377-K379 PolarHBondContact O-N 3.31Å; K379-N381 PolarHBondContact O-N 3.01Å; K379-S384 PolarHBondContact O-OG 2.66Å
380	I	56.5	Low	69.5	Low	130 Å²	130	75.4 Å²	75.4	67%	0.667	41%	0.409	S	S	*	.			trans	-66.5	97.3	171.6	-55.1	170.1	0	0	0	107.2	G378 S384	G378-I380 PolarHBondContact O-N 3.42Å; G378-I380 VanDerWaalsContact O-N 3.12Å; I380-S384 VanDerWaalsContact CA-OG 3.24Å; I380-S384 WeakPolarHBondContact CA-OG 3.31Å
381	N	55.3	Low	70	Confident	73 Å²	73	74.6 Å²	74.6	39%	0.39	40%	0.404	S	S	.	.			trans	-82.5	164.1	157.7	66.9	40.8	0	0	0	109.1	H375 K379 K383 S384	H375-N381 PolarHBondContact CD2-ND2 2.81Å; H375-N381 PolarHBondContact NE2-ND2 2.67Å; K379-N381 PolarHBondContact O-N 3.01Å; N381-K383 PolarHBondContact O-N 2.71Å; N381-K383 WeakPolarHBondContact OD1-CA 3.28Å; N381-K383 PolarHBondContact OD1-N 2.85Å; N381-S384 PolarHBondContact N-OG 2.75Å; N381-S384 PolarHBondContact O-N 3.23Å; N381-S384 PolarHBondContact O-OG 3.39Å; N381-S384 VanDerWaalsContact OD1-CB 3.26Å; N381-S384 WeakPolarHBondContact OD1-CB 3.14Å; N381-S384 PolarHBondContact OD1-N 2.99Å; N381-S384 PolarHBondContact OD1-OG 3.41Å; N381-S384 VanDerWaalsContact OD1-OG 3.14Å
382	D	55.6	Low	70.6	Confident	180 Å²	180	69.8 Å²	69.8	96%	0.963	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-7.1	-176.7	-63.1	-25.1	0	0	0	114.8
383	K	57.2	Low	71.3	Confident	193 Å²	193	66.5 Å²	66.5	84%	0.839	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-2.1	179.1	-68.1	-178	177.9	-178.6	0	114.3	N381	N381-K383 PolarHBondContact O-N 2.71Å; N381-K383 WeakPolarHBondContact OD1-CA 3.28Å; N381-K383 PolarHBondContact OD1-N 2.85Å
384	S	63.3	Low	72	Confident	12 Å²	12	65.4 Å²	65.4	8%	0.084	35%	0.352	C	S	.	.			trans	-109.7	139.1	-174.5	63	0	0	0	0	111.2	H375 K379 I380 N381	H375-S384 WeakPolarHBondContact CD2-CB 3.28Å; K379-S384 PolarHBondContact O-OG 2.66Å; I380-S384 VanDerWaalsContact CA-OG 3.24Å; I380-S384 WeakPolarHBondContact CA-OG 3.31Å; N381-S384 PolarHBondContact N-OG 2.75Å; N381-S384 PolarHBondContact O-N 3.23Å; N381-S384 PolarHBondContact O-OG 3.39Å; N381-S384 VanDerWaalsContact OD1-CB 3.26Å; N381-S384 WeakPolarHBondContact OD1-CB 3.14Å; N381-S384 PolarHBondContact OD1-N 2.99Å; N381-S384 PolarHBondContact OD1-OG 3.41Å; N381-S384 VanDerWaalsContact OD1-OG 3.14Å
385	M	76.7	Confident	72.7	Confident	20 Å²	20	64.8 Å²	64.8	10%	0.099	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-110.7	157.6	179	71.7	-176	62.7	0	0	110.5	Y295 L373 V374 D389 F390	Y295-M385 VanDerWaalsContact O-CE 3.26Å; Y295-M385 WeakPolarHBondContact O-CE 3.28Å; L373-M385 HydrophobicContact CB-CE 3.9Å; L373-M385 HydrophobicContact CB-CG 4.11Å; L373-M385 HydrophobicContact CB-SD 3.94Å; L373-M385 HydrophobicContact CD1-CE 3.96Å; L373-M385 HydrophobicContact CD1-SD 4.3Å; L373-M385 HydrophobicContact CD2-CE 4.23Å; L373-M385 HydrophobicContact CG-CE 4.25Å; L373-M385 PolarHBondContact O-N 3.47Å; L373-M385 VanDerWaalsContact O-N 3.12Å; V374-M385 HydrophobicContact CG2-CG 3.93Å; M385-D389 HydrophobicContact CB-CB 3.94Å; M385-D389 HydrophobicContact CG-CB 4.48Å; M385-F390 HydrophobicContact CG-CB 4.42Å; M385-F390 HydrophobicContact SD-CB 3.92Å; M385-F390 HydrophobicContact SD-CD2 4.04Å; M385-F390 HydrophobicContact SD-CG 4.49Å
386	S	83.5	Confident	73.9	Confident	38 Å²	38	61.1 Å²	61.1	27%	0.266	33%	0.331	S	S	.	.			trans	-76.8	161.1	172.2	68.1	0	0	0	0	111.6	A388 D389 F390	S386-A388 PolarHBondContact O-N 3.05Å; S386-D389 WeakPolarHBondContact CB-OD2 3.47Å; S386-D389 PolarHBondContact N-OD2 2.98Å; S386-D389 WeakPolarHBondContact O-CB 3.46Å; S386-D389 PolarHBondContact O-N 2.96Å; S386-D389 VanDerWaalsContact O-N 3.08Å; S386-D389 PolarHBondContact OG-N 2.95Å; S386-D389 VanDerWaalsContact OG-N 3.12Å; S386-D389 PolarHBondContact OG-OD2 2.65Å; S386-F390 PolarHBondContact O-N 2.98Å
387	D	84.3	Confident	75.2	Confident	59 Å²	59	57.2 Å²	57.2	32%	0.316	30%	0.301	S	S	.	.	H	α-helix	trans	-52.9	-41.8	171.2	-82.8	-31.2	0	0	0	110.8	V374 D389 F390 W391	V374-D387 VanDerWaalsContact CG1-OD1 3.3Å; V374-D387 WeakPolarHBondContact CG1-OD1 3.25Å; D387-D389 PolarHBondContact O-N 3.22Å; D387-F390 WeakPolarHBondContact O-CB 3.49Å; D387-F390 PolarHBondContact O-N 3.46Å; D387-W391 PolarHBondContact O-N 3.26Å
388	A	86.7	Confident	76.8	Confident	11 Å²	11	51.1 Å²	51.1	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-65.8	-38.2	179.4	0	0	0	0	0	112.3	R315 F319 E321 S386 W391 S392	R315-A388 VanDerWaalsContact NH2-CB 3.34Å; F319-A388 HydrophobicContact CE1-CB 4.23Å; E321-A388 WeakPolarHBondContact OE2-CB 3.41Å; S386-A388 PolarHBondContact O-N 3.05Å; A388-W391 PolarHBondContact O-N 2.95Å; A388-S392 WeakPolarHBondContact O-CB 3.23Å; A388-S392 PolarHBondContact O-N 3.21Å; A388-S392 PolarHBondContact O-OG 3.32Å
389	D	87	Confident	78.4	Confident	43 Å²	43	48.2 Å²	48.2	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-44.5	173.3	-60.7	-39.5	0	0	0	112.3	R315 M385 S386 D387 W391 S392 R393	R315-D389 IonicContact CZ-OD1 3.73Å; R315-D389 IonicContact NH1-OD1 3.59Å; R315-D389 PolarHBondContact NH1-OD1 3.14Å; R315-D389 IonicContact NH2-OD1 2.84Å; R315-D389 PolarHBondContact NH2-OD1 3.13Å; R315-D389 VanDerWaalsContact NH2-OD1 3.14Å; M385-D389 HydrophobicContact CB-CB 3.94Å; M385-D389 HydrophobicContact CG-CB 4.48Å; S386-D389 WeakPolarHBondContact CB-OD2 3.47Å; S386-D389 PolarHBondContact N-OD2 2.98Å; S386-D389 WeakPolarHBondContact O-CB 3.46Å; S386-D389 PolarHBondContact O-N 2.96Å; S386-D389 VanDerWaalsContact O-N 3.08Å; S386-D389 PolarHBondContact OG-N 2.95Å; S386-D389 VanDerWaalsContact OG-N 3.12Å; S386-D389 PolarHBondContact OG-OD2 2.65Å; D387-D389 PolarHBondContact O-N 3.22Å; D389-W391 PolarHBondContact O-N 3.17Å; D389-S392 PolarHBondContact O-OG 2.77Å; D389-R393 WeakPolarHBondContact O-CB 3.21Å; D389-R393 WeakPolarHBondContact O-CD 3.37Å; D389-R393 WeakPolarHBondContact O-CG 3.48Å; D389-R393 PolarHBondContact O-N 3.39Å; D389-R393 VanDerWaalsContact O-N 3.15Å
390	F	88.7	Confident	79.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.9	-51.4	177.8	-179.8	-85.9	0	0	0	111	Y295 L370 L373 V374 M385 S386 D387 Y394	Y295-F390 HydrophobicContact CD1-CD1 4.03Å; Y295-F390 AromaticContact CD1-CD2 3.81Å; Y295-F390 HydrophobicContact CD1-CD2 3.81Å; Y295-F390 AromaticContact CD1-CE1 3.57Å; Y295-F390 HydrophobicContact CD1-CE1 3.57Å; Y295-F390 AromaticContact CD1-CE2 3.32Å; Y295-F390 HydrophobicContact CD1-CE2 3.32Å; Y295-F390 HydrophobicContact CD1-CG 4.15Å; Y295-F390 AromaticContact CD1-CZ 3.18Å; Y295-F390 HydrophobicContact CD1-CZ 3.18Å; Y295-F390 HydrophobicContact CD2-CE2 4.22Å; Y295-F390 HydrophobicContact CD2-CZ 4.31Å; Y295-F390 HydrophobicContact CE1-CD1 4.43Å; Y295-F390 AromaticContact CE1-CE1 3.65Å; Y295-F390 HydrophobicContact CE1-CE1 3.65Å; Y295-F390 HydrophobicContact CE1-CE2 4.07Å; Y295-F390 AromaticContact CE1-CZ 3.44Å; Y295-F390 HydrophobicContact CE1-CZ 3.44Å; Y295-F390 VanDerWaalsContact CE1-CZ 3.44Å; Y295-F390 HydrophobicContact CG-CD2 4.02Å; Y295-F390 HydrophobicContact CG-CE1 4.46Å; Y295-F390 AromaticContact CG-CE2 3.4Å; Y295-F390 HydrophobicContact CG-CE2 3.4Å; Y295-F390 AromaticContact CG-CZ 3.66Å; Y295-F390 HydrophobicContact CG-CZ 3.66Å; L370-F390 HydrophobicContact CB-CE1 4.33Å; L370-F390 HydrophobicContact CB-CE2 4.32Å; L370-F390 HydrophobicContact CB-CZ 4.08Å; L370-F390 HydrophobicContact CD1-CB 4.11Å; L370-F390 HydrophobicContact CD1-CD1 3.46Å; L370-F390 VanDerWaalsContact CD1-CD1 3.46Å; L370-F390 HydrophobicContact CD1-CD2 4.04Å; L370-F390 HydrophobicContact CD1-CE1 3.79Å; L370-F390 HydrophobicContact CD1-CE2 4.32Å; L370-F390 HydrophobicContact CD1-CG 3.6Å; L370-F390 HydrophobicContact CD1-CZ 4.2Å; L373-F390 HydrophobicContact CD1-CD2 4.29Å; L373-F390 HydrophobicContact CD1-CE2 4.21Å; V374-F390 HydrophobicContact CG2-CB 3.88Å; V374-F390 HydrophobicContact CG2-CD2 4.38Å; V374-F390 HydrophobicContact CG2-CG 4.34Å; M385-F390 HydrophobicContact CG-CB 4.42Å; M385-F390 HydrophobicContact SD-CB 3.92Å; M385-F390 HydrophobicContact SD-CD2 4.04Å; M385-F390 HydrophobicContact SD-CG 4.49Å; S386-F390 PolarHBondContact O-N 2.98Å; D387-F390 WeakPolarHBondContact O-CB 3.49Å; D387-F390 PolarHBondContact O-N 3.46Å; F390-Y394 PolarHBondContact O-N 3.47Å
391	W	91.7	Very high	81	Confident	7 Å²	7	37.3 Å²	37.3	3%	0.027	19%	0.188	C	C	.	.	H	α-helix	trans	-73.3	-41.1	-176.6	-72.9	113.7	0	0	0	112.9	F319 C324 P356 L359 L360 M366 D387 A388 D389 R393 Y394 Y395	F319-W391 HydrophobicContact CZ-CB 4.03Å; C324-W391 HydrophobicContact CB-CB 3.94Å; C324-W391 HydrophobicContact CB-CG 3.95Å; P356-W391 HydrophobicContact CB-CD2 3.96Å; P356-W391 HydrophobicContact CB-CE3 4.36Å; P356-W391 HydrophobicContact CB-CH2 3.98Å; P356-W391 HydrophobicContact CB-CZ2 3.55Å; P356-W391 HydrophobicContact CB-CZ3 4.38Å; P356-W391 HydrophobicContact CG-CD2 3.89Å; P356-W391 HydrophobicContact CG-CE3 4.24Å; P356-W391 HydrophobicContact CG-CG 4.19Å; P356-W391 HydrophobicContact CG-CZ2 4.39Å; L359-W391 HydrophobicContact CB-CH2 4.08Å; L359-W391 HydrophobicContact CB-CZ3 4.27Å; L359-W391 HydrophobicContact CD1-CH2 4.33Å; L359-W391 HydrophobicContact CD1-CZ3 3.68Å; L360-W391 HydrophobicContact CD1-CZ2 4.12Å; L360-W391 HydrophobicContact CD2-CH2 4.06Å; L360-W391 HydrophobicContact CD2-CZ2 3.98Å; L360-W391 HydrophobicContact CG-CH2 4.09Å; L360-W391 HydrophobicContact CG-CZ2 3.9Å; M366-W391 HydrophobicContact CE-CH2 3.65Å; M366-W391 HydrophobicContact CE-CZ3 3.6Å; D387-W391 PolarHBondContact O-N 3.26Å; A388-W391 PolarHBondContact O-N 2.95Å; D389-W391 PolarHBondContact O-N 3.17Å; W391-R393 VanDerWaalsContact C-N 3.27Å; W391-R393 PolarHBondContact O-N 3.27Å; W391-Y394 HydrophobicContact CE3-CD1 4.05Å; W391-Y394 HydrophobicContact CZ3-CD1 4.17Å; W391-Y394 HydrophobicContact CZ3-CE1 4.48Å; W391-Y394 PolarHBondContact O-N 3.47Å; W391-Y395 HydrophobicContact CB-CD2 4.21Å; W391-Y395 HydrophobicContact CB-CE2 4.17Å; W391-Y395 HydrophobicContact CD2-CE2 4.4Å; W391-Y395 HydrophobicContact CE3-CD2 4.47Å; W391-Y395 AromaticContact CE3-CE2 3.79Å; W391-Y395 HydrophobicContact CE3-CE2 3.79Å; W391-Y395 WeakPolarHBondContact O-CD2 3.38Å; W391-Y395 PolarHBondContact O-N 2.92Å
392	S	90.5	Very high	82.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-35.5	179.4	63	0	0	0	0	111.9	Y311 R315 A388 D389 Y396	Y311-S392 PolarHBondContact OH-OG 3.43Å; R315-S392 PolarHBondContact NH1-OG 2.98Å; A388-S392 WeakPolarHBondContact O-CB 3.23Å; A388-S392 PolarHBondContact O-N 3.21Å; A388-S392 PolarHBondContact O-OG 3.32Å; D389-S392 PolarHBondContact O-OG 2.77Å; S392-Y396 WeakPolarHBondContact O-CB 3.37Å; S392-Y396 PolarHBondContact O-N 3.33Å
393	R	90.1	Very high	83.1	Confident	33 Å²	33	26 Å²	26	13%	0.125	13%	0.128	C	C	.	.	H	α-helix	trans	-65.9	-39.4	175.8	-72.9	172.9	-179.6	-159.3	-4.4	112.5	Y295 E296 Y311 D389 W391 R397	Y295-R393 WeakPolarHBondContact O-CD 3.29Å; Y295-R393 PolarHBondContact O-NH1 3.32Å; E296-R393 PolarHBondContact O-NH1 2.87Å; Y311-R393 HydrophobicContact CE2-CG 4.1Å; D389-R393 WeakPolarHBondContact O-CB 3.21Å; D389-R393 WeakPolarHBondContact O-CD 3.37Å; D389-R393 WeakPolarHBondContact O-CG 3.48Å; D389-R393 PolarHBondContact O-N 3.39Å; D389-R393 VanDerWaalsContact O-N 3.15Å; W391-R393 VanDerWaalsContact C-N 3.27Å; W391-R393 PolarHBondContact O-N 3.27Å; R393-R397 PolarHBondContact O-N 2.97Å; R393-R397 PolarHBondContact O-NH1 3.32Å; R393-R397 VanDerWaalsContact O-NH1 3.07Å
394	Y	90.2	Very high	83.8	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-66.5	-55.1	173.9	168.3	-102	0	0	0	111.3	R289 T294 Y295 L359 F390 W391 Y396 R397 V398	R289-Y394 HydrophobicContact CG-CE2 3.58Å; R289-Y394 PolarHBondContact NE-OH 3.46Å; R289-Y394 PolarHBondContact NH2-OH 3.45Å; T294-Y394 HydrophobicContact CG2-CD2 4.03Å; Y295-Y394 HydrophobicContact CE1-CD2 4.08Å; Y295-Y394 HydrophobicContact CE1-CG 4.18Å; L359-Y394 HydrophobicContact CD1-CD1 4.37Å; L359-Y394 HydrophobicContact CD1-CE1 3.5Å; L359-Y394 VanDerWaalsContact CD1-CE1 3.5Å; F390-Y394 PolarHBondContact O-N 3.47Å; W391-Y394 HydrophobicContact CE3-CD1 4.05Å; W391-Y394 HydrophobicContact CZ3-CD1 4.17Å; W391-Y394 HydrophobicContact CZ3-CE1 4.48Å; W391-Y394 PolarHBondContact O-N 3.47Å; Y394-Y396 VanDerWaalsContact C-N 3.3Å; Y394-Y396 PolarHBondContact O-N 3.35Å; Y394-R397 PolarHBondContact O-N 3.45Å; Y394-R397 VanDerWaalsContact O-N 3.13Å; Y394-V398 HydrophobicContact CD1-CG2 4.38Å; Y394-V398 HydrophobicContact CD2-CG2 4.24Å; Y394-V398 HydrophobicContact CE1-CG2 3.97Å; Y394-V398 HydrophobicContact CE2-CG2 3.8Å; Y394-V398 WeakPolarHBondContact O-CG2 3.33Å; Y394-V398 PolarHBondContact O-N 2.98Å
395	Y	90.8	Very high	84.2	Confident	1 Å²	1	20.2 Å²	20.2	0%	0.004	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-31.7	-176.9	-74.4	-68.1	0	0	0	113.3	F319 C324 P326 H353 P354 P356 L359 W391 V398 W399	F319-Y395 AromaticContact CE2-CD2 3.96Å; F319-Y395 HydrophobicContact CE2-CD2 3.96Å; C324-Y395 VanDerWaalsContact O-CE2 3.25Å; C324-Y395 WeakPolarHBondContact O-CE2 3.46Å; P326-Y395 HydrophobicContact CG-CD1 3.99Å; P326-Y395 HydrophobicContact CG-CE1 4.47Å; P326-Y395 HydrophobicContact CG-CG 4.21Å; H353-Y395 HydrophobicContact CB-CD1 4.29Å; H353-Y395 HydrophobicContact CB-CE1 3.79Å; P354-Y395 PolarHBondContact O-OH 2.78Å; P356-Y395 WeakPolarHBondContact CD-OH 3.45Å; P356-Y395 HydrophobicContact CG-CE2 4.4Å; L359-Y395 HydrophobicContact CD1-CE1 4.43Å; W391-Y395 HydrophobicContact CB-CD2 4.21Å; W391-Y395 HydrophobicContact CB-CE2 4.17Å; W391-Y395 HydrophobicContact CD2-CE2 4.4Å; W391-Y395 HydrophobicContact CE3-CD2 4.47Å; W391-Y395 AromaticContact CE3-CE2 3.79Å; W391-Y395 HydrophobicContact CE3-CE2 3.79Å; W391-Y395 WeakPolarHBondContact O-CD2 3.38Å; W391-Y395 PolarHBondContact O-N 2.92Å; Y395-V398 PolarHBondContact O-N 3.47Å; Y395-W399 WeakPolarHBondContact O-CB 3.47Å; Y395-W399 PolarHBondContact O-N 2.84Å
396	Y	88	Confident	83.9	Confident	3 Å²	3	19.4 Å²	19.4	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-44.4	173	-179.2	-103.4	0	0	0	111.7	P299 H309 Y311 W314 S392 Y394 V398 W399 L400	P299-Y396 HydrophobicContact CB-CD1 3.61Å; P299-Y396 HydrophobicContact CB-CE1 3.52Å; P299-Y396 HydrophobicContact CG-CD1 3.48Å; P299-Y396 VanDerWaalsContact CG-CD1 3.48Å; P299-Y396 HydrophobicContact CG-CE1 3.95Å; P299-Y396 HydrophobicContact CG-CG 4.42Å; H309-Y396 PolarHBondContact O-OH 2.97Å; Y311-Y396 HydrophobicContact CD2-CD1 4.03Å; Y311-Y396 HydrophobicContact CD2-CD2 4.22Å; Y311-Y396 AromaticContact CD2-CG 3.78Å; Y311-Y396 HydrophobicContact CD2-CG 3.78Å; W314-Y396 HydrophobicContact CB-CD2 3.82Å; W314-Y396 HydrophobicContact CB-CE2 3.74Å; W314-Y396 AromaticContact CD2-CD2 3.69Å; W314-Y396 HydrophobicContact CD2-CD2 3.69Å; W314-Y396 HydrophobicContact CD2-CE2 4.47Å; W314-Y396 AromaticContact CE3-CD2 3.78Å; W314-Y396 HydrophobicContact CE3-CD2 3.78Å; W314-Y396 HydrophobicContact CE3-CG 4.4Å; W314-Y396 AromaticContact CG-CD2 3.69Å; W314-Y396 HydrophobicContact CG-CD2 3.69Å; W314-Y396 AromaticContact CG-CE2 4Å; W314-Y396 HydrophobicContact CG-CE2 4Å; S392-Y396 WeakPolarHBondContact O-CB 3.37Å; S392-Y396 PolarHBondContact O-N 3.33Å; Y394-Y396 VanDerWaalsContact C-N 3.3Å; Y394-Y396 PolarHBondContact O-N 3.35Å; Y396-V398 VanDerWaalsContact C-N 3.33Å; Y396-V398 PolarHBondContact O-N 3.35Å; Y396-W399 AromaticContact CD2-CE3 3.99Å; Y396-W399 HydrophobicContact CD2-CE3 3.99Å; Y396-W399 HydrophobicContact CD2-CZ3 4.34Å; Y396-W399 AromaticContact CE2-CE3 3.84Å; Y396-W399 HydrophobicContact CE2-CE3 3.84Å; Y396-W399 AromaticContact CE2-CZ3 3.74Å; Y396-W399 HydrophobicContact CE2-CZ3 3.74Å; Y396-W399 WeakPolarHBondContact O-CB 3.22Å; Y396-W399 PolarHBondContact O-N 3.49Å; Y396-L400 HydrophobicContact CD1-CD1 3.92Å; Y396-L400 HydrophobicContact CD1-CG 4.4Å; Y396-L400 HydrophobicContact CE1-CD1 3.48Å; Y396-L400 VanDerWaalsContact CE1-CD1 3.48Å; Y396-L400 HydrophobicContact CE1-CG 4.1Å; Y396-L400 WeakPolarHBondContact O-CG 3.21Å; Y396-L400 PolarHBondContact O-N 3.29Å
397	R	85.7	Confident	83.2	Confident	43 Å²	43	20.1 Å²	20.1	16%	0.162	10%	0.103	C	C	.	.	H	α-helix	trans	-65.9	-36.5	175.6	-72.5	-173.3	-176.5	79.7	-13.6	112.2	L288 A293 T294 L297 R393 Y394 L400 L401	L288-R397 HydrophobicContact CD1-CB 4.4Å; L288-R397 HydrophobicContact CD2-CB 4.3Å; A293-R397 PolarHBondContact O-NH2 2.86Å; A293-R397 VanDerWaalsContact O-NH2 3.08Å; T294-R397 PolarHBondContact O-NH1 3.05Å; L297-R397 PolarHBondContact O-NH2 3.47Å; R393-R397 PolarHBondContact O-N 2.97Å; R393-R397 PolarHBondContact O-NH1 3.32Å; R393-R397 VanDerWaalsContact O-NH1 3.07Å; Y394-R397 PolarHBondContact O-N 3.45Å; Y394-R397 VanDerWaalsContact O-N 3.13Å; R397-L400 PolarHBondContact O-N 2.98Å; R397-L401 WeakPolarHBondContact O-CB 3.41Å; R397-L401 PolarHBondContact O-N 3.44Å
398	V	86.7	Confident	82.4	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-43.2	172	174.1	0	0	0	0	111.2	L285 H353 Y394 Y395 Y396 L400 L401 D402	L285-V398 HydrophobicContact CD2-CB 4.37Å; L285-V398 HydrophobicContact CD2-CG1 3.9Å; L285-V398 HydrophobicContact CD2-CG2 3.83Å; H353-V398 WeakPolarHBondContact CE1-CG1 3.48Å; H353-V398 WeakPolarHBondContact NE2-CG1 3.39Å; Y394-V398 HydrophobicContact CD1-CG2 4.38Å; Y394-V398 HydrophobicContact CD2-CG2 4.24Å; Y394-V398 HydrophobicContact CE1-CG2 3.97Å; Y394-V398 HydrophobicContact CE2-CG2 3.8Å; Y394-V398 WeakPolarHBondContact O-CG2 3.33Å; Y394-V398 PolarHBondContact O-N 2.98Å; Y395-V398 PolarHBondContact O-N 3.47Å; Y396-V398 VanDerWaalsContact C-N 3.33Å; Y396-V398 PolarHBondContact O-N 3.35Å; V398-L400 PolarHBondContact O-N 2.96Å; V398-L401 WeakPolarHBondContact O-CB 3.31Å; V398-L401 PolarHBondContact O-N 3.45Å; V398-L401 VanDerWaalsContact O-N 3.16Å; V398-D402 PolarHBondContact O-N 3.25Å
399	W	85.4	Confident	81.6	Confident	1 Å²	1	27.3 Å²	27.3	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-62.8	-39.6	176.4	174.3	75.8	0	0	0	112.7	I308 H309 W314 L331 A333 Q350 Y395 Y396 D402 S403	I308-W399 HydrophobicContact CG2-CH2 3.99Å; I308-W399 HydrophobicContact CG2-CZ3 3.81Å; H309-W399 HydrophobicContact CB-CH2 4.16Å; W314-W399 AromaticContact CD1-CD2 3.57Å; W314-W399 AromaticContact CD1-CE2 3.7Å; W314-W399 AromaticContact CD1-CE3 3.63Å; W314-W399 AromaticContact CD1-CH2 3.96Å; W314-W399 AromaticContact CD1-CZ2 3.91Å; W314-W399 AromaticContact CD1-CZ3 3.82Å; W314-W399 HydrophobicContact CG-CE3 4.29Å; W314-W399 HydrophobicContact CG-CZ3 4.44Å; W314-W399 HydrophobicContact CZ2-CB 4.19Å; W314-W399 HydrophobicContact CZ2-CG 4.45Å; W314-W399 AromaticContact NE1-CD1 3.74Å; W314-W399 AromaticContact NE1-CD2 3.33Å; W314-W399 VanDerWaalsContact NE1-CD2 3.33Å; W314-W399 AromaticContact NE1-CE2 3.62Å; W314-W399 AromaticContact NE1-CE3 3.79Å; W314-W399 AromaticContact NE1-CG 3.44Å; W314-W399 AromaticContact NE1-NE1 3.82Å; L331-W399 PolarHBondContact O-NE1 3.31Å; A333-W399 HydrophobicContact CB-CH2 3.76Å; A333-W399 HydrophobicContact CB-CZ2 3.81Å; Q350-W399 VanDerWaalsContact NE2-CA 3.3Å; Q350-W399 VanDerWaalsContact OE1-CD1 3.26Å; Y395-W399 WeakPolarHBondContact O-CB 3.47Å; Y395-W399 PolarHBondContact O-N 2.84Å; Y396-W399 AromaticContact CD2-CE3 3.99Å; Y396-W399 HydrophobicContact CD2-CE3 3.99Å; Y396-W399 HydrophobicContact CD2-CZ3 4.34Å; Y396-W399 AromaticContact CE2-CE3 3.84Å; Y396-W399 HydrophobicContact CE2-CE3 3.84Å; Y396-W399 AromaticContact CE2-CZ3 3.74Å; Y396-W399 HydrophobicContact CE2-CZ3 3.74Å; Y396-W399 WeakPolarHBondContact O-CB 3.22Å; Y396-W399 PolarHBondContact O-N 3.49Å; W399-D402 PolarHBondContact O-N 2.8Å; W399-S403 WeakPolarHBondContact O-CB 3.47Å; W399-S403 PolarHBondContact O-N 3.49Å; W399-S403 PolarHBondContact O-OG 2.81Å
400	L	82.5	Confident	80.9	Confident	50 Å²	50	26.6 Å²	26.6	26%	0.262	12%	0.118	S	C	.	.	H	α-helix	trans	-63.7	-42.2	171.8	-69.7	177.2	0	0	0	111.8	I308 Y396 R397 V398 S403 T404	I308-L400 HydrophobicContact CG2-CD2 3.63Å; Y396-L400 HydrophobicContact CD1-CD1 3.92Å; Y396-L400 HydrophobicContact CD1-CG 4.4Å; Y396-L400 HydrophobicContact CE1-CD1 3.48Å; Y396-L400 VanDerWaalsContact CE1-CD1 3.48Å; Y396-L400 HydrophobicContact CE1-CG 4.1Å; Y396-L400 WeakPolarHBondContact O-CG 3.21Å; Y396-L400 PolarHBondContact O-N 3.29Å; R397-L400 PolarHBondContact O-N 2.98Å; V398-L400 PolarHBondContact O-N 2.96Å; L400-S403 PolarHBondContact O-N 3.08Å; L400-T404 WeakPolarHBondContact O-CG2 3.46Å; L400-T404 PolarHBondContact O-N 3.14Å; L400-T404 PolarHBondContact O-OG1 3.12Å; L400-T404 VanDerWaalsContact O-OG1 3.06Å
401	L	81.5	Confident	79.8	Confident	15 Å²	15	30.9 Å²	30.9	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-46.3	176.8	-178.4	64.9	0	0	0	111.5	R284 L285 L288 R397 V398 S403 T404 E405	R284-L401 HydrophobicContact CB-CD1 3.94Å; R284-L401 HydrophobicContact CB-CD2 3.79Å; L285-L401 HydrophobicContact CD2-CD2 3.75Å; L285-L401 HydrophobicContact CG-CD2 3.9Å; L288-L401 HydrophobicContact CD1-CB 4.28Å; L288-L401 HydrophobicContact CD1-CD2 3.86Å; R397-L401 WeakPolarHBondContact O-CB 3.41Å; R397-L401 PolarHBondContact O-N 3.44Å; V398-L401 WeakPolarHBondContact O-CB 3.31Å; V398-L401 PolarHBondContact O-N 3.45Å; V398-L401 VanDerWaalsContact O-N 3.16Å; L401-S403 VanDerWaalsContact C-N 3.33Å; L401-S403 PolarHBondContact O-N 3.12Å; L401-T404 WeakPolarHBondContact CA-OG1 3.4Å; L401-T404 PolarHBondContact O-N 2.98Å; L401-T404 PolarHBondContact O-OG1 3.42Å; L401-E405 HydrophobicContact CD1-CG 4.43Å; L401-E405 WeakPolarHBondContact O-CB 3.07Å; L401-E405 WeakPolarHBondContact O-CG 3.39Å; L401-E405 PolarHBondContact O-N 2.64Å
402	D	79.1	Confident	78.9	Confident	13 Å²	13	36 Å²	36	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-63.8	-40.5	178.2	-76.3	5	0	0	0	111.8	H281 L332 Q350 H353 V398 W399 E405 F406	H281-D402 IonicContact CD2-OD1 3.27Å; H281-D402 IonicContact CE1-OD1 3.96Å; H281-D402 IonicContact NE2-OD1 2.89Å; H281-D402 PolarHBondContact NE2-OD1 2.8Å; L332-D402 HydrophobicContact CD2-CB 3.92Å; Q350-D402 WeakPolarHBondContact CG-OD2 3.39Å; H353-D402 IonicContact CE1-OD2 2.65Å; H353-D402 PolarHBondContact CE1-OD2 3.31Å; H353-D402 IonicContact NE2-OD2 2.66Å; H353-D402 PolarHBondContact NE2-OD2 3.02Å; V398-D402 PolarHBondContact O-N 3.25Å; W399-D402 PolarHBondContact O-N 2.8Å; D402-E405 PolarHBondContact O-N 2.96Å; D402-F406 WeakPolarHBondContact O-CB 3.23Å; D402-F406 PolarHBondContact O-N 2.81Å
403	S	75.6	Confident	78	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-46.6	176.4	-60.3	0	0	0	0	111.1	A333 W399 L400 L401 F406 H407	A333-S403 PolarHBondContact N-OG 3.27Å; W399-S403 WeakPolarHBondContact O-CB 3.47Å; W399-S403 PolarHBondContact O-N 3.49Å; W399-S403 PolarHBondContact O-OG 2.81Å; L400-S403 PolarHBondContact O-N 3.08Å; L401-S403 VanDerWaalsContact C-N 3.33Å; L401-S403 PolarHBondContact O-N 3.12Å; S403-F406 PolarHBondContact O-N 2.95Å; S403-H407 PolarHBondContact O-CD2 3.07Å; S403-H407 PolarHBondContact O-N 3.24Å
404	T	72	Confident	77	Confident	72 Å²	72	44.7 Å²	44.7	44%	0.442	20%	0.2	S	C	.	.	H	α-helix	trans	-67.5	-38.5	178.9	54.3	0	0	0	0	112.7	L400 L401 F406 H407 R408	L400-T404 WeakPolarHBondContact O-CG2 3.46Å; L400-T404 PolarHBondContact O-N 3.14Å; L400-T404 PolarHBondContact O-OG1 3.12Å; L400-T404 VanDerWaalsContact O-OG1 3.06Å; L401-T404 WeakPolarHBondContact CA-OG1 3.4Å; L401-T404 PolarHBondContact O-N 2.98Å; L401-T404 PolarHBondContact O-OG1 3.42Å; T404-F406 VanDerWaalsContact C-N 3.33Å; T404-F406 PolarHBondContact O-N 2.93Å; T404-H407 PolarHBondContact O-N 3.33Å; T404-R408 WeakPolarHBondContact O-CB 3.46Å; T404-R408 PolarHBondContact O-N 2.89Å
405	E	71.5	Confident	75.8	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.051	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-34.6	174.2	-74.7	-63.9	159.7	0	0	112.4	R284 L401 D402 R408 R409	R284-E405 IonicContact CZ-OE1 3.12Å; R284-E405 IonicContact NH1-OE1 3.43Å; R284-E405 PolarHBondContact NH1-OE1 3.04Å; L401-E405 HydrophobicContact CD1-CG 4.43Å; L401-E405 WeakPolarHBondContact O-CB 3.07Å; L401-E405 WeakPolarHBondContact O-CG 3.39Å; L401-E405 PolarHBondContact O-N 2.64Å; D402-E405 PolarHBondContact O-N 2.96Å; E405-R408 IonicContact OE1-NE 2.96Å; E405-R408 IonicContact OE2-CZ 3.77Å; E405-R408 VanDerWaalsContact OE2-CZ 3.27Å; E405-R408 IonicContact OE2-NE 3.13Å; E405-R408 PolarHBondContact OE2-NE 3.15Å; E405-R408 IonicContact OE2-NH2 3.36Å; E405-R408 PolarHBondContact OE2-NH2 3.26Å; E405-R409 WeakPolarHBondContact O-CB 3.3Å; E405-R409 WeakPolarHBondContact O-CG 3.21Å; E405-R409 PolarHBondContact O-N 3.49Å; E405-R409 PolarHBondContact O-NE 3.14Å
406	F	70.1	Confident	74.6	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.009	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-49.9	171.4	176.4	-93.2	0	0	0	111.8	L332 Y340 V343 E347 L348 D402 S403 T404 R408 R409 K410	L332-F406 HydrophobicContact CD1-CB 3.57Å; L332-F406 HydrophobicContact CD1-CD1 4.24Å; L332-F406 HydrophobicContact CD1-CD2 3.92Å; L332-F406 HydrophobicContact CD1-CG 3.64Å; Y340-F406 HydrophobicContact CD1-CE1 4.05Å; Y340-F406 HydrophobicContact CD1-CZ 4.29Å; Y340-F406 AromaticContact CE1-CE1 3.86Å; Y340-F406 HydrophobicContact CE1-CE1 3.86Å; Y340-F406 HydrophobicContact CE1-CZ 4.4Å; Y340-F406 HydrophobicContact CE2-CE1 4.37Å; Y340-F406 HydrophobicContact CG-CE1 4.39Å; V343-F406 HydrophobicContact CG1-CE2 4.43Å; V343-F406 HydrophobicContact CG1-CZ 4.19Å; E347-F406 HydrophobicContact CB-CE2 4.36Å; E347-F406 WeakPolarHBondContact O-CD2 3.45Å; E347-F406 VanDerWaalsContact O-CE2 3.32Å; E347-F406 WeakPolarHBondContact O-CE2 3.43Å; L348-F406 HydrophobicContact CD2-CE1 3.82Å; L348-F406 HydrophobicContact CD2-CE2 4.19Å; L348-F406 HydrophobicContact CD2-CZ 3.44Å; L348-F406 VanDerWaalsContact CD2-CZ 3.44Å; D402-F406 WeakPolarHBondContact O-CB 3.23Å; D402-F406 PolarHBondContact O-N 2.81Å; S403-F406 PolarHBondContact O-N 2.95Å; T404-F406 VanDerWaalsContact C-N 3.33Å; T404-F406 PolarHBondContact O-N 2.93Å; F406-R408 VanDerWaalsContact C-N 3.29Å; F406-R408 PolarHBondContact O-N 2.95Å; F406-R409 PolarHBondContact O-N 3.34Å; F406-R409 VanDerWaalsContact O-N 3.14Å; F406-K410 HydrophobicContact CD1-CG 4.28Å; F406-K410 HydrophobicContact CE1-CG 3.74Å; F406-K410 HydrophobicContact CE2-CD 4.42Å; F406-K410 HydrophobicContact CE2-CG 4.04Å; F406-K410 HydrophobicContact CZ-CD 4.14Å; F406-K410 VanDerWaalsContact CZ-CE 3.46Å; F406-K410 HydrophobicContact CZ-CG 3.6Å; F406-K410 PolarHBondContact O-N 3.27Å
407	H	68.2	Low	73.4	Confident	53 Å²	53	56.3 Å²	56.3	25%	0.245	27%	0.266	C	S	.	.	H	α-helix	trans	-57.6	-42.8	176.6	-76.6	-64	0	0	0	111.6	A333 Y340 S403 T404 R409 K410 L411	A333-H407 PolarHBondContact O-NE2 2.74Å; A333-H407 VanDerWaalsContact O-NE2 3.09Å; Y340-H407 AromaticContact CE2-CE1 3.67Å; Y340-H407 AromaticContact CZ-CE1 3.9Å; Y340-H407 AromaticContact CZ-ND1 3.76Å; Y340-H407 PolarHBondContact OH-CE1 3.12Å; Y340-H407 PolarHBondContact OH-ND1 3.15Å; S403-H407 PolarHBondContact O-CD2 3.07Å; S403-H407 PolarHBondContact O-N 3.24Å; T404-H407 PolarHBondContact O-N 3.33Å; H407-R409 PolarHBondContact O-N 3.44Å; H407-K410 PolarHBondContact O-N 3.32Å; H407-L411 WeakPolarHBondContact O-CB 3.45Å; H407-L411 PolarHBondContact O-N 3.09Å
408	R	67.9	Low	72	Confident	100 Å²	100	59 Å²	59	38%	0.377	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-42.5	176.5	-169.3	-176.5	69.7	82.9	1.4	112.3	T404 E405 F406 L411 K412	T404-R408 WeakPolarHBondContact O-CB 3.46Å; T404-R408 PolarHBondContact O-N 2.89Å; E405-R408 IonicContact OE1-NE 2.96Å; E405-R408 IonicContact OE2-CZ 3.77Å; E405-R408 VanDerWaalsContact OE2-CZ 3.27Å; E405-R408 IonicContact OE2-NE 3.13Å; E405-R408 PolarHBondContact OE2-NE 3.15Å; E405-R408 IonicContact OE2-NH2 3.36Å; E405-R408 PolarHBondContact OE2-NH2 3.26Å; F406-R408 VanDerWaalsContact C-N 3.29Å; F406-R408 PolarHBondContact O-N 2.95Å; R408-L411 PolarHBondContact O-N 2.94Å; R408-K412 WeakPolarHBondContact O-CB 3.3Å; R408-K412 PolarHBondContact O-N 3.4Å
409	R	70.5	Confident	70.6	Confident	121 Å²	121	62.5 Å²	62.5	46%	0.457	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-48.7	175.6	-77.9	-176.1	-70.5	139.7	-6.6	111.5	E405 F406 H407 L411 K412 E413	E405-R409 WeakPolarHBondContact O-CB 3.3Å; E405-R409 WeakPolarHBondContact O-CG 3.21Å; E405-R409 PolarHBondContact O-N 3.49Å; E405-R409 PolarHBondContact O-NE 3.14Å; F406-R409 PolarHBondContact O-N 3.34Å; F406-R409 VanDerWaalsContact O-N 3.14Å; H407-R409 PolarHBondContact O-N 3.44Å; R409-L411 VanDerWaalsContact C-N 3.33Å; R409-L411 PolarHBondContact O-N 3Å; R409-K412 PolarHBondContact O-N 2.79Å; R409-E413 WeakPolarHBondContact O-CG 3.24Å; R409-E413 PolarHBondContact O-N 2.83Å
410	K	71.2	Confident	69	Low	28 Å²	28	66.7 Å²	66.7	12%	0.122	34%	0.338	C	S	.	.	H	α-helix	trans	-64.9	-34.4	178	-69.2	-59.8	-179.1	-163.5	0	112.9	Y340 E347 F406 H407 E413 R414	Y340-K410 HydrophobicContact CE1-CB 4.19Å; Y340-K410 HydrophobicContact CE1-CG 4Å; E347-K410 IonicContact OE2-NZ 3.51Å; E347-K410 PolarHBondContact OE2-NZ 3.34Å; F406-K410 HydrophobicContact CD1-CG 4.28Å; F406-K410 HydrophobicContact CE1-CG 3.74Å; F406-K410 HydrophobicContact CE2-CD 4.42Å; F406-K410 HydrophobicContact CE2-CG 4.04Å; F406-K410 HydrophobicContact CZ-CD 4.14Å; F406-K410 VanDerWaalsContact CZ-CE 3.46Å; F406-K410 HydrophobicContact CZ-CG 3.6Å; F406-K410 PolarHBondContact O-N 3.27Å; H407-K410 PolarHBondContact O-N 3.32Å; K410-E413 WeakPolarHBondContact CD-OE2 3.26Å; K410-E413 IonicContact NZ-OE2 2.76Å; K410-E413 PolarHBondContact NZ-OE2 3.25Å; K410-R414 WeakPolarHBondContact O-CG 3.42Å; K410-R414 PolarHBondContact O-N 3.31Å; K410-R414 VanDerWaalsContact O-N 3.1Å; K410-R414 PolarHBondContact O-NE 3.26Å
411	L	67	Low	67.3	Low	90 Å²	90	69.8 Å²	69.8	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-67.3	-44.2	173.4	-174.3	65	0	0	0	111.2	H407 R408 R409 E413 R414 V415	H407-L411 WeakPolarHBondContact O-CB 3.45Å; H407-L411 PolarHBondContact O-N 3.09Å; R408-L411 PolarHBondContact O-N 2.94Å; R409-L411 VanDerWaalsContact C-N 3.33Å; R409-L411 PolarHBondContact O-N 3Å; L411-E413 PolarHBondContact O-N 3.32Å; L411-R414 WeakPolarHBondContact O-CB 3.4Å; L411-R414 PolarHBondContact O-N 2.91Å; L411-R414 VanDerWaalsContact O-N 3.16Å; L411-V415 WeakPolarHBondContact O-CG2 3.45Å; L411-V415 PolarHBondContact O-N 3.07Å
412	K	72.9	Confident	65.7	Low	116 Å²	116	77.6 Å²	77.6	50%	0.504	39%	0.392	S	S	.	.	H	α-helix	trans	-59.3	-45.5	175.7	-177.6	175.1	171.4	177.4	0	111.8	R408 R409 R414 V415 E416	R408-K412 WeakPolarHBondContact O-CB 3.3Å; R408-K412 PolarHBondContact O-N 3.4Å; R409-K412 PolarHBondContact O-N 2.79Å; K412-R414 VanDerWaalsContact C-N 3.31Å; K412-R414 PolarHBondContact O-N 3.38Å; K412-V415 PolarHBondContact O-N 2.92Å; K412-E416 WeakPolarHBondContact CE-OE1 3.48Å; K412-E416 HydrophobicContact CG-CG 4.44Å; K412-E416 IonicContact NZ-OE1 2.75Å; K412-E416 WeakPolarHBondContact O-CB 3.36Å; K412-E416 WeakPolarHBondContact O-CG 3.33Å; K412-E416 PolarHBondContact O-N 3.12Å
413	E	70.2	Confident	64.1	Low	95 Å²	95	85.3 Å²	85.3	44%	0.444	43%	0.428	S	S	.	.	H	α-helix	trans	-58.2	-40.9	174.3	-73.3	170.1	-161.6	0	0	112.1	R409 K410 L411 S417	R409-E413 WeakPolarHBondContact O-CG 3.24Å; R409-E413 PolarHBondContact O-N 2.83Å; K410-E413 WeakPolarHBondContact CD-OE2 3.26Å; K410-E413 IonicContact NZ-OE2 2.76Å; K410-E413 PolarHBondContact NZ-OE2 3.25Å; L411-E413 PolarHBondContact O-N 3.32Å; E413-S417 WeakPolarHBondContact O-CB 3.26Å; E413-S417 PolarHBondContact O-N 3.47Å; E413-S417 PolarHBondContact O-OG 2.9Å
414	R	68.8	Low	62.3	Low	120 Å²	120	90.5 Å²	90.5	45%	0.453	46%	0.459	S	S	.	.	H	α-helix	trans	-65.4	-43.2	174.8	-76.2	-175.1	-75.2	153.2	-11.9	112.5	K410 L411 K412 S417 V418	K410-R414 WeakPolarHBondContact O-CG 3.42Å; K410-R414 PolarHBondContact O-N 3.31Å; K410-R414 VanDerWaalsContact O-N 3.1Å; K410-R414 PolarHBondContact O-NE 3.26Å; L411-R414 WeakPolarHBondContact O-CB 3.4Å; L411-R414 PolarHBondContact O-N 2.91Å; L411-R414 VanDerWaalsContact O-N 3.16Å; K412-R414 VanDerWaalsContact C-N 3.31Å; K412-R414 PolarHBondContact O-N 3.38Å; R414-S417 WeakPolarHBondContact CA-OG 3.31Å; R414-S417 PolarHBondContact O-N 3.28Å; R414-S417 PolarHBondContact O-OG 3.11Å; R414-V418 VanDerWaalsContact O-CG2 3.29Å; R414-V418 WeakPolarHBondContact O-CG2 3.3Å; R414-V418 PolarHBondContact O-N 2.99Å; R414-V418 VanDerWaalsContact O-N 3.09Å
415	V	66.4	Low	60.6	Low	82 Å²	82	93.9 Å²	93.9	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-67	-40.1	178.8	173.1	0	0	0	0	111.5	L411 K412 V418 S419	L411-V415 WeakPolarHBondContact O-CG2 3.45Å; L411-V415 PolarHBondContact O-N 3.07Å; K412-V415 PolarHBondContact O-N 2.92Å; V415-V418 PolarHBondContact O-N 2.95Å; V415-S419 WeakPolarHBondContact O-CB 3.39Å; V415-S419 PolarHBondContact O-N 3.12Å; V415-S419 PolarHBondContact O-OG 3.03Å
416	E	64.4	Low	59.1	Low	104 Å²	104	98.3 Å²	98.3	49%	0.486	50%	0.503	S	S	.	.	H	α-helix	trans	-68.3	-38.6	178	-73.6	176	179.1	0	0	112.3	K412 S419 T420	K412-E416 WeakPolarHBondContact CE-OE1 3.48Å; K412-E416 HydrophobicContact CG-CG 4.44Å; K412-E416 IonicContact NZ-OE1 2.75Å; K412-E416 WeakPolarHBondContact O-CB 3.36Å; K412-E416 WeakPolarHBondContact O-CG 3.33Å; K412-E416 PolarHBondContact O-N 3.12Å; E416-S419 PolarHBondContact O-N 3.44Å; E416-T420 PolarHBondContact O-N 3.39Å; E416-T420 PolarHBondContact O-OG1 2.85Å
417	S	63.4	Low	57.3	Low	63 Å²	63	105.6 Å²	105.6	44%	0.441	54%	0.542	S	S	.	.	H	α-helix	trans	-68.2	-34.9	175.2	50.9	0	0	0	0	112.9	E413 R414 T420 V421	E413-S417 WeakPolarHBondContact O-CB 3.26Å; E413-S417 PolarHBondContact O-N 3.47Å; E413-S417 PolarHBondContact O-OG 2.9Å; R414-S417 WeakPolarHBondContact CA-OG 3.31Å; R414-S417 PolarHBondContact O-N 3.28Å; R414-S417 PolarHBondContact O-OG 3.11Å; S417-T420 WeakPolarHBondContact CA-OG1 3.46Å; S417-T420 PolarHBondContact O-OG1 2.93Å; S417-V421 VanDerWaalsContact O-CG2 3.29Å; S417-V421 WeakPolarHBondContact O-CG2 3.27Å; S417-V421 PolarHBondContact O-N 2.99Å
418	V	57.5	Low	55.9	Low	99 Å²	99	108.2 Å²	108.2	60%	0.6	56%	0.563	S	S	*	*	H	α-helix	trans	-68.8	-37	173.2	173.5	0	0	0	0	111.5	R414 V415	R414-V418 VanDerWaalsContact O-CG2 3.29Å; R414-V418 WeakPolarHBondContact O-CG2 3.3Å; R414-V418 PolarHBondContact O-N 2.99Å; R414-V418 VanDerWaalsContact O-N 3.09Å; V415-V418 PolarHBondContact O-N 2.95Å
419	S	55.8	Low	54.5	Low	74 Å²	74	108.8 Å²	108.8	52%	0.517	58%	0.58	S	S	.	*	H	α-helix	trans	-71.6	-36	-178.6	-58.2	0	0	0	0	112.7	V415 E416 K422	V415-S419 WeakPolarHBondContact O-CB 3.39Å; V415-S419 PolarHBondContact O-N 3.12Å; V415-S419 PolarHBondContact O-OG 3.03Å; E416-S419 PolarHBondContact O-N 3.44Å; S419-K422 PolarHBondContact O-N 3.45Å
420	T	52.7	Low	52.8	Low	89 Å²	89	109.2 Å²	109.2	55%	0.546	60%	0.596	S	S	.	*	H	α-helix	trans	-73	-26.3	177.9	32.8	0	0	0	0	113.6	E416 S417 K422 Q423	E416-T420 PolarHBondContact O-N 3.39Å; E416-T420 PolarHBondContact O-OG1 2.85Å; S417-T420 WeakPolarHBondContact CA-OG1 3.46Å; S417-T420 PolarHBondContact O-OG1 2.93Å; T420-K422 VanDerWaalsContact C-N 3.26Å; T420-K422 PolarHBondContact O-N 3.38Å; T420-Q423 PolarHBondContact O-N 2.98Å
421	V	47.6	Very low	51.2	Low	115 Å²	115	119.6 Å²	119.6	70%	0.697	64%	0.635	S	S	*	*	H	α-helix	trans	-68.6	-23.6	176.9	171.6	0	0	0	0	112.4	S417	S417-V421 VanDerWaalsContact O-CG2 3.29Å; S417-V421 WeakPolarHBondContact O-CG2 3.27Å; S417-V421 PolarHBondContact O-N 2.99Å
422	K	46	Very low	49.5	Very low	179 Å²	179	122.8 Å²	122.8	78%	0.778	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-12	177.1	-76.8	-172.6	175.8	-177.4	0	115.1	S419 T420	S419-K422 PolarHBondContact O-N 3.45Å; T420-K422 VanDerWaalsContact C-N 3.26Å; T420-K422 PolarHBondContact O-N 3.38Å
423	Q	47.1	Very low	47.8	Very low	176 Å²	176	122 Å²	122	82%	0.822	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-0.4	-179.9	-88.8	-172.7	-20.9	0	0	115.1	T420	T420-Q423 PolarHBondContact O-N 2.98Å
424	T	37.9	Very low	46	Very low	111 Å²	111	124.7 Å²	124.7	68%	0.681	69%	0.685	S	S	*	*			trans	-110.2	72.5	171.8	-44.8	0	0	0	0	109.4	P426	T424-P426 VanDerWaalsContact O-CD 3.22Å; T424-P426 WeakPolarHBondContact O-CD 3.32Å
425	I	36.1	Very low	44.5	Very low	144 Å²	144	126.4 Å²	126.4	74%	0.738	70%	0.703	S	S	*	*			trans	-72.2	113.1	160.2	-61.1	174.7	0	0	0	105.8	N427	I425-N427 PolarHBondContact O-N 3.49Å
426	P	38.6	Very low	43.2	Very low	104 Å²	104	128.3 Å²	128.3	68%	0.675	72%	0.715	S	S	*	*			trans	-69.5	125.5	171.1	-6.2	24.3	0	0	0	107	T424 P428	T424-P426 VanDerWaalsContact O-CD 3.22Å; T424-P426 WeakPolarHBondContact O-CD 3.32Å; P426-P428 VanDerWaalsContact O-N 3.17Å
427	N	34	Very low	42	Very low	154 Å²	154	130.2 Å²	130.2	82%	0.824	73%	0.728	S	S	*	*			trans	-42.6	124.5	168.8	-80.1	-39.8	0	0	0	109.5	I425	I425-N427 PolarHBondContact O-N 3.49Å
428	P	39	Very low	40.9	Very low	108 Å²	108	134.4 Å²	134.4	70%	0.701	74%	0.741	S	S	*	*			trans	-60.9	136.6	177.1	23.7	-31	0	0	0	108.9	P426 T430	P426-P428 VanDerWaalsContact O-N 3.17Å; P428-T430 PolarHBondContact O-N 3.35Å
429	P	38.5	Very low	39.9	Very low	113 Å²	113	134.3 Å²	134.3	73%	0.734	74%	0.741	S	S	*	*			trans	-66.2	120.9	-177.6	26.2	-31.6	0	0	0	109.5	W431	P429-W431 PolarHBondContact O-N 2.95Å
430	T	33.1	Very low	39	Very low	129 Å²	129	140.2 Å²	140.2	79%	0.791	76%	0.76	S	S	*	*			trans	-55	115.5	171.2	-25.8	0	0	0	0	109.3	P428	P428-T430 PolarHBondContact O-N 3.35Å
431	W	38.1	Very low	38.4	Very low	247 Å²	247	144.6 Å²	144.6	94%	0.936	77%	0.771	S	S	*	*			trans	-101	118.2	161.4	-88.7	-0.7	0	0	0	108.2	P429	P429-W431 PolarHBondContact O-N 2.95Å
432	D	31.5	Very low	37.7	Very low	157 Å²	157	146.1 Å²	146.1	84%	0.84	78%	0.776	S	S	*	*			trans	-56.6	131.5	178.5	-62.5	-51.8	0	0	0	112.2
433	A	36.4	Very low	37.1	Very low	98 Å²	98	145.3 Å²	145.3	81%	0.81	78%	0.779	S	S	*	*			trans	-156.2	114	146.7	0	0	0	0	0	109.6
434	N	34.2	Very low	36.5	Very low	152 Å²	152	144.8 Å²	144.8	81%	0.813	78%	0.782	S	S	*	*			trans	-26.6	131.5	168.5	-57.3	-37.7	0	0	0	115
435	D	37.3	Very low	36.3	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	78%	0.78	S	S	*	*				-167.7	154.9	111	-98.1	-22.7	0	0	0	111.6
436	T	39.3	Very low	36.3	Very low	121 Å²	121	143.3 Å²	143.3	74%	0.742	78%	0.779	S	S	*	*			trans	-65.1	159.1	-162.8	37.4	0	0	0	0	117.7
437	D	37.9	Very low	36.4	Very low	144 Å²	144	145.8 Å²	145.8	77%	0.77	78%	0.782	S	S	*	*			trans	98.9	113.4	147.9	-89.1	-6.2	0	0	0	121.2
438	E	39.9	Very low	36.5	Very low	151 Å²	151	145.4 Å²	145.4	71%	0.706	78%	0.78	S	S	*	*				77.3	94.1	129.3	-67.5	-90.1	170.6	0	0	119.9
439	T	36.4	Very low	36.4	Very low	97 Å²	97	146.7 Å²	146.7	60%	0.595	78%	0.781	S	S	*	*				61.4	86.8	117.9	-37.3	0	0	0	0	119
440	H	38.1	Very low	36.4	Very low	199 Å²	199	150.2 Å²	150.2	92%	0.921	79%	0.787	S	S	*	*			trans	-145.7	128.4	142.1	-81.8	-71.9	0	0	0	112.5
441	K	39.1	Very low	36.9	Very low	181 Å²	181	155.2 Å²	155.2	79%	0.787	79%	0.792	S	S	*	*			trans	-79.5	147.8	-174.5	-72.5	167.8	172.1	171.3	0	112.6
442	N	32.6	Very low	37.1	Very low	147 Å²	147	149 Å²	149	79%	0.786	78%	0.784	S	S	*	*			trans	51.2	111	143.7	-60	-13.7	0	0	0	119
443	L	34.5	Very low	37.2	Very low	161 Å²	161	149.3 Å²	149.3	84%	0.843	79%	0.785	S	S	*	*			trans	-150.3	116.4	138.3	-106.8	130	0	0	0	109.8	V445	L443-V445 HydrophobicContact CB-CG2 4.37Å; L443-V445 HydrophobicContact CD2-CG2 3.8Å
444	N	33.2	Very low	37.3	Very low	165 Å²	165	150.1 Å²	150.1	88%	0.882	79%	0.785	S	S	*	*			trans	-83	115.2	165.6	-159.7	34.7	0	0	0	105.3
445	V	34.9	Very low	37.4	Very low	105 Å²	105	149 Å²	149	64%	0.636	78%	0.779	S	S	*	*			trans	-124.9	111.7	177.8	172.3	0	0	0	0	108.2	L443	L443-V445 HydrophobicContact CB-CG2 4.37Å; L443-V445 HydrophobicContact CD2-CG2 3.8Å
446	T	36.8	Very low	37.6	Very low	120 Å²	120	149.7 Å²	149.7	74%	0.736	78%	0.783	S	S	*	*			trans	-63.9	125.2	158.5	-44.1	0	0	0	0	107.4
447	Q	39	Very low	37.4	Very low	156 Å²	156	150.9 Å²	150.9	73%	0.729	78%	0.779	S	S	*	*			trans	-100.8	100.3	173.7	-125.4	-179.7	-54.8	0	0	108.1
448	D	36.8	Very low	37.3	Very low	146 Å²	146	151 Å²	151	78%	0.781	79%	0.786	S	S	*	*			trans	-79.1	117.2	154.1	-69.4	-46.6	0	0	0	106.3	E450	D448-E450 PolarHBondContact O-N 2.93Å
449	D	36.5	Very low	36.9	Very low	134 Å²	134	149.8 Å²	149.8	72%	0.717	79%	0.789	S	S	*	*			trans	-90.1	93.8	172	-88.2	-21.9	0	0	0	108.7
450	E	38.1	Very low	37.1	Very low	187 Å²	187	152.3 Å²	152.3	87%	0.874	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89	123.3	167.7	-172.2	168.8	-161.9	0	0	108.5	D448	D448-E450 PolarHBondContact O-N 2.93Å
451	W	43.9	Very low	37	Very low	234 Å²	234	150.5 Å²	150.5	89%	0.886	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.7	141.2	175.8	-79.6	79.9	0	0	0	110.4
452	P	42.7	Very low	36.9	Very low	118 Å²	118	147.5 Å²	147.5	77%	0.766	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.4	128.6	-177.9	30.5	-31.9	0	0	0	112.2
453	D	33	Very low	37.2	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.4	139.7	162.9	-90.3	-32.2	0	0	0	111.2
454	S	39.6	Very low	37.3	Very low	116 Å²	116	145 Å²	145	81%	0.811	78%	0.779	S	S	*	*			trans	-110.2	115.5	161	59.8	0	0	0	0	109
455	D	36.4	Very low	37.5	Very low	128 Å²	128	145.8 Å²	145.8	68%	0.684	78%	0.778	S	S	*	*			trans	-50.4	138.9	179.9	-64	-57.6	0	0	0	114.7
456	D	40.1	Very low	37.3	Very low	171 Å²	171	148 Å²	148	91%	0.914	78%	0.784	S	S	*	*			trans	-140.7	112	138.2	-129.4	-9.2	0	0	0	109.6
457	H	35.6	Very low	37.4	Very low	146 Å²	146	147.8 Å²	147.8	68%	0.676	79%	0.787	S	S	*	*			trans	-74.4	135.7	-173.4	-69.9	-78.9	0	0	0	112.3
458	T	35.9	Very low	37.2	Very low	147 Å²	147	147.4 Å²	147.4	90%	0.902	79%	0.79	S	S	*	*			trans	-151.9	110.4	132.4	41.3	0	0	0	0	111.4
459	T	31.8	Very low	37.5	Very low	125 Å²	125	148.5 Å²	148.5	77%	0.767	80%	0.796	S	S	*	*			trans	-71	135.3	169.9	33.2	0	0	0	0	112.6
460	V	39.7	Very low	37.5	Very low	150 Å²	150	149.6 Å²	149.6	91%	0.909	80%	0.797	S	S	*	*			trans	-141	120.8	143.2	-174.5	0	0	0	0	109.1
461	E	36.5	Very low	37.4	Very low	162 Å²	162	146.9 Å²	146.9	76%	0.757	80%	0.799	S	S	*	*			trans	-71.5	148.2	176.3	-50.7	177.7	136.9	0	0	111.1
462	N	37.9	Very low	36.9	Very low	117 Å²	117	142 Å²	142	63%	0.626	79%	0.789	S	S	*	*				167.9	124.9	107.5	-93.6	-7	0	0	0	114.4
463	E	38.1	Very low	36.7	Very low	151 Å²	151	142.3 Å²	142.3	71%	0.706	79%	0.793	S	S	*	*				71.1	104.7	126.5	-59.2	177	-160.8	0	0	120.8
464	S	36.7	Very low	36.8	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	79%	0.792	S	S	*	*				73.6	146.7	126.6	69.6	0	0	0	0	117.8
465	E	37.4	Very low	36.5	Very low	182 Å²	182	146 Å²	146	85%	0.85	79%	0.794	S	S	*	*			cis	-165	168.2	30.7	-141.3	168.3	-158.6	0	0	109.1
466	I	31.7	Very low	36.3	Very low	152 Å²	152	145.3 Å²	145.3	78%	0.779	80%	0.798	S	S	*	*			trans	-83.7	148.2	-161.5	-62.3	140	0	0	0	113.2
467	S	38.4	Very low	35.8	Very low	114 Å²	114	144 Å²	144	80%	0.797	79%	0.792	S	S	*	*			trans	-160.1	106.2	146.6	-178.7	0	0	0	0	112
468	N	35.2	Very low	35.9	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	80%	0.801	S	S	*	*			trans	-81.5	140.3	165.7	-74.7	-35.2	0	0	0	109.9
469	D	43.3	Very low	35.7	Very low	170 Å²	170	145.2 Å²	145.2	91%	0.909	80%	0.797	S	S	*	*			trans	-138.4	122.6	152.1	-109.3	-21.9	0	0	0	110.2
470	E	34.6	Very low	35.8	Very low	156 Å²	156	145.2 Å²	145.2	73%	0.729	80%	0.797	S	S	*	*			trans	-98.6	133	-174.9	-179.8	-179.5	-177.4	0	0	108.9
471	S	37.8	Very low	35.2	Very low	130 Å²	130	144.3 Å²	144.3	91%	0.909	79%	0.792	S	S	*	*			trans	-153.8	106.6	165.7	-74.9	0	0	0	0	112.3
472	I	33.6	Very low	35.1	Very low	132 Å²	132	143.9 Å²	143.9	68%	0.677	79%	0.793	S	S	*	*			trans	-65.1	142.9	-178.6	-64	157	0	0	0	114
473	S	37.3	Very low	34.7	Very low	124 Å²	124	144.1 Å²	144.1	87%	0.867	80%	0.799	S	S	*	*			trans	-158.4	115.9	131.9	68.2	0	0	0	0	113.6
474	K	34.5	Very low	34.2	Very low	190 Å²	190	142 Å²	142	83%	0.826	80%	0.801	S	S	*	*			trans	-85.7	148.1	171.3	-65.7	170.1	173.9	175.9	0	111.8
475	L	33.1	Very low	34	Very low	165 Å²	165	143.5 Å²	143.5	86%	0.864	81%	0.806	S	S	*	*			trans	172.6	140.9	142	-125.4	66.8	0	0	0	108.3
476	C	32.9	Very low	33.7	Very low	114 Å²	114	144.4 Å²	144.4	77%	0.77	80%	0.802	S	S	*	*			cis	-166.7	149.2	-15.2	-115.1	0	0	0	0	107.2
477	N	30.5	Very low	33.8	Very low	145 Å²	145	143 Å²	143	78%	0.775	81%	0.805	S	S	*	*			trans	-60.4	163.3	178.5	-61.2	-20.6	0	0	0	114.6
478	N	37.4	Very low	33.5	Very low	164 Å²	164	143.2 Å²	143.2	88%	0.877	80%	0.798	S	S	*	*				-167.6	121.3	122.9	-87.3	-22.5	0	0	0	112
479	D	31.7	Very low	33.6	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	80%	0.798	S	S	*	*			trans	-59.3	146.2	163.2	-71	-53.1	0	0	0	111.9
480	T	33.6	Very low	33	Very low	124 Å²	124	143 Å²	143	76%	0.761	80%	0.799	S	S	*	*			trans	-153.6	111.3	147.8	-56.8	0	0	0	0	110.4	I482	T480-I482 HydrophobicContact CG2-CD1 4.31Å; T480-I482 HydrophobicContact CG2-CG1 4.07Å
481	T	27.1	Very low	32.8	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	80%	0.801	S	S	*	*			trans	-80.2	125	164	-46.4	0	0	0	0	109.7
482	I	34.5	Very low	32.4	Very low	152 Å²	152	140.6 Å²	140.6	78%	0.779	80%	0.8	S	S	*	*			trans	-140.5	127.9	157.6	-60.7	-178.4	0	0	0	109.5	T480	T480-I482 HydrophobicContact CG2-CD1 4.31Å; T480-I482 HydrophobicContact CG2-CG1 4.07Å
483	T	29.4	Very low	32.3	Very low	122 Å²	122	139.2 Å²	139.2	75%	0.748	80%	0.802	S	S	*	*			trans	-77.8	147.2	175.6	30.2	0	0	0	0	113.2
484	S	27.3	Very low	32	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	81%	0.806	S	S	*	*			trans	66.5	108.1	144.2	-171	0	0	0	0	119.6
485	T	33.5	Very low	31.7	Very low	137 Å²	137	140.6 Å²	140.6	84%	0.84	80%	0.796	S	S	*	*				-161.1	128.6	115	37.7	0	0	0	0	111.9
486	R	29.9	Very low	31.5	Very low	201 Å²	201	141 Å²	141	76%	0.758	79%	0.792	S	S	*	*			trans	-42.6	136.4	162.1	177.5	178.7	176.6	170.4	0.4	113.7	D488	R486-D488 IonicContact CZ-OD2 2.88Å; R486-D488 IonicContact NE-OD1 3.02Å; R486-D488 IonicContact NE-OD2 3.53Å; R486-D488 PolarHBondContact NE-OD2 3.14Å; R486-D488 IonicContact NH2-OD2 2.7Å; R486-D488 PolarHBondContact NH2-OD2 3.04Å; R486-D488 VanDerWaalsContact NH2-OD2 3.13Å
487	S	35.3	Very low	31.5	Very low	121 Å²	121	143.4 Å²	143.4	85%	0.846	80%	0.797	S	S	*	*			trans	-146.8	112.3	152.3	-75.6	0	0	0	0	108.2
488	D	30.8	Very low	31.5	Very low	120 Å²	120	143.4 Å²	143.4	64%	0.642	79%	0.792	S	S	*	*			trans	-72.1	134.3	179.6	-67.8	-50.8	0	0	0	110.8	R486	R486-D488 IonicContact CZ-OD2 2.88Å; R486-D488 IonicContact NE-OD1 3.02Å; R486-D488 IonicContact NE-OD2 3.53Å; R486-D488 PolarHBondContact NE-OD2 3.14Å; R486-D488 IonicContact NH2-OD2 2.7Å; R486-D488 PolarHBondContact NH2-OD2 3.04Å; R486-D488 VanDerWaalsContact NH2-OD2 3.13Å
489	S	37.9	Very low	31.2	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	79%	0.787	S	S	*	*			trans	-155.7	85.3	149.6	48.2	0	0	0	0	111.4
490	Q	30.9	Very low	31.3	Very low	197 Å²	197	142.8 Å²	142.8	92%	0.921	79%	0.788	S	S	*	*			trans	51.5	95.3	143.2	-63.3	-170.9	-56.9	0	0	120.3
491	S	29.5	Very low	31.2	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	79%	0.79	S	S	*	*			trans	-68.8	137.9	145.9	-45.8	0	0	0	0	111
492	S	29.3	Very low	31.6	Very low	125 Å²	125	145.6 Å²	145.6	87%	0.874	79%	0.791	S	S	*	*			trans	-107.2	75.9	162.7	179.5	0	0	0	0	109.1
493	S	31.8	Very low	31.5	Very low	103 Å²	103	146.5 Å²	146.5	72%	0.72	79%	0.792	S	S	*	*			trans	-106.7	109.4	167.9	-47.5	0	0	0	0	106.8
494	R	30.4	Very low	31.6	Very low	255 Å²	255	150.1 Å²	150.1	96%	0.962	80%	0.797	S	S	*	*			trans	-97.6	94.1	178.9	-147.7	176.2	-173	-174	1.6	107.9
495	S	29.4	Very low	32.1	Very low	88 Å²	88	152.7 Å²	152.7	62%	0.615	80%	0.795	S	S	*	*			trans	-116.1	146.6	166.8	64.1	0	0	0	0	110.4
496	F	28.6	Very low	32.2	Very low	174 Å²	174	152.8 Å²	152.8	76%	0.763	79%	0.789	S	S	*	*			trans	72.7	112.2	169.3	-62.9	-78.3	0	0	0	119.2	Q498	F496-Q498 HydrophobicContact CD1-CG 4.19Å
497	N	32.9	Very low	32.5	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	79%	0.787	S	S	*	*				-129.7	124	118.9	-134.7	-10.5	0	0	0	109.4
498	Q	31	Very low	32.5	Very low	144 Å²	144	156.9 Å²	156.9	67%	0.673	79%	0.786	S	S	*	*			trans	-70.5	155.1	176.6	-68.8	170.3	-26.4	0	0	110.6	F496	F496-Q498 HydrophobicContact CD1-CG 4.19Å
499	N	31.6	Very low	33	Very low	144 Å²	144	158.6 Å²	158.6	77%	0.77	80%	0.795	S	S	*	*			trans	132.4	88.7	149.7	-64.3	-23.9	0	0	0	112.7
500	N	33.2	Very low	32.9	Very low	161 Å²	161	158 Å²	158	86%	0.861	79%	0.791	S	S	*	*				-173.6	103.1	119.6	-94.2	-19	0	0	0	110.4
501	I	31.3	Very low	33.4	Very low	154 Å²	154	156.5 Å²	156.5	79%	0.79	79%	0.789	S	S	*	*			trans	-77.4	121.3	161.6	-65.5	165.4	0	0	0	106.4	E503	I501-E503 HydrophobicContact CG2-CG 4.28Å
502	I	35.2	Very low	33.6	Very low	162 Å²	162	155.7 Å²	155.7	83%	0.831	78%	0.784	S	S	*	*			trans	-132	118.2	150.4	-62.5	-176.6	0	0	0	107.6
503	E	33.4	Very low	33.9	Very low	170 Å²	170	156.9 Å²	156.9	79%	0.794	78%	0.78	S	S	*	*			trans	-64.9	147.3	-173.6	-65.3	171.8	136.5	0	0	113.8	I501	I501-E503 HydrophobicContact CG2-CG 4.28Å
504	K	31.7	Very low	34	Very low	199 Å²	199	156.6 Å²	156.6	87%	0.865	78%	0.778	S	S	*	*			trans	-57.6	132.8	160.6	-81.2	174.8	172.8	172.7	0	110.6
505	K	36.7	Very low	34.4	Very low	160 Å²	160	149.9 Å²	149.9	70%	0.696	77%	0.77	S	S	*	*			trans	-137.8	92.3	151.9	-161.5	167.9	-173.4	172.5	0	110.9
506	I	35.1	Very low	34.8	Very low	140 Å²	140	150.1 Å²	150.1	72%	0.718	77%	0.772	S	S	*	*			trans	-81	117.2	161.5	-63	169.9	0	0	0	106.3
507	R	37.7	Very low	35.3	Very low	192 Å²	192	148.9 Å²	148.9	73%	0.725	77%	0.773	S	S	*	*			trans	-113.2	112.7	158.8	-86.9	-174.5	178.3	167.1	-3.7	107.5
508	R	33.9	Very low	35.6	Very low	216 Å²	216	146.2 Å²	146.2	82%	0.815	77%	0.767	S	S	*	*			trans	-74.8	133.2	154.9	-64.7	-178.8	-141.9	122.8	1.9	106.6
509	D	42.1	Very low	36	Very low	155 Å²	155	142.3 Å²	142.3	83%	0.829	77%	0.765	S	S	*	*			trans	-138.7	107.6	147.8	-76	-44.2	0	0	0	105.7
510	S	36	Very low	36.5	Very low	104 Å²	104	141.9 Å²	141.9	73%	0.727	76%	0.763	S	S	*	*			trans	-72.2	137.9	163	-53	0	0	0	0	107.5
511	D	39.9	Very low	36.8	Very low	164 Å²	164	141.2 Å²	141.2	88%	0.877	76%	0.755	S	S	*	*			trans	-165.8	145.5	138.5	-93.6	-26	0	0	0	112.4
512	S	35.2	Very low	37.1	Very low	96 Å²	96	142.1 Å²	142.1	67%	0.671	76%	0.756	S	S	*	*			trans	-86.7	169.8	-158.1	-34.6	0	0	0	0	114.5
513	N	35.1	Very low	37.4	Very low	150 Å²	150	139.2 Å²	139.2	80%	0.802	75%	0.75	S	S	*	*			trans	114.2	103.9	154.4	-66.1	-13.2	0	0	0	114
514	S	33.5	Very low	37.6	Very low	97 Å²	97	137.7 Å²	137.7	68%	0.678	75%	0.747	S	S	*	*				97.2	134.8	57.3	70.5	0	0	0	0	113
515	S	38.8	Very low	38.1	Very low	113 Å²	113	137.5 Å²	137.5	79%	0.79	75%	0.749	S	S	*	*			trans	80	141.3	161.2	83.8	0	0	0	0	116.4
516	S	38.9	Very low	37.8	Very low	93 Å²	93	132.8 Å²	132.8	65%	0.65	75%	0.746	S	S	*	*			cis	-180	162.4	-6.4	42.5	0	0	0	0	108
517	N	39	Very low	38.1	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	76%	0.756	S	S	*	*			trans	80.6	144.1	154	-77.5	6.2	0	0	0	119.5
518	S	38.5	Very low	38	Very low	107 Å²	107	135.4 Å²	135.4	75%	0.748	77%	0.766	S	S	*	*			cis	164.1	147.8	-21.5	50.5	0	0	0	0	106.2
519	G	40.2	Very low	38.2	Very low	62 Å²	62	131.1 Å²	131.1	64%	0.639	77%	0.769	S	S	*	*			trans	126.6	99.8	158.7	0	0	0	0	0	113.3
520	N	40.8	Very low	37.9	Very low	136 Å²	136	133.4 Å²	133.4	73%	0.727	77%	0.771	S	S	*	*				78.8	138.7	88.6	-84.1	26.1	0	0	0	111.6
521	E	40.1	Very low	37.9	Very low	147 Å²	147	140.1 Å²	140.1	69%	0.687	78%	0.781	S	S	*	*			cis	-172.1	152.6	2.5	-112.6	161.9	176.9	0	0	106.2
522	E	37.5	Very low	37.6	Very low	173 Å²	173	141.4 Å²	141.4	81%	0.808	78%	0.779	S	S	*	*			trans	30.4	145.4	142.4	-58	-176.7	134.5	0	0	121.4
523	S	42	Very low	37.8	Very low	101 Å²	101	145.5 Å²	145.5	71%	0.706	79%	0.787	S	S	*	*			cis	-174.6	143	46.7	60.9	0	0	0	0	113.3
524	N	37.8	Very low	37.6	Very low	137 Å²	137	142.7 Å²	142.7	73%	0.733	78%	0.779	S	S	*	*			trans	32.6	126	136.2	-64.7	-34.6	0	0	0	122.6
525	H	42.1	Very low	37.5	Very low	196 Å²	196	148.2 Å²	148.2	91%	0.907	79%	0.786	S	S	*	*				-178.4	130.9	108.6	-100.2	-68.4	0	0	0	112
526	G	29.8	Very low	37.2	Very low	61 Å²	61	154.4 Å²	154.4	63%	0.629	79%	0.792	S	S	*	*			trans	-86.8	172.2	-179.1	0	0	0	0	0	115.4
527	N	41.8	Very low	36.8	Very low	175 Å²	175	159.5 Å²	159.5	94%	0.936	80%	0.803	S	S	*	*			trans	-161	134.4	143.2	-99.8	-29.3	0	0	0	111.7
528	K	34.4	Very low	36.8	Very low	212 Å²	212	158.3 Å²	158.3	92%	0.922	80%	0.803	S	S	*	*			trans	-75.7	142.6	179.4	-63.8	169.5	175.9	170.2	0	110.7
529	S	39.2	Very low	36.5	Very low	126 Å²	126	159.4 Å²	159.4	88%	0.881	81%	0.805	S	S	*	*			trans	-157.4	127.1	144.5	-162.1	0	0	0	0	112.7
530	K	34.6	Very low	36.2	Very low	203 Å²	203	164.3 Å²	164.3	88%	0.883	82%	0.817	S	S	*	*			trans	-80.4	140.4	177.6	-64.9	176.5	174	178.1	0	110.1
531	R	36.5	Very low	35.7	Very low	244 Å²	244	167.1 Å²	167.1	92%	0.921	82%	0.822	S	S	*	*			trans	-156.2	121.7	144.8	-128.6	171.5	176.4	163.9	-1.5	112.6
532	K	34.3	Very low	35.5	Very low	192 Å²	192	165.4 Å²	165.4	84%	0.835	83%	0.827	S	S	*	*			trans	-69.4	153.8	170.1	-67.2	179.6	169.3	-176	0	111.1
533	H	37.9	Very low	35.5	Very low	182 Å²	182	166.6 Å²	166.6	84%	0.843	83%	0.829	S	S	*	*			trans	169.1	108.1	140.4	-85.1	-63.2	0	0	0	106.5
534	S	32	Very low	34.9	Very low	91 Å²	91	170.2 Å²	170.2	64%	0.636	83%	0.834	S	S	*	*				80.8	108.3	61.4	-156.2	0	0	0	0	115.4
535	Y	30.7	Very low	34.8	Very low	213 Å²	213	171.9 Å²	171.9	84%	0.835	84%	0.842	S	S	*	*			trans	51	128.8	155	-54.5	-69.6	0	0	0	123.5
536	R	33.5	Very low	34.3	Very low	243 Å²	243	165.9 Å²	165.9	92%	0.917	83%	0.834	S	S	*	*				163.6	136.1	100.4	-92.4	-167.2	178.8	-167.2	-0.8	112.9
537	K	30.9	Very low	34.4	Very low	199 Å²	199	172.5 Å²	172.5	87%	0.865	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-70.7	149.7	162.8	-73	178.7	173.9	179.8	0	111.1
538	P	37.5	Very low	33.9	Very low	125 Å²	125	172.8 Å²	172.8	81%	0.812	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-96.9	129.6	161.5	32.5	-24.6	0	0	0	112.4
539	V	31.8	Very low	33.7	Very low	129 Å²	129	167.4 Å²	167.4	78%	0.782	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-87.4	134.6	163.9	169.8	0	0	0	0	107.9
540	N	34.3	Very low	33.2	Very low	165 Å²	165	166.6 Å²	166.6	88%	0.882	83%	0.828	S	S	*	*			trans	-109	110	166.7	-105.9	-13.3	0	0	0	110.3
541	K	29.9	Very low	33	Very low	196 Å²	196	161.2 Å²	161.2	85%	0.852	82%	0.816	S	S	*	*			trans	-136.2	124.1	157.7	-88.3	-174.1	178.2	175	0	108.5
542	S	37.6	Very low	32.8	Very low	111 Å²	111	156.6 Å²	156.6	78%	0.776	81%	0.809	S	S	*	*			trans	-173.5	139.7	166.8	147.2	0	0	0	0	107.3
543	K	36.6	Very low	32.8	Very low	198 Å²	198	156 Å²	156	86%	0.861	81%	0.807	S	S	*	*			cis	-170.9	153.4	-13.2	-115.6	172.4	-176.3	176.1	0	105.1
544	H	29.1	Very low	32.5	Very low	176 Å²	176	154 Å²	154	82%	0.815	80%	0.798	S	S	*	*			trans	-46.3	154.2	177.6	-139.5	-95.2	0	0	0	117.7
545	L	36.1	Very low	32.4	Very low	172 Å²	172	156.1 Å²	156.1	90%	0.901	80%	0.802	S	S	*	*			trans	137.8	129.4	151.3	-76.5	162	0	0	0	109.6
546	G	32.3	Very low	32.6	Very low	70 Å²	70	153.8 Å²	153.8	72%	0.722	80%	0.803	S	S	*	*			cis	-178.7	154.7	4.9	0	0	0	0	0	108.6
547	K	31.4	Very low	32.4	Very low	200 Å²	200	146.4 Å²	146.4	87%	0.87	79%	0.789	S	S	*	*			trans	-32.7	146.2	-178.9	-63.4	166.2	175.8	177.2	0	116.9
548	L	32	Very low	32.5	Very low	181 Å²	181	143.4 Å²	143.4	95%	0.948	78%	0.782	S	S	*	*				-169.9	154.5	113.2	-92.3	170.1	0	0	0	110.7
549	S	28.6	Very low	32.2	Very low	99 Å²	99	144 Å²	144	69%	0.692	78%	0.779	S	S	*	*			trans	-117.4	167.7	-147.1	-179.2	0	0	0	0	112.9
550	C	30.2	Very low	32.3	Very low	110 Å²	110	146.6 Å²	146.6	74%	0.743	79%	0.787	S	S	*	*			trans	75.9	144.6	158.2	-60.7	0	0	0	0	117
551	S	30.2	Very low	32.2	Very low	89 Å²	89	148.1 Å²	148.1	62%	0.622	79%	0.786	S	S	*	*			cis	173.1	141.8	-20.8	46.4	0	0	0	0	106.5
552	N	31.2	Very low	32.4	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	78%	0.78	S	S	*	*			trans	76.5	143.6	146.7	-63.4	-8.7	0	0	0	122.5
553	K	34.1	Very low	32.2	Very low	181 Å²	181	145.7 Å²	145.7	79%	0.787	78%	0.779	S	S	*	*			trans	86.5	138	156.3	-67.3	-173.5	170.4	-162.6	0	116.8
554	E	32.9	Very low	31.8	Very low	139 Å²	139	143.3 Å²	143.3	65%	0.65	78%	0.776	S	S	*	*			cis	-174.5	147	-9.2	-120	167.2	148.4	0	0	104.2
555	N	30.2	Very low	32	Very low	135 Å²	135	143 Å²	143	72%	0.722	78%	0.779	S	S	*	*			trans	22.7	127.8	149	-62.1	-40.8	0	0	0	120.2
556	L	33.9	Very low	31.7	Very low	164 Å²	164	143 Å²	143	86%	0.859	77%	0.772	S	S	*	*				-174.2	123.4	112.9	-96.2	150.4	0	0	0	111.5
557	S	30.1	Very low	31.4	Very low	88 Å²	88	145.9 Å²	145.9	62%	0.615	78%	0.775	S	S	*	*			trans	-47.6	141.9	161	42.5	0	0	0	0	113.6
558	D	33.3	Very low	31.4	Very low	137 Å²	137	143.2 Å²	143.2	73%	0.733	77%	0.766	S	S	*	*				175.1	127	117.9	-91.9	-33.2	0	0	0	113.3
559	N	30.9	Very low	31.1	Very low	137 Å²	137	140.5 Å²	140.5	73%	0.733	76%	0.757	S	S	*	*			trans	37.7	112.5	139.5	-68	-67.8	0	0	0	119.7
560	L	33.9	Very low	31.2	Very low	183 Å²	183	142.2 Å²	142.2	96%	0.958	76%	0.757	S	S	*	*				-167.4	126.3	128.9	-99.6	144.8	0	0	0	111.9
561	K	32.6	Very low	31	Very low	198 Å²	198	142.8 Å²	142.8	86%	0.861	76%	0.763	S	S	*	*			trans	-74.2	171.5	179.9	-106.5	-169.3	176.6	176.3	0	112.4
562	P	33.2	Very low	31.1	Very low	111 Å²	111	144.5 Å²	144.5	72%	0.721	77%	0.769	S	S	*	*			trans	-96.4	148.2	-140.4	38	-34.6	0	0	0	113.2
563	D	32.9	Very low	30.8	Very low	144 Å²	144	144.6 Å²	144.6	77%	0.77	77%	0.769	S	S	*	*			trans	-136.7	120.3	168.2	-93.2	-40.2	0	0	0	111.7
564	N	29.7	Very low	30.8	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	77%	0.769	S	S	*	*			trans	41.1	95.6	145	-76.9	-54.8	0	0	0	119
565	I	33	Very low	30.6	Very low	171 Å²	171	140.7 Å²	140.7	88%	0.877	77%	0.772	S	S	*	*			trans	-132.5	88.8	149.9	-54.8	-179.1	0	0	0	110.8
566	K	30.2	Very low	30.6	Very low	171 Å²	171	142.4 Å²	142.4	74%	0.743	78%	0.776	S	S	*	*			trans	13.7	120.6	136.6	-133.9	175.4	-178.9	-168.4	0	118.5	E568	K566-E568 PolarHBondContact O-N 3.38Å
567	V	25.3	Very low	30.6	Very low	131 Å²	131	140.9 Å²	140.9	79%	0.794	77%	0.769	S	S	*	*			trans	-57.3	118.2	156.1	177.2	0	0	0	0	109.4
568	E	31.6	Very low	30.6	Very low	144 Å²	144	144.9 Å²	144.9	67%	0.673	78%	0.778	S	S	*	*			trans	-117.3	95.1	163.8	-80	-170.7	171.2	0	0	109.7	K566	K566-E568 PolarHBondContact O-N 3.38Å
569	T	25.1	Very low	30.5	Very low	124 Å²	124	145.3 Å²	145.3	76%	0.761	78%	0.78	S	S	*	*			trans	-68.1	112.3	150.9	44.5	0	0	0	0	108.4
570	L	31	Very low	30.3	Very low	135 Å²	135	143.2 Å²	143.2	71%	0.707	78%	0.776	S	S	*	*			trans	-133.9	95	165.9	-80.9	172.4	0	0	0	110.5	T572	L570-T572 PolarHBondContact O-N 3.47Å
571	S	25.7	Very low	30.1	Very low	122 Å²	122	140.7 Å²	140.7	85%	0.853	77%	0.769	S	S	*	*			trans	-56.5	122	148.9	-72.8	0	0	0	0	109.6
572	T	31.5	Very low	29.8	Very low	124 Å²	124	138 Å²	138	76%	0.761	76%	0.763	S	S	*	*			trans	-149.2	109.3	148.1	-17.6	0	0	0	0	110	L570	L570-T572 PolarHBondContact O-N 3.47Å
573	L	26.7	Very low	29.7	Very low	149 Å²	149	138.8 Å²	138.8	78%	0.78	77%	0.766	S	S	*	*			trans	-60.9	157.5	159.4	-106.5	93	0	0	0	110.1
574	P	32.8	Very low	29.3	Very low	122 Å²	122	140.9 Å²	140.9	79%	0.792	77%	0.768	S	S	*	*				-126.5	124.6	127.6	25.2	-9.3	0	0	0	111.8
575	T	28.5	Very low	29.4	Very low	116 Å²	116	138.5 Å²	138.5	71%	0.712	76%	0.763	S	S	*	*			trans	-55.8	132.9	157.3	23.6	0	0	0	0	111.6
576	E	31.3	Very low	29.4	Very low	171 Å²	171	137.5 Å²	137.5	80%	0.799	76%	0.76	S	S	*	*				176.4	150.8	106.7	-111.5	173.3	165.8	0	0	112.3
577	D	32.7	Very low	29.3	Very low	132 Å²	132	139 Å²	139	71%	0.706	77%	0.767	S	S	*	*			trans	85.8	86.4	155.5	-61.2	-15.4	0	0	0	122.3
578	Q	30.8	Very low	29.8	Very low	173 Å²	173	142.4 Å²	142.4	81%	0.808	77%	0.774	S	S	*	*				47.4	98.2	111.4	-61.7	-105.4	-19.5	0	0	118.1
579	N	30.7	Very low	29.8	Very low	145 Å²	145	142.6 Å²	142.6	78%	0.775	78%	0.775	S	S	*	*				-175	119.6	114.7	-112.4	-35.9	0	0	0	113.3
580	S	26.7	Very low	30.2	Very low	94 Å²	94	145.5 Å²	145.5	66%	0.657	78%	0.782	S	S	*	*			trans	36.5	122.1	137.5	43.7	0	0	0	0	120.3
581	T	29.6	Very low	30.1	Very low	130 Å²	130	143.7 Å²	143.7	80%	0.798	78%	0.777	S	S	*	*				-174.6	121.5	94.6	-62.4	0	0	0	0	110.4	V583	T581-V583 HydrophobicContact CG2-CG2 4.23Å
582	N	26.2	Very low	30.4	Very low	140 Å²	140	144.8 Å²	144.8	75%	0.749	78%	0.778	S	S	*	*			trans	-82.6	126	174.5	-155.9	9.5	0	0	0	108.1
583	V	32.3	Very low	30.1	Very low	128 Å²	128	142 Å²	142	78%	0.776	78%	0.775	S	S	*	*			trans	-141.5	92.5	159.9	-175.1	0	0	0	0	108.5	T581	T581-V583 HydrophobicContact CG2-CG2 4.23Å
584	F	25.2	Very low	30.1	Very low	188 Å²	188	143.2 Å²	143.2	83%	0.825	78%	0.781	S	S	*	*			trans	-78.7	138.3	148.3	-99.2	-93.8	0	0	0	108.2
585	S	29.8	Very low	29.7	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	78%	0.781	S	S	*	*			trans	161.9	126.2	153.7	-104.7	0	0	0	0	107.5
586	D	33.8	Very low	29.7	Very low	150 Å²	150	142.8 Å²	142.8	80%	0.802	79%	0.786	S	S	*	*			cis	-146	132.8	27.9	-70.8	-44.7	0	0	0	111.6
587	F	27.5	Very low	29.5	Very low	204 Å²	204	139.6 Å²	139.6	90%	0.895	78%	0.778	S	S	*	*			trans	-103.1	129.9	157.3	-127	-93.2	0	0	0	104.9
588	E	37.1	Very low	29.3	Very low	201 Å²	201	139.5 Å²	139.5	94%	0.939	78%	0.782	S	S	*	*			trans	-125.9	138.4	155.8	-148.2	167.4	-156.9	0	0	108.4
589	E	31.7	Very low	29.3	Very low	149 Å²	149	138 Å²	138	70%	0.696	78%	0.778	S	S	*	*			trans	-120.6	128.3	-144.1	162.7	-170.9	-150.2	0	0	107.7	T591	E589-T591 HydrophobicContact CG-CG2 4.06Å
590	M	33	Very low	29.1	Very low	184 Å²	184	139.1 Å²	139.1	91%	0.906	78%	0.783	S	S	*	*			trans	-157.1	88.7	147.8	-65.5	-160	-148.1	0	0	107.3
591	T	28.3	Very low	29.3	Very low	97 Å²	97	139.1 Å²	139.1	60%	0.595	79%	0.788	S	S	*	*				69.9	130.9	89.2	63.3	0	0	0	0	115.3	E589	E589-T591 HydrophobicContact CG-CG2 4.06Å
592	T	32.2	Very low	29.2	Very low	145 Å²	145	140.3 Å²	140.3	89%	0.89	79%	0.79	S	S	*	*			trans	74	126.1	169.9	72.9	0	0	0	0	114.9
593	G	25.5	Very low	29.3	Very low	67 Å²	67	141.9 Å²	141.9	69%	0.691	79%	0.793	S	S	*	*			cis	140.4	141.2	14.5	0	0	0	0	0	108
594	L	27	Very low	29.5	Very low	173 Å²	173	142.6 Å²	142.6	91%	0.906	80%	0.797	S	S	*	*			trans	95.4	92.6	160	-50.3	175.3	0	0	0	118.6	S596	L594-S596 PolarHBondContact O-N 2.99Å
595	S	24	Very low	29.8	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	80%	0.796	S	S	*	*				-15	118	128.1	175.3	0	0	0	0	114.5
596	S	28.8	Very low	30	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	80%	0.802	S	S	*	*			trans	-104.8	114.4	167	178.5	0	0	0	0	110.3	L594	L594-S596 PolarHBondContact O-N 2.99Å
597	V	27.1	Very low	29.9	Very low	105 Å²	105	144.1 Å²	144.1	64%	0.636	80%	0.801	S	S	*	*			trans	-79.7	128.9	167.2	165.5	0	0	0	0	107.6	I599	V597-I599 HydrophobicContact CG1-CG1 4.05Å; V597-I599 PolarHBondContact O-N 3.16Å
598	V	28.7	Very low	30.1	Very low	130 Å²	130	142.4 Å²	142.4	79%	0.788	80%	0.795	S	S	*	*			trans	-67.3	110.1	168	177.3	0	0	0	0	108.4
599	I	30.6	Very low	29.8	Very low	142 Å²	142	140 Å²	140	73%	0.728	79%	0.786	S	S	*	*			trans	-105.1	114	163.9	-60.1	-176.3	0	0	0	106.7	V597	V597-I599 HydrophobicContact CG1-CG1 4.05Å; V597-I599 PolarHBondContact O-N 3.16Å
600	L	25.2	Very low	29.8	Very low	168 Å²	168	138.9 Å²	138.9	88%	0.88	79%	0.79	S	S	*	*			trans	-68.9	121.6	163.4	-66.4	167.2	0	0	0	107.5
601	A	31.4	Very low	29.5	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	79%	0.785	S	S	*	*			trans	-130.6	119.3	166.6	0	0	0	0	0	108.8
602	D	28.8	Very low	29.6	Very low	156 Å²	156	135.1 Å²	135.1	83%	0.834	80%	0.798	S	S	*	*			trans	-57.4	155.6	173.4	-121.7	-18.8	0	0	0	112.6
603	E	28.3	Very low	29.4	Very low	172 Å²	172	137.9 Å²	137.9	80%	0.804	80%	0.798	S	S	*	*			trans	-30.6	137.8	176	-55.4	179.1	158.7	0	0	116.6
604	V	35.5	Very low	29.7	Very low	144 Å²	144	139.4 Å²	139.4	87%	0.873	80%	0.804	S	S	*	*				-157.4	122.6	119.6	-149.7	0	0	0	0	111.4
605	E	30.7	Very low	29.8	Very low	169 Å²	169	137 Å²	137	79%	0.79	80%	0.796	S	S	*	*			trans	-28.5	129.8	157.1	-164.9	176	-149	0	0	116.7
606	N	33.7	Very low	30	Very low	154 Å²	154	137.4 Å²	137.4	82%	0.824	79%	0.794	S	S	*	*			trans	-176.7	146.6	131.4	-104.7	-43.9	0	0	0	114.5
607	D	32.8	Very low	30	Very low	144 Å²	144	138.6 Å²	138.6	77%	0.77	80%	0.796	S	S	*	*			trans	-66.6	164.9	-167.8	-72.2	-50.3	0	0	0	118
608	E	30.9	Very low	30.1	Very low	168 Å²	168	141 Å²	141	79%	0.785	81%	0.805	S	S	*	*			trans	94.7	128.7	138.3	-108.2	-174.3	157.5	0	0	121.2
609	M	31.6	Very low	30.4	Very low	150 Å²	150	144.4 Å²	144.4	74%	0.739	81%	0.81	S	S	*	*			trans	95.9	90.2	151.4	-73.2	-171.4	-158.6	0	0	121.9
610	T	31.3	Very low	30.2	Very low	127 Å²	127	142.7 Å²	142.7	78%	0.779	81%	0.81	S	S	*	*				57.9	106.1	107.4	-39.1	0	0	0	0	120.6
611	A	26.5	Very low	30.6	Very low	97 Å²	97	142.3 Å²	142.3	80%	0.802	81%	0.807	S	S	*	*			trans	55.2	124.1	131.7	0	0	0	0	0	122.1
612	A	30.3	Very low	30.5	Very low	105 Å²	105	146.5 Å²	146.5	87%	0.868	81%	0.809	S	S	*	*			trans	-156.2	117.7	134.4	0	0	0	0	0	112.2
613	K	28.1	Very low	30.7	Very low	203 Å²	203	148 Å²	148	88%	0.883	81%	0.81	S	S	*	*			trans	-74.2	142.7	162.6	-88.5	174.9	168.6	176.4	0	110.6
614	A	31.8	Very low	30.7	Very low	99 Å²	99	145 Å²	145	82%	0.818	81%	0.808	S	S	*	*			trans	-146.8	96.9	154.3	0	0	0	0	0	107.2
615	V	29.5	Very low	30.6	Very low	123 Å²	123	143.5 Å²	143.5	75%	0.745	80%	0.804	S	S	*	*				59.6	89.3	83.7	-173.7	0	0	0	0	114.1
616	T	27.2	Very low	30.6	Very low	120 Å²	120	144.3 Å²	144.3	74%	0.736	81%	0.808	S	S	*	*			trans	16.7	134.1	137.3	54.6	0	0	0	0	120.5
617	T	30.7	Very low	30.6	Very low	141 Å²	141	146 Å²	146	87%	0.865	81%	0.808	S	S	*	*			trans	-151.6	114.1	133.6	-42.4	0	0	0	0	111.4
618	D	27.6	Very low	30.5	Very low	156 Å²	156	145 Å²	145	83%	0.834	81%	0.809	S	S	*	*			trans	-67.7	141.7	167	-110.3	-35.2	0	0	0	112
619	K	34.9	Very low	30.4	Very low	202 Å²	202	142.8 Å²	142.8	88%	0.878	81%	0.807	S	S	*	*			trans	-145.6	98.7	156.9	-100.3	-177.9	-178	175.3	0	110.3
620	S	28.1	Very low	30.5	Very low	106 Å²	106	142.1 Å²	142.1	74%	0.741	81%	0.805	S	S	*	*			trans	-66.6	130.9	163.3	61	0	0	0	0	111.6
621	I	33.3	Very low	30.5	Very low	160 Å²	160	143.3 Å²	143.3	82%	0.821	80%	0.802	S	S	*	*			trans	-142.8	118	147.9	-61.3	-174.7	0	0	0	108.5
622	F	28.3	Very low	30.7	Very low	181 Å²	181	148.7 Å²	148.7	79%	0.794	80%	0.803	S	S	*	*			trans	-45	137.4	171.5	-90.8	-107.5	0	0	0	114.2
623	H	32.7	Very low	30.8	Very low	188 Å²	188	152.1 Å²	152.1	87%	0.87	80%	0.798	S	S	*	*			trans	-147.1	108.1	134.7	-87.7	-62.8	0	0	0	110.6
624	S	28.7	Very low	30.9	Very low	109 Å²	109	146.8 Å²	146.8	76%	0.762	79%	0.792	S	S	*	*			trans	-72.7	127.8	167.4	161.5	0	0	0	0	109.9
625	S	34.7	Very low	31	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	79%	0.793	S	S	*	*			trans	-147.8	94.1	157.8	64.6	0	0	0	0	111.2
626	E	30.9	Very low	31.1	Very low	186 Å²	186	149 Å²	149	87%	0.869	79%	0.794	S	S	*	*				49.7	108.6	128.1	-117.5	166.1	178.3	0	0	119.8
627	K	32	Very low	31.6	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	80%	0.797	S	S	*	*			trans	-63.7	139.2	161.1	-67.7	176	175.5	179.1	0	110.2	T629	K627-T629 PolarHBondContact O-N 2.96Å
628	P	31.4	Very low	31.7	Very low	123 Å²	123	148.5 Å²	148.5	80%	0.799	79%	0.79	S	S	*	*			trans	-77.1	103.7	166.3	29.9	-28.4	0	0	0	109.7	I630	P628-I630 PolarHBondContact O-N 3.18Å
629	T	28.2	Very low	32.2	Very low	120 Å²	120	148.4 Å²	148.4	74%	0.736	79%	0.79	S	S	*	*			trans	-66.4	116	162.7	-57.1	0	0	0	0	108.8	K627 E631	K627-T629 PolarHBondContact O-N 2.96Å; T629-E631 HydrophobicContact CG2-CG 4.35Å; T629-E631 PolarHBondContact O-N 3.24Å
630	I	33.4	Very low	32.5	Very low	136 Å²	136	147.9 Å²	147.9	70%	0.697	79%	0.79	S	S	*	*			trans	-85.7	99.8	169.6	-60.5	174.7	0	0	0	107.4	P628 Y632	P628-I630 PolarHBondContact O-N 3.18Å; I630-Y632 HydrophobicContact CG2-CD2 4.36Å; I630-Y632 HydrophobicContact CG2-CE2 4.04Å
631	E	31.7	Very low	33.1	Very low	152 Å²	152	146.2 Å²	146.2	71%	0.71	78%	0.783	S	S	*	*			trans	-77.8	114.8	167.1	-76.5	-175.6	167.1	0	0	110	T629 K633	T629-E631 HydrophobicContact CG2-CG 4.35Å; T629-E631 PolarHBondContact O-N 3.24Å; E631-K633 PolarHBondContact O-N 3.22Å
632	Y	31.7	Very low	33.2	Very low	211 Å²	211	150 Å²	150	83%	0.827	79%	0.787	S	S	*	*			trans	-76.3	101.2	163.7	-74.5	-89.2	0	0	0	109.3	I630 A634	I630-Y632 HydrophobicContact CG2-CD2 4.36Å; I630-Y632 HydrophobicContact CG2-CE2 4.04Å; Y632-A634 PolarHBondContact O-N 2.96Å
633	K	32.7	Very low	33.5	Very low	176 Å²	176	145.3 Å²	145.3	77%	0.765	78%	0.777	S	S	*	*			trans	-75.9	102.9	164.7	-74.3	-169.6	176.1	-175.2	0	109.6	E631 S635	E631-K633 PolarHBondContact O-N 3.22Å; K633-S635 PolarHBondContact O-N 3.06Å
634	A	29.9	Very low	33.7	Very low	92 Å²	92	143.3 Å²	143.3	76%	0.76	77%	0.773	S	S	*	*			trans	-73.4	107	160.7	0	0	0	0	0	108.7	Y632 I636	Y632-A634 PolarHBondContact O-N 2.96Å; A634-I636 PolarHBondContact O-N 2.86Å
635	S	34.1	Very low	34	Very low	120 Å²	120	142.6 Å²	142.6	84%	0.839	77%	0.767	S	S	*	*			trans	-79.9	101.1	168.5	-59.6	0	0	0	0	108.5	K633	K633-S635 PolarHBondContact O-N 3.06Å
636	I	30.9	Very low	34.2	Very low	148 Å²	148	145.8 Å²	145.8	76%	0.759	77%	0.77	S	S	*	*			trans	-81.9	120.4	162.6	-69.3	165.1	0	0	0	106.7	A634	A634-I636 PolarHBondContact O-N 2.86Å
637	S	36.7	Very low	34.6	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	76%	0.763	S	S	*	*			trans	-92.1	105.1	162.8	57	0	0	0	0	108
638	D	33.5	Very low	34.8	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	75%	0.754	S	S	*	*			trans	-58.2	134.7	155	-79.7	-36.1	0	0	0	108.8
639	D	38.5	Very low	35	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	75%	0.748	S	S	*	*			trans	-166.2	133.4	135.5	-92.5	-27.9	0	0	0	110.1
640	E	41.4	Very low	35.5	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	74%	0.743	S	S	*	*			trans	83.5	129.7	163.3	-64.6	177.8	-179.8	0	0	118.7
641	A	39.9	Very low	35.7	Very low	71 Å²	71	143.9 Å²	143.9	59%	0.587	74%	0.74	S	S	*	*			cis	164.3	110.7	-12	0	0	0	0	0	106.5
642	W	35.8	Very low	35.9	Very low	241 Å²	241	147.4 Å²	147.4	91%	0.913	75%	0.749	S	S	*	*			trans	59.5	150	150.3	-49.8	81	0	0	0	119.6
643	S	34.1	Very low	36	Very low	82 Å²	82	142.1 Å²	142.1	57%	0.573	74%	0.743	S	S	*	*			cis	-177.9	155.6	-22.8	-82.3	0	0	0	0	105.1
644	D	36.7	Very low	35.9	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	75%	0.745	S	S	*	*			trans	132.3	96.4	139.1	-70.2	-12.4	0	0	0	115
645	S	35.6	Very low	36.2	Very low	93 Å²	93	145 Å²	145	65%	0.65	75%	0.75	S	S	*	*				1.5	146.7	124.7	53.2	0	0	0	0	116.6
646	E	38.3	Very low	36.1	Very low	179 Å²	179	148.6 Å²	148.6	84%	0.836	75%	0.751	S	S	*	*			cis	179.5	169.8	46.6	-142.4	165.5	-149.7	0	0	109.1
647	N	39.1	Very low	36.4	Very low	136 Å²	136	148.8 Å²	148.8	73%	0.727	76%	0.759	S	S	*	*			trans	114.1	80.8	142.8	-141.9	34.4	0	0	0	118.4
648	E	36.5	Very low	36.1	Very low	134 Å²	134	151.2 Å²	151.2	63%	0.626	76%	0.763	S	S	*	*				47.8	130.6	111.1	-92.4	-163.9	179.8	0	0	122.3
649	R	36.8	Very low	36.4	Very low	177 Å²	177	155.1 Å²	155.1	67%	0.668	77%	0.774	S	S	*	*				106.4	110.9	129.9	-79.7	175.9	-176.4	-178.9	12.8	120.7
650	K	38.3	Very low	36.1	Very low	147 Å²	147	156.1 Å²	156.1	64%	0.639	77%	0.771	S	S	*	*				111.2	128.4	105.6	-89.5	174.6	-174.9	177.7	0	120.3
651	N	37.2	Very low	35.9	Very low	121 Å²	121	152.6 Å²	152.6	65%	0.647	77%	0.768	S	S	*	*			trans	79	129.2	146.1	-52.5	-20.5	0	0	0	116.2
652	Y	36.6	Very low	35.4	Very low	226 Å²	226	154.3 Å²	154.3	89%	0.886	77%	0.771	S	S	*	*				-157.1	159.5	54.9	-96.4	-93.2	0	0	0	113.5
653	S	33.2	Very low	35.3	Very low	101 Å²	101	152.3 Å²	152.3	71%	0.706	77%	0.772	S	S	*	*			trans	-114.7	160.5	-174.2	-176.5	0	0	0	0	112.3
654	M	30.6	Very low	35.2	Very low	165 Å²	165	153 Å²	153	81%	0.813	78%	0.776	S	S	*	*			trans	70.4	122.7	158	-70.8	-141.5	179	0	0	120.7
655	D	37	Very low	35.1	Very low	162 Å²	162	154 Å²	154	87%	0.866	78%	0.781	S	S	*	*				-162.1	136.7	97.4	-111.2	-26.5	0	0	0	113.4
656	K	32.1	Very low	34.9	Very low	197 Å²	197	156.1 Å²	156.1	86%	0.857	79%	0.786	S	S	*	*			trans	-102.4	140.7	173.2	-81	179.8	174.8	175.9	0	109.3
657	T	36.3	Very low	34.8	Very low	151 Å²	151	155.7 Å²	155.7	93%	0.926	79%	0.789	S	S	*	*			trans	-138.8	122.8	152.6	36	0	0	0	0	112.5
658	N	30.6	Very low	34.5	Very low	165 Å²	165	156.6 Å²	156.6	88%	0.882	79%	0.794	S	S	*	*			trans	-73.5	150.4	172.5	-98.3	-26	0	0	0	112
659	K	39.3	Very low	34.3	Very low	219 Å²	219	159.1 Å²	159.1	95%	0.952	81%	0.806	S	S	*	*			trans	-149.8	142.9	139.2	-112.4	173.2	-174.4	176.3	0	111.7
660	K	32.6	Very low	34.1	Very low	174 Å²	174	155.6 Å²	155.6	76%	0.757	81%	0.814	S	S	*	*			trans	-114.6	149.4	-156.5	166.7	-174.9	-177.7	-179.3	0	110.1	T662	K660-T662 WeakPolarHBondContact CE-OG1 3.37Å
661	S	37.2	Very low	33.8	Very low	118 Å²	118	154.4 Å²	154.4	83%	0.825	82%	0.819	S	S	*	*			trans	-179.6	98.3	146.8	-74	0	0	0	0	106.2
662	T	29.9	Very low	33.4	Very low	106 Å²	106	158.2 Å²	158.2	65%	0.65	83%	0.83	S	S	*	*				54	99.5	73.6	-31.8	0	0	0	0	114.2	K660	K660-T662 WeakPolarHBondContact CE-OG1 3.37Å
663	E	34.2	Very low	33.3	Very low	200 Å²	200	154.8 Å²	154.8	94%	0.935	83%	0.825	S	S	*	*				-160.8	133.8	128.5	-117.7	166.2	-170.3	0	0	111.3
664	S	30.4	Very low	33.3	Very low	96 Å²	96	159.1 Å²	159.1	67%	0.671	83%	0.831	S	S	*	*			trans	-101.5	149.4	-173.5	47.8	0	0	0	0	110.5
665	N	35.5	Very low	33.2	Very low	166 Å²	166	159.5 Å²	159.5	89%	0.888	84%	0.837	S	S	*	*			trans	-165.1	123.9	130.8	-97.6	-19.3	0	0	0	112.5
666	N	31.3	Very low	33	Very low	138 Å²	138	157 Å²	157	74%	0.738	83%	0.832	S	S	*	*			trans	-64.6	155	168.5	-67.4	-36.8	0	0	0	111.2
667	N	36.6	Very low	32.8	Very low	170 Å²	170	156.5 Å²	156.5	91%	0.909	83%	0.833	S	S	*	*				-162.1	131.4	122.9	-88.2	-22.2	0	0	0	111.8
668	N	33.1	Very low	32.6	Very low	155 Å²	155	154.9 Å²	154.9	83%	0.829	83%	0.825	S	S	*	*			trans	-73	141.8	-177.5	-67.2	-40.8	0	0	0	112.8
669	E	32.2	Very low	32.4	Very low	187 Å²	187	155.5 Å²	155.5	87%	0.874	82%	0.823	S	S	*	*			trans	-161.2	103.3	134.6	-140.9	166.8	-170	0	0	109.9
670	A	32	Very low	32	Very low	103 Å²	103	153.4 Å²	153.4	85%	0.851	82%	0.821	S	S	*	*			trans	-118.8	104.2	173	0	0	0	0	0	108.7
671	V	32.6	Very low	31.9	Very low	122 Å²	122	150.7 Å²	150.7	74%	0.739	82%	0.819	S	S	*	*			trans	-78.7	123.3	177.4	172.9	0	0	0	0	109.3	I673	V671-I673 HydrophobicContact CG1-CG1 4.43Å
672	K	29.3	Very low	31.5	Very low	202 Å²	202	152.5 Å²	152.5	88%	0.878	82%	0.82	S	S	*	*			trans	-65.4	124.5	171.2	-78.8	174.4	172.5	176.3	0	110.8
673	I	32.9	Very low	31.6	Very low	153 Å²	153	155.5 Å²	155.5	79%	0.785	83%	0.826	S	S	*	*			trans	-132	132.2	155.9	-57.4	-178.3	0	0	0	108.6	V671	V671-I673 HydrophobicContact CG1-CG1 4.43Å
674	K	33.2	Very low	31.5	Very low	192 Å²	192	153.1 Å²	153.1	84%	0.835	82%	0.818	S	S	*	*			trans	-75.6	130.2	-172.7	-65.8	169.6	174	177.5	0	110.2	S676	K674-S676 PolarHBondContact O-N 3.01Å
675	N	29.1	Very low	31.7	Very low	173 Å²	173	154.7 Å²	154.7	93%	0.925	82%	0.819	S	S	*	*			trans	-77.5	112.5	161.8	-78.4	-3.2	0	0	0	108.7
676	S	33.3	Very low	31.5	Very low	110 Å²	110	153 Å²	153	77%	0.769	81%	0.81	S	S	*	*			trans	-93.7	114.9	163.3	39.5	0	0	0	0	108.6	K674	K674-S676 PolarHBondContact O-N 3.01Å
677	E	27.7	Very low	31.6	Very low	186 Å²	186	158.5 Å²	158.5	87%	0.869	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-66.9	126.4	173.4	-173.5	177.4	-159.5	0	0	110.8
678	P	30.9	Very low	31.5	Very low	118 Å²	118	159 Å²	159	77%	0.766	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-99.5	127.5	163.4	16.1	1.8	0	0	0	110.3
679	Q	27.9	Very low	31.6	Very low	177 Å²	177	158.4 Å²	158.4	83%	0.827	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-62.9	130.7	174.9	-62.7	-170.3	-23.6	0	0	111.2	T681	Q679-T681 PolarHBondContact O-N 3.2Å
680	L	29.3	Very low	31.6	Very low	176 Å²	176	162 Å²	162	92%	0.921	82%	0.82	S	S	*	*			trans	-74.4	108.6	164.1	-90.6	152.6	0	0	0	108.3
681	T	31.8	Very low	31.4	Very low	116 Å²	116	166 Å²	166	71%	0.712	84%	0.842	S	S	*	*			trans	-89.8	125.7	161.7	46.6	0	0	0	0	108.4	Q679 E683	Q679-T681 PolarHBondContact O-N 3.2Å; T681-E683 PolarHBondContact O-N 3.24Å
682	D	29.1	Very low	31.4	Very low	157 Å²	157	168.2 Å²	168.2	84%	0.84	85%	0.847	S	S	*	*			trans	-55	114.4	172.8	-64.6	-48.6	0	0	0	110.6
683	E	31.8	Very low	31.5	Very low	169 Å²	169	166.4 Å²	166.4	79%	0.79	85%	0.845	S	S	*	*			trans	-117.4	101.8	166	-146.1	162	-150.9	0	0	107.6	T681 D685	T681-E683 PolarHBondContact O-N 3.24Å; E683-D685 PolarHBondContact O-N 3.42Å
684	I	30.9	Very low	31.4	Very low	150 Å²	150	167.2 Å²	167.2	77%	0.769	85%	0.849	S	S	*	*			trans	-73.2	106.2	170.7	-69.7	154	0	0	0	105.4
685	D	34.9	Very low	31.3	Very low	128 Å²	128	165.7 Å²	165.7	68%	0.684	85%	0.85	S	S	*	*			trans	-98.7	123.6	175.1	-100.6	-28.1	0	0	0	111	E683 W687	E683-D685 PolarHBondContact O-N 3.42Å; D685-W687 VanDerWaalsContact O-CD1 3.29Å
686	D	31.3	Very low	31.4	Very low	130 Å²	130	165.3 Å²	165.3	70%	0.695	85%	0.845	S	S	*	*			trans	-67.1	116.1	-174.4	-70.8	-44.1	0	0	0	112.8	E688	D686-E688 VanDerWaalsContact C-N 3.34Å
687	W	33.5	Very low	31.3	Very low	254 Å²	254	168.9 Å²	168.9	96%	0.962	85%	0.85	S	S	*	*	S	Bend	trans	-88.2	5.9	172.2	-76.3	60.6	0	0	0	113.4	D685	D685-W687 VanDerWaalsContact O-CD1 3.29Å
688	E	35.7	Very low	31.5	Very low	182 Å²	182	167.7 Å²	167.7	85%	0.85	85%	0.848	S	S	*	*			trans	-98.2	4.6	-169.6	-73.6	-165.1	160.9	0	0	115.9	D686	D686-E688 VanDerWaalsContact C-N 3.34Å
689	N	35.2	Very low	31.6	Very low	141 Å²	141	171.5 Å²	171.5	75%	0.754	86%	0.855	S	S	*	*			trans	-109.4	16.1	-167	-128.1	0.2	0	0	0	117.4
690	W	31.4	Very low	31.9	Very low	262 Å²	262	171.1 Å²	171.1	99%	0.992	86%	0.857	S	S	*	*			trans	-115.4	85.6	174.8	-78.8	33.1	0	0	0	110.1
691	S	28	Very low	32.1	Very low	188 Å²	188	170.6 Å²	170.6	100%	1.315	85%	0.851	S	S	*	*			trans	-81.1	0	167.2	-61.6	0	0	0	0	112.3

Retrieved 691 of 691 residues in 659.1 ms (Link to these results)

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